*HEADER    TRANSFERASE/TRANSFERASE INHIBITOR       06-SEP-17   6AXD              
*TITLE     STRUCTURES OF REV1 UBM2 DOMAIN COMPLEX WITH UBIQUITIN AND WITH THE    
*TITLE    2 FIRST SMALL-MOLECULE THAT INHIBITS THE REV1 UBM2-UBIQUITIN           
*TITLE    3 INTERACTION                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA REPAIR PROTEIN REV1;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 998-1040;                                         
*COMPND   5 SYNONYM: ALPHA INTEGRIN-BINDING PROTEIN 80,AIBP80,REV1-LIKE TERMINAL 
*COMPND   6 DEOXYCYTIDYL TRANSFERASE;                                            
*COMPND   7 EC: 2.7.7.-;                                                         
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: REV1, REV1L;                                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI-PICHIA PASTORIS SHUTTLE VECTOR   
*SOURCE   7 PPPARG4;                                                             
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 1182032                                     
*KEYWDS    UBIQUITIN-BINDING MOTIF, STRUCTURAL PROTEIN, TRANSFERASE-TRANSFERASE  
*KEYWDS   2 INHIBITOR COMPLEX                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.FUJII,M.VANAROTTI                                                   
*REVDAT   1   27-JUN-18 6AXD    0                                                
# Restraints file 1: 13C-aliNOESY.upl
 39 LEU  HA     40 ILE  H       2.40            #peak    13
 39 LEU  HA     39 LEU  QD1     2.40            #peak    18
 61 GLN  QG     61 GLN  HE21    3.22            #peak    42
 61 GLN  QB     61 GLN  QG      2.40            #peak    53
 61 GLN  QG     61 GLN  HE22    3.22            #peak    63
 40 ILE  HA     40 ILE  HG12    2.82            #peak    70
 40 ILE  H      40 ILE  HA      2.67            #peak    75
 40 ILE  HA     41 ALA  H       2.40            #peak    80
 40 ILE  HA     40 ILE  HB      2.40            #peak    85
 40 ILE  HA     40 ILE  QD1     2.40            #peak  3660
 59 GLU  HA     62 ARG  QG      2.40            #peak  1534
 62 ARG  QG     62 ARG  QD      2.40            #peak   117
 62 ARG  QB     62 ARG  QG      2.40            #peak   121
 62 ARG  QG     63 GLU  H       3.11            #peak   125
 62 ARG  H      62 ARG  QG      2.92            #peak   129
 42 LEU  HA     42 LEU  QD1     2.92            #peak   139
 42 LEU  QB     42 LEU  QD1     2.48            #peak   154
 47 GLN  HA     50 PRO  HD2     2.40            #peak   876
 57 PRO  HA     58 ALA  H       2.40            #peak  2870
 56 LEU  HA     58 ALA  H       4.35            #peak  3050
 58 ALA  H      58 ALA  HA      2.81            #peak  3207
 58 ALA  H      58 ALA  QB      2.40            #peak  4908
 41 ALA  H      41 ALA  QB      2.40            #peak   208
 40 ILE  H      40 ILE  HG12    2.84            #peak   227
 49 ASP  HA     51 GLU  H       3.57            #peak   255
 60 LEU  HA     63 GLU  QB      2.40            #peak   270
 63 GLU  QB     63 GLU  QG      2.40            #peak   273
 63 GLU  H      63 GLU  QB      2.40            #peak   279
 63 GLU  QB     64 LEU  H       2.72            #peak   282
 68 TYR  H      68 TYR  HB3     2.56            #peak   292
 68 TYR  HB3    69 ASP  H       2.96            #peak   308
 65 LYS  HA     68 TYR  HB3     2.71            #peak  4081
 60 LEU  QB     60 LEU  QD2     2.40            #peak   336
 54 ALA  HA     55 ALA  H       2.40            #peak   916
 52 VAL  HA     55 ALA  H       3.17            #peak  2393
 54 ALA  QB     55 ALA  H       2.63            #peak  2930
 55 ALA  H      55 ALA  HA      2.47            #peak  4642
 52 VAL  HA     52 VAL  HB      2.57            #peak  2397
 52 VAL  HB     53 PHE  H       2.56            #peak   441
 42 LEU  HA     43 PRO  HD2     2.40            #peak   356
 42 LEU  HA     42 LEU  QD2     2.92            #peak   467
 42 LEU  HA     42 LEU  HG      2.72            #peak  2437
 51 GLU  H      51 GLU  QB      2.40            #peak   497
 48 VAL  HA     51 GLU  QB      2.54            #peak   500
 51 GLU  QB     52 VAL  H       2.57            #peak   503
 51 GLU  HA     51 GLU  QB      2.40            #peak   509
 64 LEU  QB     64 LEU  QD2     2.40            #peak   968
 61 GLN  HA     64 LEU  QB      2.40            #peak  1848
 69 ASP  HA     69 ASP  QB      2.40            #peak   558
 66 ALA  HA     69 ASP  QB      2.40            #peak  4353
 48 VAL  QG2    49 ASP  H       2.40            #peak   577
 66 ALA  H      67 ALA  H       3.93            #peak   773
 66 ALA  QB     67 ALA  H       3.71            #peak   930
 63 GLU  HA     67 ALA  H       2.67            #peak  3703
 66 ALA  HA     67 ALA  H       2.48            #peak   601
 67 ALA  H      67 ALA  QB      2.40            #peak  4653
 45 PHE  H      45 PHE  QD      3.75            #peak   614
 45 PHE  QD     68 TYR  QE      3.75            #peak  3628
 50 PRO  HA     53 PHE  HB2     2.47            #peak  4442
 65 LYS  QB     66 ALA  H       3.12            #peak   652
 65 LYS  H      65 LYS  QB      2.64            #peak   657
 65 LYS  QB     65 LYS  QG      2.40            #peak   672
 65 LYS  HA     65 LYS  QB      2.40            #peak  4086
 65 LYS  QB     65 LYS  HD2     2.40            #peak   682
 70 GLN  HG2    70 GLN  HE21    3.66            #peak   687
 70 GLN  H      70 GLN  HG2     2.94            #peak   690
 67 ALA  HA     70 GLN  HG2     2.94            #peak   699
 70 GLN  HB3    70 GLN  HG2     2.40            #peak   702
 56 LEU  HA     56 LEU  QD1     2.40            #peak   733
 53 PHE  QD     56 LEU  QD1     2.40            #peak  4325
 66 ALA  H      66 ALA  HA      2.40            #peak  4357
 47 GLN  HA     51 GLU  H       2.95            #peak   879
 48 VAL  HA     51 GLU  H       3.96            #peak   813
 49 ASP  QB     51 GLU  H       3.50            #peak  2280
 47 GLN  HA     48 VAL  H       2.40            #peak   885
 47 GLN  HA     47 GLN  QB      2.54            #peak   897
 47 GLN  HA     49 ASP  H       3.75            #peak   903
 47 GLN  HA     47 GLN  QG      2.40            #peak   909
 47 GLN  HA     47 GLN  HE22    2.64            #peak   912
 66 ALA  H      66 ALA  QB      2.44            #peak   932
 68 TYR  HA     71 ARG  QB      2.91            #peak  1145
 71 ARG  QB     71 ARG  QG      2.40            #peak   954
 71 ARG  QB     72 GLN  H       3.08            #peak   955
 71 ARG  HA     71 ARG  QB      2.40            #peak  4371
 71 ARG  H      71 ARG  QB      2.92            #peak   963
 61 GLN  HA     64 LEU  QD2     2.48            #peak   985
 53 PHE  QD     64 LEU  QD2     2.40            #peak   998
 48 VAL  H      48 VAL  QG2     2.40            #peak   567
 47 GLN  H      48 VAL  H       4.19            #peak  1032
 46 SER  HA     48 VAL  H       3.97            #peak  2626
 48 VAL  H      49 ASP  H       4.10            #peak  1055
 45 PHE  HA     48 VAL  H       3.90            #peak  4041
 47 GLN  QG     48 VAL  H       3.07            #peak  4622
 38 ASN  HB3    38 ASN  HD21    3.93            #peak  3469
 34 ASP  HA     35 ALA  H       2.81            #peak  1091
 48 VAL  HA     48 VAL  QG2     2.40            #peak  1096
 48 VAL  H      48 VAL  HA      2.67            #peak  1107
 48 VAL  HA     48 VAL  HB      2.40            #peak  1119
 48 VAL  HA     49 ASP  H       2.40            #peak  1123
 48 VAL  HA     48 VAL  QG1     2.40            #peak  1124
 55 ALA  H      55 ALA  QB      2.40            #peak  1128
 52 VAL  HA     55 ALA  QB      2.53            #peak  1132
 55 ALA  QB     56 LEU  H       2.96            #peak  1136
 68 TYR  HA     68 TYR  HB3     2.57            #peak   288
 68 TYR  HA     70 GLN  H       2.40            #peak  1157
 68 TYR  HA     68 TYR  HB2     2.57            #peak  3098
 68 TYR  HA     69 ASP  H       2.89            #peak  1173
 72 GLN  HA     72 GLN  QG      2.48            #peak  4665
 30 GLU  H      30 GLU  HB2     4.01            #peak   834
 30 GLU  H      30 GLU  HB3     4.01            #peak  1203
 67 ALA  H      68 TYR  H       4.38            #peak   593
 68 TYR  H      68 TYR  HA      2.40            #peak  1153
 68 TYR  H      68 TYR  HB2     2.56            #peak  3102
 68 TYR  H      69 ASP  H       3.96            #peak  1242
 64 LEU  HA     68 TYR  H       2.72            #peak  1248
 65 LYS  HA     68 TYR  H       2.89            #peak  4096
 66 ALA  HA     68 TYR  H       2.40            #peak  4361
 67 ALA  QB     68 TYR  H       2.40            #peak  4655
 33 SER  H      33 SER  QB      4.19            #peak  1267
 47 GLN  HA     47 GLN  HE21    2.64            #peak   888
 47 GLN  QG     47 GLN  HE21    3.08            #peak  4625
 35 ALA  H      35 ALA  QB      3.05            #peak  1292
 56 LEU  HG     58 ALA  H       3.91            #peak  1298
 56 LEU  QB     56 LEU  HG      2.51            #peak  4747
 45 PHE  HA     45 PHE  HB3     2.40            #peak  4043
 39 LEU  H      39 LEU  HA      2.77            #peak     8
 39 LEU  H      39 LEU  QD1     2.79            #peak  1778
 39 LEU  H      39 LEU  QB      2.68            #peak  1928
 39 LEU  H      39 LEU  QD2     2.79            #peak  3423
 39 LEU  H      39 LEU  HG      2.65            #peak  3568
 38 ASN  HA     39 LEU  H       2.68            #peak  5219
 64 LEU  QB     65 LYS  H       2.92            #peak   521
 65 LYS  H      66 ALA  H       3.91            #peak  1410
 64 LEU  QD2    65 LYS  H       2.40            #peak   980
 61 GLN  HA     65 LYS  H       4.13            #peak  1854
 64 LEU  HG     65 LYS  H       3.64            #peak  2490
 65 LYS  H      65 LYS  QG      2.99            #peak  2667
 63 GLU  HA     65 LYS  H       2.88            #peak  3712
 64 LEU  HA     65 LYS  H       2.71            #peak  3905
 65 LYS  H      65 LYS  HA      2.43            #peak  4101
 64 LEU  QD1    65 LYS  H       2.40            #peak  4406
 64 LEU  H      65 LYS  H       3.72            #peak  5119
 61 GLN  QB     61 GLN  HE21    3.61            #peak  3486
 37 ILE  HA     37 ILE  HG13    2.74            #peak  1502
 37 ILE  HA     38 ASN  H       2.43            #peak  1517
 37 ILE  HA     37 ILE  HG12    2.74            #peak  1527
 59 GLU  HA     60 LEU  H       2.86            #peak  1540
 59 GLU  H      59 GLU  HA      2.48            #peak  1543
 59 GLU  HA     62 ARG  QB      2.40            #peak  3600
 59 GLU  HA     61 GLN  H       3.94            #peak  1552
 59 GLU  HA     59 GLU  QB      2.40            #peak  5085
 39 LEU  H      40 ILE  H       3.73            #peak  1357
 40 ILE  H      41 ALA  H       4.41            #peak  1594
 40 ILE  H      40 ILE  HB      2.40            #peak  2037
 40 ILE  H      40 ILE  HG13    2.84            #peak  2252
 39 LEU  HG     40 ILE  H       2.84            #peak  3573
 40 ILE  H      40 ILE  QG2     3.08            #peak  3827
 47 GLN  H      47 GLN  HA      2.51            #peak   891
 47 GLN  H      47 GLN  HE21    4.11            #peak  1276
 46 SER  HA     47 GLN  H       3.19            #peak  2627
 46 SER  QB     47 GLN  H       3.65            #peak  4313
 46 SER  H      47 GLN  H       4.25            #peak  5177
 70 GLN  H      70 GLN  HE21    4.48            #peak  2168
 70 GLN  HA     70 GLN  HE21    2.40            #peak  2522
 70 GLN  HG3    70 GLN  HE21    3.66            #peak  2699
 60 LEU  HA     60 LEU  QD2     2.40            #peak   321
 60 LEU  H      60 LEU  HA      2.50            #peak  1729
 60 LEU  HA     60 LEU  QD1     2.40            #peak  3146
 60 LEU  HA     60 LEU  QB      2.40            #peak  3382
 60 LEU  HA     63 GLU  H       2.41            #peak  1749
 60 LEU  HA     64 LEU  H       3.11            #peak  1759
 60 LEU  HA     60 LEU  HG      2.40            #peak  5238
 39 LEU  QB     39 LEU  QD1     2.40            #peak  1785
 71 ARG  QB     71 ARG  QD      2.48            #peak  1800
 71 ARG  QG     71 ARG  QD      2.40            #peak  1808
 71 ARG  H      71 ARG  QD      3.22            #peak  1816
 31 SER  QB     32 ASN  H       3.18            #peak   870
 31 SER  HA     32 ASN  H       2.76            #peak  4573
 38 ASN  HB2    38 ASN  HD21    3.93            #peak  1829
 38 ASN  HB2    39 LEU  H       3.52            #peak  1831
 61 GLN  HA     61 GLN  QG      2.40            #peak  1845
 61 GLN  HA     61 GLN  QB      2.40            #peak  1866
 61 GLN  H      61 GLN  HA      2.62            #peak  1869
 61 GLN  HA     62 ARG  H       3.09            #peak  1878
 65 LYS  QB     65 LYS  HD3     2.40            #peak   661
 65 LYS  HA     65 LYS  HD3     2.92            #peak  4106
 39 LEU  HA     39 LEU  QB      2.40            #peak  1923
 39 LEU  QB     40 ILE  H       2.98            #peak  1932
 39 LEU  QB     39 LEU  QD2     2.40            #peak  1946
 62 ARG  HA     62 ARG  QG      2.79            #peak   113
 62 ARG  HA     65 LYS  QB      2.40            #peak  1961
 62 ARG  HA     66 ALA  H       2.59            #peak  1965
 62 ARG  HA     65 LYS  H       2.97            #peak  1969
 62 ARG  HA     62 ARG  QD      2.43            #peak  2071
 62 ARG  HA     62 ARG  QB      2.40            #peak  3604
 62 ARG  HA     63 GLU  H       3.05            #peak  1989
 62 ARG  H      62 ARG  HA      2.74            #peak  1993
 62 ARG  HA     64 LEU  H       3.54            #peak  1997
 40 ILE  HG12   41 ALA  H       3.47            #peak   229
 40 ILE  HG13   41 ALA  H       3.47            #peak  2257
 40 ILE  QG2    41 ALA  H       2.99            #peak  3833
 40 ILE  HB     40 ILE  HG12    2.70            #peak  2032
 40 ILE  HB     41 ALA  H       2.83            #peak  2042
 40 ILE  HB     40 ILE  HG13    2.70            #peak  2262
 62 ARG  H      62 ARG  QD      3.98            #peak  2083
 42 LEU  HA     43 PRO  HD3     2.40            #peak   472
 33 SER  QB     34 ASP  H       3.16            #peak  4613
 69 ASP  QB     70 GLN  H       2.88            #peak   554
 70 GLN  H      70 GLN  HA      2.68            #peak  2525
 67 ALA  HA     70 GLN  H       2.69            #peak  2947
 66 ALA  HA     70 GLN  H       2.40            #peak  4363
 44 ALA  HA     48 VAL  H       3.38            #peak  2225
 44 ALA  HA     47 GLN  H       4.15            #peak  2227
 44 ALA  HA     46 SER  H       3.31            #peak  2237
 40 ILE  HA     40 ILE  HG13    2.82            #peak  2242
 49 ASP  HA     49 ASP  QB      2.73            #peak   258
 49 ASP  H      49 ASP  QB      2.40            #peak  2284
 45 PHE  QD     68 TYR  QD      2.40            #peak  2308
 68 TYR  HA     68 TYR  QD      2.75            #peak  1161
 68 TYR  H      68 TYR  QD      3.93            #peak  2316
 49 ASP  HA     52 VAL  H       4.20            #peak  2333
 52 VAL  H      52 VAL  HB      2.40            #peak   429
 51 GLU  H      52 VAL  H       4.46            #peak  2348
 47 GLN  HA     52 VAL  H       3.55            #peak   894
 48 VAL  HA     52 VAL  H       4.16            #peak  1114
 52 VAL  H      52 VAL  QG1     2.66            #peak  2605
 52 VAL  H      53 PHE  H       4.09            #peak  4215
 52 VAL  H      52 VAL  QG2     2.66            #peak  4292
 35 ALA  QB     36 GLY  H       2.76            #peak  1290
 36 GLY  H      36 GLY  HA2     2.77            #peak  3200
 35 ALA  H      36 GLY  H       4.86            #peak  2384
 36 GLY  H      36 GLY  HA3     2.77            #peak  4904
 36 GLY  H      37 ILE  H       3.79            #peak  2387
 52 VAL  H      52 VAL  HA      2.44            #peak  2405
 52 VAL  HA     52 VAL  QG2     2.40            #peak  2421
 52 VAL  HA     54 ALA  H       3.16            #peak  2425
 42 LEU  HG     44 ALA  H       2.96            #peak  2450
 51 GLU  QB     51 GLU  QG      2.40            #peak  2465
 51 GLU  H      51 GLU  QG      3.82            #peak  2468
 51 GLU  HA     51 GLU  QG      2.40            #peak  3870
 64 LEU  QB     64 LEU  HG      2.40            #peak  2481
 61 GLN  HA     64 LEU  HG      3.24            #peak  2496
 64 LEU  HA     64 LEU  HG      2.50            #peak  3910
 64 LEU  H      64 LEU  HG      2.71            #peak  2516
 70 GLN  HA     70 GLN  HG2     2.42            #peak   693
 70 GLN  HA     70 GLN  HG3     2.42            #peak  2705
 70 GLN  HA     70 GLN  HB3     2.41            #peak  2534
 70 GLN  HA     72 GLN  H       2.40            #peak  3785
 70 GLN  HA     70 GLN  HB2     2.41            #peak  4146
 70 GLN  HA     70 GLN  HE22    2.40            #peak  2546
 43 PRO  HA     44 ALA  H       2.40            #peak  2568
 30 GLU  HA     30 GLU  HB2     2.83            #peak  2581
 30 GLU  HA     30 GLU  HB3     2.83            #peak  2860
 30 GLU  HA     31 SER  H       3.33            #peak  2596
 52 VAL  HA     52 VAL  QG1     2.40            #peak  2609
 52 VAL  QG1    53 PHE  H       3.00            #peak  2617
 46 SER  HA     51 GLU  H       4.12            #peak  2624
 53 PHE  HA     53 PHE  HB3     2.45            #peak  2642
 50 PRO  HA     53 PHE  HB3     2.47            #peak  2651
 65 LYS  QG     66 ALA  H       3.87            #peak  2662
 65 LYS  QG     65 LYS  HD3     2.40            #peak  1906
 62 ARG  HA     65 LYS  QG      2.75            #peak  1981
 65 LYS  QG     65 LYS  HD2     2.40            #peak  2693
 70 GLN  H      70 GLN  HG3     2.94            #peak  2702
 70 GLN  HB2    70 GLN  HG3     2.40            #peak  2717
 70 GLN  HG3    70 GLN  HE22    3.66            #peak  2723
 56 LEU  HA     56 LEU  QD2     2.40            #peak  2745
 56 LEU  QB     56 LEU  QD2     2.40            #peak  2754
 60 LEU  H      60 LEU  QD2     2.40            #peak   326
 60 LEU  H      60 LEU  QD1     2.40            #peak  3148
 58 ALA  HA     60 LEU  H       2.91            #peak  3209
 59 GLU  H      60 LEU  H       4.33            #peak  3247
 59 GLU  QG     60 LEU  H       4.24            #peak  3309
 60 LEU  H      60 LEU  QB      2.40            #peak  3387
 60 LEU  H      61 GLN  H       3.98            #peak  2836
 60 LEU  H      62 ARG  H       3.75            #peak  2840
 60 LEU  H      60 LEU  HG      2.74            #peak  5242
 47 GLN  QB     48 VAL  H       3.38            #peak  2912
 47 GLN  H      47 GLN  QB      2.88            #peak  2918
 47 GLN  QB     47 GLN  QG      2.40            #peak  2924
 54 ALA  QB     61 GLN  QG      2.40            #peak    48
 67 ALA  H      67 ALA  HA      2.53            #peak  2941
 67 ALA  HA     68 TYR  H       3.02            #peak  2945
 67 ALA  HA     70 GLN  HG3     2.94            #peak  2949
 67 ALA  HA     69 ASP  H       4.11            #peak  3739
 67 ALA  HA     71 ARG  H       2.70            #peak  2957
 71 ARG  HA     71 ARG  QG      2.40            #peak  4379
 71 ARG  H      71 ARG  QG      2.59            #peak  2983
 45 PHE  H      45 PHE  HB3     3.47            #peak  1334
 44 ALA  HA     45 PHE  H       2.40            #peak  2231
 44 ALA  H      45 PHE  H       4.54            #peak  3330
 44 ALA  QB     45 PHE  H       2.48            #peak  3810
 45 PHE  H      45 PHE  HA      2.85            #peak  4047
 45 PHE  H      46 SER  H       5.41            #peak  3007
 41 ALA  H      41 ALA  HA      2.40            #peak  3010
 34 ASP  HA     34 ASP  QB      2.40            #peak  1089
 34 ASP  H      34 ASP  QB      3.85            #peak  3019
 34 ASP  QB     35 ALA  H       3.10            #peak  3022
 48 VAL  H      48 VAL  HB      2.50            #peak  3029
 48 VAL  HB     49 ASP  H       2.88            #peak  3041
 56 LEU  HA     56 LEU  HG      2.68            #peak  3058
 56 LEU  HA     59 GLU  H       3.62            #peak  3076
 56 LEU  HA     56 LEU  QB      2.44            #peak  3078
 56 LEU  HA     59 GLU  QB      3.00            #peak  5091
 65 LYS  HA     68 TYR  HB2     2.71            #peak  4116
 72 GLN  QB     72 GLN  QG      2.40            #peak  3126
 72 GLN  H      72 GLN  QB      3.05            #peak  3131
 72 GLN  HA     72 GLN  QB      2.40            #peak  4668
 60 LEU  QD1    61 GLN  H       2.40            #peak  3166
 47 GLN  HA     50 PRO  HD3     2.40            #peak  3178
 58 ALA  HA     61 GLN  QG      2.40            #peak  3205
 58 ALA  HA     61 GLN  QB      2.40            #peak  3215
 58 ALA  HA     63 GLU  H       3.52            #peak  3219
 32 ASN  H      32 ASN  HA      2.72            #peak  3226
 58 ALA  H      59 GLU  H       4.32            #peak  3238
 54 ALA  HA     59 GLU  H       3.93            #peak  3239
 58 ALA  HA     59 GLU  H       3.04            #peak  3213
 55 ALA  HA     59 GLU  H       3.62            #peak  4646
 37 ILE  HA     37 ILE  HB      2.40            #peak  1507
 37 ILE  HB     37 ILE  HG13    2.91            #peak  3277
 37 ILE  HB     37 ILE  QD1     2.40            #peak  3287
 37 ILE  HB     37 ILE  HG12    2.91            #peak  5060
 59 GLU  HA     59 GLU  QG      2.40            #peak  3304
 59 GLU  H      59 GLU  QG      2.74            #peak  3310
 42 LEU  HA     44 ALA  H       3.67            #peak   482
 44 ALA  H      44 ALA  HA      2.75            #peak  2233
 44 ALA  H      44 ALA  QB      2.40            #peak  3812
 37 ILE  HA     37 ILE  QD1     2.40            #peak  1512
 37 ILE  QD1    38 ASN  H       3.39            #peak  3363
 57 PRO  HA     60 LEU  QB      2.84            #peak  3392
 60 LEU  QB     60 LEU  QD1     2.40            #peak  3396
 60 LEU  QB     61 GLN  H       2.62            #peak  3407
 39 LEU  HA     39 LEU  QD2     2.40            #peak  3418
 70 GLN  H      70 GLN  HB3     3.24            #peak  3451
 70 GLN  HB3    70 GLN  HG3     2.40            #peak  3457
 38 ASN  HB3    39 LEU  H       3.52            #peak  3471
 61 GLN  QB     61 GLN  HE22    3.61            #peak  3504
 42 LEU  HA     42 LEU  QB      2.40            #peak   487
 42 LEU  QB     42 LEU  QD2     2.48            #peak  3519
 42 LEU  QB     42 LEU  HG      2.40            #peak  3523
 42 LEU  QB     44 ALA  H       3.18            #peak  3527
 39 LEU  HA     39 LEU  HG      2.50            #peak    33
 39 LEU  QB     39 LEU  HG      2.40            #peak  3581
 62 ARG  QB     62 ARG  QD      2.40            #peak  3608
 68 TYR  HA     68 TYR  QE      4.25            #peak  1169
 68 TYR  H      68 TYR  QE      4.19            #peak  3638
 53 PHE  QD     68 TYR  QE      2.77            #peak  4337
 40 ILE  H      40 ILE  QD1     2.77            #peak  3671
 40 ILE  QD1    41 ALA  H       2.70            #peak  3676
 40 ILE  HB     40 ILE  QD1     2.40            #peak  2057
 40 ILE  QG2    40 ILE  QD1     2.40            #peak  3695
 63 GLU  HA     63 GLU  QB      2.40            #peak  3700
 63 GLU  HA     66 ALA  H       2.97            #peak  3706
 63 GLU  HA     66 ALA  QB      2.40            #peak  3709
 63 GLU  HA     63 GLU  QG      2.55            #peak  3715
 63 GLU  HA     64 LEU  H       2.97            #peak  3724
 69 ASP  H      69 ASP  QB      2.40            #peak   556
 69 ASP  H      70 GLN  H       4.30            #peak  3734
 68 TYR  QD     69 ASP  H       4.11            #peak  3736
 68 TYR  HB2    69 ASP  H       2.96            #peak  3118
 65 LYS  HA     69 ASP  H       3.09            #peak  4121
 66 ALA  HA     69 ASP  H       3.12            #peak  4365
 47 GLN  HA     50 PRO  QB      2.62            #peak   906
 68 TYR  HA     72 GLN  H       2.40            #peak  1177
 72 GLN  H      72 GLN  QG      2.40            #peak  1189
 71 ARG  QG     72 GLN  H       4.17            #peak  3787
 71 ARG  HA     72 GLN  H       2.40            #peak  3801
 71 ARG  H      72 GLN  H       4.47            #peak  3802
 72 GLN  H      72 GLN  HA      2.41            #peak  4671
 40 ILE  HA     40 ILE  QG2     2.40            #peak   100
 40 ILE  QG2    40 ILE  HG12    2.40            #peak  3822
 40 ILE  QG2    40 ILE  HG13    2.40            #peak  3842
 51 GLU  HA     55 ALA  H       4.10            #peak  3857
 51 GLU  H      51 GLU  HA      2.40            #peak  3864
 51 GLU  HA     52 VAL  H       2.44            #peak  3867
 51 GLU  HA     54 ALA  QB      2.40            #peak  2936
 64 LEU  HA     64 LEU  QB      2.40            #peak  3885
 64 LEU  HA     67 ALA  H       2.42            #peak   599
 64 LEU  HA     64 LEU  QD2     2.40            #peak  3895
 64 LEU  HA     67 ALA  QB      2.40            #peak  3925
 64 LEU  H      64 LEU  HA      2.47            #peak  3930
 69 ASP  HA     70 GLN  H       2.93            #peak  3935
 69 ASP  H      69 ASP  HA      2.41            #peak  3937
 69 ASP  HA     72 GLN  H       2.70            #peak  3939
 48 VAL  H      48 VAL  QG1     2.40            #peak  3951
 48 VAL  QG1    49 ASP  H       2.40            #peak  3963
 38 ASN  H      38 ASN  HD21    4.88            #peak  3969
 38 ASN  H      39 LEU  H       4.17            #peak  1391
 38 ASN  H      38 ASN  HB2     3.81            #peak  1838
 37 ILE  HB     38 ASN  H       4.20            #peak  3290
 38 ASN  H      38 ASN  HB3     3.81            #peak  3982
 38 ASN  H      38 ASN  HD22    4.88            #peak  4723
 61 GLN  H      61 GLN  QG      2.61            #peak    57
 60 LEU  QD2    61 GLN  H       2.40            #peak   341
 61 GLN  H      61 GLN  HE21    4.18            #peak  4001
 60 LEU  HA     61 GLN  H       2.82            #peak  1744
 58 ALA  HA     61 GLN  H       2.83            #peak  3217
 61 GLN  H      61 GLN  QB      2.89            #peak  3498
 45 PHE  HA     45 PHE  QD      2.40            #peak  4039
 45 PHE  HA     47 GLN  H       3.35            #peak  4045
 53 PHE  HA     55 ALA  H       3.81            #peak   395
 53 PHE  HA     53 PHE  HB2     2.45            #peak   630
 53 PHE  HA     54 ALA  H       3.10            #peak  4074
 65 LYS  HA     66 ALA  H       2.88            #peak  4091
 65 LYS  HA     65 LYS  QG      2.59            #peak  4111
 70 GLN  HB2    70 GLN  HG2     2.40            #peak  4137
 70 GLN  H      70 GLN  HB2     3.24            #peak  4143
 49 ASP  HA     53 PHE  H       2.53            #peak   264
 53 PHE  H      53 PHE  HB2     2.40            #peak   633
 52 VAL  HA     53 PHE  H       2.70            #peak  2417
 53 PHE  H      53 PHE  HB3     2.40            #peak  2645
 51 GLU  HA     53 PHE  H       2.84            #peak  3879
 53 PHE  H      53 PHE  HA      2.61            #peak  4068
 53 PHE  H      53 PHE  QD      3.32            #peak  4343
 30 GLU  HB2    30 GLU  QG      2.40            #peak   842
 30 GLU  H      30 GLU  QG      3.33            #peak  4247
 30 GLU  HA     30 GLU  QG      2.65            #peak  4250
 30 GLU  HB3    30 GLU  QG      2.40            #peak  4253
 52 VAL  QG2    53 PHE  H       3.00            #peak  4306
 46 SER  HA     46 SER  QB      2.41            #peak  4315
 46 SER  H      46 SER  QB      3.44            #peak  4319
 53 PHE  QD     56 LEU  QD2     2.40            #peak  4334
 53 PHE  HA     53 PHE  QD      3.17            #peak  4071
 71 ARG  HA     71 ARG  QD      2.88            #peak  1812
 64 LEU  QB     64 LEU  QD1     2.40            #peak  4396
 61 GLN  HA     64 LEU  QD1     2.48            #peak  4411
 64 LEU  HA     64 LEU  QD1     2.40            #peak  3920
 53 PHE  QD     64 LEU  QD1     2.40            #peak  4424
 68 TYR  HA     71 ARG  H       2.85            #peak  1181
 70 GLN  H      71 ARG  H       4.16            #peak  2200
 70 GLN  HA     71 ARG  H       2.40            #peak  2543
 69 ASP  HA     71 ARG  H       2.83            #peak  3943
 71 ARG  H      71 ARG  HA      2.40            #peak  4391
 54 ALA  H      55 ALA  H       4.02            #peak   396
 54 ALA  H      54 ALA  HA      2.43            #peak   926
 54 ALA  H      54 ALA  QB      2.40            #peak  2938
 51 GLU  HA     54 ALA  H       2.60            #peak  3882
 53 PHE  H      54 ALA  H       3.94            #peak  4242
 53 PHE  QD     54 ALA  H       3.24            #peak  4352
 31 SER  HA     31 SER  QB      2.40            #peak   872
 31 SER  H      31 SER  QB      3.04            #peak   874
 33 SER  HA     33 SER  QB      2.40            #peak  4615
 47 GLN  H      47 GLN  QG      2.89            #peak  4628
 55 ALA  HA     58 ALA  H       3.52            #peak  4640
 59 GLU  HA     63 GLU  H       2.96            #peak  1555
 61 GLN  HA     63 GLU  H       3.39            #peak  1875
 63 GLU  H      63 GLU  QG      2.88            #peak  2295
 62 ARG  QB     63 GLU  H       2.46            #peak  3616
 63 GLU  H      63 GLU  HA      2.58            #peak  3721
 62 ARG  H      63 GLU  H       3.82            #peak  4880
 38 ASN  HB2    38 ASN  HD22    3.93            #peak  1839
 38 ASN  HB3    38 ASN  HD22    3.93            #peak  3479
 38 ASN  HA     38 ASN  HD22    3.79            #peak  5227
 35 ALA  HA     36 GLY  H       2.81            #peak  4730
 56 LEU  QB     58 ALA  H       3.63            #peak  4738
 56 LEU  QB     56 LEU  QD1     2.40            #peak  4743
 53 PHE  HA     56 LEU  QB      3.37            #peak  4762
 56 LEU  H      56 LEU  QB      3.26            #peak  4772
 45 PHE  H      45 PHE  HB2     3.47            #peak  4782
 45 PHE  HA     45 PHE  HB2     2.40            #peak  4051
 42 LEU  H      42 LEU  QD1     2.74            #peak   159
 41 ALA  QB     42 LEU  H       4.50            #peak  4799
 42 LEU  H      42 LEU  QD2     2.74            #peak  2117
 42 LEU  H      42 LEU  HG      2.90            #peak  2462
 41 ALA  HA     42 LEU  H       2.59            #peak  3014
 42 LEU  H      42 LEU  QB      3.34            #peak  3539
 61 GLN  QG     62 ARG  H       3.67            #peak    60
 59 GLU  HA     62 ARG  H       2.58            #peak  1558
 60 LEU  HA     62 ARG  H       2.43            #peak  1754
 58 ALA  HA     62 ARG  H       4.06            #peak  4864
 61 GLN  QB     62 ARG  H       2.59            #peak  3501
 62 ARG  H      62 ARG  QB      2.40            #peak  3620
 61 GLN  H      62 ARG  H       4.11            #peak  4874
 47 GLN  H      47 GLN  HE22    4.11            #peak  1656
 47 GLN  QG     47 GLN  HE22    3.08            #peak  4637
 58 ALA  QB     59 GLU  H       2.40            #peak  4912
 55 ALA  HA     58 ALA  QB      2.40            #peak  4650
 32 ASN  H      32 ASN  QB      3.34            #peak  4919
 32 ASN  HA     32 ASN  QB      2.40            #peak  4921
 56 LEU  H      56 LEU  QD1     2.40            #peak   748
 54 ALA  HA     56 LEU  H       3.64            #peak   928
 56 LEU  H      56 LEU  HG      4.26            #peak  1326
 52 VAL  HA     56 LEU  H       3.69            #peak  2429
 56 LEU  H      56 LEU  QD2     2.40            #peak  2760
 53 PHE  HA     56 LEU  H       3.73            #peak  4960
 55 ALA  HA     56 LEU  H       2.40            #peak  4652
 37 ILE  H      37 ILE  HA      2.62            #peak  1522
 37 ILE  H      37 ILE  HG13    3.00            #peak  1705
 37 ILE  H      37 ILE  HB      3.11            #peak  3297
 37 ILE  H      37 ILE  QD1     2.98            #peak  3368
 37 ILE  H      38 ASN  H       3.74            #peak  3987
 37 ILE  H      37 ILE  HG12    3.00            #peak  5075
 61 GLN  H      61 GLN  HE22    4.18            #peak  4032
 59 GLU  QB     60 LEU  H       2.46            #peak  5088
 59 GLU  H      59 GLU  QB      2.40            #peak  5094
 59 GLU  QB     59 GLU  QG      2.40            #peak  5097
 64 LEU  H      64 LEU  QB      2.40            #peak   546
 64 LEU  H      64 LEU  QD2     2.40            #peak  1010
 61 GLN  HA     64 LEU  H       3.22            #peak  1884
 63 GLU  QG     64 LEU  H       3.98            #peak  2298
 64 LEU  H      64 LEU  QD1     2.40            #peak  4436
 63 GLU  H      64 LEU  H       4.42            #peak  4715
 45 PHE  QD     46 SER  H       3.61            #peak   622
 45 PHE  HB3    46 SER  H       2.83            #peak  1342
 45 PHE  HA     46 SER  H       2.92            #peak  4053
 45 PHE  HB2    46 SER  H       2.83            #peak  4788
 70 GLN  HG2    70 GLN  HE22    3.66            #peak   711
 70 GLN  H      70 GLN  HE22    4.48            #peak  5199
 38 ASN  HA     38 ASN  HD21    3.79            #peak  1083
 38 ASN  HA     38 ASN  HB2     2.53            #peak  5220
 38 ASN  HA     38 ASN  HB3     2.53            #peak  3481
 60 LEU  QB     60 LEU  HG      2.40            #peak  5253
 60 LEU  HG     61 GLN  H       2.73            #peak  5258
 65 LYS  HA     65 LYS  HD2     2.92            #peak  4131
 36 GLY  H      36 GLY  QA      2.26            #peak  4904
 36 GLY  QA     37 ILE  H       2.36            #peak  4907
 37 ILE  HA     37 ILE  QG1     2.38            #peak  1502
 37 ILE  HB     37 ILE  QG1     2.30            #peak  5060
 37 ILE  QG1    38 ASN  H       3.10            #peak  5071
 38 ASN  H      38 ASN  QB      3.34            #peak  3982
 38 ASN  H      38 ASN  QD2     4.29            #peak  4723
 38 ASN  HA     38 ASN  QB      2.19            #peak  5220
 38 ASN  HA     38 ASN  QD2     3.28            #peak  5227
 38 ASN  QB     38 ASN  QD2     2.73            #peak  3469
 38 ASN  QB     39 LEU  H       2.86            #peak  3471
 39 LEU  H      39 LEU  QQD     2.27            #peak  1778
 40 ILE  HB     40 ILE  QG1     2.24            #peak  2032
 40 ILE  QG1    41 ALA  H       2.75            #peak   229
 42 LEU  HA     42 LEU  QQD     2.29            #peak   467
 42 LEU  QQD    44 ALA  H       3.47            #peak  2107
 45 PHE  H      45 PHE  QB      2.73            #peak  1334
 45 PHE  QB     46 SER  H       2.42            #peak  1342
 45 PHE  QB     68 TYR  QE      3.38            #peak  1336
 47 GLN  H      47 GLN  QE2     3.61            #peak  1276
 47 GLN  HA     47 GLN  QE2     2.23            #peak   888
 47 GLN  QB     47 GLN  QE2     3.30            #peak  2915
 47 GLN  QG     47 GLN  QE2     2.42            #peak  4625
 52 VAL  H      52 VAL  QQG     2.23            #peak  2605
 53 PHE  QB     54 ALA  H       2.64            #peak   642
 54 ALA  HA     57 PRO  QB      2.60            #peak  4266
 61 GLN  H      61 GLN  QE2     3.55            #peak  4001
 61 GLN  HA     61 GLN  QE2     3.02            #peak  1857
 61 GLN  QB     61 GLN  QE2     2.91            #peak  3504
 61 GLN  QG     61 GLN  QE2     2.72            #peak    42
 62 ARG  HA     65 LYS  QD      2.87            #peak  2001
 65 LYS  H      65 LYS  QD      3.16            #peak  1897
 65 LYS  HA     65 LYS  QD      2.42            #peak  4106
 65 LYS  QD     66 ALA  H       2.85            #peak  1891
 67 ALA  HA     70 GLN  QB      2.92            #peak  4152
 68 TYR  H      68 TYR  QB      2.23            #peak   292
 68 TYR  QB     69 ASP  H       2.56            #peak   308
 70 GLN  H      70 GLN  QB      2.80            #peak  4143
 70 GLN  H      70 GLN  QG      2.30            #peak  2702
 70 GLN  QB     70 GLN  QE2     2.52            #peak  4140
 70 GLN  QB     71 ARG  H       2.83            #peak  4161
 70 GLN  QG     70 GLN  QE2     2.57            #peak  2723
 70 GLN  QG     71 ARG  H       2.98            #peak  2720
# Restraints file 2: 15N-NOESY.upl
 56 LEU  HG     58 ALA  H       5.27            #peak     3
 57 PRO  HA     58 ALA  H       3.36            #peak     4
 56 LEU  HA     58 ALA  H       4.03            #peak     5
 58 ALA  H      59 GLU  H       5.14            #peak     7
 55 ALA  HA     58 ALA  H       4.58            #peak     8
 56 LEU  QB     58 ALA  H       5.50            #peak     9
 58 ALA  H      58 ALA  QB      3.68            #peak    10
 55 ALA  H      55 ALA  QB      2.87            #peak    15
 52 VAL  HA     55 ALA  H       4.85            #peak    16
 54 ALA  QB     55 ALA  H       3.23            #peak    17
 51 GLU  HA     55 ALA  H       4.41            #peak    18
 53 PHE  HA     55 ALA  H       3.90            #peak    19
 54 ALA  H      55 ALA  H       4.03            #peak    20
 66 ALA  QB     67 ALA  H       3.32            #peak    25
 67 ALA  H      67 ALA  HA      2.40            #peak    27
 63 GLU  HA     67 ALA  H       2.40            #peak    28
 64 LEU  HA     67 ALA  H       2.40            #peak    29
 66 ALA  HA     67 ALA  H       2.40            #peak    30
 67 ALA  H      67 ALA  QB      2.87            #peak    31
 66 ALA  H      67 ALA  H       2.40            #peak    24
 65 LYS  QB     66 ALA  H       3.74            #peak    34
 66 ALA  H      66 ALA  QB      2.81            #peak    36
 65 LYS  HD3    66 ALA  H       3.68            #peak    38
 62 ARG  HA     66 ALA  H       4.05            #peak    39
 65 LYS  QG     66 ALA  H       2.94            #peak    40
 63 GLU  HA     66 ALA  H       4.43            #peak    41
 65 LYS  HD2    66 ALA  H       3.68            #peak    44
 49 ASP  HA     51 GLU  H       4.26            #peak    46
 51 GLU  H      51 GLU  QB      3.07            #peak    47
 47 GLN  HA     51 GLU  H       3.99            #peak    49
 48 VAL  HA     51 GLU  H       4.39            #peak    50
 49 ASP  QB     51 GLU  H       4.78            #peak    51
 51 GLU  H      51 GLU  QG      3.98            #peak    53
 46 SER  HA     51 GLU  H       4.27            #peak    54
 48 VAL  H      48 VAL  QG2     2.40            #peak    58
 47 GLN  HA     48 VAL  H       3.16            #peak    59
 47 GLN  H      48 VAL  H       4.31            #peak   152
 44 ALA  HA     48 VAL  H       5.50            #peak    63
 46 SER  HA     48 VAL  H       3.65            #peak    64
 47 GLN  QB     48 VAL  H       3.26            #peak    65
 48 VAL  H      48 VAL  HB      3.52            #peak    66
 48 VAL  H      48 VAL  QG1     2.40            #peak    68
 45 PHE  HA     48 VAL  H       3.55            #peak    69
 47 GLN  QG     48 VAL  H       5.50            #peak    70
 38 ASN  H      38 ASN  HD21    5.50            #peak    74
 30 GLU  H      30 GLU  QG      4.87            #peak    81
 68 TYR  H      68 TYR  HB3     3.98            #peak    82
 67 ALA  H      68 TYR  H       2.40            #peak    26
 68 TYR  H      68 TYR  QD      4.24            #peak    86
 67 ALA  HA     68 TYR  H       2.40            #peak    87
 68 TYR  H      68 TYR  HB2     3.98            #peak    88
 68 TYR  H      68 TYR  QE      5.50            #peak    89
 68 TYR  H      69 ASP  H       3.12            #peak   297
 64 LEU  HA     68 TYR  H       2.40            #peak    91
 65 LYS  HA     68 TYR  H       3.30            #peak    92
 66 ALA  HA     68 TYR  H       2.40            #peak    93
 67 ALA  QB     68 TYR  H       3.72            #peak    94
 32 ASN  HA     33 SER  H       3.09            #peak    97
 47 GLN  HA     47 GLN  HE21    5.50            #peak    99
 47 GLN  H      47 GLN  HE21    5.50            #peak   101
 47 GLN  QB     47 GLN  HE21    5.50            #peak   102
 39 LEU  H      39 LEU  QD1     5.48            #peak   108
 38 ASN  HB2    39 LEU  H       5.43            #peak   109
 39 LEU  H      39 LEU  QB      3.10            #peak   110
 39 LEU  H      39 LEU  QD2     5.48            #peak   111
 38 ASN  HB3    39 LEU  H       5.43            #peak   112
 39 LEU  H      39 LEU  HG      3.56            #peak   113
 38 ASN  HA     39 LEU  H       2.88            #peak   115
 64 LEU  QB     65 LYS  H       3.36            #peak   116
 65 LYS  H      65 LYS  QB      2.63            #peak   117
 65 LYS  H      66 ALA  H       4.05            #peak    37
 64 LEU  QD2    65 LYS  H       5.50            #peak   119
 61 GLN  HA     65 LYS  H       5.19            #peak   121
 65 LYS  H      65 LYS  HD3     3.72            #peak   122
 62 ARG  HA     65 LYS  H       4.76            #peak   123
 64 LEU  HG     65 LYS  H       2.80            #peak   124
 65 LYS  H      65 LYS  QG      3.82            #peak   125
 63 GLU  HA     65 LYS  H       3.99            #peak   126
 64 LEU  QD1    65 LYS  H       5.50            #peak   129
 64 LEU  H      65 LYS  H       3.41            #peak   130
 65 LYS  H      65 LYS  HD2     3.72            #peak   131
 61 GLN  HA     61 GLN  HE21    5.50            #peak   134
 61 GLN  QB     61 GLN  HE21    5.50            #peak   135
 40 ILE  H      40 ILE  HG12    4.23            #peak   140
 39 LEU  H      40 ILE  H       2.94            #peak   141
 39 LEU  QB     40 ILE  H       3.83            #peak   143
 40 ILE  H      40 ILE  HB      3.60            #peak   145
 40 ILE  H      40 ILE  HG13    4.23            #peak   146
 39 LEU  HG     40 ILE  H       4.23            #peak   147
 40 ILE  H      40 ILE  QD1     4.81            #peak   148
 40 ILE  H      40 ILE  QG2     3.78            #peak   149
 44 ALA  HA     47 GLN  H       5.30            #peak   155
 45 PHE  HA     47 GLN  H       4.45            #peak   158
 46 SER  QB     47 GLN  H       5.50            #peak   159
 47 GLN  H      47 GLN  QG      4.71            #peak   160
 46 SER  H      47 GLN  H       2.81            #peak   489
 70 GLN  H      70 GLN  HE21    5.50            #peak   165
 70 GLN  HA     70 GLN  HE21    5.50            #peak   166
 70 GLN  HB3    70 GLN  HE21    5.50            #peak   168
 70 GLN  HB2    70 GLN  HE21    5.50            #peak   169
 31 SER  QB     32 ASN  H       5.50            #peak   171
 40 ILE  HA     41 ALA  H       3.37            #peak   178
 41 ALA  H      41 ALA  QB      3.46            #peak   179
 40 ILE  HG12   41 ALA  H       4.72            #peak   180
 40 ILE  H      41 ALA  H       2.64            #peak   144
 40 ILE  HB     41 ALA  H       4.61            #peak   183
 40 ILE  HG13   41 ALA  H       4.72            #peak   184
 40 ILE  QD1    41 ALA  H       5.50            #peak   186
 40 ILE  QG2    41 ALA  H       4.22            #peak   187
 33 SER  QB     34 ASP  H       5.50            #peak   192
 69 ASP  QB     70 GLN  H       4.12            #peak   194
 70 GLN  H      70 GLN  HG2     4.45            #peak   195
 68 TYR  HA     70 GLN  H       4.85            #peak   196
 70 GLN  H      70 GLN  HG3     4.45            #peak   200
 67 ALA  HA     70 GLN  H       3.12            #peak   201
 69 ASP  H      70 GLN  H       3.42            #peak   298
 66 ALA  HA     70 GLN  H       3.05            #peak   206
 49 ASP  HA     52 VAL  H       5.33            #peak   210
 52 VAL  H      52 VAL  HB      3.36            #peak   211
 51 GLU  QB     52 VAL  H       4.35            #peak   212
 51 GLU  H      52 VAL  H       3.46            #peak   213
 47 GLN  HA     52 VAL  H       5.50            #peak   214
 48 VAL  HA     52 VAL  H       5.50            #peak   215
 35 ALA  QB     36 GLY  H       5.04            #peak   222
 36 GLY  H      37 ILE  H       4.85            #peak   228
 60 LEU  H      60 LEU  QD2     5.50            #peak   234
 60 LEU  H      60 LEU  QD1     5.50            #peak   238
 58 ALA  HA     60 LEU  H       5.50            #peak   239
 59 GLU  QG     60 LEU  H       4.81            #peak   241
 60 LEU  H      62 ARG  H       4.64            #peak   244
 59 GLU  QB     60 LEU  H       3.99            #peak   245
 60 LEU  H      60 LEU  HG      3.29            #peak   246
 45 PHE  H      45 PHE  QD      4.81            #peak   250
 44 ALA  H      45 PHE  H       2.51            #peak   254
 44 ALA  QB     45 PHE  H       4.18            #peak   255
 45 PHE  H      46 SER  H       2.86            #peak   492
 54 ALA  HA     59 GLU  H       3.24            #peak   264
 59 GLU  H      60 LEU  H       4.26            #peak   266
 56 LEU  HA     59 GLU  H       5.50            #peak   267
 59 GLU  H      59 GLU  QG      4.61            #peak   270
 55 ALA  HA     59 GLU  H       5.19            #peak   271
 58 ALA  QB     59 GLU  H       4.10            #peak   272
 59 GLU  H      59 GLU  QB      3.61            #peak   273
 42 LEU  HA     44 ALA  H       5.50            #peak   274
 42 LEU  HG     44 ALA  H       5.50            #peak   277
 42 LEU  QB     44 ALA  H       5.30            #peak   281
 44 ALA  H      44 ALA  QB      3.70            #peak   282
 48 VAL  QG2    49 ASP  H       2.40            #peak   286
 47 GLN  HA     49 ASP  H       4.44            #peak   287
 48 VAL  H      49 ASP  H       5.09            #peak   288
 48 VAL  HA     49 ASP  H       3.13            #peak   289
 49 ASP  H      49 ASP  QB      3.66            #peak   290
 48 VAL  HB     49 ASP  H       4.32            #peak   291
 48 VAL  QG1    49 ASP  H       2.40            #peak   293
 68 TYR  HB3    69 ASP  H       4.57            #peak   294
 69 ASP  H      69 ASP  QB      3.30            #peak   295
 68 TYR  QD     69 ASP  H       4.95            #peak   299
 67 ALA  HA     69 ASP  H       5.50            #peak   300
 68 TYR  HB2    69 ASP  H       4.57            #peak   301
 65 LYS  HA     69 ASP  H       5.50            #peak   304
 66 ALA  HA     69 ASP  H       4.67            #peak   305
 71 ARG  QB     72 GLN  H       5.13            #peak   307
 68 TYR  HA     72 GLN  H       2.43            #peak   308
 72 GLN  H      72 GLN  QG      4.56            #peak   309
 70 GLN  HA     72 GLN  H       2.40            #peak   310
 71 ARG  QG     72 GLN  H       4.89            #peak   311
 69 ASP  HA     72 GLN  H       3.39            #peak   314
 71 ARG  HA     72 GLN  H       2.40            #peak   315
 72 GLN  H      72 GLN  HA      2.40            #peak   317
 38 ASN  H      39 LEU  H       5.06            #peak   114
 37 ILE  HB     38 ASN  H       5.00            #peak   322
 37 ILE  QD1    38 ASN  H       5.10            #peak   323
 38 ASN  H      38 ASN  HD22    5.50            #peak   413
 37 ILE  H      38 ASN  H       4.77            #peak   463
 61 GLN  H      61 GLN  QG      3.34            #peak   330
 60 LEU  QD2    61 GLN  H       5.50            #peak   331
 59 GLU  HA     61 GLN  H       5.50            #peak   333
 60 LEU  H      61 GLN  H       3.32            #peak   336
 60 LEU  QD1    61 GLN  H       5.50            #peak   337
 58 ALA  HA     61 GLN  H       4.56            #peak   338
 60 LEU  QB     61 GLN  H       3.83            #peak   339
 61 GLN  H      61 GLN  QB      3.52            #peak   340
 61 GLN  H      62 ARG  H       2.56            #peak   436
 60 LEU  HG     61 GLN  H       4.38            #peak   344
 34 ASP  HA     35 ALA  H       3.54            #peak   345
 35 ALA  H      35 ALA  QB      3.77            #peak   346
 35 ALA  H      36 GLY  H       3.38            #peak   347
 34 ASP  QB     35 ALA  H       4.99            #peak   348
 49 ASP  HA     53 PHE  H       4.05            #peak   352
 52 VAL  HB     53 PHE  H       3.75            #peak   353
 53 PHE  H      53 PHE  HB2     3.95            #peak   354
 52 VAL  H      53 PHE  H       3.53            #peak   220
 52 VAL  QG1    53 PHE  H       4.73            #peak   357
 53 PHE  H      53 PHE  HB3     3.95            #peak   358
 51 GLU  HA     53 PHE  H       4.99            #peak   359
 52 VAL  QG2    53 PHE  H       4.73            #peak   362
 53 PHE  H      53 PHE  QD      4.93            #peak   363
 70 GLN  HG2    71 ARG  H       5.50            #peak   367
 71 ARG  H      71 ARG  QB      4.18            #peak   368
 68 TYR  HA     71 ARG  H       4.55            #peak   369
 71 ARG  H      71 ARG  QD      5.50            #peak   370
 70 GLN  H      71 ARG  H       2.40            #peak   371
 70 GLN  HA     71 ARG  H       3.11            #peak   372
 70 GLN  HG3    71 ARG  H       5.50            #peak   373
 67 ALA  HA     71 ARG  H       4.77            #peak   374
 71 ARG  H      71 ARG  QG      4.45            #peak   375
 71 ARG  H      72 GLN  H       2.40            #peak   376
 69 ASP  HA     71 ARG  H       5.30            #peak   377
 52 VAL  HA     54 ALA  H       5.50            #peak   384
 54 ALA  H      54 ALA  QB      3.24            #peak   386
 51 GLU  HA     54 ALA  H       4.45            #peak   387
 53 PHE  H      54 ALA  H       3.86            #peak   364
 53 PHE  QD     54 ALA  H       5.03            #peak   390
 62 ARG  QG     63 GLU  H       5.02            #peak   397
 63 GLU  H      63 GLU  QB      3.36            #peak   398
 59 GLU  HA     63 GLU  H       2.40            #peak   399
 60 LEU  HA     63 GLU  H       3.87            #peak   400
 61 GLN  HA     63 GLU  H       4.91            #peak   401
 62 ARG  HA     63 GLU  H       2.40            #peak   402
 63 GLU  H      63 GLU  QG      4.27            #peak   403
 58 ALA  HA     63 GLU  H       3.75            #peak   404
 62 ARG  QB     63 GLU  H       3.59            #peak   405
 62 ARG  H      63 GLU  H       2.56            #peak   408
 42 LEU  H      42 LEU  QD1     5.01            #peak   417
 41 ALA  QB     42 LEU  H       4.75            #peak   418
 42 LEU  H      42 LEU  QD2     5.01            #peak   420
 42 LEU  H      42 LEU  HG      3.32            #peak   421
 42 LEU  H      42 LEU  QB      3.72            #peak   423
 61 GLN  QG     62 ARG  H       3.72            #peak   425
 62 ARG  H      62 ARG  QG      4.43            #peak   426
 59 GLU  HA     62 ARG  H       3.17            #peak   427
 60 LEU  HA     62 ARG  H       4.66            #peak   428
 62 ARG  H      62 ARG  QD      5.40            #peak   431
 58 ALA  HA     62 ARG  H       4.53            #peak   433
 61 GLN  QB     62 ARG  H       4.94            #peak   434
 62 ARG  H      62 ARG  QB      3.13            #peak   435
 47 GLN  HA     47 GLN  HE22    5.50            #peak   439
 47 GLN  H      47 GLN  HE22    5.50            #peak   441
 47 GLN  QB     47 GLN  HE22    5.50            #peak   442
 56 LEU  H      56 LEU  QD1     2.71            #peak   445
 54 ALA  HA     56 LEU  H       5.26            #peak   446
 55 ALA  QB     56 LEU  H       4.86            #peak   447
 56 LEU  H      56 LEU  HG      5.50            #peak   448
 52 VAL  HA     56 LEU  H       5.16            #peak   449
 56 LEU  H      56 LEU  QD2     2.71            #peak   450
 53 PHE  HA     56 LEU  H       5.50            #peak   452
 55 ALA  HA     56 LEU  H       3.04            #peak   453
 56 LEU  H      56 LEU  QB      3.45            #peak   454
 37 ILE  H      37 ILE  HG13    4.37            #peak   458
 37 ILE  H      37 ILE  HB      3.79            #peak   461
 37 ILE  H      37 ILE  QD1     4.30            #peak   462
 37 ILE  H      37 ILE  HG12    4.37            #peak   466
 61 GLN  HA     61 GLN  HE22    5.50            #peak   469
 61 GLN  QB     61 GLN  HE22    5.50            #peak   470
 63 GLU  QB     64 LEU  H       3.78            #peak   473
 64 LEU  H      64 LEU  QB      3.53            #peak   474
 64 LEU  H      64 LEU  QD2     4.48            #peak   475
 60 LEU  HA     64 LEU  H       4.98            #peak   477
 61 GLN  HA     64 LEU  H       4.84            #peak   478
 62 ARG  HA     64 LEU  H       5.50            #peak   479
 63 GLU  QG     64 LEU  H       5.06            #peak   480
 64 LEU  H      64 LEU  HG      3.97            #peak   481
 64 LEU  H      64 LEU  QD1     4.48            #peak   484
 63 GLU  H      64 LEU  H       3.90            #peak   485
 45 PHE  QD     46 SER  H       5.50            #peak   487
 45 PHE  HB3    46 SER  H       5.50            #peak   488
 44 ALA  HA     46 SER  H       5.07            #peak   490
 45 PHE  HB2    46 SER  H       5.50            #peak   495
 70 GLN  H      70 GLN  HE22    5.50            #peak   499
 70 GLN  HA     70 GLN  HE22    5.50            #peak   500
 70 GLN  HB3    70 GLN  HE22    5.50            #peak   502
 70 GLN  HB2    70 GLN  HE22    5.50            #peak   503
 36 GLY  QA     37 ILE  H       3.00            #peak   464
 37 ILE  H      37 ILE  QG1     3.81            #peak   458
 37 ILE  QG1    38 ASN  H       5.34            #peak   328
 38 ASN  H      38 ASN  QD2     4.79            #peak   413
 38 ASN  HA     38 ASN  QD2     3.03            #peak    76
 39 LEU  H      39 LEU  QQD     4.37            #peak   108
 40 ILE  QG1    41 ALA  H       3.98            #peak   180
 42 LEU  H      42 LEU  QQD     4.24            #peak   417
 42 LEU  QQD    44 ALA  H       5.40            #peak   275
 45 PHE  H      45 PHE  QB      3.55            #peak   251
 52 VAL  H      52 VAL  QQG     3.42            #peak   218
 52 VAL  QQG    53 PHE  H       3.89            #peak   362
 53 PHE  H      53 PHE  QB      3.25            #peak   358
 53 PHE  QB     54 ALA  H       3.72            #peak   382
 61 GLN  H      61 GLN  QE2     4.06            #peak   332
 65 LYS  H      65 LYS  QD      3.04            #peak   131
 65 LYS  QD     66 ALA  H       3.06            #peak    38
 68 TYR  H      68 TYR  QB      3.30            #peak    82
 68 TYR  QB     69 ASP  H       3.85            #peak   301
 70 GLN  H      70 GLN  QB      3.46            #peak   205
 70 GLN  H      70 GLN  QG      3.67            #peak   195
 70 GLN  HA     70 GLN  QE2     4.66            #peak   166
# Restraints file 3: 13C-aroNOESY.upl
 68 TYR  HB3    69 ASP  H       5.50            #peak    27
 65 LYS  HA     68 TYR  HB3     5.50            #peak    30
 45 PHE  HA     45 PHE  QD      5.50            #peak    46
 45 PHE  QD     46 SER  H       5.50            #peak    50
 50 PRO  HA     53 PHE  HB2     5.50            #peak    66
 53 PHE  HB2    54 ALA  H       5.50            #peak    69
 68 TYR  HA     71 ARG  QB      5.50            #peak    79
 68 TYR  HA     70 GLN  H       5.50            #peak    91
 68 TYR  HA     68 TYR  QE      2.76            #peak   293
 68 TYR  HA     72 GLN  H       5.50            #peak   111
 68 TYR  HA     71 ARG  H       5.50            #peak   112
 67 ALA  H      68 TYR  H       3.43            #peak   122
 67 ALA  HA     68 TYR  H       2.40            #peak   138
 68 TYR  H      68 TYR  QE      2.78            #peak   297
 68 TYR  H      69 ASP  H       3.83            #peak   150
 64 LEU  HA     68 TYR  H       2.40            #peak   152
 65 LYS  HA     68 TYR  H       3.26            #peak   158
 66 ALA  HA     68 TYR  H       2.40            #peak   162
 67 ALA  QB     68 TYR  H       3.53            #peak   166
 45 PHE  HB3    46 SER  H       5.50            #peak   181
 45 PHE  QD     68 TYR  QD      2.40            #peak   188
 68 TYR  HA     68 TYR  QD      2.40            #peak   192
 68 TYR  H      68 TYR  QD      2.40            #peak   196
 68 TYR  QD     69 ASP  H       2.58            #peak   212
 50 PRO  HA     53 PHE  HB3     5.50            #peak   229
 53 PHE  HB3    54 ALA  H       5.50            #peak   232
 45 PHE  H      45 PHE  QD      5.50            #peak   236
 44 ALA  H      45 PHE  H       5.50            #peak   244
 44 ALA  QB     45 PHE  H       5.50            #peak   246
 45 PHE  H      46 SER  H       5.50            #peak   251
 68 TYR  HB2    69 ASP  H       5.50            #peak   280
 65 LYS  HA     68 TYR  HB2     5.50            #peak   281
 45 PHE  QD     68 TYR  QE      2.40            #peak   289
 45 PHE  HA     48 VAL  H       5.50            #peak   323
 45 PHE  HA     47 GLN  H       5.50            #peak   328
 53 PHE  HA     55 ALA  H       5.50            #peak   337
 53 PHE  HA     56 LEU  QB      5.50            #peak   358
 53 PHE  HA     56 LEU  H       5.50            #peak   361
 49 ASP  HA     53 PHE  H       4.21            #peak   364
 52 VAL  HB     53 PHE  H       4.73            #peak   367
 52 VAL  H      53 PHE  H       3.36            #peak   373
 52 VAL  QG1    53 PHE  H       4.10            #peak   379
 51 GLU  HA     53 PHE  H       3.27            #peak   385
 52 VAL  QG2    53 PHE  H       4.10            #peak   394
 53 PHE  H      53 PHE  QD      2.40            #peak   424
 53 PHE  H      54 ALA  H       3.72            #peak   400
 53 PHE  QD     56 LEU  QD1     2.40            #peak   406
 53 PHE  QD     64 LEU  QD2     2.40            #peak   409
 53 PHE  QD     56 LEU  QD2     2.40            #peak   415
 53 PHE  QD     68 TYR  QE      2.40            #peak   317
 53 PHE  HA     53 PHE  QD      2.69            #peak   421
 53 PHE  QD     64 LEU  QD1     2.40            #peak   430
 53 PHE  QD     54 ALA  H       3.85            #peak   433
 45 PHE  HB2    46 SER  H       5.50            #peak   447
 45 PHE  QB     68 TYR  QE      2.39            #peak   303
 52 VAL  QQG    53 PHE  H       3.25            #peak   379
 53 PHE  H      53 PHE  QB      3.45            #peak   370
 68 TYR  H      68 TYR  QB      3.04            #peak   118
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ILE  40           H        ILE  40   1.807   0.001   0.855
    2    HA   ILE  40           HA       ILE  40   1.719   0.800  -1.863
    3    HB   ILE  40           HB       ILE  40   4.068   0.446  -1.928
    4   HG12  ILE  40          1HG1      ILE  40   4.699  -0.718   0.578
    5   HG13  ILE  40          2HG1      ILE  40   3.461  -1.730  -0.159
    6   HG21  ILE  40          1HG2      ILE  40   2.849   1.999  -0.011
    7   HG22  ILE  40          2HG2      ILE  40   4.087   1.134   0.898
    8   HG23  ILE  40          3HG2      ILE  40   4.539   2.100  -0.506
    9   HD11  ILE  40          1HD1      ILE  40   5.088  -1.401  -2.262
   10   HD12  ILE  40          2HD1      ILE  40   6.258  -1.278  -0.948
   11   HD13  ILE  40          3HD1      ILE  40   5.248  -2.715  -1.097
   12    H    ALA  41           H        ALA  41   3.438  -0.856  -3.209
   13    HA   ALA  41           HA       ALA  41   3.543  -2.743  -4.480
   14    HB1  ALA  41          1HB       ALA  41   3.201  -4.821  -3.478
   15    HB2  ALA  41          2HB       ALA  41   3.623  -3.766  -2.128
   16    HB3  ALA  41          3HB       ALA  41   1.938  -4.205  -2.411
   17    H    LEU  42           H        LEU  42   0.999  -0.939  -4.171
   18    HA   LEU  42           HA       LEU  42  -0.905  -2.721  -5.518
   19    HB2  LEU  42          1HB       LEU  42  -1.170  -0.173  -3.987
   20    HB3  LEU  42          2HB       LEU  42  -2.399  -0.601  -5.175
   21    HG   LEU  42           HG       LEU  42  -1.624  -2.313  -2.815
   22   HD11  LEU  42          1HD1      LEU  42  -3.377  -1.452  -1.612
   23   HD12  LEU  42          2HD1      LEU  42  -4.227  -0.881  -3.048
   24   HD13  LEU  42          3HD1      LEU  42  -2.813  -0.010  -2.456
   25   HD21  LEU  42          1HD2      LEU  42  -3.901  -2.509  -4.783
   26   HD22  LEU  42          2HD2      LEU  42  -3.671  -3.538  -3.369
   27   HD23  LEU  42          3HD2      LEU  42  -2.506  -3.585  -4.693
   28    HA   PRO  43           HA       PRO  43  -0.426  -0.815  -9.440
   29    HB2  PRO  43          1HB       PRO  43  -2.980  -0.724 -10.356
   30    HB3  PRO  43          2HB       PRO  43  -2.062  -2.228 -10.219
   31    HG2  PRO  43          1HG       PRO  43  -4.115  -1.086  -8.364
   32    HG3  PRO  43          2HG       PRO  43  -3.910  -2.760  -8.911
   33    HD2  PRO  43          1HD       PRO  43  -3.054  -1.904  -6.489
   34    HD3  PRO  43          2HD       PRO  43  -2.221  -3.180  -7.400
   35    H    ALA  44           H        ALA  44  -2.095   0.745  -6.951
   36    HA   ALA  44           HA       ALA  44  -3.207   2.985  -8.160
   37    HB1  ALA  44          1HB       ALA  44  -2.118   2.399  -5.459
   38    HB2  ALA  44          2HB       ALA  44  -2.444   4.081  -5.877
   39    HB3  ALA  44          3HB       ALA  44  -3.741   2.889  -5.944
   40    H    PHE  45           H        PHE  45   0.119   2.158  -7.635
   41    HA   PHE  45           HA       PHE  45   1.249   4.737  -7.813
   42    HB2  PHE  45          1HB       PHE  45   2.333   1.978  -8.346
   43    HB3  PHE  45          2HB       PHE  45   3.320   3.419  -8.567
   44    HD1  PHE  45           HD1      PHE  45   4.560   4.205  -6.795
   45    HD2  PHE  45           HD2      PHE  45   1.153   1.775  -6.021
   46    HE1  PHE  45           HE1      PHE  45   5.119   4.192  -4.399
   47    HE2  PHE  45           HE2      PHE  45   1.706   1.758  -3.624
   48    HZ   PHE  45           HZ       PHE  45   3.690   2.968  -2.810
   49    H    SER  46           H        SER  46  -0.295   2.812 -10.126
   50    HA   SER  46           HA       SER  46   1.042   3.275 -12.486
   51    HB2  SER  46          1HB       SER  46  -0.784   1.893 -12.778
   52    HB3  SER  46          2HB       SER  46  -1.839   2.902 -11.788
   53    HG   SER  46           HG       SER  46  -1.397   2.963 -14.473
   54    H    GLN  47           H        GLN  47  -1.875   5.152 -11.734
   55    HA   GLN  47           HA       GLN  47  -0.742   7.694 -11.745
   56    HB2  GLN  47          1HB       GLN  47  -0.986   6.508 -14.377
   57    HB3  GLN  47          2HB       GLN  47  -1.947   7.976 -14.250
   58    HG2  GLN  47          1HG       GLN  47   0.780   8.159 -13.172
   59    HG3  GLN  47          2HG       GLN  47   0.663   7.917 -14.914
   60   HE21  GLN  47          1HE2      GLN  47  -1.120  11.268 -13.370
   61   HE22  GLN  47          2HE2      GLN  47  -1.210   9.763 -12.528
   62    H    VAL  48           H        VAL  48  -3.504   6.504 -13.648
   63    HA   VAL  48           HA       VAL  48  -5.751   6.794 -13.422
   64    HB   VAL  48           HB       VAL  48  -5.020   7.271 -10.532
   65   HG11  VAL  48          1HG1      VAL  48  -7.065   8.247 -10.491
   66   HG12  VAL  48          2HG1      VAL  48  -7.612   7.419 -11.950
   67   HG13  VAL  48          3HG1      VAL  48  -7.595   6.568 -10.405
   68   HG21  VAL  48          1HG2      VAL  48  -6.027   4.989 -10.272
   69   HG22  VAL  48          2HG2      VAL  48  -6.061   4.873 -12.032
   70   HG23  VAL  48          3HG2      VAL  48  -4.521   5.032 -11.188
   71    H    ASP  49           H        ASP  49  -4.826   9.128 -10.929
   72    HA   ASP  49           HA       ASP  49  -5.036  11.400 -12.649
   73    HB2  ASP  49          1HB       ASP  49  -7.462  10.374 -11.581
   74    HB3  ASP  49          2HB       ASP  49  -7.104  11.875 -10.732
   75    HA   PRO  50           HA       PRO  50  -2.699  13.187  -9.391
   76    HB2  PRO  50          1HB       PRO  50  -3.225  15.822  -9.779
   77    HB3  PRO  50          2HB       PRO  50  -2.189  14.880 -10.858
   78    HG2  PRO  50          1HG       PRO  50  -5.066  15.642 -11.183
   79    HG3  PRO  50          2HG       PRO  50  -3.761  15.658 -12.384
   80    HD2  PRO  50          1HD       PRO  50  -5.594  13.669 -12.251
   81    HD3  PRO  50          2HD       PRO  50  -3.920  13.392 -12.773
   82    H    GLU  51           H        GLU  51  -5.974  14.553  -9.726
   83    HA   GLU  51           HA       GLU  51  -6.249  15.688  -7.226
   84    HB2  GLU  51          1HB       GLU  51  -8.153  14.538  -9.205
   85    HB3  GLU  51          2HB       GLU  51  -8.762  14.883  -7.593
   86    HG2  GLU  51          1HG       GLU  51  -7.249  17.119  -8.502
   87    HG3  GLU  51          2HG       GLU  51  -8.409  16.662  -9.748
   88    H    VAL  52           H        VAL  52  -6.308  12.333  -8.131
   89    HA   VAL  52           HA       VAL  52  -7.554  11.328  -5.784
   90    HB   VAL  52           HB       VAL  52  -5.588   9.799  -7.476
   91   HG11  VAL  52          1HG1      VAL  52  -6.286   8.617  -5.521
   92   HG12  VAL  52          2HG1      VAL  52  -7.979   9.019  -5.817
   93   HG13  VAL  52          3HG1      VAL  52  -7.130   7.918  -6.902
   94   HG21  VAL  52          1HG2      VAL  52  -7.655   9.129  -8.798
   95   HG22  VAL  52          2HG2      VAL  52  -8.439  10.537  -8.081
   96   HG23  VAL  52          3HG2      VAL  52  -7.011  10.744  -9.096
   97    H    PHE  53           H        PHE  53  -4.154  11.651  -6.768
   98    HA   PHE  53           HA       PHE  53  -3.054  10.543  -4.419
   99    HB2  PHE  53          1HB       PHE  53  -2.008  11.222  -6.793
  100    HB3  PHE  53          2HB       PHE  53  -1.525  12.640  -5.868
  101    HD1  PHE  53           HD1      PHE  53  -0.522   9.488  -6.896
  102    HD2  PHE  53           HD2      PHE  53  -0.500  12.017  -3.472
  103    HE1  PHE  53           HE1      PHE  53   1.391   8.235  -5.987
  104    HE2  PHE  53           HE2      PHE  53   1.413  10.768  -2.558
  105    HZ   PHE  53           HZ       PHE  53   2.361   8.875  -3.816
  106    H    ALA  54           H        ALA  54  -3.776  13.880  -5.359
  107    HA   ALA  54           HA       ALA  54  -2.754  15.011  -2.937
  108    HB1  ALA  54          1HB       ALA  54  -2.914  16.212  -5.132
  109    HB2  ALA  54          2HB       ALA  54  -4.658  16.304  -4.878
  110    HB3  ALA  54          3HB       ALA  54  -3.559  17.098  -3.750
  111    H    ALA  55           H        ALA  55  -5.672  13.479  -3.821
  112    HA   ALA  55           HA       ALA  55  -7.476  14.796  -2.088
  113    HB1  ALA  55          1HB       ALA  55  -8.790  13.555  -3.393
  114    HB2  ALA  55          2HB       ALA  55  -7.487  12.430  -3.777
  115    HB3  ALA  55          3HB       ALA  55  -8.427  12.218  -2.300
  116    H    LEU  56           H        LEU  56  -5.321  12.033  -1.661
  117    HA   LEU  56           HA       LEU  56  -6.267  11.482   1.003
  118    HB2  LEU  56          1HB       LEU  56  -4.116  10.398  -0.761
  119    HB3  LEU  56          2HB       LEU  56  -4.088  10.039   0.964
  120    HG   LEU  56           HG       LEU  56  -6.624   9.499  -0.466
  121   HD11  LEU  56          1HD1      LEU  56  -4.048   8.277  -1.202
  122   HD12  LEU  56          2HD1      LEU  56  -5.551   8.405  -2.116
  123   HD13  LEU  56          3HD1      LEU  56  -5.370   7.152  -0.888
  124   HD21  LEU  56          1HD2      LEU  56  -6.763   8.844   1.721
  125   HD22  LEU  56          2HD2      LEU  56  -5.054   8.419   1.820
  126   HD23  LEU  56          3HD2      LEU  56  -6.183   7.348   0.989
  127    HA   PRO  57           HA       PRO  57  -3.605  14.042   3.371
  128    HB2  PRO  57          1HB       PRO  57  -2.889  12.415   5.423
  129    HB3  PRO  57          2HB       PRO  57  -4.513  13.090   5.254
  130    HG2  PRO  57          1HG       PRO  57  -3.509  10.367   4.522
  131    HG3  PRO  57          2HG       PRO  57  -5.022  10.822   5.326
  132    HD2  PRO  57          1HD       PRO  57  -4.899  10.213   2.691
  133    HD3  PRO  57          2HD       PRO  57  -6.049  11.397   3.344
  134    H    ALA  58           H        ALA  58  -1.509  14.658   3.423
  135    HA   ALA  58           HA       ALA  58   0.436  13.467   1.882
  136    HB1  ALA  58          1HB       ALA  58   0.268  15.795   3.233
  137    HB2  ALA  58          2HB       ALA  58   1.453  14.939   4.220
  138    HB3  ALA  58          3HB       ALA  58   1.753  15.187   2.500
  139    H    GLU  59           H        GLU  59  -0.229  13.003   5.317
  140    HA   GLU  59           HA       GLU  59   2.013  11.578   6.080
  141    HB2  GLU  59          1HB       GLU  59   0.438  12.220   7.746
  142    HB3  GLU  59          2HB       GLU  59  -0.862  11.339   6.954
  143    HG2  GLU  59          1HG       GLU  59  -0.106  10.180   8.944
  144    HG3  GLU  59          2HG       GLU  59   0.218   9.228   7.497
  145    H    LEU  60           H        LEU  60  -0.849  10.466   4.356
  146    HA   LEU  60           HA       LEU  60   0.095   7.720   4.334
  147    HB2  LEU  60          1HB       LEU  60  -2.199   7.761   4.532
  148    HB3  LEU  60          2HB       LEU  60  -2.372   9.134   3.440
  149    HG   LEU  60           HG       LEU  60  -1.442   6.544   2.306
  150   HD11  LEU  60          1HD1      LEU  60  -3.256   5.774   3.652
  151   HD12  LEU  60          2HD1      LEU  60  -3.827   5.885   1.988
  152   HD13  LEU  60          3HD1      LEU  60  -4.271   7.128   3.157
  153   HD21  LEU  60          1HD2      LEU  60  -3.457   7.787   0.791
  154   HD22  LEU  60          2HD2      LEU  60  -1.726   7.734   0.455
  155   HD23  LEU  60          3HD2      LEU  60  -2.405   9.076   1.377
  156    H    GLN  61           H        GLN  61  -0.296  10.420   2.097
  157    HA   GLN  61           HA       GLN  61   0.367   9.053  -0.267
  158    HB2  GLN  61          1HB       GLN  61  -0.035  11.046  -1.193
  159    HB3  GLN  61          2HB       GLN  61  -0.329  11.660   0.428
  160    HG2  GLN  61          1HG       GLN  61   1.898  12.449   0.627
  161    HG3  GLN  61          2HG       GLN  61   2.394  11.605  -0.839
  162   HE21  GLN  61          1HE2      GLN  61  -0.196  14.679  -1.526
  163   HE22  GLN  61          2HE2      GLN  61  -0.561  13.445  -0.374
  164    H    ARG  62           H        ARG  62   2.314  10.308   2.318
  165    HA   ARG  62           HA       ARG  62   4.783  10.198   0.827
  166    HB2  ARG  62          1HB       ARG  62   5.801  11.118   2.689
  167    HB3  ARG  62          2HB       ARG  62   4.160  11.729   2.850
  168    HG2  ARG  62          1HG       ARG  62   3.749   9.689   4.341
  169    HG3  ARG  62          2HG       ARG  62   5.507   9.546   4.394
  170    HD2  ARG  62          1HD       ARG  62   5.637  11.870   5.218
  171    HD3  ARG  62          2HD       ARG  62   3.876  11.941   5.230
  172    HE   ARG  62           HE       ARG  62   4.361   9.806   6.778
  173   HH11  ARG  62          1HH1      ARG  62   5.686  13.025   6.768
  174   HH12  ARG  62          2HH1      ARG  62   5.984  13.049   8.474
  175   HH21  ARG  62          1HH2      ARG  62   4.748   9.825   9.026
  176   HH22  ARG  62          2HH2      ARG  62   5.450  11.227   9.758
  177    H    GLU  63           H        GLU  63   2.916   8.088   2.840
  178    HA   GLU  63           HA       GLU  63   5.020   6.289   3.523
  179    HB2  GLU  63          1HB       GLU  63   3.063   6.313   4.901
  180    HB3  GLU  63          2HB       GLU  63   2.016   6.005   3.523
  181    HG2  GLU  63          1HG       GLU  63   2.438   3.786   3.517
  182    HG3  GLU  63          2HG       GLU  63   4.098   3.987   4.074
  183    H    LEU  64           H        LEU  64   2.885   6.649   0.799
  184    HA   LEU  64           HA       LEU  64   3.482   4.031  -0.277
  185    HB2  LEU  64          1HB       LEU  64   1.935   4.489  -1.934
  186    HB3  LEU  64          2HB       LEU  64   1.303   5.369  -0.544
  187    HG   LEU  64           HG       LEU  64   2.722   7.331  -1.700
  188   HD11  LEU  64          1HD1      LEU  64   1.841   6.890  -4.222
  189   HD12  LEU  64          2HD1      LEU  64   2.349   5.268  -3.753
  190   HD13  LEU  64          3HD1      LEU  64   3.495   6.606  -3.678
  191   HD21  LEU  64          1HD2      LEU  64   0.123   6.852  -1.190
  192   HD22  LEU  64          2HD2      LEU  64   0.090   6.886  -2.954
  193   HD23  LEU  64          3HD2      LEU  64   0.704   8.275  -2.055
  194    H    LYS  65           H        LYS  65   4.550   7.333  -0.696
  195    HA   LYS  65           HA       LYS  65   6.094   6.747  -3.065
  196    HB2  LYS  65          1HB       LYS  65   6.077   9.197  -1.292
  197    HB3  LYS  65          2HB       LYS  65   6.880   9.072  -2.852
  198    HG2  LYS  65          1HG       LYS  65   4.894   9.095  -4.027
  199    HG3  LYS  65          2HG       LYS  65   3.947   8.551  -2.639
  200    HD2  LYS  65          1HD       LYS  65   3.385  10.693  -2.353
  201    HD3  LYS  65          2HD       LYS  65   5.038  10.946  -1.790
  202    HE2  LYS  65          1HE       LYS  65   5.750  11.592  -3.986
  203    HE3  LYS  65          2HE       LYS  65   4.191  11.144  -4.676
  204    HZ1  LYS  65          1HZ       LYS  65   3.742  13.308  -4.419
  205    HZ2  LYS  65          2HZ       LYS  65   4.964  13.550  -3.275
  206    HZ3  LYS  65          3HZ       LYS  65   3.471  12.915  -2.796
  207    H    ALA  66           H        ALA  66   6.767   7.441   0.350
  208    HA   ALA  66           HA       ALA  66   9.575   7.286   0.167
  209    HB1  ALA  66          1HB       ALA  66   7.875   6.677   2.580
  210    HB2  ALA  66          2HB       ALA  66   9.573   7.155   2.567
  211    HB3  ALA  66          3HB       ALA  66   8.331   8.299   2.058
  212    H    ALA  67           H        ALA  67   7.122   4.853   0.971
  213    HA   ALA  67           HA       ALA  67   8.752   2.740   1.685
  214    HB1  ALA  67          1HB       ALA  67   6.825   1.366   0.510
  215    HB2  ALA  67          2HB       ALA  67   6.549   2.245   2.014
  216    HB3  ALA  67          3HB       ALA  67   6.045   2.948   0.477
  217    H    TYR  68           H        TYR  68   7.816   3.820  -1.550
  218    HA   TYR  68           HA       TYR  68   9.033   1.665  -2.939
  219    HB2  TYR  68          1HB       TYR  68   7.765   4.229  -3.633
  220    HB3  TYR  68          2HB       TYR  68   9.009   3.702  -4.761
  221    HD1  TYR  68           HD1      TYR  68   6.622   1.616  -2.813
  222    HD2  TYR  68           HD2      TYR  68   7.795   3.041  -6.647
  223    HE1  TYR  68           HE1      TYR  68   5.010   0.088  -3.868
  224    HE2  TYR  68           HE2      TYR  68   6.185   1.518  -7.712
  225    HH   TYR  68           HH       TYR  68   4.673  -0.073  -7.402
  226    H    ASP  69           H        ASP  69  10.228   4.604  -1.570
  227    HA   ASP  69           HA       ASP  69  12.691   4.573  -3.094
  228    HB2  ASP  69          1HB       ASP  69  11.307   6.446  -1.373
  229    HB3  ASP  69          2HB       ASP  69  13.004   6.311  -0.921
  230    H    GLN  70           H        GLN  70  11.576   3.715   0.131
  231    HA   GLN  70           HA       GLN  70  13.991   3.336   1.427
  232    HB2  GLN  70          1HB       GLN  70  11.403   1.803   1.681
  233    HB3  GLN  70          2HB       GLN  70  12.759   1.611   2.784
  234    HG2  GLN  70          1HG       GLN  70  11.006   4.005   2.377
  235    HG3  GLN  70          2HG       GLN  70  11.296   3.086   3.853
  236   HE21  GLN  70          1HE2      GLN  70  13.620   6.208   2.867
  237   HE22  GLN  70          2HE2      GLN  70  12.255   5.713   1.932
  238    H    ARG  71           H        ARG  71  12.141   0.953  -0.466
  239    HA   ARG  71           HA       ARG  71  14.084  -1.099  -0.226
  240    HB2  ARG  71          1HB       ARG  71  11.960  -0.775  -2.353
  241    HB3  ARG  71          2HB       ARG  71  12.802  -2.261  -1.936
  242    HG2  ARG  71          1HG       ARG  71  10.897  -0.731  -0.177
  243    HG3  ARG  71          2HG       ARG  71  10.583  -2.265  -0.991
  244    HD2  ARG  71          1HD       ARG  71  12.545  -3.198   0.310
  245    HD3  ARG  71          2HD       ARG  71  12.502  -1.713   1.260
  246    HE   ARG  71           HE       ARG  71   9.938  -2.728   1.313
  247   HH11  ARG  71          1HH1      ARG  71  13.111  -3.781   2.284
  248   HH12  ARG  71          2HH1      ARG  71  12.529  -4.759   3.591
  249   HH21  ARG  71          1HH2      ARG  71   9.160  -4.011   3.030
  250   HH22  ARG  71          2HH2      ARG  71  10.281  -4.890   4.013
  251    H    GLN  72           H        GLN  72  13.850   1.683  -2.211
  252    HA   GLN  72           HA       GLN  72  15.535   0.680  -4.326
  253    HB2  GLN  72          1HB       GLN  72  13.730   2.736  -4.150
  254    HB3  GLN  72          2HB       GLN  72  15.264   3.592  -4.074
  255    HG2  GLN  72          1HG       GLN  72  15.538   1.725  -6.139
  256    HG3  GLN  72          2HG       GLN  72  13.933   2.429  -6.330
  257   HE21  GLN  72          1HE2      GLN  72  17.283   4.682  -6.885
  258   HE22  GLN  72          2HE2      GLN  72  17.355   3.157  -6.077
  Start of MODEL    2
    1    H    ILE  40           H        ILE  40   2.846  -1.304  -3.517
    2    HA   ILE  40           HA       ILE  40   4.014  -2.532  -1.135
    3    HB   ILE  40           HB       ILE  40   4.957  -0.351  -0.646
    4   HG12  ILE  40          1HG1      ILE  40   4.586   1.316  -2.735
    5   HG13  ILE  40          2HG1      ILE  40   3.023   0.506  -2.724
    6   HG21  ILE  40          1HG2      ILE  40   6.203  -1.782  -2.150
    7   HG22  ILE  40          2HG2      ILE  40   5.313  -1.146  -3.532
    8   HG23  ILE  40          3HG2      ILE  40   6.401  -0.095  -2.626
    9   HD11  ILE  40          1HD1      ILE  40   3.187   1.082  -0.139
   10   HD12  ILE  40          2HD1      ILE  40   4.208   2.375  -0.768
   11   HD13  ILE  40          3HD1      ILE  40   2.543   2.214  -1.328
   12    H    ALA  41           H        ALA  41   1.272  -0.676  -2.156
   13    HA   ALA  41           HA       ALA  41  -0.171  -1.150   0.206
   14    HB1  ALA  41          1HB       ALA  41   1.022   1.607  -0.021
   15    HB2  ALA  41          2HB       ALA  41  -0.321   1.194   1.046
   16    HB3  ALA  41          3HB       ALA  41   1.256   0.440   1.280
   17    H    LEU  42           H        LEU  42   0.302   0.890  -2.618
   18    HA   LEU  42           HA       LEU  42  -2.603   1.234  -2.864
   19    HB2  LEU  42          1HB       LEU  42  -0.244   2.693  -3.985
   20    HB3  LEU  42          2HB       LEU  42  -1.818   2.811  -4.770
   21    HG   LEU  42           HG       LEU  42  -1.193   3.625  -1.931
   22   HD11  LEU  42          1HD1      LEU  42  -1.773   5.286  -4.379
   23   HD12  LEU  42          2HD1      LEU  42  -0.206   5.121  -3.587
   24   HD13  LEU  42          3HD1      LEU  42  -1.544   5.897  -2.740
   25   HD21  LEU  42          1HD2      LEU  42  -3.458   2.851  -2.067
   26   HD22  LEU  42          2HD2      LEU  42  -3.732   3.763  -3.551
   27   HD23  LEU  42          3HD2      LEU  42  -3.475   4.615  -2.027
   28    HA   PRO  43           HA       PRO  43  -2.956  -1.541  -6.244
   29    HB2  PRO  43          1HB       PRO  43  -4.771  -0.279  -7.820
   30    HB3  PRO  43          2HB       PRO  43  -5.199  -1.043  -6.284
   31    HG2  PRO  43          1HG       PRO  43  -4.680   1.844  -6.885
   32    HG3  PRO  43          2HG       PRO  43  -5.954   1.120  -5.886
   33    HD2  PRO  43          1HD       PRO  43  -3.721   2.227  -4.825
   34    HD3  PRO  43          2HD       PRO  43  -4.553   0.849  -4.075
   35    H    ALA  44           H        ALA  44  -2.161   1.796  -6.935
   36    HA   ALA  44           HA       ALA  44  -0.146   1.166  -8.775
   37    HB1  ALA  44          1HB       ALA  44  -2.820   1.798  -9.967
   38    HB2  ALA  44          2HB       ALA  44  -1.328   2.215 -10.812
   39    HB3  ALA  44          3HB       ALA  44  -1.672   0.533 -10.408
   40    H    PHE  45           H        PHE  45  -0.298   2.829  -6.595
   41    HA   PHE  45           HA       PHE  45   0.099   4.947  -5.852
   42    HB2  PHE  45          1HB       PHE  45   1.451   4.741  -8.488
   43    HB3  PHE  45          2HB       PHE  45   1.303   6.354  -7.797
   44    HD1  PHE  45           HD1      PHE  45   3.502   6.858  -7.209
   45    HD2  PHE  45           HD2      PHE  45   1.798   3.148  -6.002
   46    HE1  PHE  45           HE1      PHE  45   5.461   6.425  -5.784
   47    HE2  PHE  45           HE2      PHE  45   3.754   2.711  -4.575
   48    HZ   PHE  45           HZ       PHE  45   5.588   4.350  -4.463
   49    H    SER  46           H        SER  46  -2.462   4.402  -7.275
   50    HA   SER  46           HA       SER  46  -4.314   5.514  -7.995
   51    HB2  SER  46          1HB       SER  46  -3.713   6.754  -5.831
   52    HB3  SER  46          2HB       SER  46  -3.068   8.021  -6.874
   53    HG   SER  46           HG       SER  46  -5.173   8.096  -7.862
   54    H    GLN  47           H        GLN  47  -2.323   5.201  -9.922
   55    HA   GLN  47           HA       GLN  47  -1.625   7.540 -11.302
   56    HB2  GLN  47          1HB       GLN  47  -1.983   4.691 -12.218
   57    HB3  GLN  47          2HB       GLN  47  -1.433   5.967 -13.296
   58    HG2  GLN  47          1HG       GLN  47   0.068   5.875 -10.811
   59    HG3  GLN  47          2HG       GLN  47   0.152   4.368 -11.721
   60   HE21  GLN  47          1HE2      GLN  47   1.824   7.785 -13.198
   61   HE22  GLN  47          2HE2      GLN  47   0.637   7.846 -11.945
   62    H    VAL  48           H        VAL  48  -4.632   5.983 -10.954
   63    HA   VAL  48           HA       VAL  48  -5.971   6.394 -13.309
   64    HB   VAL  48           HB       VAL  48  -7.078   5.321 -11.467
   65   HG11  VAL  48          1HG1      VAL  48  -7.183   7.981 -10.058
   66   HG12  VAL  48          2HG1      VAL  48  -7.709   6.413  -9.443
   67   HG13  VAL  48          3HG1      VAL  48  -5.993   6.729  -9.703
   68   HG21  VAL  48          1HG2      VAL  48  -8.625   7.858 -11.883
   69   HG22  VAL  48          2HG2      VAL  48  -8.385   6.698 -13.189
   70   HG23  VAL  48          3HG2      VAL  48  -9.229   6.209 -11.720
   71    H    ASP  49           H        ASP  49  -5.337   8.769 -10.758
   72    HA   ASP  49           HA       ASP  49  -5.407  10.929 -12.634
   73    HB2  ASP  49          1HB       ASP  49  -7.863  10.221 -11.432
   74    HB3  ASP  49          2HB       ASP  49  -7.322  11.693 -10.630
   75    HA   PRO  50           HA       PRO  50  -2.708  12.644  -9.622
   76    HB2  PRO  50          1HB       PRO  50  -2.896  15.277 -10.256
   77    HB3  PRO  50          2HB       PRO  50  -2.033  14.107 -11.260
   78    HG2  PRO  50          1HG       PRO  50  -4.794  15.215 -11.592
   79    HG3  PRO  50          2HG       PRO  50  -3.543  14.942 -12.819
   80    HD2  PRO  50          1HD       PRO  50  -5.615  13.239 -12.449
   81    HD3  PRO  50          2HD       PRO  50  -4.012  12.691 -12.979
   82    H    GLU  51           H        GLU  51  -5.800  14.370 -10.011
   83    HA   GLU  51           HA       GLU  51  -5.842  15.792  -7.650
   84    HB2  GLU  51          1HB       GLU  51  -7.618  15.356  -9.692
   85    HB3  GLU  51          2HB       GLU  51  -8.428  14.583  -8.337
   86    HG2  GLU  51          1HG       GLU  51  -7.341  17.362  -8.113
   87    HG3  GLU  51          2HG       GLU  51  -8.927  17.047  -8.814
   88    H    VAL  52           H        VAL  52  -6.351  12.385  -8.166
   89    HA   VAL  52           HA       VAL  52  -7.578  11.795  -5.679
   90    HB   VAL  52           HB       VAL  52  -5.868   9.876  -7.247
   91   HG11  VAL  52          1HG1      VAL  52  -7.565   8.252  -6.405
   92   HG12  VAL  52          2HG1      VAL  52  -6.600   9.012  -5.138
   93   HG13  VAL  52          3HG1      VAL  52  -8.253   9.552  -5.434
   94   HG21  VAL  52          1HG2      VAL  52  -8.542  11.019  -7.901
   95   HG22  VAL  52          2HG2      VAL  52  -7.203  10.600  -8.971
   96   HG23  VAL  52          3HG2      VAL  52  -8.215   9.328  -8.286
   97    H    PHE  53           H        PHE  53  -4.209  11.606  -6.796
   98    HA   PHE  53           HA       PHE  53  -3.058  10.571  -4.492
   99    HB2  PHE  53          1HB       PHE  53  -2.061  11.212  -6.866
  100    HB3  PHE  53          2HB       PHE  53  -1.579  12.673  -6.010
  101    HD1  PHE  53           HD1      PHE  53  -0.367   9.697  -7.080
  102    HD2  PHE  53           HD2      PHE  53  -0.650  11.967  -3.491
  103    HE1  PHE  53           HE1      PHE  53   1.596   8.515  -6.182
  104    HE2  PHE  53           HE2      PHE  53   1.313  10.791  -2.588
  105    HZ   PHE  53           HZ       PHE  53   2.439   9.063  -3.934
  106    H    ALA  54           H        ALA  54  -3.624  13.965  -5.369
  107    HA   ALA  54           HA       ALA  54  -2.549  14.998  -2.934
  108    HB1  ALA  54          1HB       ALA  54  -2.453  16.690  -4.406
  109    HB2  ALA  54          2HB       ALA  54  -3.820  16.087  -5.344
  110    HB3  ALA  54          3HB       ALA  54  -4.103  17.015  -3.872
  111    H    ALA  55           H        ALA  55  -5.537  13.603  -3.801
  112    HA   ALA  55           HA       ALA  55  -7.236  14.968  -1.981
  113    HB1  ALA  55          1HB       ALA  55  -8.854  13.289  -2.460
  114    HB2  ALA  55          2HB       ALA  55  -7.989  13.628  -3.960
  115    HB3  ALA  55          3HB       ALA  55  -7.615  12.173  -3.036
  116    H    LEU  56           H        LEU  56  -5.020  12.302  -1.680
  117    HA   LEU  56           HA       LEU  56  -6.049  11.480   0.898
  118    HB2  LEU  56          1HB       LEU  56  -3.390  10.577  -0.042
  119    HB3  LEU  56          2HB       LEU  56  -4.684   9.668   0.735
  120    HG   LEU  56           HG       LEU  56  -4.572  10.488  -2.167
  121   HD11  LEU  56          1HD1      LEU  56  -4.468   7.730  -0.967
  122   HD12  LEU  56          2HD1      LEU  56  -3.035   8.649  -1.428
  123   HD13  LEU  56          3HD1      LEU  56  -4.219   8.190  -2.652
  124   HD21  LEU  56          1HD2      LEU  56  -6.763   9.630  -0.459
  125   HD22  LEU  56          2HD2      LEU  56  -6.536   8.579  -1.858
  126   HD23  LEU  56          3HD2      LEU  56  -6.794  10.310  -2.086
  127    HA   PRO  57           HA       PRO  57  -3.535  13.982   3.481
  128    HB2  PRO  57          1HB       PRO  57  -2.939  12.274   5.506
  129    HB3  PRO  57          2HB       PRO  57  -4.550  12.965   5.274
  130    HG2  PRO  57          1HG       PRO  57  -3.517  10.265   4.495
  131    HG3  PRO  57          2HG       PRO  57  -5.071  10.699   5.231
  132    HD2  PRO  57          1HD       PRO  57  -4.805  10.189   2.585
  133    HD3  PRO  57          2HD       PRO  57  -5.985  11.355   3.219
  134    H    ALA  58           H        ALA  58  -1.440  14.578   3.691
  135    HA   ALA  58           HA       ALA  58   0.582  13.443   2.207
  136    HB1  ALA  58          1HB       ALA  58   1.108  15.573   2.819
  137    HB2  ALA  58          2HB       ALA  58   0.512  15.367   4.466
  138    HB3  ALA  58          3HB       ALA  58   2.074  14.693   4.003
  139    H    GLU  59           H        GLU  59  -0.441  12.675   5.463
  140    HA   GLU  59           HA       GLU  59   1.795  11.254   6.346
  141    HB2  GLU  59          1HB       GLU  59  -0.025  11.875   7.842
  142    HB3  GLU  59          2HB       GLU  59  -1.127  10.809   6.981
  143    HG2  GLU  59          1HG       GLU  59  -0.319   9.874   9.114
  144    HG3  GLU  59          2HG       GLU  59   0.071   8.872   7.717
  145    H    LEU  60           H        LEU  60  -1.024  10.177   4.492
  146    HA   LEU  60           HA       LEU  60   0.016   7.476   4.301
  147    HB2  LEU  60          1HB       LEU  60  -2.260   7.365   4.440
  148    HB3  LEU  60          2HB       LEU  60  -2.496   8.865   3.546
  149    HG   LEU  60           HG       LEU  60  -1.463   6.519   2.046
  150   HD11  LEU  60          1HD1      LEU  60  -4.311   6.786   2.991
  151   HD12  LEU  60          2HD1      LEU  60  -3.193   5.467   3.338
  152   HD13  LEU  60          3HD1      LEU  60  -3.780   5.716   1.693
  153   HD21  LEU  60          1HD2      LEU  60  -2.472   9.087   1.478
  154   HD22  LEU  60          2HD2      LEU  60  -3.652   7.928   0.867
  155   HD23  LEU  60          3HD2      LEU  60  -1.971   7.838   0.338
  156    H    GLN  61           H        GLN  61  -0.381  10.315   2.257
  157    HA   GLN  61           HA       GLN  61   0.331   9.108  -0.190
  158    HB2  GLN  61          1HB       GLN  61  -0.339  11.123  -0.872
  159    HB3  GLN  61          2HB       GLN  61  -0.256  11.745   0.771
  160    HG2  GLN  61          1HG       GLN  61   1.946  12.486   0.502
  161    HG3  GLN  61          2HG       GLN  61   2.186  11.514  -0.949
  162   HE21  GLN  61          1HE2      GLN  61  -0.349  14.671  -1.462
  163   HE22  GLN  61          2HE2      GLN  61  -0.565  13.561  -0.156
  164    H    ARG  62           H        ARG  62   2.210  10.324   2.478
  165    HA   ARG  62           HA       ARG  62   4.696  10.341   1.016
  166    HB2  ARG  62          1HB       ARG  62   5.710  11.063   3.028
  167    HB3  ARG  62          2HB       ARG  62   4.136  11.846   2.983
  168    HG2  ARG  62          1HG       ARG  62   3.869  11.096   5.058
  169    HG3  ARG  62          2HG       ARG  62   3.627   9.505   4.334
  170    HD2  ARG  62          1HD       ARG  62   5.955   8.970   4.607
  171    HD3  ARG  62          2HD       ARG  62   6.308  10.607   5.159
  172    HE   ARG  62           HE       ARG  62   4.397   9.563   6.878
  173   HH11  ARG  62          1HH1      ARG  62   7.683   8.894   5.945
  174   HH12  ARG  62          2HH1      ARG  62   8.118   8.216   7.479
  175   HH21  ARG  62          1HH2      ARG  62   4.957   8.673   8.902
  176   HH22  ARG  62          2HH2      ARG  62   6.567   8.090   9.160
  177    H    GLU  63           H        GLU  63   2.845   8.066   2.823
  178    HA   GLU  63           HA       GLU  63   5.022   6.309   3.461
  179    HB2  GLU  63          1HB       GLU  63   3.092   6.237   4.876
  180    HB3  GLU  63          2HB       GLU  63   2.025   5.957   3.507
  181    HG2  GLU  63          1HG       GLU  63   2.596   3.748   3.332
  182    HG3  GLU  63          2HG       GLU  63   4.181   3.986   4.065
  183    H    LEU  64           H        LEU  64   2.882   6.767   0.771
  184    HA   LEU  64           HA       LEU  64   3.455   4.190  -0.409
  185    HB2  LEU  64          1HB       LEU  64   1.896   4.711  -2.021
  186    HB3  LEU  64          2HB       LEU  64   1.297   5.600  -0.622
  187    HG   LEU  64           HG       LEU  64   2.731   7.546  -1.741
  188   HD11  LEU  64          1HD1      LEU  64   1.853   7.006  -4.306
  189   HD12  LEU  64          2HD1      LEU  64   2.573   5.486  -3.774
  190   HD13  LEU  64          3HD1      LEU  64   3.523   6.971  -3.739
  191   HD21  LEU  64          1HD2      LEU  64   0.072   6.969  -1.412
  192   HD22  LEU  64          2HD2      LEU  64   0.196   7.231  -3.151
  193   HD23  LEU  64          3HD2      LEU  64   0.724   8.486  -2.030
  194    H    LYS  65           H        LYS  65   4.545   7.501  -0.709
  195    HA   LYS  65           HA       LYS  65   6.100   6.982  -3.087
  196    HB2  LYS  65          1HB       LYS  65   6.073   9.378  -1.242
  197    HB3  LYS  65          2HB       LYS  65   6.893   9.298  -2.795
  198    HG2  LYS  65          1HG       LYS  65   4.950   9.444  -3.988
  199    HG3  LYS  65          2HG       LYS  65   3.977   8.727  -2.702
  200    HD2  LYS  65          1HD       LYS  65   3.305  10.914  -2.556
  201    HD3  LYS  65          2HD       LYS  65   4.654  10.923  -1.418
  202    HE2  LYS  65          1HE       LYS  65   6.075  11.994  -2.937
  203    HE3  LYS  65          2HE       LYS  65   5.050  11.594  -4.315
  204    HZ1  LYS  65          1HZ       LYS  65   3.897  13.453  -4.039
  205    HZ2  LYS  65          2HZ       LYS  65   5.052  13.946  -2.906
  206    HZ3  LYS  65          3HZ       LYS  65   3.648  13.156  -2.392
  207    H    ALA  66           H        ALA  66   6.713   7.455   0.366
  208    HA   ALA  66           HA       ALA  66   9.537   7.340   0.197
  209    HB1  ALA  66          1HB       ALA  66   9.527   7.171   2.574
  210    HB2  ALA  66          2HB       ALA  66   8.222   8.266   2.115
  211    HB3  ALA  66          3HB       ALA  66   7.856   6.606   2.585
  212    H    ALA  67           H        ALA  67   7.060   4.888   0.826
  213    HA   ALA  67           HA       ALA  67   8.653   2.737   1.506
  214    HB1  ALA  67          1HB       ALA  67   6.004   2.994   0.171
  215    HB2  ALA  67          2HB       ALA  67   6.778   1.410   0.232
  216    HB3  ALA  67          3HB       ALA  67   6.420   2.275   1.727
  217    H    TYR  68           H        TYR  68   7.792   3.911  -1.725
  218    HA   TYR  68           HA       TYR  68   9.058   1.834  -3.161
  219    HB2  TYR  68          1HB       TYR  68   7.801   4.403  -3.769
  220    HB3  TYR  68          2HB       TYR  68   9.144   4.023  -4.842
  221    HD1  TYR  68           HD1      TYR  68   6.406   2.007  -3.274
  222    HD2  TYR  68           HD2      TYR  68   8.406   3.167  -6.846
  223    HE1  TYR  68           HE1      TYR  68   4.939   0.519  -4.571
  224    HE2  TYR  68           HE2      TYR  68   6.943   1.683  -8.153
  225    HH   TYR  68           HH       TYR  68   5.519  -0.168  -7.922
  226    H    ASP  69           H        ASP  69  10.245   4.687  -1.612
  227    HA   ASP  69           HA       ASP  69  12.769   4.675  -3.036
  228    HB2  ASP  69          1HB       ASP  69  11.568   6.755  -2.136
  229    HB3  ASP  69          2HB       ASP  69  12.145   6.257  -0.548
  230    H    GLN  70           H        GLN  70  11.530   3.767   0.140
  231    HA   GLN  70           HA       GLN  70  13.914   3.250   1.458
  232    HB2  GLN  70          1HB       GLN  70  11.246   1.849   1.674
  233    HB3  GLN  70          2HB       GLN  70  12.578   1.593   2.793
  234    HG2  GLN  70          1HG       GLN  70  10.946   4.069   2.368
  235    HG3  GLN  70          2HG       GLN  70  11.167   3.132   3.845
  236   HE21  GLN  70          1HE2      GLN  70  13.649   6.146   2.915
  237   HE22  GLN  70          2HE2      GLN  70  12.273   5.722   1.960
  238    H    ARG  71           H        ARG  71  11.954   1.010  -0.496
  239    HA   ARG  71           HA       ARG  71  14.178  -0.896  -0.485
  240    HB2  ARG  71          1HB       ARG  71  12.502  -2.449  -1.518
  241    HB3  ARG  71          2HB       ARG  71  12.084  -1.894   0.097
  242    HG2  ARG  71          1HG       ARG  71  10.954  -0.081  -1.768
  243    HG3  ARG  71          2HG       ARG  71  10.562  -1.722  -2.284
  244    HD2  ARG  71          1HD       ARG  71  10.122  -0.631   0.492
  245    HD3  ARG  71          2HD       ARG  71   8.879  -0.750  -0.752
  246    HE   ARG  71           HE       ARG  71   9.847  -2.857   0.908
  247   HH11  ARG  71          1HH1      ARG  71   8.555  -2.142  -2.245
  248   HH12  ARG  71          2HH1      ARG  71   7.904  -3.729  -2.482
  249   HH21  ARG  71          1HH2      ARG  71   8.994  -4.951   0.608
  250   HH22  ARG  71          2HH2      ARG  71   8.153  -5.326  -0.858
  251    H    GLN  72           H        GLN  72  14.386   1.532  -2.001
  252    HA   GLN  72           HA       GLN  72  14.960   2.295  -4.068
  253    HB2  GLN  72          1HB       GLN  72  15.842  -0.500  -3.937
  254    HB3  GLN  72          2HB       GLN  72  15.650   0.109  -5.576
  255    HG2  GLN  72          1HG       GLN  72  17.004   2.150  -4.405
  256    HG3  GLN  72          2HG       GLN  72  17.654   0.756  -3.543
  257   HE21  GLN  72          1HE2      GLN  72  19.560   1.522  -6.699
  258   HE22  GLN  72          2HE2      GLN  72  18.999   2.513  -5.399
  Start of MODEL    3
    1    H    ILE  40           H        ILE  40   3.923  -1.166  -3.139
    2    HA   ILE  40           HA       ILE  40   5.253  -2.522  -0.888
    3    HB   ILE  40           HB       ILE  40   5.228  -0.426   0.309
    4   HG12  ILE  40          1HG1      ILE  40   4.544   1.561  -1.465
    5   HG13  ILE  40          2HG1      ILE  40   3.346   0.320  -1.815
    6   HG21  ILE  40          1HG2      ILE  40   6.625   0.968  -1.301
    7   HG22  ILE  40          2HG2      ILE  40   7.174  -0.676  -0.978
    8   HG23  ILE  40          3HG2      ILE  40   6.330  -0.309  -2.481
    9   HD11  ILE  40          1HD1      ILE  40   3.172   0.319   0.840
   10   HD12  ILE  40          2HD1      ILE  40   3.710   1.981   0.595
   11   HD13  ILE  40          3HD1      ILE  40   2.235   1.408  -0.183
   12    H    ALA  41           H        ALA  41   2.236  -1.489  -2.204
   13    HA   ALA  41           HA       ALA  41   0.701  -3.070  -0.475
   14    HB1  ALA  41          1HB       ALA  41   1.035  -1.625   1.317
   15    HB2  ALA  41          2HB       ALA  41   0.941  -0.186   0.300
   16    HB3  ALA  41          3HB       ALA  41  -0.518  -1.109   0.660
   17    H    LEU  42           H        LEU  42   0.775  -0.163  -2.476
   18    HA   LEU  42           HA       LEU  42  -1.548  -1.170  -3.937
   19    HB2  LEU  42          1HB       LEU  42  -1.441   1.745  -3.322
   20    HB3  LEU  42          2HB       LEU  42  -2.824   0.738  -3.748
   21    HG   LEU  42           HG       LEU  42  -2.322  -0.331  -1.380
   22   HD11  LEU  42          1HD1      LEU  42  -1.053   0.832   0.040
   23   HD12  LEU  42          2HD1      LEU  42  -1.711   2.379  -0.493
   24   HD13  LEU  42          3HD1      LEU  42  -0.399   1.622  -1.395
   25   HD21  LEU  42          1HD2      LEU  42  -4.441   0.560  -1.799
   26   HD22  LEU  42          2HD2      LEU  42  -3.812   2.190  -2.040
   27   HD23  LEU  42          3HD2      LEU  42  -3.850   1.489  -0.421
   28    HA   PRO  43           HA       PRO  43   1.897   0.323  -6.666
   29    HB2  PRO  43          1HB       PRO  43   1.872  -1.859  -8.282
   30    HB3  PRO  43          2HB       PRO  43   2.811  -1.782  -6.786
   31    HG2  PRO  43          1HG       PRO  43   0.147  -3.052  -7.288
   32    HG3  PRO  43          2HG       PRO  43   1.525  -3.673  -6.362
   33    HD2  PRO  43          1HD       PRO  43  -0.631  -2.540  -5.180
   34    HD3  PRO  43          2HD       PRO  43   1.005  -2.414  -4.502
   35    H    ALA  44           H        ALA  44  -0.128   1.755  -7.049
   36    HA   ALA  44           HA       ALA  44  -0.823   1.477  -9.843
   37    HB1  ALA  44          1HB       ALA  44  -3.222   1.990  -8.231
   38    HB2  ALA  44          2HB       ALA  44  -3.014   1.010  -9.684
   39    HB3  ALA  44          3HB       ALA  44  -2.577   0.353  -8.106
   40    H    PHE  45           H        PHE  45   0.547   3.319  -7.852
   41    HA   PHE  45           HA       PHE  45  -1.014   5.761  -8.339
   42    HB2  PHE  45          1HB       PHE  45   0.345   6.797  -6.589
   43    HB3  PHE  45          2HB       PHE  45  -0.417   5.327  -5.992
   44    HD1  PHE  45           HD1      PHE  45   2.739   6.905  -6.953
   45    HD2  PHE  45           HD2      PHE  45   0.893   3.382  -5.437
   46    HE1  PHE  45           HE1      PHE  45   4.940   6.056  -6.254
   47    HE2  PHE  45           HE2      PHE  45   3.091   2.528  -4.735
   48    HZ   PHE  45           HZ       PHE  45   5.118   3.866  -5.143
   49    H    SER  46           H        SER  46   1.421   4.034  -9.700
   50    HA   SER  46           HA       SER  46   3.472   5.818 -10.236
   51    HB2  SER  46          1HB       SER  46   4.235   4.139 -11.522
   52    HB3  SER  46          2HB       SER  46   2.774   3.258 -11.078
   53    HG   SER  46           HG       SER  46   3.268   4.806 -13.389
   54    H    GLN  47           H        GLN  47   0.354   5.439 -11.848
   55    HA   GLN  47           HA       GLN  47   0.403   8.137 -12.779
   56    HB2  GLN  47          1HB       GLN  47   1.813   7.297 -14.515
   57    HB3  GLN  47          2HB       GLN  47   0.776   5.899 -14.767
   58    HG2  GLN  47          1HG       GLN  47  -0.736   8.304 -15.121
   59    HG3  GLN  47          2HG       GLN  47   0.719   8.353 -16.115
   60   HE21  GLN  47          1HE2      GLN  47  -0.291   5.164 -17.701
   61   HE22  GLN  47          2HE2      GLN  47   1.025   5.685 -16.711
   62    H    VAL  48           H        VAL  48  -1.613   8.682 -12.282
   63    HA   VAL  48           HA       VAL  48  -3.820   7.205 -13.462
   64    HB   VAL  48           HB       VAL  48  -3.649   7.651 -10.479
   65   HG11  VAL  48          1HG1      VAL  48  -5.890   8.021 -10.994
   66   HG12  VAL  48          2HG1      VAL  48  -5.897   6.805 -12.273
   67   HG13  VAL  48          3HG1      VAL  48  -5.841   6.308 -10.581
   68   HG21  VAL  48          1HG2      VAL  48  -3.973   5.114 -10.509
   69   HG22  VAL  48          2HG2      VAL  48  -3.497   5.198 -12.205
   70   HG23  VAL  48          3HG2      VAL  48  -2.383   5.736 -10.948
   71    H    ASP  49           H        ASP  49  -3.491   9.618 -10.859
   72    HA   ASP  49           HA       ASP  49  -4.140  11.859 -12.412
   73    HB2  ASP  49          1HB       ASP  49  -6.373  10.230 -11.951
   74    HB3  ASP  49          2HB       ASP  49  -6.531  11.561 -10.808
   75    HA   PRO  50           HA       PRO  50  -2.749  13.745  -8.693
   76    HB2  PRO  50          1HB       PRO  50  -3.601  16.286  -9.127
   77    HB3  PRO  50          2HB       PRO  50  -2.230  15.573  -9.985
   78    HG2  PRO  50          1HG       PRO  50  -5.065  15.904 -10.888
   79    HG3  PRO  50          2HG       PRO  50  -3.564  16.184 -11.789
   80    HD2  PRO  50          1HD       PRO  50  -5.043  13.935 -12.085
   81    HD3  PRO  50          2HD       PRO  50  -3.275  13.945 -12.251
   82    H    GLU  51           H        GLU  51  -6.103  14.304  -9.682
   83    HA   GLU  51           HA       GLU  51  -7.080  15.375  -7.299
   84    HB2  GLU  51          1HB       GLU  51  -8.381  13.754  -9.476
   85    HB3  GLU  51          2HB       GLU  51  -9.291  14.324  -8.084
   86    HG2  GLU  51          1HG       GLU  51  -7.790  16.488  -9.199
   87    HG3  GLU  51          2HG       GLU  51  -8.730  15.697 -10.463
   88    H    VAL  52           H        VAL  52  -6.097  12.172  -8.064
   89    HA   VAL  52           HA       VAL  52  -7.546  10.970  -5.849
   90    HB   VAL  52           HB       VAL  52  -5.423   9.500  -7.345
   91   HG11  VAL  52          1HG1      VAL  52  -8.057   8.845  -6.067
   92   HG12  VAL  52          2HG1      VAL  52  -7.266   7.727  -7.180
   93   HG13  VAL  52          3HG1      VAL  52  -6.456   8.211  -5.689
   94   HG21  VAL  52          1HG2      VAL  52  -6.374  10.344  -9.252
   95   HG22  VAL  52          2HG2      VAL  52  -7.414   8.947  -8.974
   96   HG23  VAL  52          3HG2      VAL  52  -7.956  10.558  -8.502
   97    H    PHE  53           H        PHE  53  -4.147  11.443  -6.804
   98    HA   PHE  53           HA       PHE  53  -3.020  10.445  -4.431
   99    HB2  PHE  53          1HB       PHE  53  -1.993  11.184  -6.803
  100    HB3  PHE  53          2HB       PHE  53  -1.582  12.613  -5.860
  101    HD1  PHE  53           HD1      PHE  53  -0.480   9.465  -6.867
  102    HD2  PHE  53           HD2      PHE  53  -0.502  12.067  -3.499
  103    HE1  PHE  53           HE1      PHE  53   1.478   8.290  -5.951
  104    HE2  PHE  53           HE2      PHE  53   1.456  10.897  -2.578
  105    HZ   PHE  53           HZ       PHE  53   2.449   9.006  -3.805
  106    H    ALA  54           H        ALA  54  -3.916  13.729  -5.404
  107    HA   ALA  54           HA       ALA  54  -2.982  14.942  -2.989
  108    HB1  ALA  54          1HB       ALA  54  -3.922  16.964  -3.818
  109    HB2  ALA  54          2HB       ALA  54  -3.222  16.111  -5.194
  110    HB3  ALA  54          3HB       ALA  54  -4.967  16.091  -4.940
  111    H    ALA  55           H        ALA  55  -5.799  13.221  -3.862
  112    HA   ALA  55           HA       ALA  55  -7.692  14.427  -2.154
  113    HB1  ALA  55          1HB       ALA  55  -9.001  13.016  -3.253
  114    HB2  ALA  55          2HB       ALA  55  -7.590  12.182  -3.905
  115    HB3  ALA  55          3HB       ALA  55  -8.283  11.672  -2.365
  116    H    LEU  56           H        LEU  56  -5.354  11.826  -1.661
  117    HA   LEU  56           HA       LEU  56  -6.258  11.308   1.029
  118    HB2  LEU  56          1HB       LEU  56  -4.093  10.256  -0.734
  119    HB3  LEU  56          2HB       LEU  56  -4.005   9.970   1.002
  120    HG   LEU  56           HG       LEU  56  -6.566   9.260  -0.270
  121   HD11  LEU  56          1HD1      LEU  56  -5.275   8.445  -2.045
  122   HD12  LEU  56          2HD1      LEU  56  -5.525   7.049  -0.997
  123   HD13  LEU  56          3HD1      LEU  56  -3.982   7.904  -0.973
  124   HD21  LEU  56          1HD2      LEU  56  -4.701   7.979   1.719
  125   HD22  LEU  56          2HD2      LEU  56  -6.209   7.247   1.172
  126   HD23  LEU  56          3HD2      LEU  56  -6.238   8.781   2.044
  127    HA   PRO  57           HA       PRO  57  -3.692  14.071   3.272
  128    HB2  PRO  57          1HB       PRO  57  -2.907  12.557   5.384
  129    HB3  PRO  57          2HB       PRO  57  -4.557  13.163   5.197
  130    HG2  PRO  57          1HG       PRO  57  -3.452  10.452   4.571
  131    HG3  PRO  57          2HG       PRO  57  -4.979  10.882   5.363
  132    HD2  PRO  57          1HD       PRO  57  -4.842  10.171   2.754
  133    HD3  PRO  57          2HD       PRO  57  -6.034  11.336   3.365
  134    H    ALA  58           H        ALA  58  -1.613  14.761   3.336
  135    HA   ALA  58           HA       ALA  58   0.370  13.615   1.813
  136    HB1  ALA  58          1HB       ALA  58   1.878  15.189   2.745
  137    HB2  ALA  58          2HB       ALA  58   0.293  15.965   2.712
  138    HB3  ALA  58          3HB       ALA  58   0.929  15.323   4.226
  139    H    GLU  59           H        GLU  59  -0.233  13.210   5.274
  140    HA   GLU  59           HA       GLU  59   2.039  11.854   6.041
  141    HB2  GLU  59          1HB       GLU  59   0.268  12.548   7.598
  142    HB3  GLU  59          2HB       GLU  59  -0.796  11.313   6.940
  143    HG2  GLU  59          1HG       GLU  59  -0.039  10.233   8.789
  144    HG3  GLU  59          2HG       GLU  59   1.177   9.716   7.622
  145    H    LEU  60           H        LEU  60  -0.801  10.617   4.361
  146    HA   LEU  60           HA       LEU  60   0.228   7.904   4.373
  147    HB2  LEU  60          1HB       LEU  60  -2.218   9.123   3.104
  148    HB3  LEU  60          2HB       LEU  60  -1.811   7.410   3.041
  149    HG   LEU  60           HG       LEU  60  -2.359   8.941   5.581
  150   HD11  LEU  60          1HD1      LEU  60  -4.541   8.156   5.569
  151   HD12  LEU  60          2HD1      LEU  60  -4.202   6.933   4.345
  152   HD13  LEU  60          3HD1      LEU  60  -4.283   8.635   3.891
  153   HD21  LEU  60          1HD2      LEU  60  -0.993   6.603   5.264
  154   HD22  LEU  60          2HD2      LEU  60  -2.643   6.028   5.505
  155   HD23  LEU  60          3HD2      LEU  60  -1.885   7.066   6.713
  156    H    GLN  61           H        GLN  61  -0.235  10.555   2.090
  157    HA   GLN  61           HA       GLN  61   0.475   9.171  -0.249
  158    HB2  GLN  61          1HB       GLN  61   0.014  11.136  -1.205
  159    HB3  GLN  61          2HB       GLN  61  -0.289  11.771   0.407
  160    HG2  GLN  61          1HG       GLN  61   1.895  12.646   0.580
  161    HG3  GLN  61          2HG       GLN  61   2.442  11.752  -0.838
  162   HE21  GLN  61          1HE2      GLN  61  -0.222  14.711  -1.715
  163   HE22  GLN  61          2HE2      GLN  61  -0.577  13.515  -0.520
  164    H    ARG  62           H        ARG  62   2.366  10.374   2.366
  165    HA   ARG  62           HA       ARG  62   4.850  10.361   0.871
  166    HB2  ARG  62          1HB       ARG  62   5.894  11.073   2.920
  167    HB3  ARG  62          2HB       ARG  62   4.418  12.003   2.693
  168    HG2  ARG  62          1HG       ARG  62   3.318  10.927   4.420
  169    HG3  ARG  62          2HG       ARG  62   4.398   9.532   4.372
  170    HD2  ARG  62          1HD       ARG  62   6.235  11.088   5.134
  171    HD3  ARG  62          2HD       ARG  62   4.979  12.290   5.426
  172    HE   ARG  62           HE       ARG  62   4.354  11.136   7.306
  173   HH11  ARG  62          1HH1      ARG  62   6.432   9.133   5.360
  174   HH12  ARG  62          2HH1      ARG  62   6.590   7.899   6.567
  175   HH21  ARG  62          1HH2      ARG  62   4.554   9.519   8.902
  176   HH22  ARG  62          2HH2      ARG  62   5.521   8.120   8.580
  177    H    GLU  63           H        GLU  63   3.004   8.215   2.852
  178    HA   GLU  63           HA       GLU  63   5.165   6.466   3.541
  179    HB2  GLU  63          1HB       GLU  63   3.254   6.491   4.982
  180    HB3  GLU  63          2HB       GLU  63   2.166   6.150   3.643
  181    HG2  GLU  63          1HG       GLU  63   2.544   3.944   3.725
  182    HG3  GLU  63          2HG       GLU  63   4.261   4.144   4.066
  183    H    LEU  64           H        LEU  64   3.000   6.803   0.855
  184    HA   LEU  64           HA       LEU  64   3.533   4.159  -0.191
  185    HB2  LEU  64          1HB       LEU  64   1.998   4.644  -1.867
  186    HB3  LEU  64          2HB       LEU  64   1.372   5.496  -0.457
  187    HG   LEU  64           HG       LEU  64   2.731   7.505  -1.535
  188   HD11  LEU  64          1HD1      LEU  64   2.727   5.472  -3.590
  189   HD12  LEU  64          2HD1      LEU  64   3.574   7.017  -3.532
  190   HD13  LEU  64          3HD1      LEU  64   1.915   6.944  -4.126
  191   HD21  LEU  64          1HD2      LEU  64   0.174   6.933  -2.915
  192   HD22  LEU  64          2HD2      LEU  64   0.703   8.381  -2.058
  193   HD23  LEU  64          3HD2      LEU  64   0.149   6.972  -1.152
  194    H    LYS  65           H        LYS  65   4.565   7.469  -0.779
  195    HA   LYS  65           HA       LYS  65   6.086   6.827  -3.125
  196    HB2  LYS  65          1HB       LYS  65   6.199   9.270  -1.345
  197    HB3  LYS  65          2HB       LYS  65   6.937   9.125  -2.935
  198    HG2  LYS  65          1HG       LYS  65   4.892   9.175  -4.029
  199    HG3  LYS  65          2HG       LYS  65   3.994   8.722  -2.578
  200    HD2  LYS  65          1HD       LYS  65   3.521  10.920  -2.472
  201    HD3  LYS  65          2HD       LYS  65   5.138  11.047  -1.775
  202    HE2  LYS  65          1HE       LYS  65   6.073  11.783  -3.780
  203    HE3  LYS  65          2HE       LYS  65   4.723  11.179  -4.740
  204    HZ1  LYS  65          1HZ       LYS  65   5.044  13.711  -3.425
  205    HZ2  LYS  65          2HZ       LYS  65   3.556  12.982  -3.089
  206    HZ3  LYS  65          3HZ       LYS  65   4.011  13.276  -4.692
  207    H    ALA  66           H        ALA  66   6.869   7.500   0.272
  208    HA   ALA  66           HA       ALA  66   9.667   7.232  -0.001
  209    HB1  ALA  66          1HB       ALA  66   9.660   6.978   2.464
  210    HB2  ALA  66          2HB       ALA  66   8.736   8.372   1.902
  211    HB3  ALA  66          3HB       ALA  66   7.898   6.909   2.418
  212    H    ALA  67           H        ALA  67   7.132   4.933   0.926
  213    HA   ALA  67           HA       ALA  67   8.672   2.763   1.656
  214    HB1  ALA  67          1HB       ALA  67   6.005   2.914   0.280
  215    HB2  ALA  67          2HB       ALA  67   6.730   1.381   0.768
  216    HB3  ALA  67          3HB       ALA  67   6.349   2.603   1.982
  217    H    TYR  68           H        TYR  68   7.686   3.762  -1.598
  218    HA   TYR  68           HA       TYR  68   8.790   1.545  -2.956
  219    HB2  TYR  68          1HB       TYR  68   7.633   4.142  -3.673
  220    HB3  TYR  68          2HB       TYR  68   8.877   3.594  -4.791
  221    HD1  TYR  68           HD1      TYR  68   8.047   2.524  -6.648
  222    HD2  TYR  68           HD2      TYR  68   6.039   2.006  -2.933
  223    HE1  TYR  68           HE1      TYR  68   6.416   1.045  -7.744
  224    HE2  TYR  68           HE2      TYR  68   4.402   0.525  -4.018
  225    HH   TYR  68           HH       TYR  68   4.681  -0.319  -7.453
  226    H    ASP  69           H        ASP  69  10.171   4.445  -1.670
  227    HA   ASP  69           HA       ASP  69  12.616   4.223  -3.208
  228    HB2  ASP  69          1HB       ASP  69  11.360   6.335  -2.013
  229    HB3  ASP  69          2HB       ASP  69  12.618   5.968  -0.836
  230    H    GLN  70           H        GLN  70  11.504   3.575   0.076
  231    HA   GLN  70           HA       GLN  70  13.913   3.055   1.329
  232    HB2  GLN  70          1HB       GLN  70  11.225   1.733   1.714
  233    HB3  GLN  70          2HB       GLN  70  12.590   1.509   2.800
  234    HG2  GLN  70          1HG       GLN  70  11.000   3.997   2.290
  235    HG3  GLN  70          2HG       GLN  70  11.246   3.136   3.809
  236   HE21  GLN  70          1HE2      GLN  70  13.748   6.048   2.661
  237   HE22  GLN  70          2HE2      GLN  70  12.321   5.619   1.788
  238    H    ARG  71           H        ARG  71  11.831   0.759  -0.423
  239    HA   ARG  71           HA       ARG  71  13.592  -1.443  -0.129
  240    HB2  ARG  71          1HB       ARG  71  11.478  -1.011  -2.247
  241    HB3  ARG  71          2HB       ARG  71  12.192  -2.549  -1.783
  242    HG2  ARG  71          1HG       ARG  71  10.445  -0.795  -0.071
  243    HG3  ARG  71          2HG       ARG  71   9.997  -2.332  -0.814
  244    HD2  ARG  71          1HD       ARG  71  12.320  -2.878   0.622
  245    HD3  ARG  71          2HD       ARG  71  11.383  -1.813   1.669
  246    HE   ARG  71           HE       ARG  71   9.587  -3.678   0.794
  247   HH11  ARG  71          1HH1      ARG  71  12.650  -3.781   2.446
  248   HH12  ARG  71          2HH1      ARG  71  12.282  -5.236   3.311
  249   HH21  ARG  71          1HH2      ARG  71   9.091  -5.594   1.927
  250   HH22  ARG  71          2HH2      ARG  71  10.258  -6.267   3.015
  251    H    GLN  72           H        GLN  72  13.578   1.273  -2.217
  252    HA   GLN  72           HA       GLN  72  15.584  -0.007  -3.953
  253    HB2  GLN  72          1HB       GLN  72  13.739   2.318  -4.516
  254    HB3  GLN  72          2HB       GLN  72  15.020   1.789  -5.597
  255    HG2  GLN  72          1HG       GLN  72  13.219  -0.358  -4.797
  256    HG3  GLN  72          2HG       GLN  72  12.419   0.952  -5.665
  257   HE21  GLN  72          1HE2      GLN  72  15.133  -1.443  -7.542
  258   HE22  GLN  72          2HE2      GLN  72  15.040  -1.381  -5.818
  Start of MODEL    4
    1    H    ILE  40           H        ILE  40   6.243  -2.326   1.029
    2    HA   ILE  40           HA       ILE  40   4.101  -2.720  -0.272
    3    HB   ILE  40           HB       ILE  40   5.335  -0.228   0.413
    4   HG12  ILE  40          1HG1      ILE  40   2.452  -1.060   0.028
    5   HG13  ILE  40          2HG1      ILE  40   3.378  -1.174   1.520
    6   HG21  ILE  40          1HG2      ILE  40   3.627  -0.145  -2.070
    7   HG22  ILE  40          2HG2      ILE  40   4.163   1.255  -1.143
    8   HG23  ILE  40          3HG2      ILE  40   5.344   0.245  -1.975
    9   HD11  ILE  40          1HD1      ILE  40   2.112   0.724   1.840
   10   HD12  ILE  40          2HD1      ILE  40   3.643   1.382   1.263
   11   HD13  ILE  40          3HD1      ILE  40   2.273   1.241   0.162
   12    H    ALA  41           H        ALA  41   3.093  -2.577  -2.284
   13    HA   ALA  41           HA       ALA  41   4.309  -1.616  -4.634
   14    HB1  ALA  41          1HB       ALA  41   5.418  -3.345  -5.530
   15    HB2  ALA  41          2HB       ALA  41   5.492  -3.948  -3.874
   16    HB3  ALA  41          3HB       ALA  41   4.234  -4.524  -4.967
   17    H    LEU  42           H        LEU  42   1.774  -1.480  -3.405
   18    HA   LEU  42           HA       LEU  42  -0.088  -3.241  -4.639
   19    HB2  LEU  42          1HB       LEU  42  -0.236  -0.725  -3.068
   20    HB3  LEU  42          2HB       LEU  42  -1.646  -1.186  -4.018
   21    HG   LEU  42           HG       LEU  42  -0.696  -3.410  -2.442
   22   HD11  LEU  42          1HD1      LEU  42  -0.964  -0.773  -1.104
   23   HD12  LEU  42          2HD1      LEU  42   0.076  -2.142  -0.714
   24   HD13  LEU  42          3HD1      LEU  42  -1.636  -2.190  -0.296
   25   HD21  LEU  42          1HD2      LEU  42  -3.134  -2.921  -1.516
   26   HD22  LEU  42          2HD2      LEU  42  -2.861  -3.650  -3.099
   27   HD23  LEU  42          3HD2      LEU  42  -3.210  -1.926  -2.970
   28    HA   PRO  43           HA       PRO  43  -0.731  -1.463  -8.597
   29    HB2  PRO  43          1HB       PRO  43  -3.425  -1.636  -8.889
   30    HB3  PRO  43          2HB       PRO  43  -2.361  -3.046  -8.941
   31    HG2  PRO  43          1HG       PRO  43  -4.026  -2.013  -6.678
   32    HG3  PRO  43          2HG       PRO  43  -3.794  -3.684  -7.225
   33    HD2  PRO  43          1HD       PRO  43  -2.485  -2.655  -5.090
   34    HD3  PRO  43          2HD       PRO  43  -1.768  -3.889  -6.146
   35    H    ALA  44           H        ALA  44  -1.934   0.042  -5.816
   36    HA   ALA  44           HA       ALA  44  -3.466   2.144  -6.846
   37    HB1  ALA  44          1HB       ALA  44  -2.640   1.362  -4.349
   38    HB2  ALA  44          2HB       ALA  44  -1.806   2.900  -4.573
   39    HB3  ALA  44          3HB       ALA  44  -3.562   2.820  -4.720
   40    H    PHE  45           H        PHE  45  -0.095   1.537  -7.033
   41    HA   PHE  45           HA       PHE  45   0.744   4.249  -7.395
   42    HB2  PHE  45          1HB       PHE  45   2.078   1.597  -7.944
   43    HB3  PHE  45          2HB       PHE  45   2.858   3.142  -8.267
   44    HD1  PHE  45           HD1      PHE  45   4.222   4.015  -6.645
   45    HD2  PHE  45           HD2      PHE  45   1.075   1.388  -5.499
   46    HE1  PHE  45           HE1      PHE  45   4.994   4.114  -4.310
   47    HE2  PHE  45           HE2      PHE  45   1.841   1.483  -3.163
   48    HZ   PHE  45           HZ       PHE  45   3.802   2.848  -2.566
   49    H    SER  46           H        SER  46  -1.031   2.192  -9.296
   50    HA   SER  46           HA       SER  46  -0.048   2.412 -11.860
   51    HB2  SER  46          1HB       SER  46  -1.906   1.106 -11.928
   52    HB3  SER  46          2HB       SER  46  -2.721   2.026 -10.663
   53    HG   SER  46           HG       SER  46  -3.824   2.419 -12.532
   54    H    GLN  47           H        GLN  47  -1.679   4.819  -9.918
   55    HA   GLN  47           HA       GLN  47  -1.973   7.058 -10.188
   56    HB2  GLN  47          1HB       GLN  47   0.471   6.532 -11.327
   57    HB3  GLN  47          2HB       GLN  47  -0.380   7.348 -12.632
   58    HG2  GLN  47          1HG       GLN  47  -0.335   8.502  -9.873
   59    HG3  GLN  47          2HG       GLN  47   1.013   8.744 -10.983
   60   HE21  GLN  47          1HE2      GLN  47  -2.536  10.650 -11.546
   61   HE22  GLN  47          2HE2      GLN  47  -2.382   9.344 -10.426
   62    H    VAL  48           H        VAL  48  -3.971   7.555 -10.803
   63    HA   VAL  48           HA       VAL  48  -4.709   7.151 -13.629
   64    HB   VAL  48           HB       VAL  48  -6.096   5.791 -12.198
   65   HG11  VAL  48          1HG1      VAL  48  -5.736   7.137 -10.135
   66   HG12  VAL  48          2HG1      VAL  48  -6.900   8.312 -10.753
   67   HG13  VAL  48          3HG1      VAL  48  -7.415   6.663 -10.395
   68   HG21  VAL  48          1HG2      VAL  48  -8.085   6.318 -13.173
   69   HG22  VAL  48          2HG2      VAL  48  -7.959   8.030 -12.769
   70   HG23  VAL  48          3HG2      VAL  48  -7.033   7.372 -14.118
   71    H    ASP  49           H        ASP  49  -4.983   9.325 -10.853
   72    HA   ASP  49           HA       ASP  49  -5.021  11.609 -12.623
   73    HB2  ASP  49          1HB       ASP  49  -7.469  10.567 -11.585
   74    HB3  ASP  49          2HB       ASP  49  -7.148  12.110 -10.800
   75    HA   PRO  50           HA       PRO  50  -2.834  13.467  -9.304
   76    HB2  PRO  50          1HB       PRO  50  -3.455  16.085  -9.668
   77    HB3  PRO  50          2HB       PRO  50  -2.366  15.198 -10.742
   78    HG2  PRO  50          1HG       PRO  50  -5.264  15.854 -11.104
   79    HG3  PRO  50          2HG       PRO  50  -3.943  15.936 -12.283
   80    HD2  PRO  50          1HD       PRO  50  -5.699  13.877 -12.206
   81    HD3  PRO  50          2HD       PRO  50  -4.008  13.671 -12.703
   82    H    GLU  51           H        GLU  51  -6.195  14.564  -9.673
   83    HA   GLU  51           HA       GLU  51  -6.524  15.681  -7.136
   84    HB2  GLU  51          1HB       GLU  51  -8.157  15.121  -9.373
   85    HB3  GLU  51          2HB       GLU  51  -8.952  14.400  -7.980
   86    HG2  GLU  51          1HG       GLU  51  -8.931  16.524  -6.825
   87    HG3  GLU  51          2HG       GLU  51  -8.048  17.264  -8.159
   88    H    VAL  52           H        VAL  52  -6.298  12.395  -8.120
   89    HA   VAL  52           HA       VAL  52  -7.638  11.271  -5.842
   90    HB   VAL  52           HB       VAL  52  -5.662   9.797  -7.563
   91   HG11  VAL  52          1HG1      VAL  52  -7.468   7.997  -7.147
   92   HG12  VAL  52          2HG1      VAL  52  -6.371   8.420  -5.831
   93   HG13  VAL  52          3HG1      VAL  52  -8.011   9.067  -5.856
   94   HG21  VAL  52          1HG2      VAL  52  -7.598   9.248  -9.046
   95   HG22  VAL  52          2HG2      VAL  52  -8.513  10.515  -8.229
   96   HG23  VAL  52          3HG2      VAL  52  -7.061  10.925  -9.142
   97    H    PHE  53           H        PHE  53  -4.239  11.604  -6.840
   98    HA   PHE  53           HA       PHE  53  -3.167  10.461  -4.479
   99    HB2  PHE  53          1HB       PHE  53  -2.101  11.002  -6.863
  100    HB3  PHE  53          2HB       PHE  53  -1.579  12.456  -6.018
  101    HD1  PHE  53           HD1      PHE  53  -0.643   9.243  -6.890
  102    HD2  PHE  53           HD2      PHE  53  -0.571  11.923  -3.584
  103    HE1  PHE  53           HE1      PHE  53   1.244   7.994  -5.923
  104    HE2  PHE  53           HE2      PHE  53   1.316  10.680  -2.613
  105    HZ   PHE  53           HZ       PHE  53   2.227   8.713  -3.782
  106    H    ALA  54           H        ALA  54  -3.916  13.763  -5.452
  107    HA   ALA  54           HA       ALA  54  -2.748  14.957  -3.120
  108    HB1  ALA  54          1HB       ALA  54  -4.722  16.168  -5.050
  109    HB2  ALA  54          2HB       ALA  54  -3.662  17.027  -3.931
  110    HB3  ALA  54          3HB       ALA  54  -2.974  16.137  -5.289
  111    H    ALA  55           H        ALA  55  -5.736  13.450  -3.844
  112    HA   ALA  55           HA       ALA  55  -7.420  14.807  -2.022
  113    HB1  ALA  55          1HB       ALA  55  -8.715  13.598  -3.427
  114    HB2  ALA  55          2HB       ALA  55  -7.537  12.293  -3.568
  115    HB3  ALA  55          3HB       ALA  55  -8.576  12.393  -2.147
  116    H    LEU  56           H        LEU  56  -5.300  12.003  -1.705
  117    HA   LEU  56           HA       LEU  56  -6.124  11.425   0.984
  118    HB2  LEU  56          1HB       LEU  56  -3.526  10.465  -0.096
  119    HB3  LEU  56          2HB       LEU  56  -4.718   9.621   0.891
  120    HG   LEU  56           HG       LEU  56  -4.874  10.153  -2.074
  121   HD11  LEU  56          1HD1      LEU  56  -4.590   7.829  -2.356
  122   HD12  LEU  56          2HD1      LEU  56  -4.789   7.517  -0.632
  123   HD13  LEU  56          3HD1      LEU  56  -3.341   8.335  -1.218
  124   HD21  LEU  56          1HD2      LEU  56  -6.888   9.132  -0.111
  125   HD22  LEU  56          2HD2      LEU  56  -6.905   8.573  -1.784
  126   HD23  LEU  56          3HD2      LEU  56  -7.093  10.290  -1.425
  127    HA   PRO  57           HA       PRO  57  -3.477  14.068   3.278
  128    HB2  PRO  57          1HB       PRO  57  -2.783  12.484   5.371
  129    HB3  PRO  57          2HB       PRO  57  -4.402  13.168   5.179
  130    HG2  PRO  57          1HG       PRO  57  -3.415  10.420   4.516
  131    HG3  PRO  57          2HG       PRO  57  -4.929  10.906   5.302
  132    HD2  PRO  57          1HD       PRO  57  -4.798  10.234   2.682
  133    HD3  PRO  57          2HD       PRO  57  -5.942  11.442   3.302
  134    H    ALA  58           H        ALA  58  -1.382  14.674   3.294
  135    HA   ALA  58           HA       ALA  58   0.560  13.423   1.802
  136    HB1  ALA  58          1HB       ALA  58   2.167  14.805   3.335
  137    HB2  ALA  58          2HB       ALA  58   1.044  15.624   2.249
  138    HB3  ALA  58          3HB       ALA  58   0.661  15.474   3.964
  139    H    GLU  59           H        GLU  59  -0.246  12.946   5.181
  140    HA   GLU  59           HA       GLU  59   2.026  11.573   6.031
  141    HB2  GLU  59          1HB       GLU  59   0.427  12.258   7.658
  142    HB3  GLU  59          2HB       GLU  59  -0.862  11.362   6.868
  143    HG2  GLU  59          1HG       GLU  59   0.156  10.403   9.012
  144    HG3  GLU  59          2HG       GLU  59  -0.096   9.318   7.646
  145    H    LEU  60           H        LEU  60  -0.858  10.406   4.361
  146    HA   LEU  60           HA       LEU  60   0.118   7.673   4.370
  147    HB2  LEU  60          1HB       LEU  60  -2.159   7.639   4.587
  148    HB3  LEU  60          2HB       LEU  60  -2.386   9.049   3.554
  149    HG   LEU  60           HG       LEU  60  -1.420   6.584   2.232
  150   HD11  LEU  60          1HD1      LEU  60  -3.033   5.577   3.672
  151   HD12  LEU  60          2HD1      LEU  60  -3.762   5.737   2.075
  152   HD13  LEU  60          3HD1      LEU  60  -4.198   6.864   3.360
  153   HD21  LEU  60          1HD2      LEU  60  -2.456   9.065   1.482
  154   HD22  LEU  60          2HD2      LEU  60  -3.728   7.899   1.117
  155   HD23  LEU  60          3HD2      LEU  60  -2.116   7.688   0.434
  156    H    GLN  61           H        GLN  61  -0.320  10.333   2.098
  157    HA   GLN  61           HA       GLN  61   0.323   8.912  -0.250
  158    HB2  GLN  61          1HB       GLN  61  -0.126  10.870  -1.231
  159    HB3  GLN  61          2HB       GLN  61  -0.451  11.506   0.376
  160    HG2  GLN  61          1HG       GLN  61   1.740  12.386   0.567
  161    HG3  GLN  61          2HG       GLN  61   2.282  11.521  -0.870
  162   HE21  GLN  61          1HE2      GLN  61  -0.409  14.484  -1.659
  163   HE22  GLN  61          2HE2      GLN  61  -0.739  13.271  -0.473
  164    H    ARG  62           H        ARG  62   2.272  10.280   2.274
  165    HA   ARG  62           HA       ARG  62   4.721  10.194   0.746
  166    HB2  ARG  62          1HB       ARG  62   5.800  10.985   2.732
  167    HB3  ARG  62          2HB       ARG  62   4.288  11.866   2.561
  168    HG2  ARG  62          1HG       ARG  62   3.774  11.295   4.633
  169    HG3  ARG  62          2HG       ARG  62   3.700   9.609   4.117
  170    HD2  ARG  62          1HD       ARG  62   5.910   9.195   4.763
  171    HD3  ARG  62          2HD       ARG  62   6.305  10.912   4.829
  172    HE   ARG  62           HE       ARG  62   4.306  10.396   6.715
  173   HH11  ARG  62          1HH1      ARG  62   7.653   9.638   6.126
  174   HH12  ARG  62          2HH1      ARG  62   8.048   9.480   7.806
  175   HH21  ARG  62          1HH2      ARG  62   4.813  10.190   8.929
  176   HH22  ARG  62          2HH2      ARG  62   6.432   9.793   9.399
  177    H    GLU  63           H        GLU  63   2.924   8.083   2.805
  178    HA   GLU  63           HA       GLU  63   5.086   6.367   3.534
  179    HB2  GLU  63          1HB       GLU  63   3.143   6.371   4.929
  180    HB3  GLU  63          2HB       GLU  63   2.091   6.007   3.568
  181    HG2  GLU  63          1HG       GLU  63   2.428   3.815   3.748
  182    HG3  GLU  63          2HG       GLU  63   4.167   4.009   3.961
  183    H    LEU  64           H        LEU  64   2.916   6.589   0.821
  184    HA   LEU  64           HA       LEU  64   3.585   3.962  -0.189
  185    HB2  LEU  64          1HB       LEU  64   2.018   4.335  -1.858
  186    HB3  LEU  64          2HB       LEU  64   1.360   5.200  -0.471
  187    HG   LEU  64           HG       LEU  64   2.701   7.203  -1.666
  188   HD11  LEU  64          1HD1      LEU  64   3.453   6.456  -3.649
  189   HD12  LEU  64          2HD1      LEU  64   1.789   6.733  -4.161
  190   HD13  LEU  64          3HD1      LEU  64   2.311   5.113  -3.699
  191   HD21  LEU  64          1HD2      LEU  64   0.149   6.691  -1.062
  192   HD22  LEU  64          2HD2      LEU  64   0.039   6.626  -2.821
  193   HD23  LEU  64          3HD2      LEU  64   0.644   8.081  -2.028
  194    H    LYS  65           H        LYS  65   4.515   7.293  -0.742
  195    HA   LYS  65           HA       LYS  65   6.054   6.695  -3.104
  196    HB2  LYS  65          1HB       LYS  65   6.008   9.179  -1.380
  197    HB3  LYS  65          2HB       LYS  65   6.775   9.042  -2.956
  198    HG2  LYS  65          1HG       LYS  65   4.756   8.975  -4.080
  199    HG3  LYS  65          2HG       LYS  65   3.861   8.461  -2.649
  200    HD2  LYS  65          1HD       LYS  65   3.279  10.594  -2.369
  201    HD3  LYS  65          2HD       LYS  65   4.962  10.917  -1.945
  202    HE2  LYS  65          1HE       LYS  65   5.474  11.406  -4.270
  203    HE3  LYS  65          2HE       LYS  65   3.819  11.014  -4.736
  204    HZ1  LYS  65          1HZ       LYS  65   3.007  12.878  -3.536
  205    HZ2  LYS  65          2HZ       LYS  65   4.285  13.429  -4.496
  206    HZ3  LYS  65          3HZ       LYS  65   4.518  13.185  -2.839
  207    H    ALA  66           H        ALA  66   6.735   7.390   0.301
  208    HA   ALA  66           HA       ALA  66   9.559   7.309   0.055
  209    HB1  ALA  66          1HB       ALA  66   9.635   7.433   2.399
  210    HB2  ALA  66          2HB       ALA  66   8.189   8.332   1.939
  211    HB3  ALA  66          3HB       ALA  66   8.043   6.694   2.574
  212    H    ALA  67           H        ALA  67   7.135   4.889   0.956
  213    HA   ALA  67           HA       ALA  67   8.794   2.819   1.747
  214    HB1  ALA  67          1HB       ALA  67   6.927   1.321   0.880
  215    HB2  ALA  67          2HB       ALA  67   6.489   2.533   2.084
  216    HB3  ALA  67          3HB       ALA  67   6.119   2.808   0.381
  217    H    TYR  68           H        TYR  68   7.919   3.869  -1.497
  218    HA   TYR  68           HA       TYR  68   9.054   1.642  -2.852
  219    HB2  TYR  68          1HB       TYR  68   7.834   4.205  -3.577
  220    HB3  TYR  68          2HB       TYR  68   9.113   3.702  -4.677
  221    HD1  TYR  68           HD1      TYR  68   6.634   1.627  -2.824
  222    HD2  TYR  68           HD2      TYR  68   8.011   3.005  -6.606
  223    HE1  TYR  68           HE1      TYR  68   5.063   0.102  -3.944
  224    HE2  TYR  68           HE2      TYR  68   6.444   1.484  -7.737
  225    HH   TYR  68           HH       TYR  68   5.264  -0.900  -6.897
  226    H    ASP  69           H        ASP  69  10.339   4.560  -1.520
  227    HA   ASP  69           HA       ASP  69  12.825   4.376  -3.014
  228    HB2  ASP  69          1HB       ASP  69  11.592   6.541  -2.192
  229    HB3  ASP  69          2HB       ASP  69  12.430   6.210  -0.678
  230    H    GLN  70           H        GLN  70  11.623   3.790   0.246
  231    HA   GLN  70           HA       GLN  70  13.994   3.400   1.610
  232    HB2  GLN  70          1HB       GLN  70  11.343   1.985   1.906
  233    HB3  GLN  70          2HB       GLN  70  12.670   1.807   3.046
  234    HG2  GLN  70          1HG       GLN  70  11.031   4.245   2.455
  235    HG3  GLN  70          2HG       GLN  70  11.243   3.403   3.990
  236   HE21  GLN  70          1HE2      GLN  70  13.747   6.341   2.868
  237   HE22  GLN  70          2HE2      GLN  70  12.395   5.842   1.916
  238    H    ARG  71           H        ARG  71  12.093   0.966  -0.164
  239    HA   ARG  71           HA       ARG  71  14.418  -0.828  -0.069
  240    HB2  ARG  71          1HB       ARG  71  12.882  -2.634  -0.579
  241    HB3  ARG  71          2HB       ARG  71  12.288  -1.724   0.804
  242    HG2  ARG  71          1HG       ARG  71  11.149  -0.545  -1.482
  243    HG3  ARG  71          2HG       ARG  71  10.991  -2.292  -1.673
  244    HD2  ARG  71          1HD       ARG  71  10.293  -0.989   0.927
  245    HD3  ARG  71          2HD       ARG  71   9.148  -0.960  -0.413
  246    HE   ARG  71           HE       ARG  71   9.753  -3.176   1.264
  247   HH11  ARG  71          1HH1      ARG  71   8.883  -2.309  -1.994
  248   HH12  ARG  71          2HH1      ARG  71   8.128  -3.830  -2.336
  249   HH21  ARG  71          1HH2      ARG  71   8.762  -5.183   0.825
  250   HH22  ARG  71          2HH2      ARG  71   8.059  -5.464  -0.731
  251    H    GLN  72           H        GLN  72  14.253   1.443  -1.865
  252    HA   GLN  72           HA       GLN  72  14.596   1.994  -4.046
  253    HB2  GLN  72          1HB       GLN  72  15.886  -0.538  -3.582
  254    HB3  GLN  72          2HB       GLN  72  15.311  -0.455  -5.242
  255    HG2  GLN  72          1HG       GLN  72  16.772   1.166  -5.816
  256    HG3  GLN  72          2HG       GLN  72  16.728   1.924  -4.225
  257   HE21  GLN  72          1HE2      GLN  72  19.975   0.730  -3.843
  258   HE22  GLN  72          2HE2      GLN  72  18.944   2.097  -4.075
  Start of MODEL    5
    1    H    ILE  40           H        ILE  40   4.389  -3.689  -1.041
    2    HA   ILE  40           HA       ILE  40   3.360  -1.669  -2.864
    3    HB   ILE  40           HB       ILE  40   5.484  -0.618  -2.734
    4   HG12  ILE  40          1HG1      ILE  40   7.035  -2.258  -1.033
    5   HG13  ILE  40          2HG1      ILE  40   6.421  -3.303  -2.309
    6   HG21  ILE  40          1HG2      ILE  40   5.211  -1.703   0.040
    7   HG22  ILE  40          2HG2      ILE  40   5.569  -0.059  -0.487
    8   HG23  ILE  40          3HG2      ILE  40   3.937  -0.705  -0.661
    9   HD11  ILE  40          1HD1      ILE  40   8.233  -2.601  -3.413
   10   HD12  ILE  40          2HD1      ILE  40   7.255  -1.171  -3.748
   11   HD13  ILE  40          3HD1      ILE  40   8.410  -1.158  -2.416
   12    H    ALA  41           H        ALA  41   5.465  -1.270  -4.565
   13    HA   ALA  41           HA       ALA  41   6.359  -1.934  -6.551
   14    HB1  ALA  41          1HB       ALA  41   6.808  -4.101  -4.768
   15    HB2  ALA  41          2HB       ALA  41   6.398  -4.760  -6.352
   16    HB3  ALA  41          3HB       ALA  41   7.741  -3.629  -6.189
   17    H    LEU  42           H        LEU  42   3.341  -2.208  -5.800
   18    HA   LEU  42           HA       LEU  42   2.408  -4.084  -7.796
   19    HB2  LEU  42          1HB       LEU  42   1.112  -2.285  -5.795
   20    HB3  LEU  42          2HB       LEU  42   0.158  -2.938  -7.126
   21    HG   LEU  42           HG       LEU  42   1.640  -5.027  -5.790
   22   HD11  LEU  42          1HD1      LEU  42   1.103  -3.134  -3.986
   23   HD12  LEU  42          2HD1      LEU  42   1.017  -4.857  -3.622
   24   HD13  LEU  42          3HD1      LEU  42  -0.454  -3.961  -3.997
   25   HD21  LEU  42          1HD2      LEU  42  -1.251  -4.434  -6.366
   26   HD22  LEU  42          2HD2      LEU  42  -0.725  -5.894  -5.527
   27   HD23  LEU  42          3HD2      LEU  42  -0.186  -5.581  -7.178
   28    HA   PRO  43           HA       PRO  43   1.933  -1.346 -11.192
   29    HB2  PRO  43          1HB       PRO  43  -0.418  -2.172 -12.268
   30    HB3  PRO  43          2HB       PRO  43   1.071  -3.119 -12.372
   31    HG2  PRO  43          1HG       PRO  43  -1.237  -3.419 -10.490
   32    HG3  PRO  43          2HG       PRO  43  -0.326  -4.672 -11.352
   33    HD2  PRO  43          1HD       PRO  43   0.114  -4.085  -8.746
   34    HD3  PRO  43          2HD       PRO  43   1.405  -4.638  -9.831
   35    H    ALA  44           H        ALA  44  -0.196  -1.249  -8.572
   36    HA   ALA  44           HA       ALA  44  -2.215   0.478  -9.365
   37    HB1  ALA  44          1HB       ALA  44  -2.630   0.865  -7.110
   38    HB2  ALA  44          2HB       ALA  44  -1.846  -0.716  -7.113
   39    HB3  ALA  44          3HB       ALA  44  -0.927   0.723  -6.672
   40    H    PHE  45           H        PHE  45   1.110   1.178  -8.441
   41    HA   PHE  45           HA       PHE  45   0.898   3.966  -8.227
   42    HB2  PHE  45          1HB       PHE  45   3.164   2.087  -8.801
   43    HB3  PHE  45          2HB       PHE  45   3.417   3.825  -8.918
   44    HD1  PHE  45           HD1      PHE  45   1.592   1.608  -6.531
   45    HD2  PHE  45           HD2      PHE  45   4.522   4.643  -7.090
   46    HE1  PHE  45           HE1      PHE  45   1.939   1.715  -4.098
   47    HE2  PHE  45           HE2      PHE  45   4.875   4.755  -4.658
   48    HZ   PHE  45           HZ       PHE  45   3.584   3.289  -3.158
   49    H    SER  46           H        SER  46   0.744   1.923 -10.951
   50    HA   SER  46           HA       SER  46   1.468   4.050 -12.818
   51    HB2  SER  46          1HB       SER  46   1.349   1.130 -12.922
   52    HB3  SER  46          2HB       SER  46   0.629   1.896 -14.338
   53    HG   SER  46           HG       SER  46   3.263   1.827 -13.502
   54    H    GLN  47           H        GLN  47  -1.028   3.923 -11.091
   55    HA   GLN  47           HA       GLN  47  -2.833   4.877 -13.118
   56    HB2  GLN  47          1HB       GLN  47  -3.165   2.379 -13.105
   57    HB3  GLN  47          2HB       GLN  47  -3.725   2.528 -11.445
   58    HG2  GLN  47          1HG       GLN  47  -5.758   3.052 -12.127
   59    HG3  GLN  47          2HG       GLN  47  -5.134   4.390 -13.090
   60   HE21  GLN  47          1HE2      GLN  47  -4.692   2.153 -15.975
   61   HE22  GLN  47          2HE2      GLN  47  -3.680   3.153 -14.995
   62    H    VAL  48           H        VAL  48  -1.692   6.292 -11.120
   63    HA   VAL  48           HA       VAL  48  -3.908   6.693  -9.216
   64    HB   VAL  48           HB       VAL  48  -1.660   7.891  -8.082
   65   HG11  VAL  48          1HG1      VAL  48  -2.267   6.674  -6.276
   66   HG12  VAL  48          2HG1      VAL  48  -3.684   6.322  -7.268
   67   HG13  VAL  48          3HG1      VAL  48  -2.354   5.166  -7.185
   68   HG21  VAL  48          1HG2      VAL  48  -0.320   6.555  -9.725
   69   HG22  VAL  48          2HG2      VAL  48   0.060   6.238  -8.032
   70   HG23  VAL  48          3HG2      VAL  48  -0.930   5.097  -8.942
   71    H    ASP  49           H        ASP  49  -4.912   8.221 -10.559
   72    HA   ASP  49           HA       ASP  49  -3.765  10.369 -11.853
   73    HB2  ASP  49          1HB       ASP  49  -6.432   9.638 -10.942
   74    HB3  ASP  49          2HB       ASP  49  -6.175  11.380 -10.906
   75    HA   PRO  50           HA       PRO  50  -2.396  13.265  -8.859
   76    HB2  PRO  50          1HB       PRO  50  -3.128  15.635  -9.963
   77    HB3  PRO  50          2HB       PRO  50  -1.810  14.644 -10.600
   78    HG2  PRO  50          1HG       PRO  50  -4.641  14.868 -11.548
   79    HG3  PRO  50          2HG       PRO  50  -3.145  14.814 -12.497
   80    HD2  PRO  50          1HD       PRO  50  -4.739  12.651 -12.165
   81    HD3  PRO  50          2HD       PRO  50  -2.976  12.521 -12.334
   82    H    GLU  51           H        GLU  51  -5.675  14.031 -10.032
   83    HA   GLU  51           HA       GLU  51  -6.503  15.602  -7.892
   84    HB2  GLU  51          1HB       GLU  51  -7.727  14.302 -10.147
   85    HB3  GLU  51          2HB       GLU  51  -8.749  14.113  -8.729
   86    HG2  GLU  51          1HG       GLU  51  -8.547  16.598  -8.391
   87    HG3  GLU  51          2HG       GLU  51  -7.791  16.668  -9.982
   88    H    VAL  52           H        VAL  52  -5.973  12.211  -8.060
   89    HA   VAL  52           HA       VAL  52  -7.577  11.638  -5.699
   90    HB   VAL  52           HB       VAL  52  -5.716   9.621  -6.862
   91   HG11  VAL  52          1HG1      VAL  52  -8.448   9.614  -5.614
   92   HG12  VAL  52          2HG1      VAL  52  -7.799   8.205  -6.455
   93   HG13  VAL  52          3HG1      VAL  52  -6.970   8.845  -5.035
   94   HG21  VAL  52          1HG2      VAL  52  -6.598  10.564  -8.870
   95   HG22  VAL  52          2HG2      VAL  52  -7.460   9.056  -8.568
   96   HG23  VAL  52          3HG2      VAL  52  -8.230  10.600  -8.204
   97    H    PHE  53           H        PHE  53  -4.167  11.675  -6.670
   98    HA   PHE  53           HA       PHE  53  -3.012  10.735  -4.336
   99    HB2  PHE  53          1HB       PHE  53  -2.043  11.647  -6.695
  100    HB3  PHE  53          2HB       PHE  53  -1.609  12.988  -5.640
  101    HD1  PHE  53           HD1      PHE  53  -0.541   9.935  -6.933
  102    HD2  PHE  53           HD2      PHE  53  -0.495  12.235  -3.352
  103    HE1  PHE  53           HE1      PHE  53   1.425   8.676  -6.154
  104    HE2  PHE  53           HE2      PHE  53   1.471  10.981  -2.568
  105    HZ   PHE  53           HZ       PHE  53   2.434   9.200  -3.969
  106    H    ALA  54           H        ALA  54  -3.751  14.107  -5.202
  107    HA   ALA  54           HA       ALA  54  -2.915  15.187  -2.714
  108    HB1  ALA  54          1HB       ALA  54  -4.212  17.208  -3.480
  109    HB2  ALA  54          2HB       ALA  54  -2.953  16.645  -4.580
  110    HB3  ALA  54          3HB       ALA  54  -4.646  16.283  -4.918
  111    H    ALA  55           H        ALA  55  -5.743  13.542  -3.708
  112    HA   ALA  55           HA       ALA  55  -7.654  14.683  -1.984
  113    HB1  ALA  55          1HB       ALA  55  -7.692  12.754  -3.923
  114    HB2  ALA  55          2HB       ALA  55  -7.977  11.818  -2.455
  115    HB3  ALA  55          3HB       ALA  55  -9.041  13.164  -2.863
  116    H    LEU  56           H        LEU  56  -5.315  12.078  -1.530
  117    HA   LEU  56           HA       LEU  56  -6.263  11.514   1.146
  118    HB2  LEU  56          1HB       LEU  56  -4.124  10.420  -0.628
  119    HB3  LEU  56          2HB       LEU  56  -4.078  10.083   1.101
  120    HG   LEU  56           HG       LEU  56  -6.419   9.410  -0.675
  121   HD11  LEU  56          1HD1      LEU  56  -4.614   7.305   0.362
  122   HD12  LEU  56          2HD1      LEU  56  -4.042   8.257  -1.008
  123   HD13  LEU  56          3HD1      LEU  56  -5.558   7.363  -1.128
  124   HD21  LEU  56          1HD2      LEU  56  -5.782   8.119   1.937
  125   HD22  LEU  56          2HD2      LEU  56  -7.338   8.333   1.134
  126   HD23  LEU  56          3HD2      LEU  56  -6.557   9.704   1.924
  127    HA   PRO  57           HA       PRO  57  -3.594  14.140   3.431
  128    HB2  PRO  57          1HB       PRO  57  -2.867  12.562   5.518
  129    HB3  PRO  57          2HB       PRO  57  -4.492  13.234   5.342
  130    HG2  PRO  57          1HG       PRO  57  -3.492  10.494   4.669
  131    HG3  PRO  57          2HG       PRO  57  -5.001  10.968   5.470
  132    HD2  PRO  57          1HD       PRO  57  -4.891  10.296   2.849
  133    HD3  PRO  57          2HD       PRO  57  -6.038  11.496   3.480
  134    H    ALA  58           H        ALA  58  -1.479  14.736   3.568
  135    HA   ALA  58           HA       ALA  58   0.461  13.595   1.995
  136    HB1  ALA  58          1HB       ALA  58   1.176  15.063   4.512
  137    HB2  ALA  58          2HB       ALA  58   1.993  15.081   2.948
  138    HB3  ALA  58          3HB       ALA  58   0.434  15.884   3.138
  139    H    GLU  59           H        GLU  59  -0.291  12.908   5.365
  140    HA   GLU  59           HA       GLU  59   1.944  11.423   6.076
  141    HB2  GLU  59          1HB       GLU  59  -0.942  11.150   6.912
  142    HB3  GLU  59          2HB       GLU  59   0.357  10.223   7.647
  143    HG2  GLU  59          1HG       GLU  59   0.533  13.199   7.530
  144    HG3  GLU  59          2HG       GLU  59  -0.460  12.416   8.758
  145    H    LEU  60           H        LEU  60  -0.933  10.452   4.287
  146    HA   LEU  60           HA       LEU  60  -0.044   7.696   4.118
  147    HB2  LEU  60          1HB       LEU  60  -2.397   9.118   2.882
  148    HB3  LEU  60          2HB       LEU  60  -2.083   7.388   2.750
  149    HG   LEU  60           HG       LEU  60  -2.561   8.808   5.366
  150   HD11  LEU  60          1HD1      LEU  60  -4.661   7.037   4.432
  151   HD12  LEU  60          2HD1      LEU  60  -4.433   8.428   3.373
  152   HD13  LEU  60          3HD1      LEU  60  -4.765   8.671   5.088
  153   HD21  LEU  60          1HD2      LEU  60  -1.368   6.441   4.997
  154   HD22  LEU  60          2HD2      LEU  60  -3.053   5.919   4.974
  155   HD23  LEU  60          3HD2      LEU  60  -2.417   6.786   6.373
  156    H    GLN  61           H        GLN  61  -0.344  10.516   2.015
  157    HA   GLN  61           HA       GLN  61   0.343   9.258  -0.401
  158    HB2  GLN  61          1HB       GLN  61  -0.031  11.299  -1.224
  159    HB3  GLN  61          2HB       GLN  61  -0.307  11.847   0.424
  160    HG2  GLN  61          1HG       GLN  61   1.936  12.575   0.652
  161    HG3  GLN  61          2HG       GLN  61   2.413  11.780  -0.848
  162   HE21  GLN  61          1HE2      GLN  61  -0.104  14.937  -1.415
  163   HE22  GLN  61          2HE2      GLN  61  -0.503  13.662  -0.320
  164    H    ARG  62           H        ARG  62   2.258  10.339   2.282
  165    HA   ARG  62           HA       ARG  62   4.754  10.262   0.831
  166    HB2  ARG  62          1HB       ARG  62   5.794  10.876   2.886
  167    HB3  ARG  62          2HB       ARG  62   4.299  11.797   2.775
  168    HG2  ARG  62          1HG       ARG  62   3.250  10.526   4.422
  169    HG3  ARG  62          2HG       ARG  62   4.416   9.208   4.275
  170    HD2  ARG  62          1HD       ARG  62   5.483  10.099   6.014
  171    HD3  ARG  62          2HD       ARG  62   5.955  11.417   4.943
  172    HE   ARG  62           HE       ARG  62   3.957  11.493   7.025
  173   HH11  ARG  62          1HH1      ARG  62   5.179  12.983   4.125
  174   HH12  ARG  62          2HH1      ARG  62   4.477  14.529   4.468
  175   HH21  ARG  62          1HH2      ARG  62   3.028  13.524   7.487
  176   HH22  ARG  62          2HH2      ARG  62   3.255  14.837   6.381
  177    H    GLU  63           H        GLU  63   2.813   8.093   2.705
  178    HA   GLU  63           HA       GLU  63   4.870   6.228   3.346
  179    HB2  GLU  63          1HB       GLU  63   2.883   6.215   4.679
  180    HB3  GLU  63          2HB       GLU  63   1.863   5.997   3.264
  181    HG2  GLU  63          1HG       GLU  63   2.162   3.780   3.229
  182    HG3  GLU  63          2HG       GLU  63   3.870   3.900   3.650
  183    H    LEU  64           H        LEU  64   2.802   6.748   0.596
  184    HA   LEU  64           HA       LEU  64   3.389   4.177  -0.591
  185    HB2  LEU  64          1HB       LEU  64   1.887   4.736  -2.259
  186    HB3  LEU  64          2HB       LEU  64   1.235   5.557  -0.843
  187    HG   LEU  64           HG       LEU  64   2.705   7.553  -1.868
  188   HD11  LEU  64          1HD1      LEU  64   2.388   5.591  -4.017
  189   HD12  LEU  64          2HD1      LEU  64   3.505   6.949  -3.870
  190   HD13  LEU  64          3HD1      LEU  64   1.856   7.221  -4.433
  191   HD21  LEU  64          1HD2      LEU  64   0.082   7.071  -1.455
  192   HD22  LEU  64          2HD2      LEU  64   0.105   7.222  -3.212
  193   HD23  LEU  64          3HD2      LEU  64   0.708   8.540  -2.205
  194    H    LYS  65           H        LYS  65   4.506   7.482  -0.834
  195    HA   LYS  65           HA       LYS  65   6.095   6.989  -3.192
  196    HB2  LYS  65          1HB       LYS  65   6.080   9.347  -1.298
  197    HB3  LYS  65          2HB       LYS  65   6.911   9.286  -2.847
  198    HG2  LYS  65          1HG       LYS  65   4.944   9.391  -4.057
  199    HG3  LYS  65          2HG       LYS  65   3.964   8.811  -2.707
  200    HD2  LYS  65          1HD       LYS  65   3.440  10.953  -2.351
  201    HD3  LYS  65          2HD       LYS  65   5.084  11.142  -1.737
  202    HE2  LYS  65          1HE       LYS  65   5.867  11.878  -3.872
  203    HE3  LYS  65          2HE       LYS  65   4.330  11.475  -4.635
  204    HZ1  LYS  65          1HZ       LYS  65   3.795  13.589  -4.276
  205    HZ2  LYS  65          2HZ       LYS  65   5.090  13.843  -3.219
  206    HZ3  LYS  65          3HZ       LYS  65   3.641  13.192  -2.639
  207    H    ALA  66           H        ALA  66   6.699   7.482   0.268
  208    HA   ALA  66           HA       ALA  66   9.511   7.290   0.130
  209    HB1  ALA  66          1HB       ALA  66   8.106   8.196   2.040
  210    HB2  ALA  66          2HB       ALA  66   7.865   6.516   2.521
  211    HB3  ALA  66          3HB       ALA  66   9.491   7.197   2.481
  212    H    ALA  67           H        ALA  67   6.987   4.877   0.725
  213    HA   ALA  67           HA       ALA  67   8.543   2.696   1.403
  214    HB1  ALA  67          1HB       ALA  67   6.142   2.608   1.535
  215    HB2  ALA  67          2HB       ALA  67   6.001   2.765  -0.216
  216    HB3  ALA  67          3HB       ALA  67   6.707   1.309   0.485
  217    H    TYR  68           H        TYR  68   7.778   3.965  -1.806
  218    HA   TYR  68           HA       TYR  68   8.976   1.854  -3.266
  219    HB2  TYR  68          1HB       TYR  68   7.810   4.475  -3.849
  220    HB3  TYR  68          2HB       TYR  68   9.139   4.052  -4.922
  221    HD1  TYR  68           HD1      TYR  68   6.429   2.003  -3.363
  222    HD2  TYR  68           HD2      TYR  68   8.266   3.369  -6.949
  223    HE1  TYR  68           HE1      TYR  68   4.909   0.583  -4.675
  224    HE2  TYR  68           HE2      TYR  68   6.750   1.954  -8.271
  225    HH   TYR  68           HH       TYR  68   5.107   0.469  -8.222
  226    H    ASP  69           H        ASP  69  10.231   4.650  -1.668
  227    HA   ASP  69           HA       ASP  69  12.771   4.567  -3.066
  228    HB2  ASP  69          1HB       ASP  69  11.974   6.747  -2.438
  229    HB3  ASP  69          2HB       ASP  69  11.764   6.244  -0.763
  230    H    GLN  70           H        GLN  70  11.453   3.690   0.084
  231    HA   GLN  70           HA       GLN  70  13.765   3.131   1.482
  232    HB2  GLN  70          1HB       GLN  70  11.098   1.718   1.540
  233    HB3  GLN  70          2HB       GLN  70  12.380   1.423   2.707
  234    HG2  GLN  70          1HG       GLN  70  10.774   3.918   2.289
  235    HG3  GLN  70          2HG       GLN  70  10.919   2.930   3.742
  236   HE21  GLN  70          1HE2      GLN  70  13.462   5.956   3.033
  237   HE22  GLN  70          2HE2      GLN  70  12.135   5.572   1.996
  238    H    ARG  71           H        ARG  71  11.909   0.901  -0.585
  239    HA   ARG  71           HA       ARG  71  14.216  -0.918  -0.588
  240    HB2  ARG  71          1HB       ARG  71  12.569  -2.566  -1.553
  241    HB3  ARG  71          2HB       ARG  71  12.238  -2.050   0.095
  242    HG2  ARG  71          1HG       ARG  71  10.897  -0.315  -1.748
  243    HG3  ARG  71          2HG       ARG  71  10.506  -1.999  -2.106
  244    HD2  ARG  71          1HD       ARG  71  10.445  -1.053   0.723
  245    HD3  ARG  71          2HD       ARG  71   9.109  -0.640  -0.351
  246    HE   ARG  71           HE       ARG  71   9.483  -3.345  -0.652
  247   HH11  ARG  71          1HH1      ARG  71   8.762  -1.183   1.980
  248   HH12  ARG  71          2HH1      ARG  71   7.855  -2.361   2.871
  249   HH21  ARG  71          1HH2      ARG  71   8.291  -4.904   0.511
  250   HH22  ARG  71          2HH2      ARG  71   7.589  -4.477   2.035
  251    H    GLN  72           H        GLN  72  13.981   1.565  -2.177
  252    HA   GLN  72           HA       GLN  72  14.400   2.323  -4.281
  253    HB2  GLN  72          1HB       GLN  72  15.803  -0.173  -3.983
  254    HB3  GLN  72          2HB       GLN  72  15.290   0.029  -5.653
  255    HG2  GLN  72          1HG       GLN  72  16.842   2.074  -4.083
  256    HG3  GLN  72          2HG       GLN  72  17.554   0.903  -5.192
  257   HE21  GLN  72          1HE2      GLN  72  16.707   4.318  -6.712
  258   HE22  GLN  72          2HE2      GLN  72  17.300   3.920  -5.139
  Start of MODEL    6
    1    H    ILE  40           H        ILE  40   3.641  -1.037  -3.993
    2    HA   ILE  40           HA       ILE  40   4.465  -2.513  -1.615
    3    HB   ILE  40           HB       ILE  40   4.863  -0.390  -0.577
    4   HG12  ILE  40          1HG1      ILE  40   4.413   1.581  -2.462
    5   HG13  ILE  40          2HG1      ILE  40   2.999   0.547  -2.627
    6   HG21  ILE  40          1HG2      ILE  40   6.428   0.653  -2.243
    7   HG22  ILE  40          2HG2      ILE  40   6.647  -1.077  -1.985
    8   HG23  ILE  40          3HG2      ILE  40   5.816  -0.500  -3.429
    9   HD11  ILE  40          1HD1      ILE  40   2.570   2.331  -1.060
   10   HD12  ILE  40          2HD1      ILE  40   2.575   0.777  -0.224
   11   HD13  ILE  40          3HD1      ILE  40   3.967   1.852  -0.096
   12    H    ALA  41           H        ALA  41   1.644  -1.200  -3.042
   13    HA   ALA  41           HA       ALA  41  -0.067  -2.275  -1.081
   14    HB1  ALA  41          1HB       ALA  41   0.493  -0.546   0.394
   15    HB2  ALA  41          2HB       ALA  41   0.485   0.668  -0.886
   16    HB3  ALA  41          3HB       ALA  41  -1.033  -0.034  -0.327
   17    H    LEU  42           H        LEU  42   0.294   0.259  -3.530
   18    HA   LEU  42           HA       LEU  42  -2.069  -0.785  -4.891
   19    HB2  LEU  42          1HB       LEU  42  -3.073   1.365  -5.173
   20    HB3  LEU  42          2HB       LEU  42  -2.818   1.083  -3.453
   21    HG   LEU  42           HG       LEU  42  -0.610   2.531  -4.664
   22   HD11  LEU  42          1HD1      LEU  42  -1.775   4.607  -5.080
   23   HD12  LEU  42          2HD1      LEU  42  -3.323   3.845  -4.714
   24   HD13  LEU  42          3HD1      LEU  42  -2.408   3.344  -6.136
   25   HD21  LEU  42          1HD2      LEU  42  -2.399   2.713  -2.293
   26   HD22  LEU  42          2HD2      LEU  42  -1.487   4.143  -2.775
   27   HD23  LEU  42          3HD2      LEU  42  -0.639   2.647  -2.380
   28    HA   PRO  43           HA       PRO  43   0.366  -0.210  -8.502
   29    HB2  PRO  43          1HB       PRO  43  -1.582   0.119 -10.365
   30    HB3  PRO  43          2HB       PRO  43  -1.226  -1.441  -9.612
   31    HG2  PRO  43          1HG       PRO  43  -3.387   0.527  -8.964
   32    HG3  PRO  43          2HG       PRO  43  -3.481  -1.240  -9.083
   33    HD2  PRO  43          1HD       PRO  43  -3.311   0.053  -6.710
   34    HD3  PRO  43          2HD       PRO  43  -2.606  -1.555  -6.974
   35    H    ALA  44           H        ALA  44   0.663   2.046  -7.180
   36    HA   ALA  44           HA       ALA  44  -0.418   4.301  -8.649
   37    HB1  ALA  44          1HB       ALA  44   0.580   3.902  -6.047
   38    HB2  ALA  44          2HB       ALA  44   1.653   5.062  -6.831
   39    HB3  ALA  44          3HB       ALA  44  -0.079   5.383  -6.743
   40    H    PHE  45           H        PHE  45   1.637   6.095  -8.668
   41    HA   PHE  45           HA       PHE  45   3.322   6.838 -10.004
   42    HB2  PHE  45          1HB       PHE  45   4.529   4.086  -9.771
   43    HB3  PHE  45          2HB       PHE  45   5.358   5.629  -9.943
   44    HD1  PHE  45           HD1      PHE  45   5.807   7.013  -8.056
   45    HD2  PHE  45           HD2      PHE  45   3.524   3.447  -7.627
   46    HE1  PHE  45           HE1      PHE  45   6.039   7.163  -5.611
   47    HE2  PHE  45           HE2      PHE  45   3.750   3.592  -5.181
   48    HZ   PHE  45           HZ       PHE  45   5.008   5.452  -4.170
   49    H    SER  46           H        SER  46   1.009   5.340 -11.184
   50    HA   SER  46           HA       SER  46   2.270   4.557 -13.730
   51    HB2  SER  46          1HB       SER  46   0.169   3.313 -12.134
   52    HB3  SER  46          2HB       SER  46  -0.325   3.575 -13.806
   53    HG   SER  46           HG       SER  46   0.913   1.981 -14.348
   54    H    GLN  47           H        GLN  47  -1.089   5.356 -12.935
   55    HA   GLN  47           HA       GLN  47  -1.190   7.947 -13.910
   56    HB2  GLN  47          1HB       GLN  47  -0.954   5.968 -16.002
   57    HB3  GLN  47          2HB       GLN  47  -2.481   6.829 -16.135
   58    HG2  GLN  47          1HG       GLN  47  -0.131   8.522 -15.656
   59    HG3  GLN  47          2HG       GLN  47  -0.148   7.670 -17.199
   60   HE21  GLN  47          1HE2      GLN  47  -3.209  10.284 -16.425
   61   HE22  GLN  47          2HE2      GLN  47  -2.546   9.315 -15.158
   62    H    VAL  48           H        VAL  48  -2.999   8.695 -13.043
   63    HA   VAL  48           HA       VAL  48  -5.488   7.222 -13.316
   64    HB   VAL  48           HB       VAL  48  -4.397   7.958 -10.596
   65   HG11  VAL  48          1HG1      VAL  48  -7.061   6.799 -11.403
   66   HG12  VAL  48          2HG1      VAL  48  -6.476   6.927  -9.743
   67   HG13  VAL  48          3HG1      VAL  48  -6.771   8.385 -10.690
   68   HG21  VAL  48          1HG2      VAL  48  -3.361   5.947 -11.290
   69   HG22  VAL  48          2HG2      VAL  48  -4.675   5.473 -10.213
   70   HG23  VAL  48          3HG2      VAL  48  -4.866   5.316 -11.959
   71    H    ASP  49           H        ASP  49  -4.387   9.836 -11.165
   72    HA   ASP  49           HA       ASP  49  -5.331  11.987 -12.661
   73    HB2  ASP  49          1HB       ASP  49  -7.474  10.511 -11.762
   74    HB3  ASP  49          2HB       ASP  49  -7.323  11.756 -10.525
   75    HA   PRO  50           HA       PRO  50  -3.068  13.973  -9.450
   76    HB2  PRO  50          1HB       PRO  50  -3.765  16.544  -9.975
   77    HB3  PRO  50          2HB       PRO  50  -2.640  15.628 -10.985
   78    HG2  PRO  50          1HG       PRO  50  -5.554  16.171 -11.406
   79    HG3  PRO  50          2HG       PRO  50  -4.225  16.224 -12.579
   80    HD2  PRO  50          1HD       PRO  50  -5.919  14.120 -12.390
   81    HD3  PRO  50          2HD       PRO  50  -4.217  13.936 -12.863
   82    H    GLU  51           H        GLU  51  -6.452  13.892  -9.614
   83    HA   GLU  51           HA       GLU  51  -6.842  15.468  -7.192
   84    HB2  GLU  51          1HB       GLU  51  -8.455  14.787  -9.441
   85    HB3  GLU  51          2HB       GLU  51  -9.237  14.154  -8.000
   86    HG2  GLU  51          1HG       GLU  51  -8.256  16.978  -8.108
   87    HG3  GLU  51          2HG       GLU  51  -9.822  16.526  -8.780
   88    H    VAL  52           H        VAL  52  -6.142  12.298  -8.028
   89    HA   VAL  52           HA       VAL  52  -7.578  11.070  -5.821
   90    HB   VAL  52           HB       VAL  52  -5.498   9.628  -7.416
   91   HG11  VAL  52          1HG1      VAL  52  -8.000   8.947  -5.933
   92   HG12  VAL  52          2HG1      VAL  52  -7.414   7.876  -7.207
   93   HG13  VAL  52          3HG1      VAL  52  -6.393   8.230  -5.812
   94   HG21  VAL  52          1HG2      VAL  52  -6.527  10.412  -9.283
   95   HG22  VAL  52          2HG2      VAL  52  -7.648   9.104  -8.907
   96   HG23  VAL  52          3HG2      VAL  52  -8.037  10.759  -8.440
   97    H    PHE  53           H        PHE  53  -4.165  11.347  -6.826
   98    HA   PHE  53           HA       PHE  53  -3.081  10.359  -4.430
   99    HB2  PHE  53          1HB       PHE  53  -2.029  10.929  -6.830
  100    HB3  PHE  53          2HB       PHE  53  -1.527  12.376  -5.962
  101    HD1  PHE  53           HD1      PHE  53  -0.522   9.215  -6.897
  102    HD2  PHE  53           HD2      PHE  53  -0.552  11.793  -3.510
  103    HE1  PHE  53           HE1      PHE  53   1.374   7.974  -5.939
  104    HE2  PHE  53           HE2      PHE  53   1.345  10.557  -2.548
  105    HZ   PHE  53           HZ       PHE  53   2.311   8.645  -3.763
  106    H    ALA  54           H        ALA  54  -3.826  13.647  -5.491
  107    HA   ALA  54           HA       ALA  54  -2.746  14.901  -3.161
  108    HB1  ALA  54          1HB       ALA  54  -2.995  16.024  -5.367
  109    HB2  ALA  54          2HB       ALA  54  -4.740  16.041  -5.111
  110    HB3  ALA  54          3HB       ALA  54  -3.681  16.933  -4.020
  111    H    ALA  55           H        ALA  55  -5.699  13.321  -3.891
  112    HA   ALA  55           HA       ALA  55  -7.421  14.666  -2.096
  113    HB1  ALA  55          1HB       ALA  55  -8.827  13.407  -3.271
  114    HB2  ALA  55          2HB       ALA  55  -7.531  12.331  -3.795
  115    HB3  ALA  55          3HB       ALA  55  -8.342  12.050  -2.254
  116    H    LEU  56           H        LEU  56  -5.219  11.940  -1.730
  117    HA   LEU  56           HA       LEU  56  -6.063  11.370   0.962
  118    HB2  LEU  56          1HB       LEU  56  -3.451  10.419  -0.085
  119    HB3  LEU  56          2HB       LEU  56  -4.651   9.574   0.891
  120    HG   LEU  56           HG       LEU  56  -4.781  10.088  -2.079
  121   HD11  LEU  56          1HD1      LEU  56  -4.460   7.765  -2.347
  122   HD12  LEU  56          2HD1      LEU  56  -4.654   7.462  -0.621
  123   HD13  LEU  56          3HD1      LEU  56  -3.221   8.302  -1.213
  124   HD21  LEU  56          1HD2      LEU  56  -6.818   9.237  -0.106
  125   HD22  LEU  56          2HD2      LEU  56  -6.763   8.356  -1.633
  126   HD23  LEU  56          3HD2      LEU  56  -7.004  10.103  -1.631
  127    HA   PRO  57           HA       PRO  57  -3.449  14.079   3.218
  128    HB2  PRO  57          1HB       PRO  57  -2.758  12.540   5.345
  129    HB3  PRO  57          2HB       PRO  57  -4.379  13.210   5.131
  130    HG2  PRO  57          1HG       PRO  57  -3.373  10.456   4.526
  131    HG3  PRO  57          2HG       PRO  57  -4.893  10.948   5.294
  132    HD2  PRO  57          1HD       PRO  57  -4.743  10.227   2.688
  133    HD3  PRO  57          2HD       PRO  57  -5.898  11.439   3.278
  134    H    ALA  58           H        ALA  58  -1.353  14.694   3.264
  135    HA   ALA  58           HA       ALA  58   0.606  13.437   1.796
  136    HB1  ALA  58          1HB       ALA  58   1.937  14.876   3.830
  137    HB2  ALA  58          2HB       ALA  58   1.580  15.391   2.180
  138    HB3  ALA  58          3HB       ALA  58   0.434  15.731   3.478
  139    H    GLU  59           H        GLU  59  -0.242  12.974   5.163
  140    HA   GLU  59           HA       GLU  59   2.034  11.626   6.050
  141    HB2  GLU  59          1HB       GLU  59   0.296  12.382   7.579
  142    HB3  GLU  59          2HB       GLU  59  -0.850  11.252   6.871
  143    HG2  GLU  59          1HG       GLU  59   0.056  10.494   9.029
  144    HG3  GLU  59          2HG       GLU  59   0.392   9.378   7.706
  145    H    LEU  60           H        LEU  60  -0.844  10.420   4.391
  146    HA   LEU  60           HA       LEU  60   0.161   7.697   4.418
  147    HB2  LEU  60          1HB       LEU  60  -2.114   7.640   4.644
  148    HB3  LEU  60          2HB       LEU  60  -2.361   9.041   3.603
  149    HG   LEU  60           HG       LEU  60  -1.381   6.563   2.306
  150   HD11  LEU  60          1HD1      LEU  60  -4.172   6.871   3.395
  151   HD12  LEU  60          2HD1      LEU  60  -3.015   5.590   3.755
  152   HD13  LEU  60          3HD1      LEU  60  -3.717   5.716   2.143
  153   HD21  LEU  60          1HD2      LEU  60  -3.666   7.852   1.139
  154   HD22  LEU  60          2HD2      LEU  60  -2.034   7.668   0.495
  155   HD23  LEU  60          3HD2      LEU  60  -2.425   9.043   1.529
  156    H    GLN  61           H        GLN  61  -0.307  10.336   2.128
  157    HA   GLN  61           HA       GLN  61   0.333   8.905  -0.213
  158    HB2  GLN  61          1HB       GLN  61  -0.141  10.854  -1.199
  159    HB3  GLN  61          2HB       GLN  61  -0.439  11.506   0.407
  160    HG2  GLN  61          1HG       GLN  61   1.753  12.386   0.555
  161    HG3  GLN  61          2HG       GLN  61   2.275  11.505  -0.880
  162   HE21  GLN  61          1HE2      GLN  61  -0.427  14.455  -1.670
  163   HE22  GLN  61          2HE2      GLN  61  -0.743  13.255  -0.469
  164    H    ARG  62           H        ARG  62   2.289  10.321   2.285
  165    HA   ARG  62           HA       ARG  62   4.731  10.228   0.749
  166    HB2  ARG  62          1HB       ARG  62   5.800  11.119   2.655
  167    HB3  ARG  62          2HB       ARG  62   4.214  11.878   2.619
  168    HG2  ARG  62          1HG       ARG  62   4.103  11.297   4.769
  169    HG3  ARG  62          2HG       ARG  62   3.747   9.679   4.162
  170    HD2  ARG  62          1HD       ARG  62   6.067   9.057   4.320
  171    HD3  ARG  62          2HD       ARG  62   6.519  10.704   4.754
  172    HE   ARG  62           HE       ARG  62   4.661   9.788   6.628
  173   HH11  ARG  62          1HH1      ARG  62   7.918   9.125   5.594
  174   HH12  ARG  62          2HH1      ARG  62   8.436   8.563   7.149
  175   HH21  ARG  62          1HH2      ARG  62   5.330   9.049   8.680
  176   HH22  ARG  62          2HH2      ARG  62   6.963   8.519   8.903
  177    H    GLU  63           H        GLU  63   2.960   8.126   2.845
  178    HA   GLU  63           HA       GLU  63   5.135   6.424   3.564
  179    HB2  GLU  63          1HB       GLU  63   3.202   6.432   4.974
  180    HB3  GLU  63          2HB       GLU  63   2.143   6.046   3.626
  181    HG2  GLU  63          1HG       GLU  63   2.580   3.848   3.734
  182    HG3  GLU  63          2HG       GLU  63   4.278   4.096   4.139
  183    H    LEU  64           H        LEU  64   2.937   6.612   0.871
  184    HA   LEU  64           HA       LEU  64   3.611   3.981  -0.125
  185    HB2  LEU  64          1HB       LEU  64   2.022   4.329  -1.774
  186    HB3  LEU  64          2HB       LEU  64   1.378   5.218  -0.396
  187    HG   LEU  64           HG       LEU  64   2.713   7.198  -1.643
  188   HD11  LEU  64          1HD1      LEU  64   1.583   6.387  -4.098
  189   HD12  LEU  64          2HD1      LEU  64   2.625   5.077  -3.545
  190   HD13  LEU  64          3HD1      LEU  64   3.278   6.705  -3.727
  191   HD21  LEU  64          1HD2      LEU  64   0.654   8.077  -1.994
  192   HD22  LEU  64          2HD2      LEU  64   0.168   6.708  -0.992
  193   HD23  LEU  64          3HD2      LEU  64   0.032   6.609  -2.749
  194    H    LYS  65           H        LYS  65   4.573   7.295  -0.654
  195    HA   LYS  65           HA       LYS  65   6.065   6.708  -3.052
  196    HB2  LYS  65          1HB       LYS  65   6.058   9.177  -1.305
  197    HB3  LYS  65          2HB       LYS  65   6.813   9.048  -2.888
  198    HG2  LYS  65          1HG       LYS  65   4.784   9.005  -3.998
  199    HG3  LYS  65          2HG       LYS  65   3.895   8.491  -2.562
  200    HD2  LYS  65          1HD       LYS  65   3.314  10.641  -2.348
  201    HD3  LYS  65          2HD       LYS  65   4.969  10.906  -1.795
  202    HE2  LYS  65          1HE       LYS  65   5.676  11.546  -3.978
  203    HE3  LYS  65          2HE       LYS  65   4.150  11.026  -4.690
  204    HZ1  LYS  65          1HZ       LYS  65   3.485  12.865  -2.749
  205    HZ2  LYS  65          2HZ       LYS  65   3.447  13.096  -4.424
  206    HZ3  LYS  65          3HZ       LYS  65   4.824  13.530  -3.542
  207    H    ALA  66           H        ALA  66   6.851   7.527   0.317
  208    HA   ALA  66           HA       ALA  66   9.649   7.368   0.037
  209    HB1  ALA  66          1HB       ALA  66   9.766   7.505   2.374
  210    HB2  ALA  66          2HB       ALA  66   8.300   8.389   1.947
  211    HB3  ALA  66          3HB       ALA  66   8.186   6.749   2.584
  212    H    ALA  67           H        ALA  67   7.239   4.963   1.032
  213    HA   ALA  67           HA       ALA  67   8.884   2.884   1.785
  214    HB1  ALA  67          1HB       ALA  67   6.251   2.774   0.323
  215    HB2  ALA  67          2HB       ALA  67   7.037   1.380   1.066
  216    HB3  ALA  67          3HB       ALA  67   6.508   2.732   2.067
  217    H    TYR  68           H        TYR  68   7.876   3.810  -1.480
  218    HA   TYR  68           HA       TYR  68   8.966   1.635  -2.862
  219    HB2  TYR  68          1HB       TYR  68   7.946   4.289  -3.525
  220    HB3  TYR  68          2HB       TYR  68   9.240   3.773  -4.600
  221    HD1  TYR  68           HD1      TYR  68   8.827   2.220  -6.315
  222    HD2  TYR  68           HD2      TYR  68   5.939   2.758  -3.237
  223    HE1  TYR  68           HE1      TYR  68   7.232   0.839  -7.579
  224    HE2  TYR  68           HE2      TYR  68   4.336   1.377  -4.492
  225    HH   TYR  68           HH       TYR  68   4.468   0.749  -7.571
  226    H    ASP  69           H        ASP  69  10.431   4.568  -1.637
  227    HA   ASP  69           HA       ASP  69  12.937   4.110  -3.002
  228    HB2  ASP  69          1HB       ASP  69  12.219   6.402  -2.599
  229    HB3  ASP  69          2HB       ASP  69  12.166   6.106  -0.863
  230    H    GLN  70           H        GLN  70  11.680   3.834   0.295
  231    HA   GLN  70           HA       GLN  70  14.005   3.219   1.654
  232    HB2  GLN  70          1HB       GLN  70  11.209   2.160   2.077
  233    HB3  GLN  70          2HB       GLN  70  12.527   1.931   3.218
  234    HG2  GLN  70          1HG       GLN  70  11.160   4.480   2.434
  235    HG3  GLN  70          2HG       GLN  70  11.291   3.746   4.032
  236   HE21  GLN  70          1HE2      GLN  70  14.047   6.341   2.731
  237   HE22  GLN  70          2HE2      GLN  70  12.605   5.960   1.859
  238    H    ARG  71           H        ARG  71  11.775   0.961   0.041
  239    HA   ARG  71           HA       ARG  71  13.316  -1.351   0.582
  240    HB2  ARG  71          1HB       ARG  71  11.320  -0.902  -1.645
  241    HB3  ARG  71          2HB       ARG  71  11.888  -2.459  -1.057
  242    HG2  ARG  71          1HG       ARG  71  10.542  -2.421   0.751
  243    HG3  ARG  71          2HG       ARG  71  10.688  -0.675   0.958
  244    HD2  ARG  71          1HD       ARG  71   8.775  -0.324  -0.121
  245    HD3  ARG  71          2HD       ARG  71   9.316  -1.288  -1.494
  246    HE   ARG  71           HE       ARG  71   8.061  -3.034  -0.714
  247   HH11  ARG  71          1HH1      ARG  71   8.465  -0.697   1.834
  248   HH12  ARG  71          2HH1      ARG  71   7.358  -1.484   2.909
  249   HH21  ARG  71          1HH2      ARG  71   6.601  -4.080   0.692
  250   HH22  ARG  71          2HH2      ARG  71   6.299  -3.409   2.259
  251    H    GLN  72           H        GLN  72  13.601   1.156  -1.749
  252    HA   GLN  72           HA       GLN  72  14.951  -0.242  -3.795
  253    HB2  GLN  72          1HB       GLN  72  14.088   2.377  -3.366
  254    HB3  GLN  72          2HB       GLN  72  15.836   2.506  -3.513
  255    HG2  GLN  72          1HG       GLN  72  15.077   2.780  -5.685
  256    HG3  GLN  72          2HG       GLN  72  15.572   1.089  -5.627
  257   HE21  GLN  72          1HE2      GLN  72  11.751   2.123  -6.391
  258   HE22  GLN  72          2HE2      GLN  72  12.983   3.287  -6.062
  Start of MODEL    7
    1    H    ILE  40           H        ILE  40   5.190  -2.296   1.672
    2    HA   ILE  40           HA       ILE  40   2.943  -1.532   0.780
    3    HB   ILE  40           HB       ILE  40   4.214  -0.290  -1.273
    4   HG12  ILE  40          1HG1      ILE  40   6.389  -0.694   0.769
    5   HG13  ILE  40          2HG1      ILE  40   6.250  -1.743  -0.638
    6   HG21  ILE  40          1HG2      ILE  40   4.849   0.698   1.450
    7   HG22  ILE  40          2HG2      ILE  40   4.154   1.546   0.070
    8   HG23  ILE  40          3HG2      ILE  40   3.151   0.464   1.037
    9   HD11  ILE  40          1HD1      ILE  40   7.828   0.290  -0.727
   10   HD12  ILE  40          2HD1      ILE  40   6.787  -0.047  -2.111
   11   HD13  ILE  40          3HD1      ILE  40   6.352   1.223  -0.967
   12    H    ALA  41           H        ALA  41   4.994  -2.197  -2.027
   13    HA   ALA  41           HA       ALA  41   4.448  -2.976  -4.108
   14    HB1  ALA  41          1HB       ALA  41   4.824  -5.061  -2.942
   15    HB2  ALA  41          2HB       ALA  41   3.150  -5.085  -2.388
   16    HB3  ALA  41          3HB       ALA  41   3.513  -5.255  -4.105
   17    H    LEU  42           H        LEU  42   2.873  -0.924  -3.786
   18    HA   LEU  42           HA       LEU  42   0.161  -1.850  -4.474
   19    HB2  LEU  42          1HB       LEU  42  -0.558   0.452  -3.766
   20    HB3  LEU  42          2HB       LEU  42   0.002  -0.611  -2.477
   21    HG   LEU  42           HG       LEU  42   2.143   1.046  -3.518
   22   HD11  LEU  42          1HD1      LEU  42   1.388   3.169  -3.100
   23   HD12  LEU  42          2HD1      LEU  42   0.086   2.619  -2.047
   24   HD13  LEU  42          3HD1      LEU  42  -0.059   2.439  -3.795
   25   HD21  LEU  42          1HD2      LEU  42   0.895   0.780  -0.785
   26   HD22  LEU  42          2HD2      LEU  42   2.453   1.521  -1.151
   27   HD23  LEU  42          3HD2      LEU  42   2.214  -0.207  -1.415
   28    HA   PRO  43           HA       PRO  43   2.010   0.109  -8.255
   29    HB2  PRO  43          1HB       PRO  43   1.116  -1.801  -9.965
   30    HB3  PRO  43          2HB       PRO  43   2.646  -1.934  -9.091
   31    HG2  PRO  43          1HG       PRO  43  -0.008  -3.166  -8.460
   32    HG3  PRO  43          2HG       PRO  43   1.608  -3.893  -8.390
   33    HD2  PRO  43          1HD       PRO  43   0.317  -2.996  -6.185
   34    HD3  PRO  43          2HD       PRO  43   2.084  -2.943  -6.345
   35    H    ALA  44           H        ALA  44   0.104   1.526  -7.409
   36    HA   ALA  44           HA       ALA  44  -2.012   1.402  -9.444
   37    HB1  ALA  44          1HB       ALA  44  -2.365   1.718  -6.481
   38    HB2  ALA  44          2HB       ALA  44  -3.573   2.301  -7.628
   39    HB3  ALA  44          3HB       ALA  44  -3.160   0.587  -7.576
   40    H    PHE  45           H        PHE  45  -0.239   3.350  -7.091
   41    HA   PHE  45           HA       PHE  45  -1.231   5.847  -8.091
   42    HB2  PHE  45          1HB       PHE  45   0.354   6.874  -6.565
   43    HB3  PHE  45          2HB       PHE  45  -0.469   5.549  -5.749
   44    HD1  PHE  45           HD1      PHE  45   0.719   3.413  -5.362
   45    HD2  PHE  45           HD2      PHE  45   2.696   6.853  -6.903
   46    HE1  PHE  45           HE1      PHE  45   2.894   2.423  -4.774
   47    HE2  PHE  45           HE2      PHE  45   4.873   5.868  -6.319
   48    HZ   PHE  45           HZ       PHE  45   4.975   3.650  -5.254
   49    H    SER  46           H        SER  46   0.857   3.645  -9.369
   50    HA   SER  46           HA       SER  46   3.072   5.009 -10.268
   51    HB2  SER  46          1HB       SER  46   2.652   2.589 -10.636
   52    HB3  SER  46          2HB       SER  46   1.460   3.005 -11.868
   53    HG   SER  46           HG       SER  46   3.029   3.670 -13.192
   54    H    GLN  47           H        GLN  47  -0.212   5.074 -11.543
   55    HA   GLN  47           HA       GLN  47   0.067   7.638 -12.659
   56    HB2  GLN  47          1HB       GLN  47   1.457   6.498 -14.319
   57    HB3  GLN  47          2HB       GLN  47   0.151   5.368 -14.653
   58    HG2  GLN  47          1HG       GLN  47  -1.206   7.492 -15.239
   59    HG3  GLN  47          2HG       GLN  47   0.377   8.257 -15.367
   60   HE21  GLN  47          1HE2      GLN  47  -0.382   5.151 -17.929
   61   HE22  GLN  47          2HE2      GLN  47  -0.882   5.067 -16.277
   62    H    VAL  48           H        VAL  48  -1.909   8.334 -12.193
   63    HA   VAL  48           HA       VAL  48  -4.205   6.984 -13.355
   64    HB   VAL  48           HB       VAL  48  -4.027   7.494 -10.383
   65   HG11  VAL  48          1HG1      VAL  48  -6.234   7.979 -10.855
   66   HG12  VAL  48          2HG1      VAL  48  -6.309   6.831 -12.193
   67   HG13  VAL  48          3HG1      VAL  48  -6.308   6.248 -10.529
   68   HG21  VAL  48          1HG2      VAL  48  -2.848   5.478 -11.049
   69   HG22  VAL  48          2HG2      VAL  48  -4.330   5.063 -10.188
   70   HG23  VAL  48          3HG2      VAL  48  -4.263   4.924 -11.944
   71    H    ASP  49           H        ASP  49  -3.728   9.434 -10.811
   72    HA   ASP  49           HA       ASP  49  -4.213  11.672 -12.429
   73    HB2  ASP  49          1HB       ASP  49  -6.555  10.216 -11.931
   74    HB3  ASP  49          2HB       ASP  49  -6.622  11.586 -10.826
   75    HA   PRO  50           HA       PRO  50  -2.705  13.563  -8.758
   76    HB2  PRO  50          1HB       PRO  50  -3.388  16.142  -9.261
   77    HB3  PRO  50          2HB       PRO  50  -2.067  15.318 -10.097
   78    HG2  PRO  50          1HG       PRO  50  -4.874  15.811 -11.013
   79    HG3  PRO  50          2HG       PRO  50  -3.358  15.968 -11.919
   80    HD2  PRO  50          1HD       PRO  50  -4.981  13.814 -12.158
   81    HD3  PRO  50          2HD       PRO  50  -3.217  13.703 -12.321
   82    H    GLU  51           H        GLU  51  -6.010  14.345  -9.770
   83    HA   GLU  51           HA       GLU  51  -6.920  15.536  -7.426
   84    HB2  GLU  51          1HB       GLU  51  -8.097  14.386  -9.814
   85    HB3  GLU  51          2HB       GLU  51  -9.086  14.063  -8.396
   86    HG2  GLU  51          1HG       GLU  51  -8.792  16.588  -7.918
   87    HG3  GLU  51          2HG       GLU  51  -8.338  16.681  -9.619
   88    H    VAL  52           H        VAL  52  -6.172  12.240  -8.095
   89    HA   VAL  52           HA       VAL  52  -7.673  11.216  -5.829
   90    HB   VAL  52           HB       VAL  52  -5.652   9.567  -7.283
   91   HG11  VAL  52          1HG1      VAL  52  -6.767   8.444  -5.536
   92   HG12  VAL  52          2HG1      VAL  52  -8.337   9.093  -6.014
   93   HG13  VAL  52          3HG1      VAL  52  -7.535   7.888  -7.023
   94   HG21  VAL  52          1HG2      VAL  52  -8.167  10.688  -8.443
   95   HG22  VAL  52          2HG2      VAL  52  -6.590  10.452  -9.198
   96   HG23  VAL  52          3HG2      VAL  52  -7.639   9.067  -8.897
   97    H    PHE  53           H        PHE  53  -4.255  11.442  -6.804
   98    HA   PHE  53           HA       PHE  53  -3.167  10.442  -4.422
   99    HB2  PHE  53          1HB       PHE  53  -2.116  11.113  -6.803
  100    HB3  PHE  53          2HB       PHE  53  -1.640  12.531  -5.875
  101    HD1  PHE  53           HD1      PHE  53  -0.933  11.578  -3.296
  102    HD2  PHE  53           HD2      PHE  53  -0.324   9.712  -7.073
  103    HE1  PHE  53           HE1      PHE  53   0.974  10.332  -2.369
  104    HE2  PHE  53           HE2      PHE  53   1.583   8.462  -6.151
  105    HZ   PHE  53           HZ       PHE  53   2.235   8.770  -3.796
  106    H    ALA  54           H        ALA  54  -3.856  13.770  -5.436
  107    HA   ALA  54           HA       ALA  54  -2.862  14.981  -3.066
  108    HB1  ALA  54          1HB       ALA  54  -4.825  16.053  -5.090
  109    HB2  ALA  54          2HB       ALA  54  -3.979  17.002  -3.866
  110    HB3  ALA  54          3HB       ALA  54  -3.070  16.217  -5.158
  111    H    ALA  55           H        ALA  55  -5.789  13.365  -3.839
  112    HA   ALA  55           HA       ALA  55  -7.521  14.628  -1.988
  113    HB1  ALA  55          1HB       ALA  55  -7.647  12.441  -3.832
  114    HB2  ALA  55          2HB       ALA  55  -8.349  11.959  -2.287
  115    HB3  ALA  55          3HB       ALA  55  -8.961  13.383  -3.126
  116    H    LEU  56           H        LEU  56  -5.264  11.940  -1.737
  117    HA   LEU  56           HA       LEU  56  -6.105  11.202   0.910
  118    HB2  LEU  56          1HB       LEU  56  -3.439  10.432  -0.154
  119    HB3  LEU  56          2HB       LEU  56  -4.601   9.482   0.770
  120    HG   LEU  56           HG       LEU  56  -4.730  10.132  -2.173
  121   HD11  LEU  56          1HD1      LEU  56  -4.328   7.828  -2.537
  122   HD12  LEU  56          2HD1      LEU  56  -4.500   7.453  -0.823
  123   HD13  LEU  56          3HD1      LEU  56  -3.107   8.375  -1.388
  124   HD21  LEU  56          1HD2      LEU  56  -6.771   9.217  -0.268
  125   HD22  LEU  56          2HD2      LEU  56  -6.634   8.251  -1.738
  126   HD23  LEU  56          3HD2      LEU  56  -6.949   9.984  -1.846
  127    HA   PRO  57           HA       PRO  57  -3.648  13.895   3.352
  128    HB2  PRO  57          1HB       PRO  57  -2.896  12.271   5.393
  129    HB3  PRO  57          2HB       PRO  57  -4.548  12.869   5.201
  130    HG2  PRO  57          1HG       PRO  57  -3.397  10.210   4.448
  131    HG3  PRO  57          2HG       PRO  57  -4.947  10.579   5.225
  132    HD2  PRO  57          1HD       PRO  57  -4.739  10.020   2.584
  133    HD3  PRO  57          2HD       PRO  57  -5.959  11.136   3.231
  134    H    ALA  58           H        ALA  58  -1.577  14.599   3.517
  135    HA   ALA  58           HA       ALA  58   0.455  13.566   1.975
  136    HB1  ALA  58          1HB       ALA  58   1.801  14.866   4.012
  137    HB2  ALA  58          2HB       ALA  58   1.178  15.598   2.533
  138    HB3  ALA  58          3HB       ALA  58   0.207  15.622   4.005
  139    H    GLU  59           H        GLU  59  -0.272  12.910   5.367
  140    HA   GLU  59           HA       GLU  59   2.002  11.556   6.141
  141    HB2  GLU  59          1HB       GLU  59  -0.445  12.036   7.265
  142    HB3  GLU  59          2HB       GLU  59  -0.498  10.293   7.038
  143    HG2  GLU  59          1HG       GLU  59   0.324  10.844   9.243
  144    HG3  GLU  59          2HG       GLU  59   1.583  10.061   8.291
  145    H    LEU  60           H        LEU  60  -0.816  10.288   4.404
  146    HA   LEU  60           HA       LEU  60   0.381   7.658   4.185
  147    HB2  LEU  60          1HB       LEU  60  -1.882   7.426   4.405
  148    HB3  LEU  60          2HB       LEU  60  -2.230   8.890   3.487
  149    HG   LEU  60           HG       LEU  60  -1.094   6.598   1.988
  150   HD11  LEU  60          1HD1      LEU  60  -3.903   6.642   3.075
  151   HD12  LEU  60          2HD1      LEU  60  -2.667   5.417   3.357
  152   HD13  LEU  60          3HD1      LEU  60  -3.362   5.613   1.749
  153   HD21  LEU  60          1HD2      LEU  60  -3.462   7.850   0.937
  154   HD22  LEU  60          2HD2      LEU  60  -1.832   7.793   0.268
  155   HD23  LEU  60          3HD2      LEU  60  -2.273   9.064   1.408
  156    H    GLN  61           H        GLN  61  -0.252  10.451   2.137
  157    HA   GLN  61           HA       GLN  61   0.372   9.332  -0.344
  158    HB2  GLN  61          1HB       GLN  61  -0.407  11.393  -0.789
  159    HB3  GLN  61          2HB       GLN  61   0.099  12.016   0.776
  160    HG2  GLN  61          1HG       GLN  61   2.139  12.702   0.002
  161    HG3  GLN  61          2HG       GLN  61   2.168  11.513  -1.299
  162   HE21  GLN  61          1HE2      GLN  61  -0.373  14.631  -1.979
  163   HE22  GLN  61          2HE2      GLN  61  -0.444  13.728  -0.508
  164    H    ARG  62           H        ARG  62   2.435  10.552   2.213
  165    HA   ARG  62           HA       ARG  62   4.828  10.349   0.594
  166    HB2  ARG  62          1HB       ARG  62   5.995  11.247   2.450
  167    HB3  ARG  62          2HB       ARG  62   4.455  12.095   2.395
  168    HG2  ARG  62          1HG       ARG  62   3.594  10.654   4.169
  169    HG3  ARG  62          2HG       ARG  62   5.140   9.803   4.224
  170    HD2  ARG  62          1HD       ARG  62   6.232  11.985   4.755
  171    HD3  ARG  62          2HD       ARG  62   4.625  12.700   4.875
  172    HE   ARG  62           HE       ARG  62   4.425  11.768   6.947
  173   HH11  ARG  62          1HH1      ARG  62   6.927  10.087   5.206
  174   HH12  ARG  62          2HH1      ARG  62   7.403   9.121   6.563
  175   HH21  ARG  62          1HH2      ARG  62   5.042  10.502   8.741
  176   HH22  ARG  62          2HH2      ARG  62   6.330   9.357   8.573
  177    H    GLU  63           H        GLU  63   3.044   8.409   2.834
  178    HA   GLU  63           HA       GLU  63   5.143   6.655   3.600
  179    HB2  GLU  63          1HB       GLU  63   3.180   6.756   4.968
  180    HB3  GLU  63          2HB       GLU  63   2.141   6.352   3.610
  181    HG2  GLU  63          1HG       GLU  63   2.447   4.163   3.880
  182    HG3  GLU  63          2HG       GLU  63   4.183   4.343   4.124
  183    H    LEU  64           H        LEU  64   2.963   6.793   0.878
  184    HA   LEU  64           HA       LEU  64   3.634   4.131  -0.036
  185    HB2  LEU  64          1HB       LEU  64   2.079   4.463  -1.749
  186    HB3  LEU  64          2HB       LEU  64   1.395   5.284  -0.347
  187    HG   LEU  64           HG       LEU  64   2.625   7.364  -1.487
  188   HD11  LEU  64          1HD1      LEU  64   2.588   5.292  -3.523
  189   HD12  LEU  64          2HD1      LEU  64   3.431   6.840  -3.496
  190   HD13  LEU  64          3HD1      LEU  64   1.752   6.760  -4.029
  191   HD21  LEU  64          1HD2      LEU  64   0.533   8.122  -1.896
  192   HD22  LEU  64          2HD2      LEU  64   0.084   6.673  -0.997
  193   HD23  LEU  64          3HD2      LEU  64   0.052   6.663  -2.761
  194    H    LYS  65           H        LYS  65   4.478   7.458  -0.795
  195    HA   LYS  65           HA       LYS  65   5.992   6.803  -3.137
  196    HB2  LYS  65          1HB       LYS  65   6.013   9.302  -1.434
  197    HB3  LYS  65          2HB       LYS  65   6.761   9.143  -3.017
  198    HG2  LYS  65          1HG       LYS  65   4.709   9.041  -4.113
  199    HG3  LYS  65          2HG       LYS  65   3.834   8.640  -2.633
  200    HD2  LYS  65          1HD       LYS  65   3.278  10.847  -2.814
  201    HD3  LYS  65          2HD       LYS  65   4.767  11.000  -1.877
  202    HE2  LYS  65          1HE       LYS  65   6.013  11.637  -3.767
  203    HE3  LYS  65          2HE       LYS  65   4.761  11.087  -4.880
  204    HZ1  LYS  65          1HZ       LYS  65   5.066  13.623  -3.620
  205    HZ2  LYS  65          2HZ       LYS  65   3.536  12.971  -3.313
  206    HZ3  LYS  65          3HZ       LYS  65   4.062  13.179  -4.907
  207    H    ALA  66           H        ALA  66   6.759   7.470   0.251
  208    HA   ALA  66           HA       ALA  66   9.584   7.340  -0.086
  209    HB1  ALA  66          1HB       ALA  66   8.303   8.455   1.808
  210    HB2  ALA  66          2HB       ALA  66   8.130   6.839   2.494
  211    HB3  ALA  66          3HB       ALA  66   9.735   7.526   2.250
  212    H    ALA  67           H        ALA  67   7.152   5.028   1.082
  213    HA   ALA  67           HA       ALA  67   8.778   2.937   1.831
  214    HB1  ALA  67          1HB       ALA  67   6.425   2.838   2.235
  215    HB2  ALA  67          2HB       ALA  67   6.074   2.857   0.506
  216    HB3  ALA  67          3HB       ALA  67   6.862   1.455   1.231
  217    H    TYR  68           H        TYR  68   7.591   3.721  -1.418
  218    HA   TYR  68           HA       TYR  68   8.664   1.475  -2.727
  219    HB2  TYR  68          1HB       TYR  68   7.485   4.043  -3.500
  220    HB3  TYR  68          2HB       TYR  68   8.686   3.453  -4.643
  221    HD1  TYR  68           HD1      TYR  68   7.920   2.132  -6.366
  222    HD2  TYR  68           HD2      TYR  68   5.789   2.121  -2.683
  223    HE1  TYR  68           HE1      TYR  68   6.250   0.614  -7.344
  224    HE2  TYR  68           HE2      TYR  68   4.114   0.602  -3.650
  225    HH   TYR  68           HH       TYR  68   4.320  -0.444  -7.037
  226    H    ASP  69           H        ASP  69  10.076   4.493  -1.717
  227    HA   ASP  69           HA       ASP  69  12.469   4.156  -3.299
  228    HB2  ASP  69          1HB       ASP  69  11.573   6.403  -2.733
  229    HB3  ASP  69          2HB       ASP  69  11.923   6.088  -1.036
  230    H    GLN  70           H        GLN  70  11.493   3.725   0.065
  231    HA   GLN  70           HA       GLN  70  13.963   3.258   1.231
  232    HB2  GLN  70          1HB       GLN  70  11.279   2.020   1.852
  233    HB3  GLN  70          2HB       GLN  70  12.696   1.855   2.880
  234    HG2  GLN  70          1HG       GLN  70  11.112   4.322   2.267
  235    HG3  GLN  70          2HG       GLN  70  11.433   3.577   3.832
  236   HE21  GLN  70          1HE2      GLN  70  13.896   6.357   2.332
  237   HE22  GLN  70          2HE2      GLN  70  12.414   5.888   1.578
  238    H    ARG  71           H        ARG  71  11.752   0.887  -0.242
  239    HA   ARG  71           HA       ARG  71  13.476  -1.329   0.126
  240    HB2  ARG  71          1HB       ARG  71  11.316  -1.025  -1.963
  241    HB3  ARG  71          2HB       ARG  71  11.976  -2.528  -1.334
  242    HG2  ARG  71          1HG       ARG  71  10.421  -0.515   0.277
  243    HG3  ARG  71          2HG       ARG  71   9.761  -1.998  -0.415
  244    HD2  ARG  71          1HD       ARG  71  12.049  -1.904   1.545
  245    HD3  ARG  71          2HD       ARG  71  10.366  -2.177   1.995
  246    HE   ARG  71           HE       ARG  71  11.175  -4.021   0.006
  247   HH11  ARG  71          1HH1      ARG  71  11.528  -3.308   3.395
  248   HH12  ARG  71          2HH1      ARG  71  11.813  -4.956   3.846
  249   HH21  ARG  71          1HH2      ARG  71  11.549  -6.195   0.587
  250   HH22  ARG  71          2HH2      ARG  71  11.826  -6.597   2.248
  251    H    GLN  72           H        GLN  72  13.434   1.235  -2.146
  252    HA   GLN  72           HA       GLN  72  14.735   1.749  -3.939
  253    HB2  GLN  72          1HB       GLN  72  16.373  -0.005  -2.275
  254    HB3  GLN  72          2HB       GLN  72  16.832  -0.051  -3.971
  255    HG2  GLN  72          1HG       GLN  72  16.890   2.476  -3.882
  256    HG3  GLN  72          2HG       GLN  72  16.769   2.317  -2.131
  257   HE21  GLN  72          1HE2      GLN  72  20.322   2.274  -3.711
  258   HE22  GLN  72          2HE2      GLN  72  18.899   3.034  -4.328
  Start of MODEL    8
    1    H    ILE  40           H        ILE  40   2.469   0.308  -3.080
    2    HA   ILE  40           HA       ILE  40   4.497  -1.273  -1.644
    3    HB   ILE  40           HB       ILE  40   4.262   0.100   0.232
    4   HG12  ILE  40          1HG1      ILE  40   1.746   1.203  -1.037
    5   HG13  ILE  40          2HG1      ILE  40   1.828   0.131   0.357
    6   HG21  ILE  40          1HG2      ILE  40   3.965   1.895  -2.173
    7   HG22  ILE  40          2HG2      ILE  40   4.572   2.393  -0.594
    8   HG23  ILE  40          3HG2      ILE  40   5.470   1.216  -1.553
    9   HD11  ILE  40          1HD1      ILE  40   1.798   1.938   1.630
   10   HD12  ILE  40          2HD1      ILE  40   3.415   2.314   1.032
   11   HD13  ILE  40          3HD1      ILE  40   1.998   2.996   0.233
   12    H    ALA  41           H        ALA  41   1.138  -0.930  -2.335
   13    HA   ALA  41           HA       ALA  41   0.470  -3.471  -1.354
   14    HB1  ALA  41          1HB       ALA  41  -1.175  -2.008   0.391
   15    HB2  ALA  41          2HB       ALA  41   0.115  -3.135   0.810
   16    HB3  ALA  41          3HB       ALA  41   0.467  -1.416   0.641
   17    H    LEU  42           H        LEU  42  -0.602  -0.228  -2.170
   18    HA   LEU  42           HA       LEU  42  -2.943  -1.412  -3.511
   19    HB2  LEU  42          1HB       LEU  42  -3.894   1.000  -3.119
   20    HB3  LEU  42          2HB       LEU  42  -4.016  -0.243  -1.875
   21    HG   LEU  42           HG       LEU  42  -2.123   0.735  -0.692
   22   HD11  LEU  42          1HD1      LEU  42  -0.666   1.755  -2.088
   23   HD12  LEU  42          2HD1      LEU  42  -1.607   3.179  -1.644
   24   HD13  LEU  42          3HD1      LEU  42  -1.934   2.345  -3.163
   25   HD21  LEU  42          1HD2      LEU  42  -3.215   3.058  -0.303
   26   HD22  LEU  42          2HD2      LEU  42  -4.107   1.597   0.121
   27   HD23  LEU  42          3HD2      LEU  42  -4.473   2.450  -1.379
   28    HA   PRO  43           HA       PRO  43  -1.664   0.523  -7.235
   29    HB2  PRO  43          1HB       PRO  43  -4.028   1.283  -8.333
   30    HB3  PRO  43          2HB       PRO  43  -3.511  -0.405  -8.237
   31    HG2  PRO  43          1HG       PRO  43  -5.394   1.103  -6.464
   32    HG3  PRO  43          2HG       PRO  43  -5.544  -0.540  -7.116
   33    HD2  PRO  43          1HD       PRO  43  -4.733  -0.048  -4.580
   34    HD3  PRO  43          2HD       PRO  43  -4.148  -1.438  -5.516
   35    H    ALA  44           H        ALA  44  -0.955   2.268  -5.426
   36    HA   ALA  44           HA       ALA  44  -2.369   4.778  -5.665
   37    HB1  ALA  44          1HB       ALA  44  -1.465   4.925  -3.630
   38    HB2  ALA  44          2HB       ALA  44  -0.259   3.686  -3.980
   39    HB3  ALA  44          3HB       ALA  44   0.030   5.359  -4.460
   40    H    PHE  45           H        PHE  45   0.376   3.212  -7.118
   41    HA   PHE  45           HA       PHE  45   1.314   5.666  -8.362
   42    HB2  PHE  45          1HB       PHE  45   2.342   2.900  -8.954
   43    HB3  PHE  45          2HB       PHE  45   3.189   4.437  -9.091
   44    HD1  PHE  45           HD1      PHE  45   1.995   1.858  -6.773
   45    HD2  PHE  45           HD2      PHE  45   4.229   5.457  -7.192
   46    HE1  PHE  45           HE1      PHE  45   2.933   1.535  -4.521
   47    HE2  PHE  45           HE2      PHE  45   5.170   5.139  -4.942
   48    HZ   PHE  45           HZ       PHE  45   4.523   3.176  -3.603
   49    H    SER  46           H        SER  46  -0.882   3.169  -9.019
   50    HA   SER  46           HA       SER  46  -0.838   3.785 -11.900
   51    HB2  SER  46          1HB       SER  46  -0.665   1.321 -10.762
   52    HB3  SER  46          2HB       SER  46  -2.408   1.454 -10.991
   53    HG   SER  46           HG       SER  46  -2.067   1.795 -13.177
   54    H    GLN  47           H        GLN  47  -2.044   5.592 -10.179
   55    HA   GLN  47           HA       GLN  47  -4.835   5.122  -9.885
   56    HB2  GLN  47          1HB       GLN  47  -3.072   6.972  -8.898
   57    HB3  GLN  47          2HB       GLN  47  -3.983   7.927 -10.060
   58    HG2  GLN  47          1HG       GLN  47  -5.609   8.148  -8.586
   59    HG3  GLN  47          2HG       GLN  47  -5.850   6.402  -8.600
   60   HE21  GLN  47          1HE2      GLN  47  -4.729   5.973  -5.374
   61   HE22  GLN  47          2HE2      GLN  47  -5.589   5.381  -6.750
   62    H    VAL  48           H        VAL  48  -5.967   7.497 -10.842
   63    HA   VAL  48           HA       VAL  48  -5.771   7.122 -13.761
   64    HB   VAL  48           HB       VAL  48  -7.887   6.239 -12.756
   65   HG11  VAL  48          1HG1      VAL  48  -8.152   7.874 -10.971
   66   HG12  VAL  48          2HG1      VAL  48  -8.400   9.153 -12.162
   67   HG13  VAL  48          3HG1      VAL  48  -9.577   7.848 -12.009
   68   HG21  VAL  48          1HG2      VAL  48  -8.852   6.657 -14.720
   69   HG22  VAL  48          2HG2      VAL  48  -8.975   8.382 -14.371
   70   HG23  VAL  48          3HG2      VAL  48  -7.493   7.727 -15.066
   71    H    ASP  49           H        ASP  49  -6.122   9.359 -11.102
   72    HA   ASP  49           HA       ASP  49  -5.340  11.542 -12.870
   73    HB2  ASP  49          1HB       ASP  49  -8.000  11.233 -11.801
   74    HB3  ASP  49          2HB       ASP  49  -7.251  12.688 -11.150
   75    HA   PRO  50           HA       PRO  50  -2.844  12.830  -9.502
   76    HB2  PRO  50          1HB       PRO  50  -2.916  15.534  -9.731
   77    HB3  PRO  50          2HB       PRO  50  -2.040  14.498 -10.864
   78    HG2  PRO  50          1HG       PRO  50  -4.744  15.750 -11.146
   79    HG3  PRO  50          2HG       PRO  50  -3.442  15.619 -12.342
   80    HD2  PRO  50          1HD       PRO  50  -5.584  13.962 -12.333
   81    HD3  PRO  50          2HD       PRO  50  -3.974  13.439 -12.867
   82    H    GLU  51           H        GLU  51  -5.979  14.454  -9.758
   83    HA   GLU  51           HA       GLU  51  -6.127  15.674  -7.288
   84    HB2  GLU  51          1HB       GLU  51  -8.042  14.723  -9.289
   85    HB3  GLU  51          2HB       GLU  51  -8.692  14.739  -7.655
   86    HG2  GLU  51          1HG       GLU  51  -8.127  17.087  -7.428
   87    HG3  GLU  51          2HG       GLU  51  -7.411  17.085  -9.038
   88    H    VAL  52           H        VAL  52  -6.411  12.294  -8.093
   89    HA   VAL  52           HA       VAL  52  -7.587  11.420  -5.665
   90    HB   VAL  52           HB       VAL  52  -5.770   9.763  -7.406
   91   HG11  VAL  52          1HG1      VAL  52  -7.995   9.165  -5.481
   92   HG12  VAL  52          2HG1      VAL  52  -7.462   7.993  -6.687
   93   HG13  VAL  52          3HG1      VAL  52  -6.334   8.576  -5.463
   94   HG21  VAL  52          1HG2      VAL  52  -7.941   9.126  -8.573
   95   HG22  VAL  52          2HG2      VAL  52  -8.626  10.586  -7.857
   96   HG23  VAL  52          3HG2      VAL  52  -7.259  10.705  -8.966
   97    H    PHE  53           H        PHE  53  -4.217  11.526  -6.794
   98    HA   PHE  53           HA       PHE  53  -3.053  10.424  -4.492
   99    HB2  PHE  53          1HB       PHE  53  -2.066  11.035  -6.877
  100    HB3  PHE  53          2HB       PHE  53  -1.581  12.507  -6.042
  101    HD1  PHE  53           HD1      PHE  53  -0.411   9.473  -7.052
  102    HD2  PHE  53           HD2      PHE  53  -0.600  11.879  -3.547
  103    HE1  PHE  53           HE1      PHE  53   1.556   8.304  -6.148
  104    HE2  PHE  53           HE2      PHE  53   1.368  10.716  -2.638
  105    HZ   PHE  53           HZ       PHE  53   2.449   8.926  -3.939
  106    H    ALA  54           H        ALA  54  -3.696  13.793  -5.387
  107    HA   ALA  54           HA       ALA  54  -2.583  14.859  -2.972
  108    HB1  ALA  54          1HB       ALA  54  -2.516  16.309  -4.814
  109    HB2  ALA  54          2HB       ALA  54  -4.217  16.041  -5.197
  110    HB3  ALA  54          3HB       ALA  54  -3.771  16.970  -3.767
  111    H    ALA  55           H        ALA  55  -5.553  13.419  -3.795
  112    HA   ALA  55           HA       ALA  55  -7.304  14.800  -2.062
  113    HB1  ALA  55          1HB       ALA  55  -8.166  12.122  -2.258
  114    HB2  ALA  55          2HB       ALA  55  -8.747  13.523  -3.160
  115    HB3  ALA  55          3HB       ALA  55  -7.431  12.543  -3.806
  116    H    LEU  56           H        LEU  56  -5.198  12.004  -1.603
  117    HA   LEU  56           HA       LEU  56  -6.120  11.511   1.076
  118    HB2  LEU  56          1HB       LEU  56  -3.959  10.403  -0.665
  119    HB3  LEU  56          2HB       LEU  56  -3.959  10.057   1.063
  120    HG   LEU  56           HG       LEU  56  -6.258   9.416  -0.778
  121   HD11  LEU  56          1HD1      LEU  56  -5.179   7.027  -0.067
  122   HD12  LEU  56          2HD1      LEU  56  -3.734   8.014  -0.279
  123   HD13  LEU  56          3HD1      LEU  56  -4.888   7.846  -1.602
  124   HD21  LEU  56          1HD2      LEU  56  -6.422   9.698   1.841
  125   HD22  LEU  56          2HD2      LEU  56  -5.737   8.073   1.824
  126   HD23  LEU  56          3HD2      LEU  56  -7.264   8.396   1.001
  127    HA   PRO  57           HA       PRO  57  -3.457  14.126   3.383
  128    HB2  PRO  57          1HB       PRO  57  -2.772  12.550   5.484
  129    HB3  PRO  57          2HB       PRO  57  -4.389  13.236   5.285
  130    HG2  PRO  57          1HG       PRO  57  -3.406  10.483   4.637
  131    HG3  PRO  57          2HG       PRO  57  -4.920  10.976   5.417
  132    HD2  PRO  57          1HD       PRO  57  -4.784  10.292   2.800
  133    HD3  PRO  57          2HD       PRO  57  -5.927  11.505   3.412
  134    H    ALA  58           H        ALA  58  -1.333  14.692   3.584
  135    HA   ALA  58           HA       ALA  58   0.615  13.533   2.026
  136    HB1  ALA  58          1HB       ALA  58   1.261  15.022   4.556
  137    HB2  ALA  58          2HB       ALA  58   2.169  14.979   3.044
  138    HB3  ALA  58          3HB       ALA  58   0.623  15.823   3.120
  139    H    GLU  59           H        GLU  59  -0.295  12.764   5.318
  140    HA   GLU  59           HA       GLU  59   1.952  11.275   6.077
  141    HB2  GLU  59          1HB       GLU  59   0.149  12.008   7.619
  142    HB3  GLU  59          2HB       GLU  59  -0.921  10.815   6.897
  143    HG2  GLU  59          1HG       GLU  59  -0.226   9.619   8.683
  144    HG3  GLU  59          2HG       GLU  59   1.063   9.188   7.560
  145    H    LEU  60           H        LEU  60  -0.927  10.377   4.257
  146    HA   LEU  60           HA       LEU  60  -0.102   7.599   4.098
  147    HB2  LEU  60          1HB       LEU  60  -2.419   9.074   2.856
  148    HB3  LEU  60          2HB       LEU  60  -2.141   7.340   2.714
  149    HG   LEU  60           HG       LEU  60  -2.593   8.749   5.340
  150   HD11  LEU  60          1HD1      LEU  60  -4.792   8.711   5.028
  151   HD12  LEU  60          2HD1      LEU  60  -4.749   7.055   4.426
  152   HD13  LEU  60          3HD1      LEU  60  -4.467   8.401   3.323
  153   HD21  LEU  60          1HD2      LEU  60  -1.469   6.350   4.945
  154   HD22  LEU  60          2HD2      LEU  60  -3.169   5.880   4.921
  155   HD23  LEU  60          3HD2      LEU  60  -2.504   6.714   6.326
  156    H    GLN  61           H        GLN  61  -0.339  10.423   1.990
  157    HA   GLN  61           HA       GLN  61   0.373   9.119  -0.409
  158    HB2  GLN  61          1HB       GLN  61  -0.115  11.129  -1.240
  159    HB3  GLN  61          2HB       GLN  61  -0.280  11.744   0.399
  160    HG2  GLN  61          1HG       GLN  61   1.996  12.438   0.450
  161    HG3  GLN  61          2HG       GLN  61   2.339  11.613  -1.069
  162   HE21  GLN  61          1HE2      GLN  61  -0.159  14.821  -1.439
  163   HE22  GLN  61          2HE2      GLN  61  -0.461  13.591  -0.264
  164    H    ARG  62           H        ARG  62   2.237  10.351   2.257
  165    HA   ARG  62           HA       ARG  62   4.747  10.270   0.836
  166    HB2  ARG  62          1HB       ARG  62   5.743  11.045   2.828
  167    HB3  ARG  62          2HB       ARG  62   4.176  11.840   2.759
  168    HG2  ARG  62          1HG       ARG  62   3.273  10.230   4.345
  169    HG3  ARG  62          2HG       ARG  62   4.828   9.397   4.395
  170    HD2  ARG  62          1HD       ARG  62   5.823  11.609   5.139
  171    HD3  ARG  62          2HD       ARG  62   4.166  12.165   5.368
  172    HE   ARG  62           HE       ARG  62   4.077  10.947   7.295
  173   HH11  ARG  62          1HH1      ARG  62   6.698   9.755   5.338
  174   HH12  ARG  62          2HH1      ARG  62   7.285   8.669   6.554
  175   HH21  ARG  62          1HH2      ARG  62   4.840   9.521   8.904
  176   HH22  ARG  62          2HH2      ARG  62   6.226   8.536   8.581
  177    H    GLU  63           H        GLU  63   2.847   8.137   2.801
  178    HA   GLU  63           HA       GLU  63   4.932   6.343   3.528
  179    HB2  GLU  63          1HB       GLU  63   2.924   6.328   4.827
  180    HB3  GLU  63          2HB       GLU  63   1.933   6.036   3.405
  181    HG2  GLU  63          1HG       GLU  63   2.243   3.831   3.495
  182    HG3  GLU  63          2HG       GLU  63   3.964   3.992   3.841
  183    H    LEU  64           H        LEU  64   2.889   6.700   0.730
  184    HA   LEU  64           HA       LEU  64   3.580   4.107  -0.351
  185    HB2  LEU  64          1HB       LEU  64   2.071   4.540  -2.045
  186    HB3  LEU  64          2HB       LEU  64   1.379   5.403  -0.673
  187    HG   LEU  64           HG       LEU  64   2.782   7.402  -1.772
  188   HD11  LEU  64          1HD1      LEU  64   1.981   6.894  -4.335
  189   HD12  LEU  64          2HD1      LEU  64   2.614   5.330  -3.823
  190   HD13  LEU  64          3HD1      LEU  64   3.635   6.765  -3.736
  191   HD21  LEU  64          1HD2      LEU  64   0.166   6.817  -1.396
  192   HD22  LEU  64          2HD2      LEU  64   0.232   6.922  -3.155
  193   HD23  LEU  64          3HD2      LEU  64   0.754   8.289  -2.169
  194    H    LYS  65           H        LYS  65   4.577   7.439  -0.706
  195    HA   LYS  65           HA       LYS  65   6.215   6.909  -3.026
  196    HB2  LYS  65          1HB       LYS  65   6.071   9.352  -1.250
  197    HB3  LYS  65          2HB       LYS  65   6.919   9.254  -2.787
  198    HG2  LYS  65          1HG       LYS  65   4.960   9.204  -4.016
  199    HG3  LYS  65          2HG       LYS  65   3.994   8.660  -2.642
  200    HD2  LYS  65          1HD       LYS  65   3.357  10.830  -2.599
  201    HD3  LYS  65          2HD       LYS  65   4.858  11.022  -1.690
  202    HE2  LYS  65          1HE       LYS  65   5.994  11.902  -3.514
  203    HE3  LYS  65          2HE       LYS  65   4.858  11.220  -4.676
  204    HZ1  LYS  65          1HZ       LYS  65   3.738  13.112  -4.650
  205    HZ2  LYS  65          2HZ       LYS  65   4.847  13.777  -3.559
  206    HZ3  LYS  65          3HZ       LYS  65   3.472  12.976  -2.985
  207    H    ALA  66           H        ALA  66   6.619   7.142   0.437
  208    HA   ALA  66           HA       ALA  66   9.482   7.247   0.374
  209    HB1  ALA  66          1HB       ALA  66   9.379   7.021   2.759
  210    HB2  ALA  66          2HB       ALA  66   8.108   8.132   2.247
  211    HB3  ALA  66          3HB       ALA  66   7.705   6.471   2.681
  212    H    ALA  67           H        ALA  67   7.081   4.709   1.019
  213    HA   ALA  67           HA       ALA  67   8.750   2.619   1.688
  214    HB1  ALA  67          1HB       ALA  67   6.824   1.373   0.187
  215    HB2  ALA  67          2HB       ALA  67   6.674   1.815   1.888
  216    HB3  ALA  67          3HB       ALA  67   6.041   2.888   0.640
  217    H    TYR  68           H        TYR  68   7.811   3.719  -1.551
  218    HA   TYR  68           HA       TYR  68   9.159   1.687  -2.973
  219    HB2  TYR  68          1HB       TYR  68   7.837   4.235  -3.606
  220    HB3  TYR  68          2HB       TYR  68   9.140   3.805  -4.710
  221    HD1  TYR  68           HD1      TYR  68   6.823   1.493  -2.955
  222    HD2  TYR  68           HD2      TYR  68   7.959   3.247  -6.662
  223    HE1  TYR  68           HE1      TYR  68   5.307  -0.040  -4.139
  224    HE2  TYR  68           HE2      TYR  68   6.445   1.719  -7.855
  225    HH   TYR  68           HH       TYR  68   4.370   0.394  -7.322
  226    H    ASP  69           H        ASP  69  10.233   4.611  -1.470
  227    HA   ASP  69           HA       ASP  69  12.742   4.695  -2.912
  228    HB2  ASP  69          1HB       ASP  69  11.422   6.710  -1.960
  229    HB3  ASP  69          2HB       ASP  69  12.138   6.258  -0.415
  230    H    GLN  70           H        GLN  70  11.568   3.722   0.265
  231    HA   GLN  70           HA       GLN  70  13.948   3.341   1.608
  232    HB2  GLN  70          1HB       GLN  70  11.402   1.720   1.729
  233    HB3  GLN  70          2HB       GLN  70  12.727   1.545   2.873
  234    HG2  GLN  70          1HG       GLN  70  10.911   3.894   2.466
  235    HG3  GLN  70          2HG       GLN  70  11.163   2.935   3.923
  236   HE21  GLN  70          1HE2      GLN  70  13.406   6.170   3.172
  237   HE22  GLN  70          2HE2      GLN  70  12.080   5.678   2.180
  238    H    ARG  71           H        ARG  71  12.212   0.971  -0.407
  239    HA   ARG  71           HA       ARG  71  14.209  -1.030  -0.192
  240    HB2  ARG  71          1HB       ARG  71  12.169  -0.721  -2.397
  241    HB3  ARG  71          2HB       ARG  71  12.992  -2.198  -1.913
  242    HG2  ARG  71          1HG       ARG  71  10.978  -0.654  -0.293
  243    HG3  ARG  71          2HG       ARG  71  10.726  -2.207  -1.094
  244    HD2  ARG  71          1HD       ARG  71  12.612  -3.099   0.337
  245    HD3  ARG  71          2HD       ARG  71  12.508  -1.595   1.252
  246    HE   ARG  71           HE       ARG  71  10.001  -2.984   0.997
  247   HH11  ARG  71          1HH1      ARG  71  12.930  -2.661   2.851
  248   HH12  ARG  71          2HH1      ARG  71  12.234  -3.298   4.304
  249   HH21  ARG  71          1HH2      ARG  71   9.074  -3.824   2.904
  250   HH22  ARG  71          2HH2      ARG  71  10.041  -3.960   4.333
  251    H    GLN  72           H        GLN  72  13.940   1.810  -2.087
  252    HA   GLN  72           HA       GLN  72  16.179   0.915  -3.782
  253    HB2  GLN  72          1HB       GLN  72  13.758   2.525  -4.376
  254    HB3  GLN  72          2HB       GLN  72  15.253   3.027  -5.156
  255    HG2  GLN  72          1HG       GLN  72  15.494   0.928  -6.235
  256    HG3  GLN  72          2HG       GLN  72  14.195   0.218  -5.278
  257   HE21  GLN  72          1HE2      GLN  72  13.292   2.755  -8.362
  258   HE22  GLN  72          2HE2      GLN  72  14.811   2.867  -7.548
  Start of MODEL    9
    1    H    ILE  40           H        ILE  40   2.091  -0.742  -1.552
    2    HA   ILE  40           HA       ILE  40   4.064  -2.120   0.138
    3    HB   ILE  40           HB       ILE  40   4.857   0.034   0.843
    4   HG12  ILE  40          1HG1      ILE  40   3.682   1.996  -0.628
    5   HG13  ILE  40          2HG1      ILE  40   2.305   0.941  -0.334
    6   HG21  ILE  40          1HG2      ILE  40   4.673   0.747  -1.973
    7   HG22  ILE  40          2HG2      ILE  40   6.082   0.329  -1.000
    8   HG23  ILE  40          3HG2      ILE  40   5.095  -0.945  -1.715
    9   HD11  ILE  40          1HD1      ILE  40   3.011   1.032   2.123
   10   HD12  ILE  40          2HD1      ILE  40   3.998   2.413   1.642
   11   HD13  ILE  40          3HD1      ILE  40   2.249   2.458   1.420
   12    H    ALA  41           H        ALA  41   0.932  -0.656   0.109
   13    HA   ALA  41           HA       ALA  41   0.146  -1.781   2.548
   14    HB1  ALA  41          1HB       ALA  41   1.532  -0.261   3.707
   15    HB2  ALA  41          2HB       ALA  41   1.008   1.096   2.709
   16    HB3  ALA  41          3HB       ALA  41  -0.110   0.365   3.861
   17    H    LEU  42           H        LEU  42  -0.284   0.798   0.203
   18    HA   LEU  42           HA       LEU  42  -3.194   0.388   0.388
   19    HB2  LEU  42          1HB       LEU  42  -3.275   2.838  -0.451
   20    HB3  LEU  42          2HB       LEU  42  -3.020   2.508   1.261
   21    HG   LEU  42           HG       LEU  42  -0.496   2.719  -0.115
   22   HD11  LEU  42          1HD1      LEU  42  -0.577   4.714  -1.171
   23   HD12  LEU  42          2HD1      LEU  42  -1.834   5.351  -0.112
   24   HD13  LEU  42          3HD1      LEU  42  -2.260   4.251  -1.423
   25   HD21  LEU  42          1HD2      LEU  42  -0.235   4.559   1.601
   26   HD22  LEU  42          2HD2      LEU  42  -0.596   2.952   2.233
   27   HD23  LEU  42          3HD2      LEU  42  -1.870   4.168   2.135
   28    HA   PRO  43           HA       PRO  43  -3.223  -0.370  -3.934
   29    HB2  PRO  43          1HB       PRO  43  -5.564   0.774  -4.695
   30    HB3  PRO  43          2HB       PRO  43  -5.487  -0.720  -3.754
   31    HG2  PRO  43          1HG       PRO  43  -5.979   2.082  -2.822
   32    HG3  PRO  43          2HG       PRO  43  -6.793   0.583  -2.338
   33    HD2  PRO  43          1HD       PRO  43  -4.867   1.745  -0.832
   34    HD3  PRO  43          2HD       PRO  43  -5.107  -0.013  -0.885
   35    H    ALA  44           H        ALA  44  -1.408   1.514  -3.659
   36    HA   ALA  44           HA       ALA  44  -2.195   3.811  -5.307
   37    HB1  ALA  44          1HB       ALA  44   0.536   3.813  -4.293
   38    HB2  ALA  44          2HB       ALA  44  -0.729   5.035  -4.152
   39    HB3  ALA  44          3HB       ALA  44  -0.679   3.684  -3.020
   40    H    PHE  45           H        PHE  45   0.267   4.497  -6.357
   41    HA   PHE  45           HA       PHE  45   1.484   4.185  -8.257
   42    HB2  PHE  45          1HB       PHE  45   1.754   1.273  -7.660
   43    HB3  PHE  45          2HB       PHE  45   2.977   2.429  -8.177
   44    HD1  PHE  45           HD1      PHE  45   4.013   3.949  -6.550
   45    HD2  PHE  45           HD2      PHE  45   1.283   0.910  -5.355
   46    HE1  PHE  45           HE1      PHE  45   4.784   4.176  -4.225
   47    HE2  PHE  45           HE2      PHE  45   2.049   1.133  -3.027
   48    HZ   PHE  45           HZ       PHE  45   3.801   2.768  -2.460
   49    H    SER  46           H        SER  46  -1.433   3.681  -8.344
   50    HA   SER  46           HA       SER  46  -1.504   2.506 -10.983
   51    HB2  SER  46          1HB       SER  46  -2.674   1.141  -8.592
   52    HB3  SER  46          2HB       SER  46  -3.534   1.045 -10.128
   53    HG   SER  46           HG       SER  46  -0.993   0.060  -9.442
   54    H    GLN  47           H        GLN  47  -2.038   5.090  -9.703
   55    HA   GLN  47           HA       GLN  47  -4.903   5.439  -9.786
   56    HB2  GLN  47          1HB       GLN  47  -4.438   7.776  -9.287
   57    HB3  GLN  47          2HB       GLN  47  -3.521   6.730  -8.211
   58    HG2  GLN  47          1HG       GLN  47  -1.618   7.656  -8.845
   59    HG3  GLN  47          2HG       GLN  47  -1.966   7.318 -10.540
   60   HE21  GLN  47          1HE2      GLN  47  -2.876  10.570 -11.341
   61   HE22  GLN  47          2HE2      GLN  47  -2.740   8.921 -11.839
   62    H    VAL  48           H        VAL  48  -5.195   7.887 -11.009
   63    HA   VAL  48           HA       VAL  48  -4.259   7.529 -13.763
   64    HB   VAL  48           HB       VAL  48  -6.424   6.461 -13.763
   65   HG11  VAL  48          1HG1      VAL  48  -7.255   7.644 -11.716
   66   HG12  VAL  48          2HG1      VAL  48  -7.608   9.036 -12.742
   67   HG13  VAL  48          3HG1      VAL  48  -8.434   7.502 -13.019
   68   HG21  VAL  48          1HG2      VAL  48  -7.394   8.884 -15.002
   69   HG22  VAL  48          2HG2      VAL  48  -5.698   8.599 -15.393
   70   HG23  VAL  48          3HG2      VAL  48  -6.904   7.361 -15.744
   71    H    ASP  49           H        ASP  49  -5.911   9.584 -11.408
   72    HA   ASP  49           HA       ASP  49  -4.839  11.934 -12.828
   73    HB2  ASP  49          1HB       ASP  49  -7.553  11.331 -11.994
   74    HB3  ASP  49          2HB       ASP  49  -6.981  12.837 -11.281
   75    HA   PRO  50           HA       PRO  50  -2.784  13.124  -9.140
   76    HB2  PRO  50          1HB       PRO  50  -2.973  15.830  -9.252
   77    HB3  PRO  50          2HB       PRO  50  -1.922  14.895 -10.322
   78    HG2  PRO  50          1HG       PRO  50  -4.639  16.032 -10.856
   79    HG3  PRO  50          2HG       PRO  50  -3.205  16.024 -11.899
   80    HD2  PRO  50          1HD       PRO  50  -5.244  14.270 -12.211
   81    HD3  PRO  50          2HD       PRO  50  -3.559  13.851 -12.581
   82    H    GLU  51           H        GLU  51  -5.976  14.535  -9.681
   83    HA   GLU  51           HA       GLU  51  -6.472  15.658  -7.206
   84    HB2  GLU  51          1HB       GLU  51  -8.308  14.283  -9.158
   85    HB3  GLU  51          2HB       GLU  51  -8.906  15.040  -7.688
   86    HG2  GLU  51          1HG       GLU  51  -7.335  17.001  -8.800
   87    HG3  GLU  51          2HG       GLU  51  -8.079  16.235 -10.203
   88    H    VAL  52           H        VAL  52  -6.364  12.306  -8.123
   89    HA   VAL  52           HA       VAL  52  -7.704  11.306  -5.798
   90    HB   VAL  52           HB       VAL  52  -5.790   9.716  -7.488
   91   HG11  VAL  52          1HG1      VAL  52  -8.200   9.082  -5.807
   92   HG12  VAL  52          2HG1      VAL  52  -7.549   7.946  -6.990
   93   HG13  VAL  52          3HG1      VAL  52  -6.551   8.479  -5.637
   94   HG21  VAL  52          1HG2      VAL  52  -7.835   9.167  -8.882
   95   HG22  VAL  52          2HG2      VAL  52  -8.593  10.584  -8.154
   96   HG23  VAL  52          3HG2      VAL  52  -7.132  10.766  -9.124
   97    H    PHE  53           H        PHE  53  -4.298  11.462  -6.816
   98    HA   PHE  53           HA       PHE  53  -3.244  10.344  -4.448
   99    HB2  PHE  53          1HB       PHE  53  -2.169  10.840  -6.829
  100    HB3  PHE  53          2HB       PHE  53  -1.635  12.307  -6.013
  101    HD1  PHE  53           HD1      PHE  53  -0.629  11.816  -3.571
  102    HD2  PHE  53           HD2      PHE  53  -0.720   9.073  -6.824
  103    HE1  PHE  53           HE1      PHE  53   1.252  10.580  -2.576
  104    HE2  PHE  53           HE2      PHE  53   1.160   7.832  -5.834
  105    HZ   PHE  53           HZ       PHE  53   2.149   8.585  -3.708
  106    H    ALA  54           H        ALA  54  -3.846  13.676  -5.456
  107    HA   ALA  54           HA       ALA  54  -2.692  14.834  -3.105
  108    HB1  ALA  54          1HB       ALA  54  -4.669  16.339  -4.735
  109    HB2  ALA  54          2HB       ALA  54  -3.128  16.863  -4.055
  110    HB3  ALA  54          3HB       ALA  54  -3.155  15.851  -5.499
  111    H    ALA  55           H        ALA  55  -5.708  13.411  -3.856
  112    HA   ALA  55           HA       ALA  55  -7.390  14.838  -2.091
  113    HB1  ALA  55          1HB       ALA  55  -8.821  13.620  -3.283
  114    HB2  ALA  55          2HB       ALA  55  -7.568  12.469  -3.747
  115    HB3  ALA  55          3HB       ALA  55  -8.424  12.271  -2.218
  116    H    LEU  56           H        LEU  56  -5.349  11.987  -1.673
  117    HA   LEU  56           HA       LEU  56  -6.224  11.505   1.018
  118    HB2  LEU  56          1HB       LEU  56  -4.102  10.385  -0.761
  119    HB3  LEU  56          2HB       LEU  56  -4.068  10.038   0.967
  120    HG   LEU  56           HG       LEU  56  -6.574   9.499  -0.556
  121   HD11  LEU  56          1HD1      LEU  56  -5.603   8.067  -1.943
  122   HD12  LEU  56          2HD1      LEU  56  -5.120   7.111  -0.542
  123   HD13  LEU  56          3HD1      LEU  56  -4.028   8.331  -1.195
  124   HD21  LEU  56          1HD2      LEU  56  -6.421   7.495   1.080
  125   HD22  LEU  56          2HD2      LEU  56  -6.842   9.089   1.707
  126   HD23  LEU  56          3HD2      LEU  56  -5.199   8.473   1.895
  127    HA   PRO  57           HA       PRO  57  -3.507  14.084   3.302
  128    HB2  PRO  57          1HB       PRO  57  -2.793  12.488   5.379
  129    HB3  PRO  57          2HB       PRO  57  -4.410  13.183   5.213
  130    HG2  PRO  57          1HG       PRO  57  -3.451  10.431   4.526
  131    HG3  PRO  57          2HG       PRO  57  -4.950  10.925   5.336
  132    HD2  PRO  57          1HD       PRO  57  -4.862  10.261   2.712
  133    HD3  PRO  57          2HD       PRO  57  -5.989  11.474   3.353
  134    H    ALA  58           H        ALA  58  -1.415  14.682   3.252
  135    HA   ALA  58           HA       ALA  58   0.496  13.386   1.749
  136    HB1  ALA  58          1HB       ALA  58   2.154  14.849   2.929
  137    HB2  ALA  58          2HB       ALA  58   0.763  15.697   2.251
  138    HB3  ALA  58          3HB       ALA  58   0.841  15.374   3.983
  139    H    GLU  59           H        GLU  59  -0.244  13.016   5.156
  140    HA   GLU  59           HA       GLU  59   2.037  11.686   6.026
  141    HB2  GLU  59          1HB       GLU  59   0.209  12.471   7.502
  142    HB3  GLU  59          2HB       GLU  59  -0.812  11.174   6.898
  143    HG2  GLU  59          1HG       GLU  59  -0.073  10.145   8.758
  144    HG3  GLU  59          2HG       GLU  59   1.271   9.718   7.700
  145    H    LEU  60           H        LEU  60  -0.841  10.424   4.408
  146    HA   LEU  60           HA       LEU  60   0.196   7.714   4.464
  147    HB2  LEU  60          1HB       LEU  60  -2.071   7.616   4.704
  148    HB3  LEU  60          2HB       LEU  60  -2.350   9.018   3.673
  149    HG   LEU  60           HG       LEU  60  -1.374   6.518   2.391
  150   HD11  LEU  60          1HD1      LEU  60  -3.694   5.699   2.200
  151   HD12  LEU  60          2HD1      LEU  60  -4.199   6.928   3.359
  152   HD13  LEU  60          3HD1      LEU  60  -3.085   5.654   3.855
  153   HD21  LEU  60          1HD2      LEU  60  -2.482   9.032   1.617
  154   HD22  LEU  60          2HD2      LEU  60  -3.545   7.738   1.064
  155   HD23  LEU  60          3HD2      LEU  60  -1.842   7.740   0.601
  156    H    GLN  61           H        GLN  61  -0.310  10.321   2.149
  157    HA   GLN  61           HA       GLN  61   0.304   8.878  -0.187
  158    HB2  GLN  61          1HB       GLN  61  -0.156  10.827  -1.180
  159    HB3  GLN  61          2HB       GLN  61  -0.444  11.485   0.425
  160    HG2  GLN  61          1HG       GLN  61   1.766  12.338   0.564
  161    HG3  GLN  61          2HG       GLN  61   2.257  11.469  -0.890
  162   HE21  GLN  61          1HE2      GLN  61  -0.426  14.461  -1.590
  163   HE22  GLN  61          2HE2      GLN  61  -0.729  13.256  -0.390
  164    H    ARG  62           H        ARG  62   2.300  10.314   2.273
  165    HA   ARG  62           HA       ARG  62   4.723  10.177   0.714
  166    HB2  ARG  62          1HB       ARG  62   5.790  11.178   2.520
  167    HB3  ARG  62          2HB       ARG  62   4.155  11.810   2.649
  168    HG2  ARG  62          1HG       ARG  62   3.801   9.762   4.231
  169    HG3  ARG  62          2HG       ARG  62   5.560   9.823   4.364
  170    HD2  ARG  62          1HD       ARG  62   5.414  12.175   5.047
  171    HD3  ARG  62          2HD       ARG  62   3.657  12.093   4.934
  172    HE   ARG  62           HE       ARG  62   3.630  11.109   6.990
  173   HH11  ARG  62          1HH1      ARG  62   6.808  10.730   5.619
  174   HH12  ARG  62          2HH1      ARG  62   7.480  10.014   7.047
  175   HH21  ARG  62          1HH2      ARG  62   4.504  10.168   8.875
  176   HH22  ARG  62          2HH2      ARG  62   6.169   9.695   8.898
  177    H    GLU  63           H        GLU  63   2.972   8.129   2.891
  178    HA   GLU  63           HA       GLU  63   5.134   6.416   3.601
  179    HB2  GLU  63          1HB       GLU  63   3.207   6.456   5.021
  180    HB3  GLU  63          2HB       GLU  63   2.139   6.057   3.683
  181    HG2  GLU  63          1HG       GLU  63   2.551   3.860   3.837
  182    HG3  GLU  63          2HG       GLU  63   4.261   4.098   4.193
  183    H    LEU  64           H        LEU  64   2.918   6.580   0.920
  184    HA   LEU  64           HA       LEU  64   3.578   3.934  -0.047
  185    HB2  LEU  64          1HB       LEU  64   1.971   4.258  -1.680
  186    HB3  LEU  64          2HB       LEU  64   1.345   5.177  -0.313
  187    HG   LEU  64           HG       LEU  64   2.671   7.128  -1.608
  188   HD11  LEU  64          1HD1      LEU  64   3.398   6.239  -3.557
  189   HD12  LEU  64          2HD1      LEU  64   1.754   6.621  -4.065
  190   HD13  LEU  64          3HD1      LEU  64   2.165   4.978  -3.574
  191   HD21  LEU  64          1HD2      LEU  64   0.120   6.629  -0.947
  192   HD22  LEU  64          2HD2      LEU  64  -0.009   6.543  -2.704
  193   HD23  LEU  64          3HD2      LEU  64   0.613   8.004  -1.935
  194    H    LYS  65           H        LYS  65   4.500   7.251  -0.670
  195    HA   LYS  65           HA       LYS  65   5.996   6.609  -3.050
  196    HB2  LYS  65          1HB       LYS  65   5.962   9.132  -1.384
  197    HB3  LYS  65          2HB       LYS  65   6.708   8.962  -2.967
  198    HG2  LYS  65          1HG       LYS  65   4.674   8.862  -4.061
  199    HG3  LYS  65          2HG       LYS  65   3.802   8.372  -2.607
  200    HD2  LYS  65          1HD       LYS  65   3.214  10.506  -2.354
  201    HD3  LYS  65          2HD       LYS  65   4.903  10.853  -1.977
  202    HE2  LYS  65          1HE       LYS  65   5.355  11.289  -4.326
  203    HE3  LYS  65          2HE       LYS  65   3.692  10.876  -4.741
  204    HZ1  LYS  65          1HZ       LYS  65   4.732  13.267  -3.396
  205    HZ2  LYS  65          2HZ       LYS  65   3.165  12.748  -3.028
  206    HZ3  LYS  65          3HZ       LYS  65   3.572  13.141  -4.621
  207    H    ALA  66           H        ALA  66   6.711   7.332   0.336
  208    HA   ALA  66           HA       ALA  66   9.535   7.295   0.057
  209    HB1  ALA  66          1HB       ALA  66   8.320   8.361   1.941
  210    HB2  ALA  66          2HB       ALA  66   7.930   6.751   2.550
  211    HB3  ALA  66          3HB       ALA  66   9.611   7.276   2.457
  212    H    ALA  67           H        ALA  67   7.167   4.845   1.042
  213    HA   ALA  67           HA       ALA  67   8.853   2.801   1.806
  214    HB1  ALA  67          1HB       ALA  67   6.138   2.859   0.574
  215    HB2  ALA  67          2HB       ALA  67   6.964   1.313   0.774
  216    HB3  ALA  67          3HB       ALA  67   6.636   2.326   2.180
  217    H    TYR  68           H        TYR  68   7.843   3.715  -1.459
  218    HA   TYR  68           HA       TYR  68   9.075   1.538  -2.783
  219    HB2  TYR  68          1HB       TYR  68   7.737   4.029  -3.537
  220    HB3  TYR  68          2HB       TYR  68   9.031   3.577  -4.641
  221    HD1  TYR  68           HD1      TYR  68   6.433   1.642  -2.767
  222    HD2  TYR  68           HD2      TYR  68   8.190   2.565  -6.530
  223    HE1  TYR  68           HE1      TYR  68   4.931   0.029  -3.857
  224    HE2  TYR  68           HE2      TYR  68   6.692   0.956  -7.631
  225    HH   TYR  68           HH       TYR  68   4.708  -1.239  -5.827
  226    H    ASP  69           H        ASP  69  10.238   4.602  -1.623
  227    HA   ASP  69           HA       ASP  69  12.713   4.461  -3.117
  228    HB2  ASP  69          1HB       ASP  69  11.278   6.519  -1.920
  229    HB3  ASP  69          2HB       ASP  69  12.693   6.334  -0.888
  230    H    GLN  70           H        GLN  70  11.537   3.655   0.066
  231    HA   GLN  70           HA       GLN  70  13.840   3.516   1.557
  232    HB2  GLN  70          1HB       GLN  70  11.245   2.110   1.583
  233    HB3  GLN  70          2HB       GLN  70  12.552   1.290   2.427
  234    HG2  GLN  70          1HG       GLN  70  11.348   2.641   3.987
  235    HG3  GLN  70          2HG       GLN  70  12.943   3.347   3.736
  236   HE21  GLN  70          1HE2      GLN  70  11.747   6.254   2.131
  237   HE22  GLN  70          2HE2      GLN  70  13.083   5.166   2.253
  238    H    ARG  71           H        ARG  71  12.465   0.851  -0.378
  239    HA   ARG  71           HA       ARG  71  14.729  -0.831  -0.036
  240    HB2  ARG  71          1HB       ARG  71  13.686  -2.170  -1.878
  241    HB3  ARG  71          2HB       ARG  71  12.613  -1.841  -0.524
  242    HG2  ARG  71          1HG       ARG  71  12.372   0.224  -2.505
  243    HG3  ARG  71          2HG       ARG  71  12.138  -1.366  -3.235
  244    HD2  ARG  71          1HD       ARG  71  10.770  -0.672  -0.668
  245    HD3  ARG  71          2HD       ARG  71  10.111  -0.105  -2.202
  246    HE   ARG  71           HE       ARG  71  10.611  -2.854  -2.401
  247   HH11  ARG  71          1HH1      ARG  71   8.496  -0.643  -0.741
  248   HH12  ARG  71          2HH1      ARG  71   7.193  -1.779  -0.615
  249   HH21  ARG  71          1HH2      ARG  71   8.903  -4.358  -2.242
  250   HH22  ARG  71          2HH2      ARG  71   7.427  -3.892  -1.469
  251    H    GLN  72           H        GLN  72  14.085   1.825  -2.077
  252    HA   GLN  72           HA       GLN  72  16.660   1.918  -3.151
  253    HB2  GLN  72          1HB       GLN  72  16.000   1.474  -5.582
  254    HB3  GLN  72          2HB       GLN  72  16.226   0.074  -4.542
  255    HG2  GLN  72          1HG       GLN  72  14.103  -0.572  -4.751
  256    HG3  GLN  72          2HG       GLN  72  13.486   1.070  -4.576
  257   HE21  GLN  72          1HE2      GLN  72  13.589   1.774  -8.064
  258   HE22  GLN  72          2HE2      GLN  72  13.840   2.488  -6.511
  Start of MODEL   10
    1    H    ILE  40           H        ILE  40   3.327  -3.281  -0.074
    2    HA   ILE  40           HA       ILE  40   2.846  -0.764  -1.480
    3    HB   ILE  40           HB       ILE  40   5.211  -0.401  -1.419
    4   HG12  ILE  40          1HG1      ILE  40   6.218  -2.582   0.078
    5   HG13  ILE  40          2HG1      ILE  40   5.308  -3.267  -1.263
    6   HG21  ILE  40          1HG2      ILE  40   4.754  -1.590   1.275
    7   HG22  ILE  40          2HG2      ILE  40   5.458  -0.035   0.835
    8   HG23  ILE  40          3HG2      ILE  40   3.715  -0.276   0.727
    9   HD11  ILE  40          1HD1      ILE  40   7.659  -2.977  -1.818
   10   HD12  ILE  40          2HD1      ILE  40   6.631  -1.967  -2.835
   11   HD13  ILE  40          3HD1      ILE  40   7.527  -1.248  -1.497
   12    H    ALA  41           H        ALA  41   3.209  -4.050  -2.149
   13    HA   ALA  41           HA       ALA  41   4.528  -3.818  -4.685
   14    HB1  ALA  41          1HB       ALA  41   4.546  -5.867  -3.236
   15    HB2  ALA  41          2HB       ALA  41   2.868  -6.133  -3.713
   16    HB3  ALA  41          3HB       ALA  41   4.144  -6.151  -4.930
   17    H    LEU  42           H        LEU  42   2.588  -1.964  -4.789
   18    HA   LEU  42           HA       LEU  42   0.810  -3.043  -6.843
   19    HB2  LEU  42          1HB       LEU  42  -0.287  -1.127  -4.824
   20    HB3  LEU  42          2HB       LEU  42  -1.153  -2.183  -5.938
   21    HG   LEU  42           HG       LEU  42   0.056  -4.030  -4.396
   22   HD11  LEU  42          1HD1      LEU  42   0.663  -3.342  -2.367
   23   HD12  LEU  42          2HD1      LEU  42  -0.777  -2.341  -2.185
   24   HD13  LEU  42          3HD1      LEU  42   0.636  -1.707  -3.028
   25   HD21  LEU  42          1HD2      LEU  42  -2.079  -4.227  -3.220
   26   HD22  LEU  42          2HD2      LEU  42  -2.317  -3.929  -4.942
   27   HD23  LEU  42          3HD2      LEU  42  -2.539  -2.619  -3.780
   28    HA   PRO  43           HA       PRO  43   2.876   0.930  -8.055
   29    HB2  PRO  43          1HB       PRO  43   3.607   0.063 -10.521
   30    HB3  PRO  43          2HB       PRO  43   4.595  -0.200  -9.079
   31    HG2  PRO  43          1HG       PRO  43   2.714  -2.079 -10.455
   32    HG3  PRO  43          2HG       PRO  43   4.328  -2.397  -9.794
   33    HD2  PRO  43          1HD       PRO  43   2.058  -3.064  -8.478
   34    HD3  PRO  43          2HD       PRO  43   3.545  -2.584  -7.635
   35    H    ALA  44           H        ALA  44   0.390   1.293  -7.925
   36    HA   ALA  44           HA       ALA  44  -0.699   1.482 -10.657
   37    HB1  ALA  44          1HB       ALA  44  -1.836   0.313  -8.424
   38    HB2  ALA  44          2HB       ALA  44  -2.643   1.878  -8.541
   39    HB3  ALA  44          3HB       ALA  44  -2.671   0.766  -9.910
   40    H    PHE  45           H        PHE  45   0.279   3.228  -7.859
   41    HA   PHE  45           HA       PHE  45  -1.160   5.639  -8.504
   42    HB2  PHE  45          1HB       PHE  45   0.150   6.634  -6.658
   43    HB3  PHE  45          2HB       PHE  45  -0.651   5.143  -6.175
   44    HD1  PHE  45           HD1      PHE  45   0.611   3.171  -5.634
   45    HD2  PHE  45           HD2      PHE  45   2.564   6.727  -6.920
   46    HE1  PHE  45           HE1      PHE  45   2.765   2.260  -4.869
   47    HE2  PHE  45           HE2      PHE  45   4.721   5.823  -6.157
   48    HZ   PHE  45           HZ       PHE  45   4.824   3.586  -5.131
   49    H    SER  46           H        SER  46   1.390   4.156  -9.915
   50    HA   SER  46           HA       SER  46   3.382   6.037 -10.252
   51    HB2  SER  46          1HB       SER  46   2.858   3.560 -11.302
   52    HB3  SER  46          2HB       SER  46   2.698   4.593 -12.722
   53    HG   SER  46           HG       SER  46   4.937   4.028 -11.167
   54    H    GLN  47           H        GLN  47   0.440   5.621 -12.209
   55    HA   GLN  47           HA       GLN  47   0.394   8.454 -12.780
   56    HB2  GLN  47          1HB       GLN  47   1.869   7.710 -14.546
   57    HB3  GLN  47          2HB       GLN  47   0.759   6.418 -14.982
   58    HG2  GLN  47          1HG       GLN  47  -0.704   8.816 -15.114
   59    HG3  GLN  47          2HG       GLN  47   0.842   9.116 -15.905
   60   HE21  GLN  47          1HE2      GLN  47   0.186   6.240 -18.158
   61   HE22  GLN  47          2HE2      GLN  47   1.347   6.589 -16.928
   62    H    VAL  48           H        VAL  48  -1.640   8.961 -12.338
   63    HA   VAL  48           HA       VAL  48  -3.798   7.511 -13.637
   64    HB   VAL  48           HB       VAL  48  -3.712   7.831 -10.634
   65   HG11  VAL  48          1HG1      VAL  48  -5.854   6.245 -11.186
   66   HG12  VAL  48          2HG1      VAL  48  -5.940   7.979 -10.868
   67   HG13  VAL  48          3HG1      VAL  48  -5.903   7.386 -12.529
   68   HG21  VAL  48          1HG2      VAL  48  -2.372   5.973 -11.184
   69   HG22  VAL  48          2HG2      VAL  48  -3.942   5.302 -10.743
   70   HG23  VAL  48          3HG2      VAL  48  -3.488   5.439 -12.441
   71    H    ASP  49           H        ASP  49  -3.563   9.808 -10.922
   72    HA   ASP  49           HA       ASP  49  -4.244  12.094 -12.414
   73    HB2  ASP  49          1HB       ASP  49  -6.441  10.421 -11.975
   74    HB3  ASP  49          2HB       ASP  49  -6.600  11.698 -10.772
   75    HA   PRO  50           HA       PRO  50  -2.808  13.889  -8.665
   76    HB2  PRO  50          1HB       PRO  50  -3.678  16.435  -9.025
   77    HB3  PRO  50          2HB       PRO  50  -2.314  15.751  -9.917
   78    HG2  PRO  50          1HG       PRO  50  -5.161  16.089 -10.777
   79    HG3  PRO  50          2HG       PRO  50  -3.673  16.399 -11.689
   80    HD2  PRO  50          1HD       PRO  50  -5.143  14.150 -12.023
   81    HD3  PRO  50          2HD       PRO  50  -3.377  14.174 -12.210
   82    H    GLU  51           H        GLU  51  -6.182  14.294  -9.593
   83    HA   GLU  51           HA       GLU  51  -7.131  15.342  -7.158
   84    HB2  GLU  51          1HB       GLU  51  -8.373  13.964  -9.495
   85    HB3  GLU  51          2HB       GLU  51  -9.323  14.135  -8.026
   86    HG2  GLU  51          1HG       GLU  51  -9.322  16.459  -8.148
   87    HG3  GLU  51          2HG       GLU  51  -7.958  16.492  -9.265
   88    H    VAL  52           H        VAL  52  -6.081  12.206  -8.027
   89    HA   VAL  52           HA       VAL  52  -7.539  10.881  -5.886
   90    HB   VAL  52           HB       VAL  52  -5.373   9.512  -7.414
   91   HG11  VAL  52          1HG1      VAL  52  -6.407   8.137  -5.830
   92   HG12  VAL  52          2HG1      VAL  52  -8.015   8.761  -6.205
   93   HG13  VAL  52          3HG1      VAL  52  -7.188   7.705  -7.351
   94   HG21  VAL  52          1HG2      VAL  52  -7.891  10.598  -8.565
   95   HG22  VAL  52          2HG2      VAL  52  -6.304  10.397  -9.307
   96   HG23  VAL  52          3HG2      VAL  52  -7.355   8.999  -9.082
   97    H    PHE  53           H        PHE  53  -4.136  11.427  -6.791
   98    HA   PHE  53           HA       PHE  53  -3.066  10.397  -4.383
   99    HB2  PHE  53          1HB       PHE  53  -2.000  11.094  -6.778
  100    HB3  PHE  53          2HB       PHE  53  -1.503  12.470  -5.798
  101    HD1  PHE  53           HD1      PHE  53  -0.593  11.690  -3.370
  102    HD2  PHE  53           HD2      PHE  53  -0.492   9.388  -6.948
  103    HE1  PHE  53           HE1      PHE  53   1.275  10.371  -2.464
  104    HE2  PHE  53           HE2      PHE  53   1.376   8.064  -6.047
  105    HZ   PHE  53           HZ       PHE  53   2.262   8.554  -3.802
  106    H    ALA  54           H        ALA  54  -3.932  13.655  -5.434
  107    HA   ALA  54           HA       ALA  54  -2.944  14.931  -3.070
  108    HB1  ALA  54          1HB       ALA  54  -4.023  16.932  -3.933
  109    HB2  ALA  54          2HB       ALA  54  -3.118  16.117  -5.208
  110    HB3  ALA  54          3HB       ALA  54  -4.874  15.971  -5.142
  111    H    ALA  55           H        ALA  55  -5.808  13.241  -3.881
  112    HA   ALA  55           HA       ALA  55  -7.643  14.514  -2.152
  113    HB1  ALA  55          1HB       ALA  55  -8.423  11.850  -2.301
  114    HB2  ALA  55          2HB       ALA  55  -8.951  13.169  -3.346
  115    HB3  ALA  55          3HB       ALA  55  -7.587  12.159  -3.823
  116    H    LEU  56           H        LEU  56  -5.372  11.850  -1.688
  117    HA   LEU  56           HA       LEU  56  -6.250  11.354   1.013
  118    HB2  LEU  56          1HB       LEU  56  -4.102  10.270  -0.758
  119    HB3  LEU  56          2HB       LEU  56  -4.048   9.957   0.975
  120    HG   LEU  56           HG       LEU  56  -6.532   9.303  -0.547
  121   HD11  LEU  56          1HD1      LEU  56  -5.330   8.017  -1.940
  122   HD12  LEU  56          2HD1      LEU  56  -5.220   6.935  -0.553
  123   HD13  LEU  56          3HD1      LEU  56  -3.901   8.050  -0.908
  124   HD21  LEU  56          1HD2      LEU  56  -6.373   7.373   1.158
  125   HD22  LEU  56          2HD2      LEU  56  -6.804   8.982   1.737
  126   HD23  LEU  56          3HD2      LEU  56  -5.160   8.379   1.949
  127    HA   PRO  57           HA       PRO  57  -3.605  14.066   3.226
  128    HB2  PRO  57          1HB       PRO  57  -2.828  12.537   5.331
  129    HB3  PRO  57          2HB       PRO  57  -4.468  13.176   5.161
  130    HG2  PRO  57          1HG       PRO  57  -3.425  10.443   4.524
  131    HG3  PRO  57          2HG       PRO  57  -4.934  10.904   5.333
  132    HD2  PRO  57          1HD       PRO  57  -4.839  10.190   2.722
  133    HD3  PRO  57          2HD       PRO  57  -6.001  11.379   3.345
  134    H    ALA  58           H        ALA  58  -1.534  14.730   3.148
  135    HA   ALA  58           HA       ALA  58   0.409  13.471   1.660
  136    HB1  ALA  58          1HB       ALA  58   1.411  15.155   3.865
  137    HB2  ALA  58          2HB       ALA  58   1.713  15.254   2.130
  138    HB3  ALA  58          3HB       ALA  58   0.213  15.894   2.802
  139    H    GLU  59           H        GLU  59  -0.262  13.171   5.096
  140    HA   GLU  59           HA       GLU  59   2.051  11.914   5.963
  141    HB2  GLU  59          1HB       GLU  59   0.392  12.604   7.552
  142    HB3  GLU  59          2HB       GLU  59  -0.814  11.543   6.837
  143    HG2  GLU  59          1HG       GLU  59  -0.039  10.577   8.882
  144    HG3  GLU  59          2HG       GLU  59   0.536   9.597   7.535
  145    H    LEU  60           H        LEU  60  -0.808  10.520   4.415
  146    HA   LEU  60           HA       LEU  60   0.334   7.853   4.493
  147    HB2  LEU  60          1HB       LEU  60  -1.924   7.677   4.782
  148    HB3  LEU  60          2HB       LEU  60  -2.275   9.045   3.728
  149    HG   LEU  60           HG       LEU  60  -1.227   6.558   2.479
  150   HD11  LEU  60          1HD1      LEU  60  -2.867   5.642   3.978
  151   HD12  LEU  60          2HD1      LEU  60  -3.532   5.661   2.345
  152   HD13  LEU  60          3HD1      LEU  60  -4.038   6.877   3.517
  153   HD21  LEU  60          1HD2      LEU  60  -1.779   7.721   0.673
  154   HD22  LEU  60          2HD2      LEU  60  -2.447   9.011   1.675
  155   HD23  LEU  60          3HD2      LEU  60  -3.470   7.664   1.172
  156    H    GLN  61           H        GLN  61  -0.313  10.400   2.148
  157    HA   GLN  61           HA       GLN  61   0.290   8.954  -0.182
  158    HB2  GLN  61          1HB       GLN  61  -0.259  10.883  -1.162
  159    HB3  GLN  61          2HB       GLN  61  -0.457  11.573   0.443
  160    HG2  GLN  61          1HG       GLN  61   1.734  12.454   0.439
  161    HG3  GLN  61          2HG       GLN  61   2.181  11.522  -0.989
  162   HE21  GLN  61          1HE2      GLN  61  -0.544  14.464  -1.737
  163   HE22  GLN  61          2HE2      GLN  61  -0.801  13.311  -0.476
  164    H    ARG  62           H        ARG  62   2.316  10.460   2.215
  165    HA   ARG  62           HA       ARG  62   4.706  10.326   0.603
  166    HB2  ARG  62          1HB       ARG  62   5.799  11.384   2.362
  167    HB3  ARG  62          2HB       ARG  62   4.158  12.001   2.505
  168    HG2  ARG  62          1HG       ARG  62   3.873   9.973   4.141
  169    HG3  ARG  62          2HG       ARG  62   5.630  10.098   4.253
  170    HD2  ARG  62          1HD       ARG  62   5.388  12.482   4.846
  171    HD3  ARG  62          2HD       ARG  62   3.636  12.291   4.808
  172    HE   ARG  62           HE       ARG  62   3.737  11.302   6.867
  173   HH11  ARG  62          1HH1      ARG  62   6.923  11.339   5.466
  174   HH12  ARG  62          2HH1      ARG  62   7.705  10.776   6.906
  175   HH21  ARG  62          1HH2      ARG  62   4.755  10.560   8.769
  176   HH22  ARG  62          2HH2      ARG  62   6.471  10.332   8.784
  177    H    GLU  63           H        GLU  63   3.019   8.290   2.826
  178    HA   GLU  63           HA       GLU  63   5.231   6.631   3.538
  179    HB2  GLU  63          1HB       GLU  63   3.347   6.680   5.012
  180    HB3  GLU  63          2HB       GLU  63   2.245   6.238   3.715
  181    HG2  GLU  63          1HG       GLU  63   2.680   4.051   3.913
  182    HG3  GLU  63          2HG       GLU  63   4.400   4.312   4.198
  183    H    LEU  64           H        LEU  64   2.956   6.715   0.907
  184    HA   LEU  64           HA       LEU  64   3.611   4.049  -0.010
  185    HB2  LEU  64          1HB       LEU  64   1.966   4.326  -1.617
  186    HB3  LEU  64          2HB       LEU  64   1.361   5.259  -0.251
  187    HG   LEU  64           HG       LEU  64   2.638   7.202  -1.613
  188   HD11  LEU  64          1HD1      LEU  64   3.278   6.394  -3.603
  189   HD12  LEU  64          2HD1      LEU  64   1.575   6.555  -4.028
  190   HD13  LEU  64          3HD1      LEU  64   2.207   4.997  -3.496
  191   HD21  LEU  64          1HD2      LEU  64   0.128   6.737  -0.850
  192   HD22  LEU  64          2HD2      LEU  64  -0.080   6.540  -2.590
  193   HD23  LEU  64          3HD2      LEU  64   0.559   8.052  -1.944
  194    H    LYS  65           H        LYS  65   4.540   7.344  -0.680
  195    HA   LYS  65           HA       LYS  65   5.934   6.704  -3.118
  196    HB2  LYS  65          1HB       LYS  65   6.032   9.197  -1.409
  197    HB3  LYS  65          2HB       LYS  65   6.710   9.037  -3.024
  198    HG2  LYS  65          1HG       LYS  65   4.627   8.992  -4.035
  199    HG3  LYS  65          2HG       LYS  65   3.804   8.525  -2.545
  200    HD2  LYS  65          1HD       LYS  65   3.236  10.706  -2.478
  201    HD3  LYS  65          2HD       LYS  65   4.856  10.904  -1.806
  202    HE2  LYS  65          1HE       LYS  65   5.740  11.605  -3.865
  203    HE3  LYS  65          2HE       LYS  65   4.345  11.009  -4.763
  204    HZ1  LYS  65          1HZ       LYS  65   3.102  12.752  -3.295
  205    HZ2  LYS  65          2HZ       LYS  65   3.907  13.234  -4.702
  206    HZ3  LYS  65          3HZ       LYS  65   4.631  13.468  -3.191
  207    H    ALA  66           H        ALA  66   6.827   7.427   0.234
  208    HA   ALA  66           HA       ALA  66   9.631   7.245  -0.191
  209    HB1  ALA  66          1HB       ALA  66   9.804   7.220   2.242
  210    HB2  ALA  66          2HB       ALA  66   8.680   8.466   1.699
  211    HB3  ALA  66          3HB       ALA  66   8.064   6.956   2.370
  212    H    ALA  67           H        ALA  67   7.195   4.966   1.012
  213    HA   ALA  67           HA       ALA  67   8.834   2.865   1.754
  214    HB1  ALA  67          1HB       ALA  67   6.885   1.400   1.250
  215    HB2  ALA  67          2HB       ALA  67   6.489   2.807   2.237
  216    HB3  ALA  67          3HB       ALA  67   6.086   2.793   0.520
  217    H    TYR  68           H        TYR  68   7.916   3.940  -1.436
  218    HA   TYR  68           HA       TYR  68   8.749   1.576  -2.808
  219    HB2  TYR  68          1HB       TYR  68   7.745   4.247  -3.536
  220    HB3  TYR  68          2HB       TYR  68   8.853   3.538  -4.705
  221    HD1  TYR  68           HD1      TYR  68   7.678   2.667  -6.487
  222    HD2  TYR  68           HD2      TYR  68   6.140   2.114  -2.559
  223    HE1  TYR  68           HE1      TYR  68   5.845   1.307  -7.403
  224    HE2  TYR  68           HE2      TYR  68   4.303   0.752  -3.464
  225    HH   TYR  68           HH       TYR  68   3.230   0.127  -5.349
  226    H    ASP  69           H        ASP  69  10.324   4.446  -1.666
  227    HA   ASP  69           HA       ASP  69  12.714   3.962  -3.255
  228    HB2  ASP  69          1HB       ASP  69  11.566   6.255  -2.231
  229    HB3  ASP  69          2HB       ASP  69  12.919   5.971  -1.139
  230    H    GLN  70           H        GLN  70  11.593   3.682   0.064
  231    HA   GLN  70           HA       GLN  70  14.016   3.220   1.351
  232    HB2  GLN  70          1HB       GLN  70  11.268   2.111   1.930
  233    HB3  GLN  70          2HB       GLN  70  12.641   1.935   3.014
  234    HG2  GLN  70          1HG       GLN  70  11.172   4.429   2.246
  235    HG3  GLN  70          2HG       GLN  70  11.428   3.747   3.851
  236   HE21  GLN  70          1HE2      GLN  70  14.056   6.331   2.253
  237   HE22  GLN  70          2HE2      GLN  70  12.597   5.855   1.460
  238    H    ARG  71           H        ARG  71  11.776   0.855  -0.086
  239    HA   ARG  71           HA       ARG  71  13.396  -1.400   0.452
  240    HB2  ARG  71          1HB       ARG  71  11.295  -1.054  -1.695
  241    HB3  ARG  71          2HB       ARG  71  11.936  -2.584  -1.114
  242    HG2  ARG  71          1HG       ARG  71  10.330  -0.604   0.488
  243    HG3  ARG  71          2HG       ARG  71   9.759  -2.146  -0.153
  244    HD2  ARG  71          1HD       ARG  71  11.954  -2.933   1.236
  245    HD3  ARG  71          2HD       ARG  71  11.408  -1.568   2.210
  246    HE   ARG  71           HE       ARG  71   9.185  -3.150   1.672
  247   HH11  ARG  71          1HH1      ARG  71  12.209  -3.394   3.380
  248   HH12  ARG  71          2HH1      ARG  71  11.608  -4.525   4.548
  249   HH21  ARG  71          1HH2      ARG  71   8.382  -4.639   3.203
  250   HH22  ARG  71          2HH2      ARG  71   9.431  -5.233   4.445
  251    H    GLN  72           H        GLN  72  13.560   1.056  -1.930
  252    HA   GLN  72           HA       GLN  72  14.872   1.392  -3.761
  253    HB2  GLN  72          1HB       GLN  72  16.502  -0.143  -1.847
  254    HB3  GLN  72          2HB       GLN  72  17.085  -0.177  -3.505
  255    HG2  GLN  72          1HG       GLN  72  16.350   2.440  -2.299
  256    HG3  GLN  72          2HG       GLN  72  17.865   1.674  -1.824
  257   HE21  GLN  72          1HE2      GLN  72  17.710   3.769  -5.161
  258   HE22  GLN  72          2HE2      GLN  72  16.566   3.844  -3.869
  Start of MODEL   11
    1    H    ILE  40           H        ILE  40   1.830   0.397  -1.141
    2    HA   ILE  40           HA       ILE  40   2.521   1.572  -3.705
    3    HB   ILE  40           HB       ILE  40   4.778   1.002  -3.236
    4   HG12  ILE  40          1HG1      ILE  40   4.691  -0.314  -0.727
    5   HG13  ILE  40          2HG1      ILE  40   3.590  -1.175  -1.797
    6   HG21  ILE  40          1HG2      ILE  40   4.080   1.580  -0.447
    7   HG22  ILE  40          2HG2      ILE  40   5.082   2.486  -1.579
    8   HG23  ILE  40          3HG2      ILE  40   3.326   2.644  -1.634
    9   HD11  ILE  40          1HD1      ILE  40   6.526  -0.931  -1.888
   10   HD12  ILE  40          2HD1      ILE  40   5.479  -2.283  -2.321
   11   HD13  ILE  40          3HD1      ILE  40   5.682  -0.933  -3.437
   12    H    ALA  41           H        ALA  41   4.356  -0.188  -4.711
   13    HA   ALA  41           HA       ALA  41   4.588  -2.018  -6.046
   14    HB1  ALA  41          1HB       ALA  41   4.306  -3.946  -4.967
   15    HB2  ALA  41          2HB       ALA  41   3.624  -2.995  -3.647
   16    HB3  ALA  41          3HB       ALA  41   2.560  -3.716  -4.855
   17    H    LEU  42           H        LEU  42   2.206  -0.019  -6.220
   18    HA   LEU  42           HA       LEU  42   0.558  -1.599  -8.077
   19    HB2  LEU  42          1HB       LEU  42  -0.935   0.547  -7.815
   20    HB3  LEU  42          2HB       LEU  42  -0.980  -0.755  -6.628
   21    HG   LEU  42           HG       LEU  42   0.463   0.533  -5.143
   22   HD11  LEU  42          1HD1      LEU  42   0.718   2.231  -7.533
   23   HD12  LEU  42          2HD1      LEU  42   1.856   1.935  -6.219
   24   HD13  LEU  42          3HD1      LEU  42   0.539   3.088  -6.002
   25   HD21  LEU  42          1HD2      LEU  42  -2.024   1.867  -6.171
   26   HD22  LEU  42          2HD2      LEU  42  -1.130   2.490  -4.785
   27   HD23  LEU  42          3HD2      LEU  42  -1.823   0.869  -4.731
   28    HA   PRO  43           HA       PRO  43   1.901   0.714 -11.555
   29    HB2  PRO  43          1HB       PRO  43  -0.392   1.014 -12.977
   30    HB3  PRO  43          2HB       PRO  43   0.449  -0.533 -12.826
   31    HG2  PRO  43          1HG       PRO  43  -1.938   0.479 -11.330
   32    HG3  PRO  43          2HG       PRO  43  -1.647  -1.131 -12.015
   33    HD2  PRO  43          1HD       PRO  43  -1.322  -0.588  -9.382
   34    HD3  PRO  43          2HD       PRO  43  -0.332  -1.787 -10.239
   35    H    ALA  44           H        ALA  44   1.933   2.482  -9.612
   36    HA   ALA  44           HA       ALA  44   0.283   4.756 -10.496
   37    HB1  ALA  44          1HB       ALA  44   0.030   4.013  -8.124
   38    HB2  ALA  44          2HB       ALA  44   1.710   4.481  -7.858
   39    HB3  ALA  44          3HB       ALA  44   0.518   5.697  -8.315
   40    H    PHE  45           H        PHE  45   1.729   6.814  -9.362
   41    HA   PHE  45           HA       PHE  45   3.418   8.267  -9.811
   42    HB2  PHE  45          1HB       PHE  45   5.039   5.734 -10.143
   43    HB3  PHE  45          2HB       PHE  45   5.703   7.354  -9.964
   44    HD1  PHE  45           HD1      PHE  45   3.649   4.794  -8.243
   45    HD2  PHE  45           HD2      PHE  45   6.091   8.257  -7.849
   46    HE1  PHE  45           HE1      PHE  45   3.633   4.523  -5.797
   47    HE2  PHE  45           HE2      PHE  45   6.080   7.992  -5.403
   48    HZ   PHE  45           HZ       PHE  45   4.850   6.122  -4.374
   49    H    SER  46           H        SER  46   1.756   7.052 -11.995
   50    HA   SER  46           HA       SER  46   3.538   7.731 -14.243
   51    HB2  SER  46          1HB       SER  46   3.138   5.506 -14.702
   52    HB3  SER  46          2HB       SER  46   1.552   5.521 -13.930
   53    HG   SER  46           HG       SER  46   0.836   5.689 -15.896
   54    H    GLN  47           H        GLN  47   0.036   7.190 -14.013
   55    HA   GLN  47           HA       GLN  47  -0.786   9.850 -14.033
   56    HB2  GLN  47          1HB       GLN  47  -1.502   9.975 -16.476
   57    HB3  GLN  47          2HB       GLN  47   0.208  10.212 -16.140
   58    HG2  GLN  47          1HG       GLN  47   0.823   8.331 -17.213
   59    HG3  GLN  47          2HG       GLN  47  -0.619   7.446 -16.719
   60   HE21  GLN  47          1HE2      GLN  47  -2.596   8.674 -19.442
   61   HE22  GLN  47          2HE2      GLN  47  -2.684   8.349 -17.747
   62    H    VAL  48           H        VAL  48  -1.947   8.157 -12.601
   63    HA   VAL  48           HA       VAL  48  -4.190   6.929 -14.044
   64    HB   VAL  48           HB       VAL  48  -2.918   5.459 -12.526
   65   HG11  VAL  48          1HG1      VAL  48  -4.033   6.783 -10.124
   66   HG12  VAL  48          2HG1      VAL  48  -2.530   5.883 -10.330
   67   HG13  VAL  48          3HG1      VAL  48  -2.644   7.551 -10.892
   68   HG21  VAL  48          1HG2      VAL  48  -5.551   5.788 -11.184
   69   HG22  VAL  48          2HG2      VAL  48  -5.533   5.454 -12.916
   70   HG23  VAL  48          3HG2      VAL  48  -4.767   4.331 -11.793
   71    H    ASP  49           H        ASP  49  -3.409   9.233 -11.507
   72    HA   ASP  49           HA       ASP  49  -5.708  10.778 -11.896
   73    HB2  ASP  49          1HB       ASP  49  -6.457   8.525 -10.615
   74    HB3  ASP  49          2HB       ASP  49  -6.011   9.519  -9.230
   75    HA   PRO  50           HA       PRO  50  -2.336  12.874  -9.640
   76    HB2  PRO  50          1HB       PRO  50  -2.689  15.248 -10.910
   77    HB3  PRO  50          2HB       PRO  50  -1.738  13.924 -11.594
   78    HG2  PRO  50          1HG       PRO  50  -4.562  14.728 -12.180
   79    HG3  PRO  50          2HG       PRO  50  -3.281  14.243 -13.305
   80    HD2  PRO  50          1HD       PRO  50  -5.242  12.552 -12.513
   81    HD3  PRO  50          2HD       PRO  50  -3.600  11.997 -12.897
   82    H    GLU  51           H        GLU  51  -5.714  13.341  -9.892
   83    HA   GLU  51           HA       GLU  51  -5.750  15.514  -7.943
   84    HB2  GLU  51          1HB       GLU  51  -7.330  15.911  -9.618
   85    HB3  GLU  51          2HB       GLU  51  -7.824  14.225  -9.685
   86    HG2  GLU  51          1HG       GLU  51  -9.221  14.413  -7.890
   87    HG3  GLU  51          2HG       GLU  51  -8.302  15.735  -7.173
   88    H    VAL  52           H        VAL  52  -6.135  12.099  -8.135
   89    HA   VAL  52           HA       VAL  52  -7.621  11.830  -5.681
   90    HB   VAL  52           HB       VAL  52  -7.290  10.179  -7.806
   91   HG11  VAL  52          1HG1      VAL  52  -4.945   9.720  -7.099
   92   HG12  VAL  52          2HG1      VAL  52  -5.583   8.983  -5.628
   93   HG13  VAL  52          3HG1      VAL  52  -5.958   8.281  -7.202
   94   HG21  VAL  52          1HG2      VAL  52  -8.340   8.436  -6.388
   95   HG22  VAL  52          2HG2      VAL  52  -7.997   9.429  -4.971
   96   HG23  VAL  52          3HG2      VAL  52  -9.094  10.021  -6.219
   97    H    PHE  53           H        PHE  53  -4.269  11.788  -6.667
   98    HA   PHE  53           HA       PHE  53  -3.172  10.587  -4.368
   99    HB2  PHE  53          1HB       PHE  53  -2.115  11.255  -6.707
  100    HB3  PHE  53          2HB       PHE  53  -1.651  12.704  -5.822
  101    HD1  PHE  53           HD1      PHE  53  -0.708  12.051  -3.340
  102    HD2  PHE  53           HD2      PHE  53  -0.494   9.654  -6.850
  103    HE1  PHE  53           HE1      PHE  53   1.230  10.860  -2.403
  104    HE2  PHE  53           HE2      PHE  53   1.444   8.458  -5.919
  105    HZ   PHE  53           HZ       PHE  53   2.308   9.060  -3.693
  106    H    ALA  54           H        ALA  54  -3.611  14.012  -5.225
  107    HA   ALA  54           HA       ALA  54  -2.613  15.005  -2.756
  108    HB1  ALA  54          1HB       ALA  54  -3.573  16.091  -5.219
  109    HB2  ALA  54          2HB       ALA  54  -4.355  16.918  -3.871
  110    HB3  ALA  54          3HB       ALA  54  -2.595  16.862  -3.969
  111    H    ALA  55           H        ALA  55  -5.609  13.651  -3.695
  112    HA   ALA  55           HA       ALA  55  -7.352  14.978  -1.918
  113    HB1  ALA  55          1HB       ALA  55  -8.127  12.239  -2.333
  114    HB2  ALA  55          2HB       ALA  55  -8.874  13.720  -2.934
  115    HB3  ALA  55          3HB       ALA  55  -7.566  12.961  -3.842
  116    H    LEU  56           H        LEU  56  -5.306  12.123  -1.562
  117    HA   LEU  56           HA       LEU  56  -6.278  11.500   1.066
  118    HB2  LEU  56          1HB       LEU  56  -4.074  10.491  -0.680
  119    HB3  LEU  56          2HB       LEU  56  -4.107  10.057   1.028
  120    HG   LEU  56           HG       LEU  56  -6.546   9.574  -0.616
  121   HD11  LEU  56          1HD1      LEU  56  -5.319   8.413  -2.101
  122   HD12  LEU  56          2HD1      LEU  56  -5.290   7.195  -0.826
  123   HD13  LEU  56          3HD1      LEU  56  -3.927   8.297  -1.023
  124   HD21  LEU  56          1HD2      LEU  56  -5.248   8.434   1.825
  125   HD22  LEU  56          2HD2      LEU  56  -6.419   7.482   0.913
  126   HD23  LEU  56          3HD2      LEU  56  -6.892   9.034   1.606
  127    HA   PRO  57           HA       PRO  57  -3.679  13.981   3.583
  128    HB2  PRO  57          1HB       PRO  57  -3.015  12.285   5.596
  129    HB3  PRO  57          2HB       PRO  57  -4.635  12.966   5.409
  130    HG2  PRO  57          1HG       PRO  57  -3.612  10.269   4.611
  131    HG3  PRO  57          2HG       PRO  57  -5.145  10.698   5.391
  132    HD2  PRO  57          1HD       PRO  57  -4.955  10.178   2.741
  133    HD3  PRO  57          2HD       PRO  57  -6.122  11.340   3.405
  134    H    ALA  58           H        ALA  58  -1.596  14.609   3.634
  135    HA   ALA  58           HA       ALA  58   0.386  13.433   2.133
  136    HB1  ALA  58          1HB       ALA  58   1.853  15.017   2.990
  137    HB2  ALA  58          2HB       ALA  58   0.276  15.777   3.202
  138    HB3  ALA  58          3HB       ALA  58   1.081  15.019   4.576
  139    H    GLU  59           H        GLU  59  -0.431  12.869   5.504
  140    HA   GLU  59           HA       GLU  59   1.821  11.497   6.355
  141    HB2  GLU  59          1HB       GLU  59  -1.086  11.236   7.087
  142    HB3  GLU  59          2HB       GLU  59   0.146  10.242   7.853
  143    HG2  GLU  59          1HG       GLU  59   0.172  13.250   7.830
  144    HG3  GLU  59          2HG       GLU  59  -0.481  12.267   9.140
  145    H    LEU  60           H        LEU  60  -0.993  10.299   4.580
  146    HA   LEU  60           HA       LEU  60   0.099   7.610   4.483
  147    HB2  LEU  60          1HB       LEU  60  -2.173   7.461   4.680
  148    HB3  LEU  60          2HB       LEU  60  -2.459   8.910   3.719
  149    HG   LEU  60           HG       LEU  60  -1.409   6.496   2.334
  150   HD11  LEU  60          1HD1      LEU  60  -3.137   5.523   3.694
  151   HD12  LEU  60          2HD1      LEU  60  -3.722   5.668   2.037
  152   HD13  LEU  60          3HD1      LEU  60  -4.258   6.816   3.264
  153   HD21  LEU  60          1HD2      LEU  60  -2.531   9.031   1.658
  154   HD22  LEU  60          2HD2      LEU  60  -3.565   7.754   1.017
  155   HD23  LEU  60          3HD2      LEU  60  -1.853   7.798   0.595
  156    H    GLN  61           H        GLN  61  -0.423  10.352   2.334
  157    HA   GLN  61           HA       GLN  61   0.251   9.085  -0.082
  158    HB2  GLN  61          1HB       GLN  61  -0.284  11.087  -0.906
  159    HB3  GLN  61          2HB       GLN  61  -0.468  11.672   0.742
  160    HG2  GLN  61          1HG       GLN  61   1.775  12.461   0.796
  161    HG3  GLN  61          2HG       GLN  61   2.151  11.668  -0.733
  162   HE21  GLN  61          1HE2      GLN  61  -0.487  14.762  -1.078
  163   HE22  GLN  61          2HE2      GLN  61  -0.741  13.501   0.074
  164    H    ARG  62           H        ARG  62   2.192  10.316   2.519
  165    HA   ARG  62           HA       ARG  62   4.643  10.364   1.006
  166    HB2  ARG  62          1HB       ARG  62   5.662  11.169   2.929
  167    HB3  ARG  62          2HB       ARG  62   4.014  11.754   3.110
  168    HG2  ARG  62          1HG       ARG  62   3.688   9.519   4.432
  169    HG3  ARG  62          2HG       ARG  62   5.442   9.613   4.604
  170    HD2  ARG  62          1HD       ARG  62   5.257  11.805   5.614
  171    HD3  ARG  62          2HD       ARG  62   3.514  11.808   5.351
  172    HE   ARG  62           HE       ARG  62   3.275  10.549   7.239
  173   HH11  ARG  62          1HH1      ARG  62   6.575  10.326   6.153
  174   HH12  ARG  62          2HH1      ARG  62   7.110   9.439   7.542
  175   HH21  ARG  62          1HH2      ARG  62   3.967   9.382   9.073
  176   HH22  ARG  62          2HH2      ARG  62   5.625   8.902   9.202
  177    H    GLU  63           H        GLU  63   2.923   8.098   3.018
  178    HA   GLU  63           HA       GLU  63   5.091   6.326   3.499
  179    HB2  GLU  63          1HB       GLU  63   3.190   6.204   4.943
  180    HB3  GLU  63          2HB       GLU  63   2.099   5.951   3.588
  181    HG2  GLU  63          1HG       GLU  63   2.674   3.750   3.349
  182    HG3  GLU  63          2HG       GLU  63   4.271   3.976   4.061
  183    H    LEU  64           H        LEU  64   2.850   6.757   0.872
  184    HA   LEU  64           HA       LEU  64   3.495   4.223  -0.365
  185    HB2  LEU  64          1HB       LEU  64   1.842   4.679  -1.889
  186    HB3  LEU  64          2HB       LEU  64   1.273   5.567  -0.477
  187    HG   LEU  64           HG       LEU  64   2.619   7.532  -1.695
  188   HD11  LEU  64          1HD1      LEU  64   2.713   5.508  -3.605
  189   HD12  LEU  64          2HD1      LEU  64   3.068   7.218  -3.845
  190   HD13  LEU  64          3HD1      LEU  64   1.446   6.602  -4.158
  191   HD21  LEU  64          1HD2      LEU  64   0.023   6.979  -1.137
  192   HD22  LEU  64          2HD2      LEU  64  -0.025   7.091  -2.896
  193   HD23  LEU  64          3HD2      LEU  64   0.581   8.446  -1.943
  194    H    LYS  65           H        LYS  65   4.499   7.551  -0.575
  195    HA   LYS  65           HA       LYS  65   5.922   7.203  -3.061
  196    HB2  LYS  65          1HB       LYS  65   5.965   9.463  -1.052
  197    HB3  LYS  65          2HB       LYS  65   6.745   9.499  -2.628
  198    HG2  LYS  65          1HG       LYS  65   4.731   9.607  -3.767
  199    HG3  LYS  65          2HG       LYS  65   3.812   8.966  -2.403
  200    HD2  LYS  65          1HD       LYS  65   3.252  11.203  -2.329
  201    HD3  LYS  65          2HD       LYS  65   4.613  11.143  -1.206
  202    HE2  LYS  65          1HE       LYS  65   6.044  12.192  -2.678
  203    HE3  LYS  65          2HE       LYS  65   5.120  11.695  -4.095
  204    HZ1  LYS  65          1HZ       LYS  65   4.331  13.765  -4.050
  205    HZ2  LYS  65          2HZ       LYS  65   4.849  14.046  -2.464
  206    HZ3  LYS  65          3HZ       LYS  65   3.376  13.263  -2.747
  207    H    ALA  66           H        ALA  66   6.792   7.606   0.361
  208    HA   ALA  66           HA       ALA  66   9.585   7.423  -0.019
  209    HB1  ALA  66          1HB       ALA  66   8.386   8.327   2.008
  210    HB2  ALA  66          2HB       ALA  66   8.114   6.651   2.489
  211    HB3  ALA  66          3HB       ALA  66   9.759   7.269   2.335
  212    H    ALA  67           H        ALA  67   7.136   5.003   0.842
  213    HA   ALA  67           HA       ALA  67   8.753   2.821   1.328
  214    HB1  ALA  67          1HB       ALA  67   6.486   2.522   1.770
  215    HB2  ALA  67          2HB       ALA  67   6.003   3.054   0.159
  216    HB3  ALA  67          3HB       ALA  67   6.777   1.483   0.374
  217    H    TYR  68           H        TYR  68   7.818   4.235  -1.745
  218    HA   TYR  68           HA       TYR  68   8.653   2.128  -3.418
  219    HB2  TYR  68          1HB       TYR  68   7.793   4.890  -3.728
  220    HB3  TYR  68          2HB       TYR  68   9.059   4.465  -4.875
  221    HD1  TYR  68           HD1      TYR  68   8.504   3.354  -6.841
  222    HD2  TYR  68           HD2      TYR  68   5.781   3.257  -3.573
  223    HE1  TYR  68           HE1      TYR  68   6.841   2.235  -8.267
  224    HE2  TYR  68           HE2      TYR  68   4.111   2.137  -4.989
  225    HH   TYR  68           HH       TYR  68   4.646   0.555  -7.562
  226    H    ASP  69           H        ASP  69  10.369   4.786  -1.915
  227    HA   ASP  69           HA       ASP  69  12.811   4.233  -3.382
  228    HB2  ASP  69          1HB       ASP  69  11.781   6.500  -2.179
  229    HB3  ASP  69          2HB       ASP  69  13.050   5.999  -1.065
  230    H    GLN  70           H        GLN  70  11.542   3.846  -0.108
  231    HA   GLN  70           HA       GLN  70  13.808   3.030   1.231
  232    HB2  GLN  70          1HB       GLN  70  10.960   2.075   1.535
  233    HB3  GLN  70          2HB       GLN  70  12.245   1.686   2.671
  234    HG2  GLN  70          1HG       GLN  70  11.027   4.360   2.078
  235    HG3  GLN  70          2HG       GLN  70  11.089   3.493   3.612
  236   HE21  GLN  70          1HE2      GLN  70  14.021   6.010   2.543
  237   HE22  GLN  70          2HE2      GLN  70  12.590   5.766   1.608
  238    H    ARG  71           H        ARG  71  11.500   0.962  -0.527
  239    HA   ARG  71           HA       ARG  71  13.040  -1.407  -0.165
  240    HB2  ARG  71          1HB       ARG  71  10.874  -0.831  -2.195
  241    HB3  ARG  71          2HB       ARG  71  11.484  -2.421  -1.757
  242    HG2  ARG  71          1HG       ARG  71  10.402  -2.434   0.263
  243    HG3  ARG  71          2HG       ARG  71  10.363  -0.673   0.376
  244    HD2  ARG  71          1HD       ARG  71   8.530  -0.493  -1.018
  245    HD3  ARG  71          2HD       ARG  71   8.835  -2.049  -1.789
  246    HE   ARG  71           HE       ARG  71   7.534  -3.031  -0.194
  247   HH11  ARG  71          1HH1      ARG  71   8.581   0.074   0.981
  248   HH12  ARG  71          2HH1      ARG  71   7.616   0.001   2.418
  249   HH21  ARG  71          1HH2      ARG  71   6.259  -3.139   1.694
  250   HH22  ARG  71          2HH2      ARG  71   6.296  -1.827   2.823
  251    H    GLN  72           H        GLN  72  13.249   1.236  -2.313
  252    HA   GLN  72           HA       GLN  72  15.632   0.366  -3.494
  253    HB2  GLN  72          1HB       GLN  72  14.754   0.115  -5.863
  254    HB3  GLN  72          2HB       GLN  72  14.436  -1.225  -4.770
  255    HG2  GLN  72          1HG       GLN  72  12.162  -0.351  -4.408
  256    HG3  GLN  72          2HG       GLN  72  12.492   0.925  -5.579
  257   HE21  GLN  72          1HE2      GLN  72  11.269  -2.680  -6.783
  258   HE22  GLN  72          2HE2      GLN  72  11.334  -2.185  -5.129
  Start of MODEL   12
    1    H    ILE  40           H        ILE  40   5.501  -2.756  -4.840
    2    HA   ILE  40           HA       ILE  40   4.935  -0.338  -6.187
    3    HB   ILE  40           HB       ILE  40   6.596   0.683  -4.834
    4   HG12  ILE  40          1HG1      ILE  40   7.845  -1.439  -3.444
    5   HG13  ILE  40          2HG1      ILE  40   7.940  -1.840  -5.155
    6   HG21  ILE  40          1HG2      ILE  40   5.502  -1.602  -3.204
    7   HG22  ILE  40          2HG2      ILE  40   5.966  -0.002  -2.627
    8   HG23  ILE  40          3HG2      ILE  40   4.566  -0.187  -3.684
    9   HD11  ILE  40          1HD1      ILE  40   8.679   0.758  -5.201
   10   HD12  ILE  40          2HD1      ILE  40   9.298   0.256  -3.627
   11   HD13  ILE  40          3HD1      ILE  40   9.798  -0.600  -5.086
   12    H    ALA  41           H        ALA  41   7.326   0.918  -6.620
   13    HA   ALA  41           HA       ALA  41   8.953   1.270  -8.174
   14    HB1  ALA  41          1HB       ALA  41   9.372  -1.499  -8.977
   15    HB2  ALA  41          2HB       ALA  41  10.501  -0.336  -8.282
   16    HB3  ALA  41          3HB       ALA  41   9.432  -1.263  -7.230
   17    H    LEU  42           H        LEU  42   5.996   0.496  -8.845
   18    HA   LEU  42           HA       LEU  42   6.205  -0.335 -11.603
   19    HB2  LEU  42          1HB       LEU  42   3.714   0.776 -10.387
   20    HB3  LEU  42          2HB       LEU  42   3.895  -0.478 -11.612
   21    HG   LEU  42           HG       LEU  42   5.074  -1.576  -9.357
   22   HD11  LEU  42          1HD1      LEU  42   3.678  -1.226  -7.515
   23   HD12  LEU  42          2HD1      LEU  42   2.451  -0.411  -8.484
   24   HD13  LEU  42          3HD1      LEU  42   3.984   0.393  -8.145
   25   HD21  LEU  42          1HD2      LEU  42   3.581  -2.603 -11.100
   26   HD22  LEU  42          2HD2      LEU  42   2.209  -1.948 -10.206
   27   HD23  LEU  42          3HD2      LEU  42   3.277  -3.126  -9.443
   28    HA   PRO  43           HA       PRO  43   6.404   3.611 -13.517
   29    HB2  PRO  43          1HB       PRO  43   4.960   3.174 -15.774
   30    HB3  PRO  43          2HB       PRO  43   6.574   2.498 -15.520
   31    HG2  PRO  43          1HG       PRO  43   3.899   1.198 -15.174
   32    HG3  PRO  43          2HG       PRO  43   5.373   0.546 -15.913
   33    HD2  PRO  43          1HD       PRO  43   4.612  -0.073 -13.389
   34    HD3  PRO  43          2HD       PRO  43   6.317   0.028 -13.874
   35    H    ALA  44           H        ALA  44   3.498   2.344 -12.351
   36    HA   ALA  44           HA       ALA  44   1.530   4.046 -13.278
   37    HB1  ALA  44          1HB       ALA  44   1.066   3.659 -10.511
   38    HB2  ALA  44          2HB       ALA  44   0.342   2.806 -11.876
   39    HB3  ALA  44          3HB       ALA  44   1.825   2.196 -11.141
   40    H    PHE  45           H        PHE  45   4.040   4.642 -10.906
   41    HA   PHE  45           HA       PHE  45   3.055   6.946  -9.700
   42    HB2  PHE  45          1HB       PHE  45   5.676   5.671 -10.023
   43    HB3  PHE  45          2HB       PHE  45   5.760   7.420  -9.834
   44    HD1  PHE  45           HD1      PHE  45   3.341   5.043  -8.327
   45    HD2  PHE  45           HD2      PHE  45   6.605   7.698  -7.686
   46    HE1  PHE  45           HE1      PHE  45   3.068   4.787  -5.895
   47    HE2  PHE  45           HE2      PHE  45   6.338   7.446  -5.253
   48    HZ   PHE  45           HZ       PHE  45   4.568   5.988  -4.355
   49    H    SER  46           H        SER  46   4.303   6.458 -12.882
   50    HA   SER  46           HA       SER  46   5.223   8.959 -13.595
   51    HB2  SER  46          1HB       SER  46   5.474   7.249 -15.199
   52    HB3  SER  46          2HB       SER  46   3.758   6.843 -15.162
   53    HG   SER  46           HG       SER  46   4.621   8.159 -17.001
   54    H    GLN  47           H        GLN  47   1.989   7.867 -14.590
   55    HA   GLN  47           HA       GLN  47   0.690  10.171 -13.485
   56    HB2  GLN  47          1HB       GLN  47   1.783  10.365 -16.117
   57    HB3  GLN  47          2HB       GLN  47   0.029  10.356 -16.243
   58    HG2  GLN  47          1HG       GLN  47   1.058  12.101 -14.139
   59    HG3  GLN  47          2HG       GLN  47   1.568  12.550 -15.765
   60   HE21  GLN  47          1HE2      GLN  47  -2.477  12.349 -15.190
   61   HE22  GLN  47          2HE2      GLN  47  -1.441  11.090 -14.619
   62    H    VAL  48           H        VAL  48  -1.114   9.287 -12.741
   63    HA   VAL  48           HA       VAL  48  -2.736   7.645 -14.545
   64    HB   VAL  48           HB       VAL  48  -1.549   6.008 -13.225
   65   HG11  VAL  48          1HG1      VAL  48  -1.032   7.605 -11.348
   66   HG12  VAL  48          2HG1      VAL  48  -2.659   7.293 -10.739
   67   HG13  VAL  48          3HG1      VAL  48  -1.491   5.976 -10.853
   68   HG21  VAL  48          1HG2      VAL  48  -4.122   5.958 -11.786
   69   HG22  VAL  48          2HG2      VAL  48  -4.222   6.077 -13.543
   70   HG23  VAL  48          3HG2      VAL  48  -3.362   4.729 -12.797
   71    H    ASP  49           H        ASP  49  -2.519   9.410 -11.488
   72    HA   ASP  49           HA       ASP  49  -5.044  10.677 -11.950
   73    HB2  ASP  49          1HB       ASP  49  -5.416   8.280 -10.858
   74    HB3  ASP  49          2HB       ASP  49  -5.025   9.160  -9.383
   75    HA   PRO  50           HA       PRO  50  -2.102  13.237  -9.567
   76    HB2  PRO  50          1HB       PRO  50  -2.877  15.566 -10.726
   77    HB3  PRO  50          2HB       PRO  50  -1.700  14.472 -11.462
   78    HG2  PRO  50          1HG       PRO  50  -4.621  14.779 -12.040
   79    HG3  PRO  50          2HG       PRO  50  -3.270  14.589 -13.173
   80    HD2  PRO  50          1HD       PRO  50  -4.893  12.534 -12.485
   81    HD3  PRO  50          2HD       PRO  50  -3.177  12.306 -12.876
   82    H    GLU  51           H        GLU  51  -5.480  12.991  -9.752
   83    HA   GLU  51           HA       GLU  51  -5.922  15.055  -7.723
   84    HB2  GLU  51          1HB       GLU  51  -7.559  13.787  -9.791
   85    HB3  GLU  51          2HB       GLU  51  -8.378  13.913  -8.241
   86    HG2  GLU  51          1HG       GLU  51  -7.422  16.390  -8.387
   87    HG3  GLU  51          2HG       GLU  51  -7.513  16.034 -10.111
   88    H    VAL  52           H        VAL  52  -5.655  11.650  -8.100
   89    HA   VAL  52           HA       VAL  52  -7.109  10.932  -5.731
   90    HB   VAL  52           HB       VAL  52  -6.310   9.514  -7.900
   91   HG11  VAL  52          1HG1      VAL  52  -4.482   8.619  -5.678
   92   HG12  VAL  52          2HG1      VAL  52  -4.608   7.940  -7.302
   93   HG13  VAL  52          3HG1      VAL  52  -3.959   9.564  -7.071
   94   HG21  VAL  52          1HG2      VAL  52  -6.846   8.322  -5.182
   95   HG22  VAL  52          2HG2      VAL  52  -8.086   8.964  -6.259
   96   HG23  VAL  52          3HG2      VAL  52  -7.133   7.563  -6.748
   97    H    PHE  53           H        PHE  53  -3.801  11.719  -6.525
   98    HA   PHE  53           HA       PHE  53  -2.681  10.735  -4.081
   99    HB2  PHE  53          1HB       PHE  53  -1.648  11.540  -6.508
  100    HB3  PHE  53          2HB       PHE  53  -1.173  12.850  -5.432
  101    HD1  PHE  53           HD1      PHE  53  -0.944   9.213  -6.000
  102    HD2  PHE  53           HD2      PHE  53   0.538  12.563  -3.832
  103    HE1  PHE  53           HE1      PHE  53   0.926   7.845  -5.170
  104    HE2  PHE  53           HE2      PHE  53   2.410  11.200  -2.999
  105    HZ   PHE  53           HZ       PHE  53   2.606   8.838  -3.669
  106    H    ALA  54           H        ALA  54  -3.865  13.839  -5.236
  107    HA   ALA  54           HA       ALA  54  -2.977  15.306  -2.939
  108    HB1  ALA  54          1HB       ALA  54  -4.056  17.178  -3.891
  109    HB2  ALA  54          2HB       ALA  54  -3.391  16.261  -5.244
  110    HB3  ALA  54          3HB       ALA  54  -5.112  16.164  -4.875
  111    H    ALA  55           H        ALA  55  -5.656  13.300  -3.643
  112    HA   ALA  55           HA       ALA  55  -7.552  14.473  -1.872
  113    HB1  ALA  55          1HB       ALA  55  -8.144  11.743  -2.111
  114    HB2  ALA  55          2HB       ALA  55  -8.849  13.082  -3.017
  115    HB3  ALA  55          3HB       ALA  55  -7.444  12.228  -3.656
  116    H    LEU  56           H        LEU  56  -5.132  11.921  -1.551
  117    HA   LEU  56           HA       LEU  56  -5.915  11.239   1.126
  118    HB2  LEU  56          1HB       LEU  56  -3.303  10.586  -0.212
  119    HB3  LEU  56          2HB       LEU  56  -4.083   9.730   1.117
  120    HG   LEU  56           HG       LEU  56  -5.585   9.842  -1.427
  121   HD11  LEU  56          1HD1      LEU  56  -3.866   9.166  -2.679
  122   HD12  LEU  56          2HD1      LEU  56  -4.007   7.634  -1.818
  123   HD13  LEU  56          3HD1      LEU  56  -2.849   8.848  -1.273
  124   HD21  LEU  56          1HD2      LEU  56  -5.723   8.457   0.975
  125   HD22  LEU  56          2HD2      LEU  56  -5.137   7.266  -0.188
  126   HD23  LEU  56          3HD2      LEU  56  -6.648   8.127  -0.490
  127    HA   PRO  57           HA       PRO  57  -3.599  14.161   3.441
  128    HB2  PRO  57          1HB       PRO  57  -2.828  12.671   5.576
  129    HB3  PRO  57          2HB       PRO  57  -4.495  13.206   5.329
  130    HG2  PRO  57          1HG       PRO  57  -3.250  10.549   4.735
  131    HG3  PRO  57          2HG       PRO  57  -4.823  10.908   5.471
  132    HD2  PRO  57          1HD       PRO  57  -4.557  10.218   2.866
  133    HD3  PRO  57          2HD       PRO  57  -5.821  11.326   3.435
  134    H    ALA  58           H        ALA  58  -1.508  14.845   3.944
  135    HA   ALA  58           HA       ALA  58   0.578  14.021   2.354
  136    HB1  ALA  58          1HB       ALA  58   1.113  15.169   5.068
  137    HB2  ALA  58          2HB       ALA  58   1.944  15.478   3.542
  138    HB3  ALA  58          3HB       ALA  58   0.329  16.132   3.815
  139    H    GLU  59           H        GLU  59  -0.250  12.926   5.609
  140    HA   GLU  59           HA       GLU  59   2.056  11.387   6.082
  141    HB2  GLU  59          1HB       GLU  59  -0.744  11.303   7.169
  142    HB3  GLU  59          2HB       GLU  59   0.444  10.100   7.647
  143    HG2  GLU  59          1HG       GLU  59   0.591  13.073   8.065
  144    HG3  GLU  59          2HG       GLU  59   0.403  11.823   9.293
  145    H    LEU  60           H        LEU  60  -1.114  10.486   4.753
  146    HA   LEU  60           HA       LEU  60  -0.579   7.757   4.397
  147    HB2  LEU  60          1HB       LEU  60  -2.824   8.682   4.301
  148    HB3  LEU  60          2HB       LEU  60  -2.410   9.580   2.842
  149    HG   LEU  60           HG       LEU  60  -2.216   6.597   2.842
  150   HD11  LEU  60          1HD1      LEU  60  -4.378   6.646   3.599
  151   HD12  LEU  60          2HD1      LEU  60  -4.636   6.807   1.862
  152   HD13  LEU  60          3HD1      LEU  60  -4.706   8.232   2.899
  153   HD21  LEU  60          1HD2      LEU  60  -1.531   7.198   0.792
  154   HD22  LEU  60          2HD2      LEU  60  -2.251   8.803   0.911
  155   HD23  LEU  60          3HD2      LEU  60  -3.250   7.419   0.465
  156    H    GLN  61           H        GLN  61  -0.406  10.422   2.035
  157    HA   GLN  61           HA       GLN  61   0.658   8.853  -0.055
  158    HB2  GLN  61          1HB       GLN  61   1.187  10.984  -1.136
  159    HB3  GLN  61          2HB       GLN  61  -0.435  11.006  -0.456
  160    HG2  GLN  61          1HG       GLN  61   0.118  12.513   1.179
  161    HG3  GLN  61          2HG       GLN  61   1.823  12.065   1.166
  162   HE21  GLN  61          1HE2      GLN  61   0.402  14.661  -1.666
  163   HE22  GLN  61          2HE2      GLN  61  -0.640  13.477  -0.960
  164    H    ARG  62           H        ARG  62   2.090  10.351   2.709
  165    HA   ARG  62           HA       ARG  62   4.755  10.517   1.759
  166    HB2  ARG  62          1HB       ARG  62   4.241  11.817   3.661
  167    HB3  ARG  62          2HB       ARG  62   3.538  10.447   4.510
  168    HG2  ARG  62          1HG       ARG  62   5.757   9.441   4.721
  169    HG3  ARG  62          2HG       ARG  62   6.458  10.824   3.878
  170    HD2  ARG  62          1HD       ARG  62   5.187  10.718   6.593
  171    HD3  ARG  62          2HD       ARG  62   6.797  11.284   6.148
  172    HE   ARG  62           HE       ARG  62   4.407  12.820   6.195
  173   HH11  ARG  62          1HH1      ARG  62   7.410  12.413   4.481
  174   HH12  ARG  62          2HH1      ARG  62   7.474  14.058   3.939
  175   HH21  ARG  62          1HH2      ARG  62   4.480  14.987   5.487
  176   HH22  ARG  62          2HH2      ARG  62   5.807  15.521   4.512
  177    H    GLU  63           H        GLU  63   2.878   7.976   3.287
  178    HA   GLU  63           HA       GLU  63   5.166   6.246   3.629
  179    HB2  GLU  63          1HB       GLU  63   3.425   6.058   5.263
  180    HB3  GLU  63          2HB       GLU  63   2.204   5.829   4.020
  181    HG2  GLU  63          1HG       GLU  63   2.816   3.649   3.622
  182    HG3  GLU  63          2HG       GLU  63   4.449   3.883   4.244
  183    H    LEU  64           H        LEU  64   2.792   6.878   1.212
  184    HA   LEU  64           HA       LEU  64   3.213   4.362  -0.168
  185    HB2  LEU  64          1HB       LEU  64   1.307   4.822  -1.223
  186    HB3  LEU  64          2HB       LEU  64   1.128   6.134  -0.060
  187    HG   LEU  64           HG       LEU  64   2.421   7.534  -1.824
  188   HD11  LEU  64          1HD1      LEU  64   1.164   5.870  -3.886
  189   HD12  LEU  64          2HD1      LEU  64   2.589   5.162  -3.126
  190   HD13  LEU  64          3HD1      LEU  64   2.698   6.741  -3.903
  191   HD21  LEU  64          1HD2      LEU  64   0.424   8.474  -2.042
  192   HD22  LEU  64          2HD2      LEU  64  -0.299   7.048  -1.297
  193   HD23  LEU  64          3HD2      LEU  64  -0.135   7.140  -3.051
  194    H    LYS  65           H        LYS  65   4.220   7.708  -0.399
  195    HA   LYS  65           HA       LYS  65   5.525   7.320  -2.953
  196    HB2  LYS  65          1HB       LYS  65   6.118   9.632  -2.827
  197    HB3  LYS  65          2HB       LYS  65   4.457   9.485  -2.266
  198    HG2  LYS  65          1HG       LYS  65   5.530   9.369   0.091
  199    HG3  LYS  65          2HG       LYS  65   6.933  10.083  -0.708
  200    HD2  LYS  65          1HD       LYS  65   5.191  11.780  -1.644
  201    HD3  LYS  65          2HD       LYS  65   4.198  11.223  -0.295
  202    HE2  LYS  65          1HE       LYS  65   6.226  11.707   1.174
  203    HE3  LYS  65          2HE       LYS  65   6.879  12.580  -0.211
  204    HZ1  LYS  65          1HZ       LYS  65   5.665  14.321   0.361
  205    HZ2  LYS  65          2HZ       LYS  65   5.034  13.482   1.687
  206    HZ3  LYS  65          3HZ       LYS  65   4.241  13.422   0.194
  207    H    ALA  66           H        ALA  66   6.347   7.230   0.418
  208    HA   ALA  66           HA       ALA  66   9.193   7.391  -0.013
  209    HB1  ALA  66          1HB       ALA  66   9.398   7.023   2.360
  210    HB2  ALA  66          2HB       ALA  66   8.123   8.206   2.063
  211    HB3  ALA  66          3HB       ALA  66   7.704   6.541   2.467
  212    H    ALA  67           H        ALA  67   6.874   4.839   0.846
  213    HA   ALA  67           HA       ALA  67   8.642   2.722   1.140
  214    HB1  ALA  67          1HB       ALA  67   6.719   1.268   0.555
  215    HB2  ALA  67          2HB       ALA  67   6.331   2.498   1.759
  216    HB3  ALA  67          3HB       ALA  67   5.819   2.710   0.085
  217    H    TYR  68           H        TYR  68   7.432   4.245  -1.761
  218    HA   TYR  68           HA       TYR  68   8.211   2.190  -3.569
  219    HB2  TYR  68          1HB       TYR  68   7.231   4.977  -3.775
  220    HB3  TYR  68          2HB       TYR  68   8.175   4.388  -5.139
  221    HD1  TYR  68           HD1      TYR  68   5.426   3.133  -2.927
  222    HD2  TYR  68           HD2      TYR  68   6.971   3.482  -6.876
  223    HE1  TYR  68           HE1      TYR  68   3.434   1.987  -3.801
  224    HE2  TYR  68           HE2      TYR  68   4.982   2.338  -7.761
  225    HH   TYR  68           HH       TYR  68   2.226   2.053  -6.312
  226    H    ASP  69           H        ASP  69   9.871   4.786  -2.003
  227    HA   ASP  69           HA       ASP  69  12.160   4.599  -3.805
  228    HB2  ASP  69          1HB       ASP  69  11.282   6.500  -1.686
  229    HB3  ASP  69          2HB       ASP  69  13.013   6.347  -1.980
  230    H    GLN  70           H        GLN  70  11.268   3.923  -0.459
  231    HA   GLN  70           HA       GLN  70  13.722   3.284   0.621
  232    HB2  GLN  70          1HB       GLN  70  11.022   2.025   1.114
  233    HB3  GLN  70          2HB       GLN  70  12.441   1.694   2.099
  234    HG2  GLN  70          1HG       GLN  70  10.930   4.266   1.809
  235    HG3  GLN  70          2HG       GLN  70  11.221   3.317   3.266
  236   HE21  GLN  70          1HE2      GLN  70  13.817   6.147   2.079
  237   HE22  GLN  70          2HE2      GLN  70  12.347   5.803   1.238
  238    H    ARG  71           H        ARG  71  11.478   1.067  -1.037
  239    HA   ARG  71           HA       ARG  71  13.687  -0.851  -1.316
  240    HB2  ARG  71          1HB       ARG  71  11.821  -2.457  -1.933
  241    HB3  ARG  71          2HB       ARG  71  11.840  -1.895  -0.267
  242    HG2  ARG  71          1HG       ARG  71  10.237  -0.160  -1.917
  243    HG3  ARG  71          2HG       ARG  71   9.701  -1.837  -2.042
  244    HD2  ARG  71          1HD       ARG  71  10.169  -0.389   0.560
  245    HD3  ARG  71          2HD       ARG  71   8.596  -0.540  -0.222
  246    HE   ARG  71           HE       ARG  71   9.689  -3.099   0.071
  247   HH11  ARG  71          1HH1      ARG  71   8.449  -0.500   2.028
  248   HH12  ARG  71          2HH1      ARG  71   7.911  -1.542   3.303
  249   HH21  ARG  71          1HH2      ARG  71   8.986  -4.482   1.743
  250   HH22  ARG  71          2HH2      ARG  71   8.218  -3.807   3.140
  251    H    GLN  72           H        GLN  72  13.391   1.527  -2.973
  252    HA   GLN  72           HA       GLN  72  12.243   1.109  -5.449
  253    HB2  GLN  72          1HB       GLN  72  13.358   3.213  -4.610
  254    HB3  GLN  72          2HB       GLN  72  14.900   2.475  -5.020
  255    HG2  GLN  72          1HG       GLN  72  13.303   2.223  -7.304
  256    HG3  GLN  72          2HG       GLN  72  13.038   3.858  -6.701
  257   HE21  GLN  72          1HE2      GLN  72  16.194   3.208  -8.888
  258   HE22  GLN  72          2HE2      GLN  72  14.706   2.331  -8.901
  Start of MODEL   13
    1    H    ILE  40           H        ILE  40   2.054  -1.256   0.486
    2    HA   ILE  40           HA       ILE  40   2.260   0.066  -2.038
    3    HB   ILE  40           HB       ILE  40   4.619  -0.032  -1.764
    4   HG12  ILE  40          1HG1      ILE  40   4.987  -1.551   0.612
    5   HG13  ILE  40          2HG1      ILE  40   4.050  -2.536  -0.506
    6   HG21  ILE  40          1HG2      ILE  40   3.274   0.264   0.917
    7   HG22  ILE  40          2HG2      ILE  40   4.916   0.795   0.555
    8   HG23  ILE  40          3HG2      ILE  40   3.548   1.530  -0.280
    9   HD11  ILE  40          1HD1      ILE  40   6.151  -3.119  -1.135
   10   HD12  ILE  40          2HD1      ILE  40   5.906  -1.736  -2.201
   11   HD13  ILE  40          3HD1      ILE  40   6.836  -1.549  -0.714
   12    H    ALA  41           H        ALA  41   4.360  -1.155  -3.311
   13    HA   ALA  41           HA       ALA  41   4.889  -2.775  -4.821
   14    HB1  ALA  41          1HB       ALA  41   3.201  -4.816  -3.476
   15    HB2  ALA  41          2HB       ALA  41   4.833  -4.949  -4.134
   16    HB3  ALA  41          3HB       ALA  41   4.569  -4.149  -2.585
   17    H    LEU  42           H        LEU  42   2.136  -1.302  -4.690
   18    HA   LEU  42           HA       LEU  42   0.592  -3.032  -6.466
   19    HB2  LEU  42          1HB       LEU  42  -1.069  -1.093  -6.284
   20    HB3  LEU  42          2HB       LEU  42  -0.798  -2.098  -4.862
   21    HG   LEU  42           HG       LEU  42   0.945   0.226  -4.911
   22   HD11  LEU  42          1HD1      LEU  42  -1.185   1.009  -6.125
   23   HD12  LEU  42          2HD1      LEU  42  -0.595   1.958  -4.761
   24   HD13  LEU  42          3HD1      LEU  42  -1.958   0.860  -4.547
   25   HD21  LEU  42          1HD2      LEU  42   0.342   0.366  -2.647
   26   HD22  LEU  42          2HD2      LEU  42   0.357  -1.361  -3.007
   27   HD23  LEU  42          3HD2      LEU  42  -1.176  -0.493  -2.909
   28    HA   PRO  43           HA       PRO  43   1.658  -0.971 -10.190
   29    HB2  PRO  43          1HB       PRO  43  -0.700  -0.988 -11.535
   30    HB3  PRO  43          2HB       PRO  43   0.271  -2.443 -11.279
   31    HG2  PRO  43          1HG       PRO  43  -2.138  -1.484  -9.781
   32    HG3  PRO  43          2HG       PRO  43  -1.739  -3.124 -10.328
   33    HD2  PRO  43          1HD       PRO  43  -1.368  -2.310  -7.772
   34    HD3  PRO  43          2HD       PRO  43  -0.314  -3.503  -8.557
   35    H    ALA  44           H        ALA  44   1.612   0.970  -8.419
   36    HA   ALA  44           HA       ALA  44  -0.324   2.989  -9.309
   37    HB1  ALA  44          1HB       ALA  44   0.579   2.318  -6.780
   38    HB2  ALA  44          2HB       ALA  44   1.432   3.816  -7.157
   39    HB3  ALA  44          3HB       ALA  44  -0.330   3.764  -7.221
   40    H    PHE  45           H        PHE  45   1.078   5.285  -8.676
   41    HA   PHE  45           HA       PHE  45   2.486   6.816  -9.595
   42    HB2  PHE  45          1HB       PHE  45   4.340   4.470 -10.040
   43    HB3  PHE  45          2HB       PHE  45   4.790   6.170  -9.952
   44    HD1  PHE  45           HD1      PHE  45   3.582   3.284  -8.010
   45    HD2  PHE  45           HD2      PHE  45   5.113   7.253  -7.868
   46    HE1  PHE  45           HE1      PHE  45   3.936   3.057  -5.586
   47    HE2  PHE  45           HE2      PHE  45   5.470   7.032  -5.444
   48    HZ   PHE  45           HZ       PHE  45   4.882   4.932  -4.300
   49    H    SER  46           H        SER  46   0.644   5.119 -11.293
   50    HA   SER  46           HA       SER  46   1.777   5.941 -13.871
   51    HB2  SER  46          1HB       SER  46   1.289   3.220 -13.019
   52    HB3  SER  46          2HB       SER  46   0.298   3.620 -14.421
   53    HG   SER  46           HG       SER  46   3.062   3.431 -14.184
   54    H    GLN  47           H        GLN  47  -1.167   4.186 -12.928
   55    HA   GLN  47           HA       GLN  47  -2.749   6.191 -14.351
   56    HB2  GLN  47          1HB       GLN  47  -3.018   3.724 -14.809
   57    HB3  GLN  47          2HB       GLN  47  -3.694   3.568 -13.193
   58    HG2  GLN  47          1HG       GLN  47  -5.685   4.085 -13.990
   59    HG3  GLN  47          2HG       GLN  47  -5.076   5.670 -14.464
   60   HE21  GLN  47          1HE2      GLN  47  -4.243   4.416 -17.809
   61   HE22  GLN  47          2HE2      GLN  47  -3.407   5.153 -16.489
   62    H    VAL  48           H        VAL  48  -1.773   7.234 -12.062
   63    HA   VAL  48           HA       VAL  48  -4.101   7.234 -10.252
   64    HB   VAL  48           HB       VAL  48  -1.975   8.283  -8.795
   65   HG11  VAL  48          1HG1      VAL  48  -2.571   5.411  -8.459
   66   HG12  VAL  48          2HG1      VAL  48  -2.603   6.724  -7.281
   67   HG13  VAL  48          3HG1      VAL  48  -3.950   6.508  -8.400
   68   HG21  VAL  48          1HG2      VAL  48  -1.053   5.727 -10.092
   69   HG22  VAL  48          2HG2      VAL  48  -0.494   7.324 -10.587
   70   HG23  VAL  48          3HG2      VAL  48  -0.168   6.743  -8.954
   71    H    ASP  49           H        ASP  49  -5.116   8.946 -11.322
   72    HA   ASP  49           HA       ASP  49  -4.053  11.306 -12.222
   73    HB2  ASP  49          1HB       ASP  49  -6.682  10.378 -11.389
   74    HB3  ASP  49          2HB       ASP  49  -6.455  12.093 -11.055
   75    HA   PRO  50           HA       PRO  50  -2.665  13.712  -8.829
   76    HB2  PRO  50          1HB       PRO  50  -3.511  16.207  -9.484
   77    HB3  PRO  50          2HB       PRO  50  -2.191  15.387 -10.327
   78    HG2  PRO  50          1HG       PRO  50  -5.063  15.668 -11.123
   79    HG3  PRO  50          2HG       PRO  50  -3.606  15.829 -12.120
   80    HD2  PRO  50          1HD       PRO  50  -5.120  13.585 -12.108
   81    HD3  PRO  50          2HD       PRO  50  -3.363  13.550 -12.358
   82    H    GLU  51           H        GLU  51  -6.030  14.438  -9.734
   83    HA   GLU  51           HA       GLU  51  -6.811  15.624  -7.324
   84    HB2  GLU  51          1HB       GLU  51  -8.086  14.687  -9.730
   85    HB3  GLU  51          2HB       GLU  51  -9.046  14.233  -8.329
   86    HG2  GLU  51          1HG       GLU  51  -8.124  16.966  -8.146
   87    HG3  GLU  51          2HG       GLU  51  -9.040  16.680  -9.625
   88    H    VAL  52           H        VAL  52  -6.123  12.358  -8.077
   89    HA   VAL  52           HA       VAL  52  -7.651  11.291  -5.842
   90    HB   VAL  52           HB       VAL  52  -5.697   9.625  -7.359
   91   HG11  VAL  52          1HG1      VAL  52  -6.825   8.422  -5.716
   92   HG12  VAL  52          2HG1      VAL  52  -8.357   9.238  -6.034
   93   HG13  VAL  52          3HG1      VAL  52  -7.731   8.056  -7.184
   94   HG21  VAL  52          1HG2      VAL  52  -6.692  10.844  -9.157
   95   HG22  VAL  52          2HG2      VAL  52  -7.446   9.250  -9.109
   96   HG23  VAL  52          3HG2      VAL  52  -8.305  10.651  -8.469
   97    H    PHE  53           H        PHE  53  -4.241  11.446  -6.859
   98    HA   PHE  53           HA       PHE  53  -3.182  10.369  -4.480
   99    HB2  PHE  53          1HB       PHE  53  -2.109  10.872  -6.864
  100    HB3  PHE  53          2HB       PHE  53  -1.584  12.339  -6.044
  101    HD1  PHE  53           HD1      PHE  53  -0.631   9.131  -6.878
  102    HD2  PHE  53           HD2      PHE  53  -0.601  11.826  -3.584
  103    HE1  PHE  53           HE1      PHE  53   1.253   7.896  -5.888
  104    HE2  PHE  53           HE2      PHE  53   1.283  10.596  -2.590
  105    HZ   PHE  53           HZ       PHE  53   2.213   8.629  -3.742
  106    H    ALA  54           H        ALA  54  -3.924  13.663  -5.474
  107    HA   ALA  54           HA       ALA  54  -2.745  14.865  -3.147
  108    HB1  ALA  54          1HB       ALA  54  -3.021  15.974  -5.401
  109    HB2  ALA  54          2HB       ALA  54  -4.730  16.151  -5.004
  110    HB3  ALA  54          3HB       ALA  54  -3.507  16.932  -4.002
  111    H    ALA  55           H        ALA  55  -5.733  13.369  -3.868
  112    HA   ALA  55           HA       ALA  55  -7.429  14.763  -2.088
  113    HB1  ALA  55          1HB       ALA  55  -8.888  13.504  -3.188
  114    HB2  ALA  55          2HB       ALA  55  -7.600  12.463  -3.798
  115    HB3  ALA  55          3HB       ALA  55  -8.346  12.120  -2.237
  116    H    LEU  56           H        LEU  56  -5.328  11.953  -1.693
  117    HA   LEU  56           HA       LEU  56  -6.169  11.448   1.005
  118    HB2  LEU  56          1HB       LEU  56  -3.583  10.445  -0.084
  119    HB3  LEU  56          2HB       LEU  56  -4.738   9.646   0.980
  120    HG   LEU  56           HG       LEU  56  -6.113   9.951  -1.414
  121   HD11  LEU  56          1HD1      LEU  56  -4.561   8.867  -3.039
  122   HD12  LEU  56          2HD1      LEU  56  -3.239   9.208  -1.923
  123   HD13  LEU  56          3HD1      LEU  56  -4.151  10.536  -2.641
  124   HD21  LEU  56          1HD2      LEU  56  -5.756   8.014   0.350
  125   HD22  LEU  56          2HD2      LEU  56  -4.622   7.437  -0.872
  126   HD23  LEU  56          3HD2      LEU  56  -6.319   7.682  -1.288
  127    HA   PRO  57           HA       PRO  57  -3.503  14.110   3.254
  128    HB2  PRO  57          1HB       PRO  57  -2.805  12.558   5.369
  129    HB3  PRO  57          2HB       PRO  57  -4.423  13.242   5.172
  130    HG2  PRO  57          1HG       PRO  57  -3.444  10.483   4.549
  131    HG3  PRO  57          2HG       PRO  57  -4.954  10.984   5.332
  132    HD2  PRO  57          1HD       PRO  57  -4.834  10.270   2.723
  133    HD3  PRO  57          2HD       PRO  57  -5.973  11.490   3.328
  134    H    ALA  58           H        ALA  58  -1.404  14.711   3.268
  135    HA   ALA  58           HA       ALA  58   0.531  13.442   1.782
  136    HB1  ALA  58          1HB       ALA  58   0.475  15.642   3.702
  137    HB2  ALA  58          2HB       ALA  58   2.037  14.829   3.598
  138    HB3  ALA  58          3HB       ALA  58   1.299  15.511   2.148
  139    H    GLU  59           H        GLU  59  -0.256  13.005   5.174
  140    HA   GLU  59           HA       GLU  59   2.007  11.625   6.026
  141    HB2  GLU  59          1HB       GLU  59   0.218  12.416   7.530
  142    HB3  GLU  59          2HB       GLU  59  -0.857  11.183   6.888
  143    HG2  GLU  59          1HG       GLU  59  -0.167  10.044   8.695
  144    HG3  GLU  59          2HG       GLU  59   1.188   9.630   7.646
  145    H    LEU  60           H        LEU  60  -0.878  10.459   4.358
  146    HA   LEU  60           HA       LEU  60   0.093   7.722   4.385
  147    HB2  LEU  60          1HB       LEU  60  -2.185   7.702   4.619
  148    HB3  LEU  60          2HB       LEU  60  -2.413   9.094   3.561
  149    HG   LEU  60           HG       LEU  60  -1.478   6.555   2.330
  150   HD11  LEU  60          1HD1      LEU  60  -3.203   5.700   3.745
  151   HD12  LEU  60          2HD1      LEU  60  -3.849   5.823   2.109
  152   HD13  LEU  60          3HD1      LEU  60  -4.283   7.028   3.321
  153   HD21  LEU  60          1HD2      LEU  60  -1.733   8.052   0.661
  154   HD22  LEU  60          2HD2      LEU  60  -2.889   9.030   1.566
  155   HD23  LEU  60          3HD2      LEU  60  -3.422   7.552   0.762
  156    H    GLN  61           H        GLN  61  -0.344  10.373   2.106
  157    HA   GLN  61           HA       GLN  61   0.272   8.946  -0.243
  158    HB2  GLN  61          1HB       GLN  61  -0.144  10.910  -1.229
  159    HB3  GLN  61          2HB       GLN  61  -0.476  11.543   0.378
  160    HG2  GLN  61          1HG       GLN  61   1.734  12.389   0.590
  161    HG3  GLN  61          2HG       GLN  61   2.258  11.550  -0.869
  162   HE21  GLN  61          1HE2      GLN  61  -0.412  14.550  -1.580
  163   HE22  GLN  61          2HE2      GLN  61  -0.746  13.315  -0.418
  164    H    ARG  62           H        ARG  62   2.258  10.344   2.248
  165    HA   ARG  62           HA       ARG  62   4.693  10.205   0.710
  166    HB2  ARG  62          1HB       ARG  62   5.758  11.155   2.553
  167    HB3  ARG  62          2HB       ARG  62   4.135  11.826   2.646
  168    HG2  ARG  62          1HG       ARG  62   3.679   9.803   4.214
  169    HG3  ARG  62          2HG       ARG  62   5.436   9.771   4.371
  170    HD2  ARG  62          1HD       ARG  62   5.384  12.146   5.045
  171    HD3  ARG  62          2HD       ARG  62   3.623  12.108   4.961
  172    HE   ARG  62           HE       ARG  62   3.610  11.129   7.017
  173   HH11  ARG  62          1HH1      ARG  62   6.735  10.619   5.570
  174   HH12  ARG  62          2HH1      ARG  62   7.408   9.864   6.977
  175   HH21  ARG  62          1HH2      ARG  62   4.485  10.137   8.875
  176   HH22  ARG  62          2HH2      ARG  62   6.127   9.590   8.856
  177    H    GLU  63           H        GLU  63   2.919   8.155   2.874
  178    HA   GLU  63           HA       GLU  63   5.054   6.413   3.576
  179    HB2  GLU  63          1HB       GLU  63   3.111   6.441   4.971
  180    HB3  GLU  63          2HB       GLU  63   2.056   6.075   3.613
  181    HG2  GLU  63          1HG       GLU  63   2.400   3.879   3.784
  182    HG3  GLU  63          2HG       GLU  63   4.131   4.073   4.052
  183    H    LEU  64           H        LEU  64   2.868   6.617   0.870
  184    HA   LEU  64           HA       LEU  64   3.540   3.983  -0.123
  185    HB2  LEU  64          1HB       LEU  64   1.939   4.317  -1.752
  186    HB3  LEU  64          2HB       LEU  64   1.309   5.245  -0.393
  187    HG   LEU  64           HG       LEU  64   2.631   7.196  -1.662
  188   HD11  LEU  64          1HD1      LEU  64   3.409   6.435  -3.620
  189   HD12  LEU  64          2HD1      LEU  64   1.735   6.576  -4.155
  190   HD13  LEU  64          3HD1      LEU  64   2.356   5.020  -3.604
  191   HD21  LEU  64          1HD2      LEU  64   0.039   6.593  -1.139
  192   HD22  LEU  64          2HD2      LEU  64   0.029   6.634  -2.902
  193   HD23  LEU  64          3HD2      LEU  64   0.576   8.042  -1.990
  194    H    LYS  65           H        LYS  65   4.484   7.303  -0.671
  195    HA   LYS  65           HA       LYS  65   5.979   6.718  -3.064
  196    HB2  LYS  65          1HB       LYS  65   5.981   9.180  -1.308
  197    HB3  LYS  65          2HB       LYS  65   6.734   9.055  -2.892
  198    HG2  LYS  65          1HG       LYS  65   4.698   9.009  -3.999
  199    HG3  LYS  65          2HG       LYS  65   3.813   8.512  -2.555
  200    HD2  LYS  65          1HD       LYS  65   3.247  10.668  -2.359
  201    HD3  LYS  65          2HD       LYS  65   4.904  10.923  -1.806
  202    HE2  LYS  65          1HE       LYS  65   5.618  11.550  -3.988
  203    HE3  LYS  65          2HE       LYS  65   4.094  11.029  -4.704
  204    HZ1  LYS  65          1HZ       LYS  65   3.343  12.858  -2.837
  205    HZ2  LYS  65          2HZ       LYS  65   3.478  13.142  -4.499
  206    HZ3  LYS  65          3HZ       LYS  65   4.764  13.524  -3.469
  207    H    ALA  66           H        ALA  66   6.763   7.487   0.314
  208    HA   ALA  66           HA       ALA  66   9.566   7.330   0.022
  209    HB1  ALA  66          1HB       ALA  66   8.156   6.685   2.586
  210    HB2  ALA  66          2HB       ALA  66   9.691   7.519   2.337
  211    HB3  ALA  66          3HB       ALA  66   8.174   8.329   1.945
  212    H    ALA  67           H        ALA  67   7.155   4.939   1.061
  213    HA   ALA  67           HA       ALA  67   8.825   2.854   1.764
  214    HB1  ALA  67          1HB       ALA  67   6.944   1.359   1.180
  215    HB2  ALA  67          2HB       ALA  67   6.448   2.748   2.147
  216    HB3  ALA  67          3HB       ALA  67   6.134   2.725   0.412
  217    H    TYR  68           H        TYR  68   7.753   3.852  -1.445
  218    HA   TYR  68           HA       TYR  68   8.852   1.618  -2.821
  219    HB2  TYR  68          1HB       TYR  68   7.626   4.207  -3.557
  220    HB3  TYR  68          2HB       TYR  68   8.735   3.523  -4.741
  221    HD1  TYR  68           HD1      TYR  68   7.872   2.084  -6.325
  222    HD2  TYR  68           HD2      TYR  68   5.860   2.468  -2.595
  223    HE1  TYR  68           HE1      TYR  68   6.092   0.593  -7.138
  224    HE2  TYR  68           HE2      TYR  68   4.076   0.978  -3.398
  225    HH   TYR  68           HH       TYR  68   3.600   0.225  -6.573
  226    H    ASP  69           H        ASP  69  10.146   4.595  -1.635
  227    HA   ASP  69           HA       ASP  69  12.526   4.466  -3.286
  228    HB2  ASP  69          1HB       ASP  69  11.497   6.348  -1.192
  229    HB3  ASP  69          2HB       ASP  69  13.201   6.386  -1.637
  230    H    GLN  70           H        GLN  70  11.562   3.763   0.021
  231    HA   GLN  70           HA       GLN  70  14.078   3.405   1.168
  232    HB2  GLN  70          1HB       GLN  70  11.454   2.031   1.761
  233    HB3  GLN  70          2HB       GLN  70  12.887   1.881   2.769
  234    HG2  GLN  70          1HG       GLN  70  11.189   4.298   2.279
  235    HG3  GLN  70          2HG       GLN  70  11.577   3.510   3.807
  236   HE21  GLN  70          1HE2      GLN  70  13.915   6.421   2.319
  237   HE22  GLN  70          2HE2      GLN  70  12.465   5.887   1.545
  238    H    ARG  71           H        ARG  71  11.963   1.009  -0.399
  239    HA   ARG  71           HA       ARG  71  13.768  -1.153  -0.121
  240    HB2  ARG  71          1HB       ARG  71  11.602  -0.830  -2.203
  241    HB3  ARG  71          2HB       ARG  71  12.324  -2.337  -1.656
  242    HG2  ARG  71          1HG       ARG  71  10.606  -0.481  -0.022
  243    HG3  ARG  71          2HG       ARG  71  10.137  -2.052  -0.677
  244    HD2  ARG  71          1HD       ARG  71  12.240  -1.508   1.414
  245    HD3  ARG  71          2HD       ARG  71  10.679  -2.289   1.660
  246    HE   ARG  71           HE       ARG  71  11.894  -3.850  -0.199
  247   HH11  ARG  71          1HH1      ARG  71  12.805  -2.681   2.951
  248   HH12  ARG  71          2HH1      ARG  71  13.790  -4.057   3.321
  249   HH21  ARG  71          1HH2      ARG  71  13.188  -5.668   0.277
  250   HH22  ARG  71          2HH2      ARG  71  14.008  -5.755   1.799
  251    H    GLN  72           H        GLN  72  13.636   1.504  -2.283
  252    HA   GLN  72           HA       GLN  72  14.881   2.124  -4.083
  253    HB2  GLN  72          1HB       GLN  72  16.618   0.796  -2.282
  254    HB3  GLN  72          2HB       GLN  72  17.065   0.279  -3.902
  255    HG2  GLN  72          1HG       GLN  72  16.824   2.930  -4.299
  256    HG3  GLN  72          2HG       GLN  72  17.327   2.906  -2.610
  257   HE21  GLN  72          1HE2      GLN  72  19.907   1.942  -5.584
  258   HE22  GLN  72          2HE2      GLN  72  18.224   2.191  -5.882
  Start of MODEL   14
    1    H    ILE  40           H        ILE  40   3.955  -1.008  -3.410
    2    HA   ILE  40           HA       ILE  40   5.289  -2.670  -1.399
    3    HB   ILE  40           HB       ILE  40   5.481  -0.631  -0.065
    4   HG12  ILE  40          1HG1      ILE  40   4.901   1.484  -1.690
    5   HG13  ILE  40          2HG1      ILE  40   3.601   0.371  -2.102
    6   HG21  ILE  40          1HG2      ILE  40   6.439  -0.503  -2.909
    7   HG22  ILE  40          2HG2      ILE  40   6.924   0.679  -1.695
    8   HG23  ILE  40          3HG2      ILE  40   7.323  -1.025  -1.475
    9   HD11  ILE  40          1HD1      ILE  40   3.669   2.127   0.029
   10   HD12  ILE  40          2HD1      ILE  40   2.532   0.800  -0.210
   11   HD13  ILE  40          3HD1      ILE  40   3.987   0.552   0.755
   12    H    ALA  41           H        ALA  41   2.251  -1.078  -2.108
   13    HA   ALA  41           HA       ALA  41   0.716  -2.779  -0.516
   14    HB1  ALA  41          1HB       ALA  41   0.757  -1.946   1.539
   15    HB2  ALA  41          2HB       ALA  41   2.032  -0.839   1.030
   16    HB3  ALA  41          3HB       ALA  41   0.344  -0.339   0.939
   17    H    LEU  42           H        LEU  42   1.076   0.399  -1.957
   18    HA   LEU  42           HA       LEU  42  -1.804   0.431  -2.561
   19    HB2  LEU  42          1HB       LEU  42   0.072   2.762  -2.819
   20    HB3  LEU  42          2HB       LEU  42  -1.690   2.779  -2.759
   21    HG   LEU  42           HG       LEU  42  -1.248   1.793  -0.337
   22   HD11  LEU  42          1HD1      LEU  42   0.878   1.806   0.287
   23   HD12  LEU  42          2HD1      LEU  42   0.876   3.563   0.139
   24   HD13  LEU  42          3HD1      LEU  42   1.364   2.563  -1.230
   25   HD21  LEU  42          1HD2      LEU  42  -1.110   4.265   0.415
   26   HD22  LEU  42          2HD2      LEU  42  -2.521   3.723  -0.494
   27   HD23  LEU  42          3HD2      LEU  42  -1.240   4.624  -1.307
   28    HA   PRO  43           HA       PRO  43   0.106  -0.630  -6.595
   29    HB2  PRO  43          1HB       PRO  43  -2.017  -2.091  -7.447
   30    HB3  PRO  43          2HB       PRO  43  -0.741  -2.758  -6.422
   31    HG2  PRO  43          1HG       PRO  43  -3.456  -1.756  -5.657
   32    HG3  PRO  43          2HG       PRO  43  -2.601  -3.205  -5.099
   33    HD2  PRO  43          1HD       PRO  43  -2.716  -0.928  -3.638
   34    HD3  PRO  43          2HD       PRO  43  -1.318  -2.021  -3.594
   35    H    ALA  44           H        ALA  44  -0.428   1.841  -6.632
   36    HA   ALA  44           HA       ALA  44  -2.452   2.218  -8.721
   37    HB1  ALA  44          1HB       ALA  44  -2.406   3.478  -6.058
   38    HB2  ALA  44          2HB       ALA  44  -2.717   4.559  -7.417
   39    HB3  ALA  44          3HB       ALA  44  -3.759   3.163  -7.145
   40    H    PHE  45           H        PHE  45   0.672   2.370  -7.975
   41    HA   PHE  45           HA       PHE  45   1.530   4.934  -8.714
   42    HB2  PHE  45          1HB       PHE  45   2.941   2.280  -9.062
   43    HB3  PHE  45          2HB       PHE  45   3.710   3.860  -9.177
   44    HD1  PHE  45           HD1      PHE  45   4.328   5.074  -7.240
   45    HD2  PHE  45           HD2      PHE  45   2.056   1.492  -6.893
   46    HE1  PHE  45           HE1      PHE  45   4.741   5.051  -4.814
   47    HE2  PHE  45           HE2      PHE  45   2.464   1.463  -4.467
   48    HZ   PHE  45           HZ       PHE  45   3.808   3.245  -3.424
   49    H    SER  46           H        SER  46   0.172   2.419 -10.575
   50    HA   SER  46           HA       SER  46   1.341   2.666 -13.055
   51    HB2  SER  46          1HB       SER  46  -1.107   1.604 -12.006
   52    HB3  SER  46          2HB       SER  46  -1.454   2.466 -13.505
   53    HG   SER  46           HG       SER  46  -0.758   0.697 -14.403
   54    H    GLN  47           H        GLN  47  -1.802   4.196 -12.419
   55    HA   GLN  47           HA       GLN  47  -1.093   6.834 -12.925
   56    HB2  GLN  47          1HB       GLN  47  -2.063   6.999 -15.291
   57    HB3  GLN  47          2HB       GLN  47  -0.435   6.355 -15.127
   58    HG2  GLN  47          1HG       GLN  47  -1.024   4.306 -15.846
   59    HG3  GLN  47          2HG       GLN  47  -2.610   4.372 -15.079
   60   HE21  GLN  47          1HE2      GLN  47  -4.134   6.073 -17.842
   61   HE22  GLN  47          2HE2      GLN  47  -4.086   6.079 -16.115
   62    H    VAL  48           H        VAL  48  -2.716   6.221 -11.105
   63    HA   VAL  48           HA       VAL  48  -5.431   5.774 -11.793
   64    HB   VAL  48           HB       VAL  48  -4.254   6.965  -9.278
   65   HG11  VAL  48          1HG1      VAL  48  -7.022   5.910  -9.840
   66   HG12  VAL  48          2HG1      VAL  48  -6.404   6.322  -8.240
   67   HG13  VAL  48          3HG1      VAL  48  -6.581   7.576  -9.468
   68   HG21  VAL  48          1HG2      VAL  48  -4.935   4.158 -10.102
   69   HG22  VAL  48          2HG2      VAL  48  -3.405   4.783  -9.487
   70   HG23  VAL  48          3HG2      VAL  48  -4.792   4.629  -8.408
   71    H    ASP  49           H        ASP  49  -4.188   8.681 -10.168
   72    HA   ASP  49           HA       ASP  49  -5.060  10.512 -12.131
   73    HB2  ASP  49          1HB       ASP  49  -7.144   9.487 -10.528
   74    HB3  ASP  49          2HB       ASP  49  -6.830  11.119  -9.944
   75    HA   PRO  50           HA       PRO  50  -2.440  13.094  -9.731
   76    HB2  PRO  50          1HB       PRO  50  -3.274  15.538 -10.570
   77    HB3  PRO  50          2HB       PRO  50  -2.312  14.451 -11.580
   78    HG2  PRO  50          1HG       PRO  50  -5.267  14.932 -11.595
   79    HG3  PRO  50          2HG       PRO  50  -4.153  14.769 -12.965
   80    HD2  PRO  50          1HD       PRO  50  -5.743  12.742 -12.131
   81    HD3  PRO  50          2HD       PRO  50  -4.141  12.467 -12.843
   82    H    GLU  51           H        GLU  51  -5.813  14.260  -9.851
   83    HA   GLU  51           HA       GLU  51  -5.679  15.696  -7.423
   84    HB2  GLU  51          1HB       GLU  51  -7.849  14.775  -9.238
   85    HB3  GLU  51          2HB       GLU  51  -8.304  15.241  -7.606
   86    HG2  GLU  51          1HG       GLU  51  -7.625  17.443  -7.910
   87    HG3  GLU  51          2HG       GLU  51  -6.624  17.041  -9.304
   88    H    VAL  52           H        VAL  52  -6.430  12.366  -8.188
   89    HA   VAL  52           HA       VAL  52  -7.620  11.625  -5.748
   90    HB   VAL  52           HB       VAL  52  -6.991  10.326  -8.124
   91   HG11  VAL  52          1HG1      VAL  52  -5.774   8.337  -7.507
   92   HG12  VAL  52          2HG1      VAL  52  -4.787   9.756  -7.150
   93   HG13  VAL  52          3HG1      VAL  52  -5.617   8.906  -5.845
   94   HG21  VAL  52          1HG2      VAL  52  -8.266   9.496  -5.546
   95   HG22  VAL  52          2HG2      VAL  52  -9.020   9.843  -7.102
   96   HG23  VAL  52          3HG2      VAL  52  -8.107   8.351  -6.878
   97    H    PHE  53           H        PHE  53  -4.291  12.035  -6.707
   98    HA   PHE  53           HA       PHE  53  -3.182  10.661  -4.448
   99    HB2  PHE  53          1HB       PHE  53  -2.135  11.267  -6.812
  100    HB3  PHE  53          2HB       PHE  53  -1.612  12.708  -5.947
  101    HD1  PHE  53           HD1      PHE  53  -0.554   9.629  -6.971
  102    HD2  PHE  53           HD2      PHE  53  -0.680  12.027  -3.457
  103    HE1  PHE  53           HE1      PHE  53   1.353   8.376  -6.051
  104    HE2  PHE  53           HE2      PHE  53   1.227  10.779  -2.532
  105    HZ   PHE  53           HZ       PHE  53   2.247   8.951  -3.830
  106    H    ALA  54           H        ALA  54  -3.747  14.048  -5.313
  107    HA   ALA  54           HA       ALA  54  -2.618  15.073  -2.887
  108    HB1  ALA  54          1HB       ALA  54  -4.327  17.010  -3.987
  109    HB2  ALA  54          2HB       ALA  54  -2.573  16.899  -4.146
  110    HB3  ALA  54          3HB       ALA  54  -3.617  16.143  -5.350
  111    H    ALA  55           H        ALA  55  -5.627  13.720  -3.748
  112    HA   ALA  55           HA       ALA  55  -7.326  15.112  -1.962
  113    HB1  ALA  55          1HB       ALA  55  -8.020  13.658  -3.913
  114    HB2  ALA  55          2HB       ALA  55  -7.715  12.271  -2.867
  115    HB3  ALA  55          3HB       ALA  55  -8.944  13.456  -2.424
  116    H    LEU  56           H        LEU  56  -5.341  12.211  -1.636
  117    HA   LEU  56           HA       LEU  56  -6.290  11.607   1.005
  118    HB2  LEU  56          1HB       LEU  56  -4.137  10.552  -0.776
  119    HB3  LEU  56          2HB       LEU  56  -4.143  10.123   0.934
  120    HG   LEU  56           HG       LEU  56  -6.651   9.690  -0.595
  121   HD11  LEU  56          1HD1      LEU  56  -5.847   8.229  -2.055
  122   HD12  LEU  56          2HD1      LEU  56  -4.986   7.363  -0.783
  123   HD13  LEU  56          3HD1      LEU  56  -4.218   8.726  -1.597
  124   HD21  LEU  56          1HD2      LEU  56  -6.888   9.027   1.590
  125   HD22  LEU  56          2HD2      LEU  56  -5.209   8.506   1.730
  126   HD23  LEU  56          3HD2      LEU  56  -6.368   7.517   0.842
  127    HA   PRO  57           HA       PRO  57  -3.604  14.029   3.489
  128    HB2  PRO  57          1HB       PRO  57  -2.944  12.316   5.489
  129    HB3  PRO  57          2HB       PRO  57  -4.553  13.030   5.328
  130    HG2  PRO  57          1HG       PRO  57  -3.595  10.315   4.509
  131    HG3  PRO  57          2HG       PRO  57  -5.108  10.772   5.313
  132    HD2  PRO  57          1HD       PRO  57  -4.968  10.254   2.659
  133    HD3  PRO  57          2HD       PRO  57  -6.101  11.438   3.342
  134    H    ALA  58           H        ALA  58  -1.504  14.610   3.543
  135    HA   ALA  58           HA       ALA  58   0.433  13.407   1.999
  136    HB1  ALA  58          1HB       ALA  58   2.062  14.802   3.186
  137    HB2  ALA  58          2HB       ALA  58   0.604  15.704   2.771
  138    HB3  ALA  58          3HB       ALA  58   0.855  15.147   4.425
  139    H    GLU  59           H        GLU  59  -0.371  12.816   5.365
  140    HA   GLU  59           HA       GLU  59   1.870  11.390   6.175
  141    HB2  GLU  59          1HB       GLU  59  -0.386  12.103   7.407
  142    HB3  GLU  59          2HB       GLU  59  -0.800  10.428   7.070
  143    HG2  GLU  59          1HG       GLU  59   0.130  10.506   9.245
  144    HG3  GLU  59          2HG       GLU  59   1.326   9.757   8.189
  145    H    LEU  60           H        LEU  60  -0.978  10.300   4.396
  146    HA   LEU  60           HA       LEU  60   0.005   7.571   4.294
  147    HB2  LEU  60          1HB       LEU  60  -2.276   7.525   4.470
  148    HB3  LEU  60          2HB       LEU  60  -2.488   8.979   3.497
  149    HG   LEU  60           HG       LEU  60  -1.524   6.510   2.142
  150   HD11  LEU  60          1HD1      LEU  60  -3.312   5.614   3.463
  151   HD12  LEU  60          2HD1      LEU  60  -3.881   5.807   1.806
  152   HD13  LEU  60          3HD1      LEU  60  -4.363   6.967   3.043
  153   HD21  LEU  60          1HD2      LEU  60  -1.868   7.829   0.393
  154   HD22  LEU  60          2HD2      LEU  60  -2.528   9.091   1.434
  155   HD23  LEU  60          3HD2      LEU  60  -3.590   7.848   0.772
  156    H    GLN  61           H        GLN  61  -0.398  10.336   2.146
  157    HA   GLN  61           HA       GLN  61   0.273   9.043  -0.261
  158    HB2  GLN  61          1HB       GLN  61  -0.204  11.053  -1.103
  159    HB3  GLN  61          2HB       GLN  61  -0.408  11.646   0.540
  160    HG2  GLN  61          1HG       GLN  61   1.836  12.407   0.636
  161    HG3  GLN  61          2HG       GLN  61   2.245  11.584  -0.869
  162   HE21  GLN  61          1HE2      GLN  61  -0.335  14.707  -1.351
  163   HE22  GLN  61          2HE2      GLN  61  -0.648  13.464  -0.193
  164    H    ARG  62           H        ARG  62   2.205  10.256   2.358
  165    HA   ARG  62           HA       ARG  62   4.676  10.213   0.868
  166    HB2  ARG  62          1HB       ARG  62   5.690  11.069   2.770
  167    HB3  ARG  62          2HB       ARG  62   4.052  11.691   2.915
  168    HG2  ARG  62          1HG       ARG  62   3.651   9.540   4.323
  169    HG3  ARG  62          2HG       ARG  62   5.409   9.547   4.480
  170    HD2  ARG  62          1HD       ARG  62   5.318  11.824   5.371
  171    HD3  ARG  62          2HD       ARG  62   3.562  11.818   5.208
  172    HE   ARG  62           HE       ARG  62   3.448  10.679   7.177
  173   HH11  ARG  62          1HH1      ARG  62   6.629  10.243   5.830
  174   HH12  ARG  62          2HH1      ARG  62   7.232   9.370   7.201
  175   HH21  ARG  62          1HH2      ARG  62   4.230   9.532   8.987
  176   HH22  ARG  62          2HH2      ARG  62   5.866   8.966   8.995
  177    H    GLU  63           H        GLU  63   2.837   8.030   2.834
  178    HA   GLU  63           HA       GLU  63   4.962   6.235   3.459
  179    HB2  GLU  63          1HB       GLU  63   3.014   6.196   4.845
  180    HB3  GLU  63          2HB       GLU  63   1.961   5.925   3.464
  181    HG2  GLU  63          1HG       GLU  63   2.272   3.720   3.512
  182    HG3  GLU  63          2HG       GLU  63   4.009   3.876   3.770
  183    H    LEU  64           H        LEU  64   2.815   6.645   0.751
  184    HA   LEU  64           HA       LEU  64   3.436   4.063  -0.395
  185    HB2  LEU  64          1HB       LEU  64   1.873   4.541  -2.025
  186    HB3  LEU  64          2HB       LEU  64   1.245   5.399  -0.620
  187    HG   LEU  64           HG       LEU  64   2.650   7.384  -1.752
  188   HD11  LEU  64          1HD1      LEU  64   3.413   6.706  -3.748
  189   HD12  LEU  64          2HD1      LEU  64   1.751   6.964  -4.279
  190   HD13  LEU  64          3HD1      LEU  64   2.292   5.346  -3.830
  191   HD21  LEU  64          1HD2      LEU  64   0.050   6.874  -1.249
  192   HD22  LEU  64          2HD2      LEU  64   0.020   6.957  -3.011
  193   HD23  LEU  64          3HD2      LEU  64   0.627   8.323  -2.073
  194    H    LYS  65           H        LYS  65   4.465   7.388  -0.734
  195    HA   LYS  65           HA       LYS  65   6.013   6.876  -3.118
  196    HB2  LYS  65          1HB       LYS  65   5.953   9.286  -1.291
  197    HB3  LYS  65          2HB       LYS  65   6.772   9.207  -2.846
  198    HG2  LYS  65          1HG       LYS  65   4.798   9.234  -4.039
  199    HG3  LYS  65          2HG       LYS  65   3.847   8.634  -2.679
  200    HD2  LYS  65          1HD       LYS  65   3.218  10.788  -2.485
  201    HD3  LYS  65          2HD       LYS  65   4.769  10.971  -1.663
  202    HE2  LYS  65          1HE       LYS  65   5.792  11.890  -3.548
  203    HE3  LYS  65          2HE       LYS  65   4.554  11.269  -4.638
  204    HZ1  LYS  65          1HZ       LYS  65   4.385  13.566  -2.788
  205    HZ2  LYS  65          2HZ       LYS  65   2.993  12.822  -3.394
  206    HZ3  LYS  65          3HZ       LYS  65   4.103  13.532  -4.456
  207    H    ALA  66           H        ALA  66   6.649   7.413   0.324
  208    HA   ALA  66           HA       ALA  66   9.470   7.335   0.137
  209    HB1  ALA  66          1HB       ALA  66   7.658   6.759   2.477
  210    HB2  ALA  66          2HB       ALA  66   9.406   6.970   2.578
  211    HB3  ALA  66          3HB       ALA  66   8.384   8.311   2.060
  212    H    ALA  67           H        ALA  67   7.043   4.847   0.830
  213    HA   ALA  67           HA       ALA  67   8.676   2.731   1.512
  214    HB1  ALA  67          1HB       ALA  67   6.078   2.782  -0.003
  215    HB2  ALA  67          2HB       ALA  67   6.866   1.285   0.498
  216    HB3  ALA  67          3HB       ALA  67   6.339   2.452   1.710
  217    H    TYR  68           H        TYR  68   7.760   3.838  -1.730
  218    HA   TYR  68           HA       TYR  68   9.082   1.771  -3.136
  219    HB2  TYR  68          1HB       TYR  68   7.721   4.279  -3.786
  220    HB3  TYR  68          2HB       TYR  68   9.060   3.917  -4.871
  221    HD1  TYR  68           HD1      TYR  68   8.335   2.971  -6.838
  222    HD2  TYR  68           HD2      TYR  68   6.405   1.865  -3.211
  223    HE1  TYR  68           HE1      TYR  68   6.906   1.402  -8.083
  224    HE2  TYR  68           HE2      TYR  68   4.972   0.293  -4.446
  225    HH   TYR  68           HH       TYR  68   5.487  -0.378  -7.851
  226    H    ASP  69           H        ASP  69  10.172   4.708  -1.672
  227    HA   ASP  69           HA       ASP  69  12.670   4.781  -3.130
  228    HB2  ASP  69          1HB       ASP  69  11.356   6.796  -2.159
  229    HB3  ASP  69          2HB       ASP  69  12.102   6.346  -0.628
  230    H    GLN  70           H        GLN  70  11.511   3.773   0.036
  231    HA   GLN  70           HA       GLN  70  13.885   3.408   1.388
  232    HB2  GLN  70          1HB       GLN  70  11.362   1.752   1.460
  233    HB3  GLN  70          2HB       GLN  70  12.684   1.556   2.602
  234    HG2  GLN  70          1HG       GLN  70  10.849   3.900   2.256
  235    HG3  GLN  70          2HG       GLN  70  11.110   2.905   3.687
  236   HE21  GLN  70          1HE2      GLN  70  13.348   6.165   2.996
  237   HE22  GLN  70          2HE2      GLN  70  12.044   5.678   1.974
  238    H    ARG  71           H        ARG  71  12.220   1.058  -0.705
  239    HA   ARG  71           HA       ARG  71  14.554  -0.685  -0.631
  240    HB2  ARG  71          1HB       ARG  71  13.152  -2.271  -1.872
  241    HB3  ARG  71          2HB       ARG  71  12.350  -1.714  -0.409
  242    HG2  ARG  71          1HG       ARG  71  11.486   0.072  -2.319
  243    HG3  ARG  71          2HG       ARG  71  11.546  -1.464  -3.186
  244    HD2  ARG  71          1HD       ARG  71  10.415  -2.093  -0.727
  245    HD3  ARG  71          2HD       ARG  71   9.687  -0.547  -1.165
  246    HE   ARG  71           HE       ARG  71   8.561  -1.591  -2.871
  247   HH11  ARG  71          1HH1      ARG  71  11.038  -3.709  -1.646
  248   HH12  ARG  71          2HH1      ARG  71  10.487  -5.086  -2.541
  249   HH21  ARG  71          1HH2      ARG  71   7.826  -3.397  -4.055
  250   HH22  ARG  71          2HH2      ARG  71   8.660  -4.907  -3.912
  251    H    GLN  72           H        GLN  72  15.163   1.695  -1.827
  252    HA   GLN  72           HA       GLN  72  15.588   0.857  -4.605
  253    HB2  GLN  72          1HB       GLN  72  13.795   2.424  -4.788
  254    HB3  GLN  72          2HB       GLN  72  14.579   3.546  -3.684
  255    HG2  GLN  72          1HG       GLN  72  16.246   4.087  -5.288
  256    HG3  GLN  72          2HG       GLN  72  15.725   2.784  -6.355
  257   HE21  GLN  72          1HE2      GLN  72  14.416   6.105  -7.490
  258   HE22  GLN  72          2HE2      GLN  72  15.983   5.533  -7.042
  Start of MODEL   15
    1    H    ILE  40           H        ILE  40   1.615  -1.562  -1.465
    2    HA   ILE  40           HA       ILE  40   2.892  -1.236   1.168
    3    HB   ILE  40           HB       ILE  40   4.273   0.503   0.172
    4   HG12  ILE  40          1HG1      ILE  40   3.942   0.197  -2.582
    5   HG13  ILE  40          2HG1      ILE  40   2.301   0.302  -1.954
    6   HG21  ILE  40          1HG2      ILE  40   4.924  -1.918   0.061
    7   HG22  ILE  40          2HG2      ILE  40   4.348  -1.925  -1.605
    8   HG23  ILE  40          3HG2      ILE  40   5.692  -0.882  -1.142
    9   HD11  ILE  40          1HD1      ILE  40   3.840   2.308  -0.686
   10   HD12  ILE  40          2HD1      ILE  40   4.160   2.384  -2.419
   11   HD13  ILE  40          3HD1      ILE  40   2.504   2.494  -1.822
   12    H    ALA  41           H        ALA  41   0.523   0.045  -1.024
   13    HA   ALA  41           HA       ALA  41  -0.845   1.479   0.950
   14    HB1  ALA  41          1HB       ALA  41   1.370   2.910  -0.229
   15    HB2  ALA  41          2HB       ALA  41  -0.161   3.736  -0.522
   16    HB3  ALA  41          3HB       ALA  41   0.334   3.356   1.128
   17    H    LEU  42           H        LEU  42  -0.033   1.249  -2.472
   18    HA   LEU  42           HA       LEU  42  -2.887   1.269  -3.100
   19    HB2  LEU  42          1HB       LEU  42  -0.834   2.979  -4.496
   20    HB3  LEU  42          2HB       LEU  42  -2.492   2.739  -5.044
   21    HG   LEU  42           HG       LEU  42  -2.129   3.793  -2.299
   22   HD11  LEU  42          1HD1      LEU  42  -1.877   5.672  -4.616
   23   HD12  LEU  42          2HD1      LEU  42  -0.452   4.955  -3.866
   24   HD13  LEU  42          3HD1      LEU  42  -1.542   5.957  -2.908
   25   HD21  LEU  42          1HD2      LEU  42  -4.053   4.051  -4.566
   26   HD22  LEU  42          2HD2      LEU  42  -3.997   5.302  -3.324
   27   HD23  LEU  42          3HD2      LEU  42  -4.351   3.632  -2.879
   28    HA   PRO  43           HA       PRO  43  -1.879  -2.062  -5.776
   29    HB2  PRO  43          1HB       PRO  43  -3.767  -1.773  -7.706
   30    HB3  PRO  43          2HB       PRO  43  -4.139  -2.347  -6.076
   31    HG2  PRO  43          1HG       PRO  43  -4.462   0.392  -7.240
   32    HG3  PRO  43          2HG       PRO  43  -5.572  -0.520  -6.200
   33    HD2  PRO  43          1HD       PRO  43  -3.955   1.432  -5.248
   34    HD3  PRO  43          2HD       PRO  43  -4.413   0.015  -4.281
   35    H    ALA  44           H        ALA  44  -1.611   1.174  -6.783
   36    HA   ALA  44           HA       ALA  44   0.503   0.682  -8.554
   37    HB1  ALA  44          1HB       ALA  44  -2.198   0.933  -9.809
   38    HB2  ALA  44          2HB       ALA  44  -0.771   1.546 -10.646
   39    HB3  ALA  44          3HB       ALA  44  -0.872  -0.160 -10.208
   40    H    PHE  45           H        PHE  45   0.157   2.407  -6.458
   41    HA   PHE  45           HA       PHE  45   0.333   4.582  -5.801
   42    HB2  PHE  45          1HB       PHE  45   1.722   4.386  -8.405
   43    HB3  PHE  45          2HB       PHE  45   1.346   6.018  -7.862
   44    HD1  PHE  45           HD1      PHE  45   2.229   3.085  -5.776
   45    HD2  PHE  45           HD2      PHE  45   3.453   6.860  -7.316
   46    HE1  PHE  45           HE1      PHE  45   4.199   3.043  -4.303
   47    HE2  PHE  45           HE2      PHE  45   5.426   6.823  -5.847
   48    HZ   PHE  45           HZ       PHE  45   5.802   4.913  -4.338
   49    H    SER  46           H        SER  46  -2.161   3.707  -7.169
   50    HA   SER  46           HA       SER  46  -4.137   4.589  -7.876
   51    HB2  SER  46          1HB       SER  46  -3.919   5.963  -5.866
   52    HB3  SER  46          2HB       SER  46  -2.937   7.132  -6.750
   53    HG   SER  46           HG       SER  46  -4.749   7.551  -8.068
   54    H    GLN  47           H        GLN  47  -2.313   4.263  -9.884
   55    HA   GLN  47           HA       GLN  47  -1.875   6.589 -11.442
   56    HB2  GLN  47          1HB       GLN  47  -1.451   3.714 -11.713
   57    HB3  GLN  47          2HB       GLN  47  -1.892   4.481 -13.233
   58    HG2  GLN  47          1HG       GLN  47   0.088   6.036 -11.836
   59    HG3  GLN  47          2HG       GLN  47   0.628   4.373 -12.061
   60   HE21  GLN  47          1HE2      GLN  47  -0.404   6.350 -15.489
   61   HE22  GLN  47          2HE2      GLN  47  -1.426   6.404 -14.097
   62    H    VAL  48           H        VAL  48  -3.944   7.617 -11.429
   63    HA   VAL  48           HA       VAL  48  -5.591   6.792 -13.665
   64    HB   VAL  48           HB       VAL  48  -6.668   5.566 -11.869
   65   HG11  VAL  48          1HG1      VAL  48  -5.794   7.112 -10.063
   66   HG12  VAL  48          2HG1      VAL  48  -7.149   8.174 -10.450
   67   HG13  VAL  48          3HG1      VAL  48  -7.449   6.538  -9.865
   68   HG21  VAL  48          1HG2      VAL  48  -7.909   7.285 -13.600
   69   HG22  VAL  48          2HG2      VAL  48  -8.720   6.065 -12.617
   70   HG23  VAL  48          3HG2      VAL  48  -8.621   7.732 -12.049
   71    H    ASP  49           H        ASP  49  -5.099   9.052 -10.989
   72    HA   ASP  49           HA       ASP  49  -5.271  11.301 -12.751
   73    HB2  ASP  49          1HB       ASP  49  -7.684  10.421 -11.547
   74    HB3  ASP  49          2HB       ASP  49  -7.205  11.904 -10.726
   75    HA   PRO  50           HA       PRO  50  -2.662  13.015  -9.663
   76    HB2  PRO  50          1HB       PRO  50  -3.051  15.666 -10.099
   77    HB3  PRO  50          2HB       PRO  50  -2.128  14.636 -11.200
   78    HG2  PRO  50          1HG       PRO  50  -4.967  15.562 -11.406
   79    HG3  PRO  50          2HG       PRO  50  -3.726  15.470 -12.669
   80    HD2  PRO  50          1HD       PRO  50  -5.664  13.600 -12.391
   81    HD3  PRO  50          2HD       PRO  50  -4.038  13.208 -12.986
   82    H    GLU  51           H        GLU  51  -5.886  14.512  -9.873
   83    HA   GLU  51           HA       GLU  51  -5.962  15.745  -7.396
   84    HB2  GLU  51          1HB       GLU  51  -8.079  14.575  -9.166
   85    HB3  GLU  51          2HB       GLU  51  -8.513  15.195  -7.579
   86    HG2  GLU  51          1HG       GLU  51  -7.130  17.288  -8.444
   87    HG3  GLU  51          2HG       GLU  51  -7.625  16.638 -10.006
   88    H    VAL  52           H        VAL  52  -6.253  12.377  -8.204
   89    HA   VAL  52           HA       VAL  52  -7.468  11.466  -5.823
   90    HB   VAL  52           HB       VAL  52  -5.524   9.879  -7.492
   91   HG11  VAL  52          1HG1      VAL  52  -7.802   9.178  -5.661
   92   HG12  VAL  52          2HG1      VAL  52  -7.134   8.032  -6.825
   93   HG13  VAL  52          3HG1      VAL  52  -6.112   8.688  -5.546
   94   HG21  VAL  52          1HG2      VAL  52  -7.005  10.772  -9.092
   95   HG22  VAL  52          2HG2      VAL  52  -7.616   9.156  -8.739
   96   HG23  VAL  52          3HG2      VAL  52  -8.400  10.568  -8.032
   97    H    PHE  53           H        PHE  53  -4.058  11.699  -6.798
   98    HA   PHE  53           HA       PHE  53  -2.956  10.628  -4.452
   99    HB2  PHE  53          1HB       PHE  53  -1.913  11.366  -6.812
  100    HB3  PHE  53          2HB       PHE  53  -1.453  12.771  -5.856
  101    HD1  PHE  53           HD1      PHE  53  -0.169  12.357  -3.691
  102    HD2  PHE  53           HD2      PHE  53  -0.665   9.409  -6.721
  103    HE1  PHE  53           HE1      PHE  53   1.757  11.116  -2.794
  104    HE2  PHE  53           HE2      PHE  53   1.259   8.163  -5.828
  105    HZ   PHE  53           HZ       PHE  53   2.472   9.015  -3.862
  106    H    ALA  54           H        ALA  54  -4.022  13.867  -5.266
  107    HA   ALA  54           HA       ALA  54  -2.938  15.024  -2.847
  108    HB1  ALA  54          1HB       ALA  54  -4.816  16.776  -4.024
  109    HB2  ALA  54          2HB       ALA  54  -3.055  16.872  -4.066
  110    HB3  ALA  54          3HB       ALA  54  -3.921  16.006  -5.335
  111    H    ALA  55           H        ALA  55  -5.770  13.375  -3.754
  112    HA   ALA  55           HA       ALA  55  -7.626  14.616  -1.998
  113    HB1  ALA  55          1HB       ALA  55  -9.108  12.889  -2.556
  114    HB2  ALA  55          2HB       ALA  55  -8.122  13.114  -4.001
  115    HB3  ALA  55          3HB       ALA  55  -7.799  11.763  -2.915
  116    H    LEU  56           H        LEU  56  -5.243  12.089  -1.625
  117    HA   LEU  56           HA       LEU  56  -6.241  11.311   0.985
  118    HB2  LEU  56          1HB       LEU  56  -3.574  10.419   0.084
  119    HB3  LEU  56          2HB       LEU  56  -4.878   9.508   0.843
  120    HG   LEU  56           HG       LEU  56  -4.727  10.298  -2.066
  121   HD11  LEU  56          1HD1      LEU  56  -4.542   7.561  -0.826
  122   HD12  LEU  56          2HD1      LEU  56  -3.142   8.519  -1.310
  123   HD13  LEU  56          3HD1      LEU  56  -4.315   7.996  -2.520
  124   HD21  LEU  56          1HD2      LEU  56  -6.936  10.027  -2.048
  125   HD22  LEU  56          2HD2      LEU  56  -6.923   9.430  -0.388
  126   HD23  LEU  56          3HD2      LEU  56  -6.636   8.319  -1.728
  127    HA   PRO  57           HA       PRO  57  -3.725  13.906   3.472
  128    HB2  PRO  57          1HB       PRO  57  -2.977  12.242   5.483
  129    HB3  PRO  57          2HB       PRO  57  -4.625  12.859   5.309
  130    HG2  PRO  57          1HG       PRO  57  -3.502  10.202   4.507
  131    HG3  PRO  57          2HG       PRO  57  -5.045  10.572   5.300
  132    HD2  PRO  57          1HD       PRO  57  -4.856  10.054   2.648
  133    HD3  PRO  57          2HD       PRO  57  -6.063  11.170   3.320
  134    H    ALA  58           H        ALA  58  -1.667  14.615   3.515
  135    HA   ALA  58           HA       ALA  58   0.348  13.517   1.995
  136    HB1  ALA  58          1HB       ALA  58   0.987  15.612   2.453
  137    HB2  ALA  58          2HB       ALA  58   0.159  15.625   4.011
  138    HB3  ALA  58          3HB       ALA  58   1.764  14.908   3.872
  139    H    GLU  59           H        GLU  59  -0.367  12.979   5.404
  140    HA   GLU  59           HA       GLU  59   1.946  11.649   6.176
  141    HB2  GLU  59          1HB       GLU  59   0.197  12.327   7.752
  142    HB3  GLU  59          2HB       GLU  59  -0.894  11.128   7.071
  143    HG2  GLU  59          1HG       GLU  59  -0.111  10.113   8.995
  144    HG3  GLU  59          2HG       GLU  59   0.899   9.416   7.729
  145    H    LEU  60           H        LEU  60  -0.839  10.487   4.386
  146    HA   LEU  60           HA       LEU  60   0.109   7.744   4.425
  147    HB2  LEU  60          1HB       LEU  60  -2.196   7.805   4.508
  148    HB3  LEU  60          2HB       LEU  60  -2.304   9.149   3.373
  149    HG   LEU  60           HG       LEU  60  -1.249   6.652   2.234
  150   HD11  LEU  60          1HD1      LEU  60  -4.064   6.832   3.286
  151   HD12  LEU  60          2HD1      LEU  60  -2.848   5.611   3.658
  152   HD13  LEU  60          3HD1      LEU  60  -3.551   5.691   2.043
  153   HD21  LEU  60          1HD2      LEU  60  -2.483   9.048   1.386
  154   HD22  LEU  60          2HD2      LEU  60  -3.555   7.720   0.942
  155   HD23  LEU  60          3HD2      LEU  60  -1.878   7.720   0.395
  156    H    GLN  61           H        GLN  61  -0.239  10.397   2.110
  157    HA   GLN  61           HA       GLN  61   0.593   9.005  -0.180
  158    HB2  GLN  61          1HB       GLN  61   0.358  10.990  -1.221
  159    HB3  GLN  61          2HB       GLN  61  -0.319  11.523   0.312
  160    HG2  GLN  61          1HG       GLN  61   1.693  12.552   0.963
  161    HG3  GLN  61          2HG       GLN  61   2.607  11.744  -0.310
  162   HE21  GLN  61          1HE2      GLN  61  -0.008  14.550  -1.698
  163   HE22  GLN  61          2HE2      GLN  61  -0.527  13.304  -0.621
  164    H    ARG  62           H        ARG  62   2.385  10.507   2.418
  165    HA   ARG  62           HA       ARG  62   4.919  10.431   1.090
  166    HB2  ARG  62          1HB       ARG  62   5.798  11.361   3.010
  167    HB3  ARG  62          2HB       ARG  62   4.121  11.879   3.122
  168    HG2  ARG  62          1HG       ARG  62   3.748   9.807   4.554
  169    HG3  ARG  62          2HG       ARG  62   5.507   9.701   4.645
  170    HD2  ARG  62          1HD       ARG  62   5.557  12.012   5.529
  171    HD3  ARG  62          2HD       ARG  62   3.794  12.023   5.522
  172    HE   ARG  62           HE       ARG  62   3.805  10.726   7.415
  173   HH11  ARG  62          1HH1      ARG  62   6.992  10.762   6.014
  174   HH12  ARG  62          2HH1      ARG  62   7.737   9.978   7.367
  175   HH21  ARG  62          1HH2      ARG  62   4.775   9.693   9.202
  176   HH22  ARG  62          2HH2      ARG  62   6.475   9.369   9.180
  177    H    GLU  63           H        GLU  63   3.000   8.155   2.795
  178    HA   GLU  63           HA       GLU  63   5.203   6.421   3.500
  179    HB2  GLU  63          1HB       GLU  63   3.322   6.420   4.984
  180    HB3  GLU  63          2HB       GLU  63   2.207   6.098   3.663
  181    HG2  GLU  63          1HG       GLU  63   2.679   3.885   3.612
  182    HG3  GLU  63          2HG       GLU  63   4.351   4.115   4.119
  183    H    LEU  64           H        LEU  64   3.020   6.851   0.855
  184    HA   LEU  64           HA       LEU  64   3.508   4.221  -0.258
  185    HB2  LEU  64          1HB       LEU  64   1.883   4.697  -1.805
  186    HB3  LEU  64          2HB       LEU  64   1.363   5.680  -0.437
  187    HG   LEU  64           HG       LEU  64   2.762   7.538  -1.697
  188   HD11  LEU  64          1HD1      LEU  64   3.612   6.678  -3.597
  189   HD12  LEU  64          2HD1      LEU  64   1.997   7.009  -4.223
  190   HD13  LEU  64          3HD1      LEU  64   2.415   5.385  -3.677
  191   HD21  LEU  64          1HD2      LEU  64   0.757   8.463  -2.082
  192   HD22  LEU  64          2HD2      LEU  64   0.119   7.017  -1.299
  193   HD23  LEU  64          3HD2      LEU  64   0.205   7.102  -3.060
  194    H    LYS  65           H        LYS  65   4.545   7.539  -0.774
  195    HA   LYS  65           HA       LYS  65   6.073   6.873  -3.135
  196    HB2  LYS  65          1HB       LYS  65   6.797   9.225  -3.053
  197    HB3  LYS  65          2HB       LYS  65   5.047   9.074  -2.970
  198    HG2  LYS  65          1HG       LYS  65   5.418   9.189  -0.403
  199    HG3  LYS  65          2HG       LYS  65   6.979   9.886  -0.845
  200    HD2  LYS  65          1HD       LYS  65   5.393  11.349  -2.427
  201    HD3  LYS  65          2HD       LYS  65   4.247  10.994  -1.132
  202    HE2  LYS  65          1HE       LYS  65   6.269  11.713   0.394
  203    HE3  LYS  65          2HE       LYS  65   6.777  12.567  -1.063
  204    HZ1  LYS  65          1HZ       LYS  65   4.169  13.222  -0.879
  205    HZ2  LYS  65          2HZ       LYS  65   5.446  14.176  -0.313
  206    HZ3  LYS  65          3HZ       LYS  65   4.618  13.154   0.751
  207    H    ALA  66           H        ALA  66   6.583   7.042   0.275
  208    HA   ALA  66           HA       ALA  66   9.458   7.228   0.104
  209    HB1  ALA  66          1HB       ALA  66   8.368   8.212   2.011
  210    HB2  ALA  66          2HB       ALA  66   7.630   6.666   2.434
  211    HB3  ALA  66          3HB       ALA  66   9.378   6.871   2.553
  212    H    ALA  67           H        ALA  67   7.081   4.710   0.892
  213    HA   ALA  67           HA       ALA  67   8.802   2.640   1.539
  214    HB1  ALA  67          1HB       ALA  67   6.125   2.563   0.161
  215    HB2  ALA  67          2HB       ALA  67   6.968   1.130   0.752
  216    HB3  ALA  67          3HB       ALA  67   6.457   2.383   1.884
  217    H    TYR  68           H        TYR  68   7.850   3.851  -1.621
  218    HA   TYR  68           HA       TYR  68   8.937   1.720  -3.140
  219    HB2  TYR  68          1HB       TYR  68   7.813   4.382  -3.670
  220    HB3  TYR  68          2HB       TYR  68   9.038   3.877  -4.829
  221    HD1  TYR  68           HD1      TYR  68   6.713   1.600  -3.074
  222    HD2  TYR  68           HD2      TYR  68   7.636   3.583  -6.723
  223    HE1  TYR  68           HE1      TYR  68   5.037   0.226  -4.237
  224    HE2  TYR  68           HE2      TYR  68   5.963   2.215  -7.896
  225    HH   TYR  68           HH       TYR  68   4.871  -0.445  -7.092
  226    H    ASP  69           H        ASP  69  10.313   4.504  -1.620
  227    HA   ASP  69           HA       ASP  69  12.795   4.307  -3.130
  228    HB2  ASP  69          1HB       ASP  69  11.680   6.503  -2.350
  229    HB3  ASP  69          2HB       ASP  69  12.336   6.107  -0.764
  230    H    GLN  70           H        GLN  70  11.585   3.756   0.142
  231    HA   GLN  70           HA       GLN  70  13.954   3.221   1.463
  232    HB2  GLN  70          1HB       GLN  70  11.235   1.956   1.820
  233    HB3  GLN  70          2HB       GLN  70  12.570   1.741   2.944
  234    HG2  GLN  70          1HG       GLN  70  11.036   4.240   2.324
  235    HG3  GLN  70          2HG       GLN  70  11.225   3.417   3.872
  236   HE21  GLN  70          1HE2      GLN  70  13.808   6.255   2.720
  237   HE22  GLN  70          2HE2      GLN  70  12.395   5.830   1.822
  238    H    ARG  71           H        ARG  71  11.873   0.922  -0.286
  239    HA   ARG  71           HA       ARG  71  13.442  -1.355   0.133
  240    HB2  ARG  71          1HB       ARG  71  12.297  -2.230  -1.934
  241    HB3  ARG  71          2HB       ARG  71  11.220  -1.633  -0.678
  242    HG2  ARG  71          1HG       ARG  71  10.320  -0.807  -2.661
  243    HG3  ARG  71          2HG       ARG  71  11.201   0.562  -1.980
  244    HD2  ARG  71          1HD       ARG  71  12.654   0.623  -3.686
  245    HD3  ARG  71          2HD       ARG  71  12.818  -1.132  -3.728
  246    HE   ARG  71           HE       ARG  71  10.313  -0.218  -4.773
  247   HH11  ARG  71          1HH1      ARG  71  13.668  -0.772  -5.520
  248   HH12  ARG  71          2HH1      ARG  71  13.392  -0.967  -7.219
  249   HH21  ARG  71          1HH2      ARG  71   9.937  -0.473  -7.008
  250   HH22  ARG  71          2HH2      ARG  71  11.270  -0.796  -8.065
  251    H    GLN  72           H        GLN  72  13.963   1.372  -1.871
  252    HA   GLN  72           HA       GLN  72  15.728   0.046  -3.727
  253    HB2  GLN  72          1HB       GLN  72  14.275   2.256  -3.988
  254    HB3  GLN  72          2HB       GLN  72  15.749   3.006  -3.391
  255    HG2  GLN  72          1HG       GLN  72  16.591   1.241  -5.372
  256    HG3  GLN  72          2HG       GLN  72  15.132   1.994  -6.013
  257   HE21  GLN  72          1HE2      GLN  72  16.610   5.060  -6.633
  258   HE22  GLN  72          2HE2      GLN  72  15.203   4.059  -6.691
  Start of MODEL   16
    1    H    ILE  40           H        ILE  40   2.823  -0.147  -4.430
    2    HA   ILE  40           HA       ILE  40   3.546  -1.995  -2.265
    3    HB   ILE  40           HB       ILE  40   4.015  -0.078  -0.900
    4   HG12  ILE  40          1HG1      ILE  40   3.813   2.129  -2.627
    5   HG13  ILE  40          2HG1      ILE  40   2.295   1.256  -2.802
    6   HG21  ILE  40          1HG2      ILE  40   5.171  -0.025  -3.662
    7   HG22  ILE  40          2HG2      ILE  40   5.703   1.119  -2.431
    8   HG23  ILE  40          3HG2      ILE  40   5.893  -0.614  -2.165
    9   HD11  ILE  40          1HD1      ILE  40   1.993   1.339  -0.368
   10   HD12  ILE  40          2HD1      ILE  40   3.485   2.270  -0.232
   11   HD13  ILE  40          3HD1      ILE  40   2.101   2.943  -1.093
   12    H    ALA  41           H        ALA  41   0.916  -0.289  -3.631
   13    HA   ALA  41           HA       ALA  41  -0.949  -1.466  -1.839
   14    HB1  ALA  41          1HB       ALA  41  -1.862   0.862  -1.120
   15    HB2  ALA  41          2HB       ALA  41  -0.520   0.136  -0.235
   16    HB3  ALA  41          3HB       ALA  41  -0.210   1.399  -1.426
   17    H    LEU  42           H        LEU  42  -0.324   1.086  -4.201
   18    HA   LEU  42           HA       LEU  42  -2.695   0.234  -5.679
   19    HB2  LEU  42          1HB       LEU  42  -3.496   2.476  -5.997
   20    HB3  LEU  42          2HB       LEU  42  -3.389   2.129  -4.272
   21    HG   LEU  42           HG       LEU  42  -1.134   3.560  -5.601
   22   HD11  LEU  42          1HD1      LEU  42  -3.868   4.635  -5.121
   23   HD12  LEU  42          2HD1      LEU  42  -2.726   4.989  -6.416
   24   HD13  LEU  42          3HD1      LEU  42  -2.475   5.671  -4.810
   25   HD21  LEU  42          1HD2      LEU  42  -2.286   3.268  -2.870
   26   HD22  LEU  42          2HD2      LEU  42  -1.399   4.739  -3.268
   27   HD23  LEU  42          3HD2      LEU  42  -0.609   3.168  -3.405
   28    HA   PRO  43           HA       PRO  43  -0.068   0.653  -9.174
   29    HB2  PRO  43          1HB       PRO  43  -1.899   1.153 -11.115
   30    HB3  PRO  43          2HB       PRO  43  -1.700  -0.436 -10.369
   31    HG2  PRO  43          1HG       PRO  43  -3.727   1.689  -9.788
   32    HG3  PRO  43          2HG       PRO  43  -3.954  -0.063  -9.935
   33    HD2  PRO  43          1HD       PRO  43  -3.788   1.188  -7.540
   34    HD3  PRO  43          2HD       PRO  43  -3.200  -0.467  -7.795
   35    H    ALA  44           H        ALA  44   0.351   2.864  -7.812
   36    HA   ALA  44           HA       ALA  44  -0.457   5.198  -9.350
   37    HB1  ALA  44          1HB       ALA  44   0.566   6.503  -7.610
   38    HB2  ALA  44          2HB       ALA  44  -0.430   5.249  -6.871
   39    HB3  ALA  44          3HB       ALA  44   1.323   5.067  -6.922
   40    H    PHE  45           H        PHE  45   1.728   6.836  -9.123
   41    HA   PHE  45           HA       PHE  45   3.594   7.454 -10.269
   42    HB2  PHE  45          1HB       PHE  45   4.538   4.608  -9.952
   43    HB3  PHE  45          2HB       PHE  45   5.511   6.072 -10.041
   44    HD1  PHE  45           HD1      PHE  45   5.931   7.397  -8.113
   45    HD2  PHE  45           HD2      PHE  45   3.258   4.090  -7.914
   46    HE1  PHE  45           HE1      PHE  45   5.946   7.536  -5.656
   47    HE2  PHE  45           HE2      PHE  45   3.269   4.225  -5.458
   48    HZ   PHE  45           HZ       PHE  45   4.613   5.949  -4.326
   49    H    SER  46           H        SER  46   1.302   6.180 -11.708
   50    HA   SER  46           HA       SER  46   2.753   5.361 -14.139
   51    HB2  SER  46          1HB       SER  46   0.485   4.157 -12.765
   52    HB3  SER  46          2HB       SER  46   0.127   4.496 -14.458
   53    HG   SER  46           HG       SER  46   1.078   2.547 -14.517
   54    H    GLN  47           H        GLN  47  -0.621   6.308 -13.588
   55    HA   GLN  47           HA       GLN  47  -0.497   8.911 -14.554
   56    HB2  GLN  47          1HB       GLN  47  -1.522   8.461 -16.860
   57    HB3  GLN  47          2HB       GLN  47   0.210   8.213 -16.679
   58    HG2  GLN  47          1HG       GLN  47  -1.443   5.842 -16.171
   59    HG3  GLN  47          2HG       GLN  47  -1.486   6.450 -17.825
   60   HE21  GLN  47          1HE2      GLN  47   2.128   6.020 -18.170
   61   HE22  GLN  47          2HE2      GLN  47   0.971   7.293 -18.330
   62    H    VAL  48           H        VAL  48  -1.903   7.322 -12.634
   63    HA   VAL  48           HA       VAL  48  -4.562   6.787 -13.386
   64    HB   VAL  48           HB       VAL  48  -3.498   7.538 -10.659
   65   HG11  VAL  48          1HG1      VAL  48  -5.826   7.798 -10.545
   66   HG12  VAL  48          2HG1      VAL  48  -6.121   6.394 -11.573
   67   HG13  VAL  48          3HG1      VAL  48  -5.527   6.174  -9.926
   68   HG21  VAL  48          1HG2      VAL  48  -4.096   4.783 -10.877
   69   HG22  VAL  48          2HG2      VAL  48  -3.103   5.217 -12.268
   70   HG23  VAL  48          3HG2      VAL  48  -2.523   5.542 -10.634
   71    H    ASP  49           H        ASP  49  -3.558   9.416 -11.205
   72    HA   ASP  49           HA       ASP  49  -4.641  11.537 -12.657
   73    HB2  ASP  49          1HB       ASP  49  -6.685   9.955 -11.732
   74    HB3  ASP  49          2HB       ASP  49  -6.553  11.167 -10.461
   75    HA   PRO  50           HA       PRO  50  -2.380  13.599  -9.492
   76    HB2  PRO  50          1HB       PRO  50  -3.212  16.139  -9.972
   77    HB3  PRO  50          2HB       PRO  50  -2.075  15.286 -11.023
   78    HG2  PRO  50          1HG       PRO  50  -5.022  15.694 -11.356
   79    HG3  PRO  50          2HG       PRO  50  -3.732  15.819 -12.566
   80    HD2  PRO  50          1HD       PRO  50  -5.318  13.636 -12.349
   81    HD3  PRO  50          2HD       PRO  50  -3.624  13.537 -12.871
   82    H    GLU  51           H        GLU  51  -5.837  13.711  -9.699
   83    HA   GLU  51           HA       GLU  51  -6.225  15.156  -7.242
   84    HB2  GLU  51          1HB       GLU  51  -7.842  14.343  -9.424
   85    HB3  GLU  51          2HB       GLU  51  -8.532  13.625  -7.976
   86    HG2  GLU  51          1HG       GLU  51  -8.051  16.533  -8.542
   87    HG3  GLU  51          2HG       GLU  51  -9.592  15.713  -8.292
   88    H    VAL  52           H        VAL  52  -5.585  11.915  -8.110
   89    HA   VAL  52           HA       VAL  52  -6.840  10.624  -5.901
   90    HB   VAL  52           HB       VAL  52  -4.456   9.547  -7.391
   91   HG11  VAL  52          1HG1      VAL  52  -5.984   7.436  -7.034
   92   HG12  VAL  52          2HG1      VAL  52  -4.940   8.030  -5.740
   93   HG13  VAL  52          3HG1      VAL  52  -6.661   8.419  -5.736
   94   HG21  VAL  52          1HG2      VAL  52  -6.628   8.500  -8.681
   95   HG22  VAL  52          2HG2      VAL  52  -7.126  10.171  -8.412
   96   HG23  VAL  52          3HG2      VAL  52  -5.630   9.825  -9.281
   97    H    PHE  53           H        PHE  53  -3.442  11.457  -6.587
   98    HA   PHE  53           HA       PHE  53  -2.415  10.619  -4.114
   99    HB2  PHE  53          1HB       PHE  53  -1.350  11.619  -6.451
  100    HB3  PHE  53          2HB       PHE  53  -1.020  12.906  -5.296
  101    HD1  PHE  53           HD1      PHE  53  -0.328   9.441  -6.221
  102    HD2  PHE  53           HD2      PHE  53   0.481  12.556  -3.436
  103    HE1  PHE  53           HE1      PHE  53   1.606   8.178  -5.375
  104    HE2  PHE  53           HE2      PHE  53   2.417  11.298  -2.585
  105    HZ   PHE  53           HZ       PHE  53   2.982   9.106  -3.556
  106    H    ALA  54           H        ALA  54  -3.827  13.660  -5.156
  107    HA   ALA  54           HA       ALA  54  -3.163  15.025  -2.700
  108    HB1  ALA  54          1HB       ALA  54  -5.217  16.118  -4.538
  109    HB2  ALA  54          2HB       ALA  54  -3.888  16.929  -3.710
  110    HB3  ALA  54          3HB       ALA  54  -3.570  15.963  -5.151
  111    H    ALA  55           H        ALA  55  -5.658  12.975  -3.803
  112    HA   ALA  55           HA       ALA  55  -7.813  13.959  -2.247
  113    HB1  ALA  55          1HB       ALA  55  -8.263  11.245  -2.546
  114    HB2  ALA  55          2HB       ALA  55  -8.802  12.525  -3.634
  115    HB3  ALA  55          3HB       ALA  55  -7.289  11.676  -3.953
  116    H    LEU  56           H        LEU  56  -5.139  11.806  -1.578
  117    HA   LEU  56           HA       LEU  56  -6.242  11.089   1.027
  118    HB2  LEU  56          1HB       LEU  56  -3.518  10.227   0.360
  119    HB3  LEU  56          2HB       LEU  56  -4.875   9.305   1.002
  120    HG   LEU  56           HG       LEU  56  -4.497  10.047  -1.898
  121   HD11  LEU  56          1HD1      LEU  56  -3.856   7.787  -2.278
  122   HD12  LEU  56          2HD1      LEU  56  -4.192   7.346  -0.604
  123   HD13  LEU  56          3HD1      LEU  56  -2.838   8.412  -0.980
  124   HD21  LEU  56          1HD2      LEU  56  -6.591   9.392  -2.223
  125   HD22  LEU  56          2HD2      LEU  56  -6.797   9.277  -0.475
  126   HD23  LEU  56          3HD2      LEU  56  -6.280   7.865  -1.398
  127    HA   PRO  57           HA       PRO  57  -3.891  13.917   3.418
  128    HB2  PRO  57          1HB       PRO  57  -3.074  12.400   5.517
  129    HB3  PRO  57          2HB       PRO  57  -4.751  12.912   5.297
  130    HG2  PRO  57          1HG       PRO  57  -3.471  10.288   4.640
  131    HG3  PRO  57          2HG       PRO  57  -5.041  10.607   5.399
  132    HD2  PRO  57          1HD       PRO  57  -4.791   9.970   2.779
  133    HD3  PRO  57          2HD       PRO  57  -6.067  11.048   3.382
  134    H    ALA  58           H        ALA  58  -1.862  14.730   3.536
  135    HA   ALA  58           HA       ALA  58   0.226  13.745   2.048
  136    HB1  ALA  58          1HB       ALA  58   0.055  15.704   4.283
  137    HB2  ALA  58          2HB       ALA  58   1.648  15.194   3.721
  138    HB3  ALA  58          3HB       ALA  58   0.516  15.948   2.598
  139    H    GLU  59           H        GLU  59  -0.263  13.374   5.553
  140    HA   GLU  59           HA       GLU  59   2.038  12.022   6.220
  141    HB2  GLU  59          1HB       GLU  59   0.481  12.709   7.921
  142    HB3  GLU  59          2HB       GLU  59  -0.766  11.651   7.276
  143    HG2  GLU  59          1HG       GLU  59   0.159  10.678   9.262
  144    HG3  GLU  59          2HG       GLU  59   0.615   9.702   7.867
  145    H    LEU  60           H        LEU  60  -0.774  10.839   4.522
  146    HA   LEU  60           HA       LEU  60   0.109   8.078   4.661
  147    HB2  LEU  60          1HB       LEU  60  -2.237   8.397   4.777
  148    HB3  LEU  60          2HB       LEU  60  -2.232   9.443   3.358
  149    HG   LEU  60           HG       LEU  60  -1.353   6.624   3.011
  150   HD11  LEU  60          1HD1      LEU  60  -4.154   7.492   3.623
  151   HD12  LEU  60          2HD1      LEU  60  -3.254   6.111   4.250
  152   HD13  LEU  60          3HD1      LEU  60  -3.832   6.104   2.583
  153   HD21  LEU  60          1HD2      LEU  60  -2.584   8.802   1.406
  154   HD22  LEU  60          2HD2      LEU  60  -2.914   7.132   0.944
  155   HD23  LEU  60          3HD2      LEU  60  -1.251   7.717   1.009
  156    H    GLN  61           H        GLN  61  -0.231  10.629   2.225
  157    HA   GLN  61           HA       GLN  61   0.590   9.143  -0.000
  158    HB2  GLN  61          1HB       GLN  61   0.509  11.110  -1.140
  159    HB3  GLN  61          2HB       GLN  61  -0.343  11.631   0.307
  160    HG2  GLN  61          1HG       GLN  61   1.586  12.702   1.166
  161    HG3  GLN  61          2HG       GLN  61   2.620  11.964  -0.057
  162   HE21  GLN  61          1HE2      GLN  61  -0.005  14.701  -1.560
  163   HE22  GLN  61          2HE2      GLN  61  -0.547  13.410  -0.548
  164    H    ARG  62           H        ARG  62   2.416  10.732   2.525
  165    HA   ARG  62           HA       ARG  62   4.943  10.634   1.229
  166    HB2  ARG  62          1HB       ARG  62   5.861  11.354   3.268
  167    HB3  ARG  62          2HB       ARG  62   4.254  12.068   3.234
  168    HG2  ARG  62          1HG       ARG  62   4.130  11.264   5.322
  169    HG3  ARG  62          2HG       ARG  62   3.729   9.750   4.509
  170    HD2  ARG  62          1HD       ARG  62   5.916   8.923   4.740
  171    HD3  ARG  62          2HD       ARG  62   6.566  10.517   5.123
  172    HE   ARG  62           HE       ARG  62   4.681   9.775   7.077
  173   HH11  ARG  62          1HH1      ARG  62   7.883   8.975   5.972
  174   HH12  ARG  62          2HH1      ARG  62   8.426   8.436   7.526
  175   HH21  ARG  62          1HH2      ARG  62   5.383   9.067   9.129
  176   HH22  ARG  62          2HH2      ARG  62   7.003   8.488   9.321
  177    H    GLU  63           H        GLU  63   3.058   8.337   3.010
  178    HA   GLU  63           HA       GLU  63   5.276   6.551   3.505
  179    HB2  GLU  63          1HB       GLU  63   3.521   6.555   5.136
  180    HB3  GLU  63          2HB       GLU  63   2.297   6.282   3.904
  181    HG2  GLU  63          1HG       GLU  63   2.879   4.054   3.636
  182    HG3  GLU  63          2HG       GLU  63   4.470   4.281   4.358
  183    H    LEU  64           H        LEU  64   2.936   7.088   1.031
  184    HA   LEU  64           HA       LEU  64   3.239   4.460  -0.148
  185    HB2  LEU  64          1HB       LEU  64   1.474   4.983  -1.458
  186    HB3  LEU  64          2HB       LEU  64   1.197   6.164  -0.179
  187    HG   LEU  64           HG       LEU  64   2.607   7.731  -1.736
  188   HD11  LEU  64          1HD1      LEU  64   2.920   7.142  -3.874
  189   HD12  LEU  64          2HD1      LEU  64   1.356   6.335  -3.987
  190   HD13  LEU  64          3HD1      LEU  64   2.732   5.494  -3.275
  191   HD21  LEU  64          1HD2      LEU  64   0.030   7.456  -3.011
  192   HD22  LEU  64          2HD2      LEU  64   0.646   8.750  -1.982
  193   HD23  LEU  64          3HD2      LEU  64  -0.103   7.327  -1.257
  194    H    LYS  65           H        LYS  65   4.422   7.725  -0.653
  195    HA   LYS  65           HA       LYS  65   5.763   7.031  -3.123
  196    HB2  LYS  65          1HB       LYS  65   6.591   9.348  -3.061
  197    HB3  LYS  65          2HB       LYS  65   4.844   9.272  -2.871
  198    HG2  LYS  65          1HG       LYS  65   5.417   9.316  -0.321
  199    HG3  LYS  65          2HG       LYS  65   6.938  10.010  -0.886
  200    HD2  LYS  65          1HD       LYS  65   5.221  11.497  -2.309
  201    HD3  LYS  65          2HD       LYS  65   4.203  11.139  -0.913
  202    HE2  LYS  65          1HE       LYS  65   6.319  11.844   0.445
  203    HE3  LYS  65          2HE       LYS  65   6.775  12.654  -1.053
  204    HZ1  LYS  65          1HZ       LYS  65   5.538  14.326  -0.296
  205    HZ2  LYS  65          2HZ       LYS  65   4.777  13.375   0.877
  206    HZ3  LYS  65          3HZ       LYS  65   4.191  13.391  -0.709
  207    H    ALA  66           H        ALA  66   6.499   7.223   0.261
  208    HA   ALA  66           HA       ALA  66   9.354   7.267  -0.075
  209    HB1  ALA  66          1HB       ALA  66   8.377   8.248   1.907
  210    HB2  ALA  66          2HB       ALA  66   7.660   6.700   2.354
  211    HB3  ALA  66          3HB       ALA  66   9.413   6.894   2.361
  212    H    ALA  67           H        ALA  67   6.952   4.818   0.856
  213    HA   ALA  67           HA       ALA  67   8.603   2.677   1.372
  214    HB1  ALA  67          1HB       ALA  67   6.665   1.275   0.466
  215    HB2  ALA  67          2HB       ALA  67   6.326   2.370   1.807
  216    HB3  ALA  67          3HB       ALA  67   5.860   2.815   0.165
  217    H    TYR  68           H        TYR  68   7.427   3.814  -1.771
  218    HA   TYR  68           HA       TYR  68   8.448   1.734  -3.341
  219    HB2  TYR  68          1HB       TYR  68   7.423   4.445  -3.792
  220    HB3  TYR  68          2HB       TYR  68   8.607   3.930  -4.988
  221    HD1  TYR  68           HD1      TYR  68   5.297   3.237  -3.542
  222    HD2  TYR  68           HD2      TYR  68   8.102   2.182  -6.563
  223    HE1  TYR  68           HE1      TYR  68   3.551   1.956  -4.707
  224    HE2  TYR  68           HE2      TYR  68   6.363   0.899  -7.737
  225    HH   TYR  68           HH       TYR  68   3.146   1.213  -7.168
  226    H    ASP  69           H        ASP  69   9.964   4.595  -2.014
  227    HA   ASP  69           HA       ASP  69  12.390   4.255  -3.546
  228    HB2  ASP  69          1HB       ASP  69  11.387   6.472  -2.653
  229    HB3  ASP  69          2HB       ASP  69  12.127   6.013  -1.121
  230    H    GLN  70           H        GLN  70  11.282   3.647  -0.251
  231    HA   GLN  70           HA       GLN  70  13.653   3.020   1.000
  232    HB2  GLN  70          1HB       GLN  70  10.927   1.765   1.326
  233    HB3  GLN  70          2HB       GLN  70  12.275   1.454   2.412
  234    HG2  GLN  70          1HG       GLN  70  10.782   4.016   1.978
  235    HG3  GLN  70          2HG       GLN  70  10.978   3.093   3.467
  236   HE21  GLN  70          1HE2      GLN  70  13.615   5.934   2.433
  237   HE22  GLN  70          2HE2      GLN  70  12.191   5.584   1.520
  238    H    ARG  71           H        ARG  71  11.529   0.780  -0.780
  239    HA   ARG  71           HA       ARG  71  13.397  -1.385  -0.581
  240    HB2  ARG  71          1HB       ARG  71  11.836  -2.521  -2.170
  241    HB3  ARG  71          2HB       ARG  71  11.063  -1.922  -0.709
  242    HG2  ARG  71          1HG       ARG  71  10.822   0.178  -2.490
  243    HG3  ARG  71          2HG       ARG  71  10.559  -1.260  -3.480
  244    HD2  ARG  71          1HD       ARG  71   9.177  -0.890  -0.841
  245    HD3  ARG  71          2HD       ARG  71   8.528  -0.197  -2.327
  246    HE   ARG  71           HE       ARG  71   8.893  -2.769  -3.010
  247   HH11  ARG  71          1HH1      ARG  71   7.364  -1.272  -0.264
  248   HH12  ARG  71          2HH1      ARG  71   6.223  -2.556  -0.035
  249   HH21  ARG  71          1HH2      ARG  71   7.397  -4.465  -2.719
  250   HH22  ARG  71          2HH2      ARG  71   6.243  -4.372  -1.431
  251    H    GLN  72           H        GLN  72  13.115   1.323  -2.593
  252    HA   GLN  72           HA       GLN  72  14.047   0.321  -5.045
  253    HB2  GLN  72          1HB       GLN  72  13.066   2.635  -4.504
  254    HB3  GLN  72          2HB       GLN  72  14.696   3.070  -4.009
  255    HG2  GLN  72          1HG       GLN  72  15.350   3.361  -6.106
  256    HG3  GLN  72          2HG       GLN  72  14.684   1.806  -6.604
  257   HE21  GLN  72          1HE2      GLN  72  12.850   5.218  -7.579
  258   HE22  GLN  72          2HE2      GLN  72  14.401   5.139  -6.822
  Start of MODEL   17
    1    H    ILE  40           H        ILE  40   5.948  -2.928  -3.970
    2    HA   ILE  40           HA       ILE  40   5.168  -0.960  -5.866
    3    HB   ILE  40           HB       ILE  40   6.746   0.491  -4.841
    4   HG12  ILE  40          1HG1      ILE  40   8.101  -1.141  -2.954
    5   HG13  ILE  40          2HG1      ILE  40   8.270  -1.915  -4.525
    6   HG21  ILE  40          1HG2      ILE  40   4.738  -0.368  -3.501
    7   HG22  ILE  40          2HG2      ILE  40   5.921  -1.284  -2.569
    8   HG23  ILE  40          3HG2      ILE  40   6.013   0.476  -2.622
    9   HD11  ILE  40          1HD1      ILE  40   8.865   0.577  -5.235
   10   HD12  ILE  40          2HD1      ILE  40   9.358   0.646  -3.543
   11   HD13  ILE  40          3HD1      ILE  40  10.068  -0.556  -4.620
   12    H    ALA  41           H        ALA  41   7.462   0.315  -6.633
   13    HA   ALA  41           HA       ALA  41   9.076   0.374  -8.238
   14    HB1  ALA  41          1HB       ALA  41   9.811  -2.386  -8.432
   15    HB2  ALA  41          2HB       ALA  41  10.728  -1.031  -7.773
   16    HB3  ALA  41          3HB       ALA  41   9.626  -1.936  -6.737
   17    H    LEU  42           H        LEU  42   6.189  -0.762  -8.659
   18    HA   LEU  42           HA       LEU  42   6.451  -2.287 -11.084
   19    HB2  LEU  42          1HB       LEU  42   3.909  -0.947 -10.300
   20    HB3  LEU  42          2HB       LEU  42   4.166  -2.530 -11.032
   21    HG   LEU  42           HG       LEU  42   5.308  -2.788  -8.530
   22   HD11  LEU  42          1HD1      LEU  42   4.411  -0.715  -7.735
   23   HD12  LEU  42          2HD1      LEU  42   3.500  -2.034  -7.002
   24   HD13  LEU  42          3HD1      LEU  42   2.805  -1.122  -8.341
   25   HD21  LEU  42          1HD2      LEU  42   2.445  -3.471  -9.116
   26   HD22  LEU  42          2HD2      LEU  42   3.623  -4.367  -8.157
   27   HD23  LEU  42          3HD2      LEU  42   3.780  -4.305  -9.913
   28    HA   PRO  43           HA       PRO  43   6.548   0.940 -14.057
   29    HB2  PRO  43          1HB       PRO  43   5.057  -0.120 -16.063
   30    HB3  PRO  43          2HB       PRO  43   6.680  -0.696 -15.665
   31    HG2  PRO  43          1HG       PRO  43   4.023  -1.844 -14.902
   32    HG3  PRO  43          2HG       PRO  43   5.485  -2.680 -15.459
   33    HD2  PRO  43          1HD       PRO  43   4.784  -2.556 -12.846
   34    HD3  PRO  43          2HD       PRO  43   6.477  -2.596 -13.380
   35    H    ALA  44           H        ALA  44   4.935   1.872 -12.202
   36    HA   ALA  44           HA       ALA  44   2.643   2.915 -13.711
   37    HB1  ALA  44          1HB       ALA  44   2.287   2.404 -10.800
   38    HB2  ALA  44          2HB       ALA  44   1.088   2.460 -12.093
   39    HB3  ALA  44          3HB       ALA  44   2.138   1.053 -11.924
   40    H    PHE  45           H        PHE  45   1.665   4.455 -11.498
   41    HA   PHE  45           HA       PHE  45   1.921   6.501 -10.541
   42    HB2  PHE  45          1HB       PHE  45   4.643   5.308 -10.245
   43    HB3  PHE  45          2HB       PHE  45   4.434   7.019  -9.885
   44    HD1  PHE  45           HD1      PHE  45   1.986   4.306  -9.297
   45    HD2  PHE  45           HD2      PHE  45   4.747   7.044  -7.566
   46    HE1  PHE  45           HE1      PHE  45   1.149   3.728  -7.057
   47    HE2  PHE  45           HE2      PHE  45   3.915   6.470  -5.323
   48    HZ   PHE  45           HZ       PHE  45   2.115   4.809  -5.066
   49    H    SER  46           H        SER  46   2.485   5.939 -13.508
   50    HA   SER  46           HA       SER  46   4.108   8.268 -14.191
   51    HB2  SER  46          1HB       SER  46   4.077   5.857 -15.341
   52    HB3  SER  46          2HB       SER  46   2.804   6.613 -16.298
   53    HG   SER  46           HG       SER  46   5.515   7.065 -16.300
   54    H    GLN  47           H        GLN  47   0.811   7.053 -14.516
   55    HA   GLN  47           HA       GLN  47  -0.342   9.617 -14.481
   56    HB2  GLN  47          1HB       GLN  47   0.594   9.799 -16.734
   57    HB3  GLN  47          2HB       GLN  47  -0.219   8.313 -17.206
   58    HG2  GLN  47          1HG       GLN  47  -2.377   9.565 -16.521
   59    HG3  GLN  47          2HG       GLN  47  -1.379  11.011 -16.669
   60   HE21  GLN  47          1HE2      GLN  47  -1.876   8.759 -20.056
   61   HE22  GLN  47          2HE2      GLN  47  -1.615   7.997 -18.527
   62    H    VAL  48           H        VAL  48  -1.947   8.948 -13.187
   63    HA   VAL  48           HA       VAL  48  -3.860   7.024 -14.289
   64    HB   VAL  48           HB       VAL  48  -2.547   5.656 -12.813
   65   HG11  VAL  48          1HG1      VAL  48  -1.626   7.587 -11.499
   66   HG12  VAL  48          2HG1      VAL  48  -3.132   7.589 -10.579
   67   HG13  VAL  48          3HG1      VAL  48  -2.075   6.177 -10.541
   68   HG21  VAL  48          1HG2      VAL  48  -5.173   5.719 -12.749
   69   HG22  VAL  48          2HG2      VAL  48  -4.266   4.702 -11.629
   70   HG23  VAL  48          3HG2      VAL  48  -4.903   6.256 -11.092
   71    H    ASP  49           H        ASP  49  -3.153   9.367 -11.723
   72    HA   ASP  49           HA       ASP  49  -5.443  10.906 -12.155
   73    HB2  ASP  49          1HB       ASP  49  -6.199   8.575 -10.971
   74    HB3  ASP  49          2HB       ASP  49  -5.907   9.586  -9.558
   75    HA   PRO  50           HA       PRO  50  -2.217  12.929  -9.640
   76    HB2  PRO  50          1HB       PRO  50  -2.545  15.358 -10.807
   77    HB3  PRO  50          2HB       PRO  50  -1.545  14.081 -11.511
   78    HG2  PRO  50          1HG       PRO  50  -4.350  14.880 -12.185
   79    HG3  PRO  50          2HG       PRO  50  -3.013  14.466 -13.273
   80    HD2  PRO  50          1HD       PRO  50  -4.984  12.715 -12.656
   81    HD3  PRO  50          2HD       PRO  50  -3.318  12.199 -12.990
   82    H    GLU  51           H        GLU  51  -5.577  13.252  -9.934
   83    HA   GLU  51           HA       GLU  51  -5.761  15.397  -7.961
   84    HB2  GLU  51          1HB       GLU  51  -8.212  15.223  -8.369
   85    HB3  GLU  51          2HB       GLU  51  -7.281  15.589  -9.815
   86    HG2  GLU  51          1HG       GLU  51  -7.433  13.271 -10.524
   87    HG3  GLU  51          2HG       GLU  51  -8.323  12.869  -9.057
   88    H    VAL  52           H        VAL  52  -6.042  11.961  -8.236
   89    HA   VAL  52           HA       VAL  52  -7.508  11.586  -5.792
   90    HB   VAL  52           HB       VAL  52  -7.083   9.989  -7.944
   91   HG11  VAL  52          1HG1      VAL  52  -5.680   8.139  -7.357
   92   HG12  VAL  52          2HG1      VAL  52  -4.729   9.618  -7.207
   93   HG13  VAL  52          3HG1      VAL  52  -5.359   8.824  -5.764
   94   HG21  VAL  52          1HG2      VAL  52  -8.120   8.203  -6.616
   95   HG22  VAL  52          2HG2      VAL  52  -7.764   9.101  -5.141
   96   HG23  VAL  52          3HG2      VAL  52  -8.888   9.764  -6.328
   97    H    PHE  53           H        PHE  53  -4.152  11.725  -6.744
   98    HA   PHE  53           HA       PHE  53  -3.022  10.525  -4.457
   99    HB2  PHE  53          1HB       PHE  53  -1.978  11.290  -6.777
  100    HB3  PHE  53          2HB       PHE  53  -1.578  12.733  -5.851
  101    HD1  PHE  53           HD1      PHE  53  -0.534   9.498  -6.757
  102    HD2  PHE  53           HD2      PHE  53  -0.393  12.311  -3.566
  103    HE1  PHE  53           HE1      PHE  53   1.442   8.354  -5.840
  104    HE2  PHE  53           HE2      PHE  53   1.584  11.172  -2.645
  105    HZ   PHE  53           HZ       PHE  53   2.504   9.191  -3.782
  106    H    ALA  54           H        ALA  54  -3.624  13.938  -5.255
  107    HA   ALA  54           HA       ALA  54  -2.676  14.947  -2.777
  108    HB1  ALA  54          1HB       ALA  54  -4.478  16.170  -4.860
  109    HB2  ALA  54          2HB       ALA  54  -3.832  17.040  -3.467
  110    HB3  ALA  54          3HB       ALA  54  -2.736  16.392  -4.687
  111    H    ALA  55           H        ALA  55  -5.577  13.402  -3.695
  112    HA   ALA  55           HA       ALA  55  -7.374  14.604  -1.867
  113    HB1  ALA  55          1HB       ALA  55  -8.894  13.187  -2.717
  114    HB2  ALA  55          2HB       ALA  55  -7.639  12.837  -3.907
  115    HB3  ALA  55          3HB       ALA  55  -7.849  11.780  -2.511
  116    H    LEU  56           H        LEU  56  -5.191  11.837  -1.640
  117    HA   LEU  56           HA       LEU  56  -6.095  10.981   0.920
  118    HB2  LEU  56          1HB       LEU  56  -3.760  10.384  -0.829
  119    HB3  LEU  56          2HB       LEU  56  -3.693   9.900   0.864
  120    HG   LEU  56           HG       LEU  56  -6.153   9.074  -0.474
  121   HD11  LEU  56          1HD1      LEU  56  -3.561   8.562  -1.750
  122   HD12  LEU  56          2HD1      LEU  56  -5.193   8.475  -2.411
  123   HD13  LEU  56          3HD1      LEU  56  -4.551   7.129  -1.469
  124   HD21  LEU  56          1HD2      LEU  56  -5.667   8.196   1.662
  125   HD22  LEU  56          2HD2      LEU  56  -4.019   7.772   1.197
  126   HD23  LEU  56          3HD2      LEU  56  -5.383   6.879   0.524
  127    HA   PRO  57           HA       PRO  57  -3.966  13.630   3.694
  128    HB2  PRO  57          1HB       PRO  57  -3.160  11.914   5.638
  129    HB3  PRO  57          2HB       PRO  57  -4.848  12.385   5.412
  130    HG2  PRO  57          1HG       PRO  57  -3.437   9.903   4.512
  131    HG3  PRO  57          2HG       PRO  57  -5.044  10.074   5.240
  132    HD2  PRO  57          1HD       PRO  57  -4.678   9.752   2.577
  133    HD3  PRO  57          2HD       PRO  57  -6.018  10.704   3.248
  134    H    ALA  58           H        ALA  58  -1.960  14.455   4.120
  135    HA   ALA  58           HA       ALA  58   0.215  13.778   2.568
  136    HB1  ALA  58          1HB       ALA  58   1.405  15.389   3.709
  137    HB2  ALA  58          2HB       ALA  58  -0.259  15.875   4.037
  138    HB3  ALA  58          3HB       ALA  58   0.660  14.994   5.258
  139    H    GLU  59           H        GLU  59  -0.563  12.713   5.851
  140    HA   GLU  59           HA       GLU  59   1.780  11.430   6.537
  141    HB2  GLU  59          1HB       GLU  59  -0.562  11.712   7.768
  142    HB3  GLU  59          2HB       GLU  59  -0.788  10.067   7.191
  143    HG2  GLU  59          1HG       GLU  59   0.078   9.951   9.396
  144    HG3  GLU  59          2HG       GLU  59   1.360   9.458   8.291
  145    H    LEU  60           H        LEU  60  -0.943  10.152   4.657
  146    HA   LEU  60           HA       LEU  60   0.363   7.619   4.225
  147    HB2  LEU  60          1HB       LEU  60  -2.117   8.809   2.993
  148    HB3  LEU  60          2HB       LEU  60  -1.565   7.153   2.756
  149    HG   LEU  60           HG       LEU  60  -2.349   8.301   5.431
  150   HD11  LEU  60          1HD1      LEU  60  -4.025   6.376   3.881
  151   HD12  LEU  60          2HD1      LEU  60  -4.156   8.107   3.572
  152   HD13  LEU  60          3HD1      LEU  60  -4.485   7.473   5.184
  153   HD21  LEU  60          1HD2      LEU  60  -0.798   6.168   4.989
  154   HD22  LEU  60          2HD2      LEU  60  -2.380   5.404   4.835
  155   HD23  LEU  60          3HD2      LEU  60  -1.953   6.256   6.320
  156    H    GLN  61           H        GLN  61  -0.273  10.547   2.354
  157    HA   GLN  61           HA       GLN  61   0.557   9.713  -0.152
  158    HB2  GLN  61          1HB       GLN  61  -0.295  11.818  -0.293
  159    HB3  GLN  61          2HB       GLN  61   0.384  12.312   1.252
  160    HG2  GLN  61          1HG       GLN  61   2.299  13.069   0.329
  161    HG3  GLN  61          2HG       GLN  61   2.306  11.840  -0.935
  162   HE21  GLN  61          1HE2      GLN  61  -0.296  14.902  -1.637
  163   HE22  GLN  61          2HE2      GLN  61  -0.311  14.047  -0.136
  164    H    ARG  62           H        ARG  62   2.473  10.732   2.616
  165    HA   ARG  62           HA       ARG  62   4.955  10.650   1.142
  166    HB2  ARG  62          1HB       ARG  62   6.012  11.263   3.206
  167    HB3  ARG  62          2HB       ARG  62   4.546  12.221   3.043
  168    HG2  ARG  62          1HG       ARG  62   3.398  10.862   4.637
  169    HG3  ARG  62          2HG       ARG  62   4.732   9.708   4.686
  170    HD2  ARG  62          1HD       ARG  62   5.711  10.881   6.295
  171    HD3  ARG  62          2HD       ARG  62   5.760  12.300   5.250
  172    HE   ARG  62           HE       ARG  62   3.894  11.772   7.382
  173   HH11  ARG  62          1HH1      ARG  62   4.503  13.563   4.459
  174   HH12  ARG  62          2HH1      ARG  62   3.384  14.828   4.847
  175   HH21  ARG  62          1HH2      ARG  62   2.418  13.431   7.904
  176   HH22  ARG  62          2HH2      ARG  62   2.199  14.752   6.806
  177    H    GLU  63           H        GLU  63   3.063   8.508   3.112
  178    HA   GLU  63           HA       GLU  63   5.175   6.652   3.663
  179    HB2  GLU  63          1HB       GLU  63   3.316   6.717   5.175
  180    HB3  GLU  63          2HB       GLU  63   2.171   6.446   3.870
  181    HG2  GLU  63          1HG       GLU  63   2.454   4.229   3.912
  182    HG3  GLU  63          2HG       GLU  63   4.197   4.354   4.143
  183    H    LEU  64           H        LEU  64   2.923   7.158   1.076
  184    HA   LEU  64           HA       LEU  64   3.322   4.527  -0.068
  185    HB2  LEU  64          1HB       LEU  64   1.650   5.039  -1.537
  186    HB3  LEU  64          2HB       LEU  64   1.221   6.080  -0.181
  187    HG   LEU  64           HG       LEU  64   2.666   7.833  -1.551
  188   HD11  LEU  64          1HD1      LEU  64   3.155   7.296  -3.645
  189   HD12  LEU  64          2HD1      LEU  64   1.479   6.852  -3.970
  190   HD13  LEU  64          3HD1      LEU  64   2.598   5.655  -3.316
  191   HD21  LEU  64          1HD2      LEU  64   0.042   7.509  -0.987
  192   HD22  LEU  64          2HD2      LEU  64   0.005   7.458  -2.749
  193   HD23  LEU  64          3HD2      LEU  64   0.695   8.855  -1.921
  194    H    LYS  65           H        LYS  65   4.546   7.771  -0.470
  195    HA   LYS  65           HA       LYS  65   5.884   7.204  -2.958
  196    HB2  LYS  65          1HB       LYS  65   6.094   9.541  -1.052
  197    HB3  LYS  65          2HB       LYS  65   6.914   9.451  -2.605
  198    HG2  LYS  65          1HG       LYS  65   4.941   9.650  -3.804
  199    HG3  LYS  65          2HG       LYS  65   3.944   9.143  -2.438
  200    HD2  LYS  65          1HD       LYS  65   3.537  11.382  -2.357
  201    HD3  LYS  65          2HD       LYS  65   4.995  11.338  -1.363
  202    HE2  LYS  65          1HE       LYS  65   6.230  12.420  -2.904
  203    HE3  LYS  65          2HE       LYS  65   5.466  11.581  -4.253
  204    HZ1  LYS  65          1HZ       LYS  65   4.898  14.157  -3.177
  205    HZ2  LYS  65          2HZ       LYS  65   3.506  13.197  -3.228
  206    HZ3  LYS  65          3HZ       LYS  65   4.397  13.471  -4.640
  207    H    ALA  66           H        ALA  66   6.897   7.747   0.409
  208    HA   ALA  66           HA       ALA  66   9.645   7.364   0.011
  209    HB1  ALA  66          1HB       ALA  66   8.381   6.522   2.573
  210    HB2  ALA  66          2HB       ALA  66   9.854   7.452   2.291
  211    HB3  ALA  66          3HB       ALA  66   8.277   8.214   2.085
  212    H    ALA  67           H        ALA  67   7.142   5.058   1.060
  213    HA   ALA  67           HA       ALA  67   8.752   2.819   1.380
  214    HB1  ALA  67          1HB       ALA  67   5.865   3.145   0.643
  215    HB2  ALA  67          2HB       ALA  67   6.604   1.548   0.770
  216    HB3  ALA  67          3HB       ALA  67   6.569   2.618   2.171
  217    H    TYR  68           H        TYR  68   7.564   4.325  -1.526
  218    HA   TYR  68           HA       TYR  68   8.036   2.121  -3.269
  219    HB2  TYR  68          1HB       TYR  68   7.276   4.957  -3.543
  220    HB3  TYR  68          2HB       TYR  68   8.160   4.290  -4.910
  221    HD1  TYR  68           HD1      TYR  68   6.628   3.934  -6.611
  222    HD2  TYR  68           HD2      TYR  68   5.616   2.753  -2.651
  223    HE1  TYR  68           HE1      TYR  68   4.557   2.908  -7.453
  224    HE2  TYR  68           HE2      TYR  68   3.543   1.723  -3.482
  225    HH   TYR  68           HH       TYR  68   2.611   1.960  -6.890
  226    H    ASP  69           H        ASP  69  10.019   4.603  -1.907
  227    HA   ASP  69           HA       ASP  69  12.189   4.091  -3.794
  228    HB2  ASP  69          1HB       ASP  69  11.642   6.176  -1.724
  229    HB3  ASP  69          2HB       ASP  69  13.312   5.859  -2.185
  230    H    GLN  70           H        GLN  70  11.400   3.719  -0.374
  231    HA   GLN  70           HA       GLN  70  13.851   2.875   0.601
  232    HB2  GLN  70          1HB       GLN  70  11.067   2.016   1.397
  233    HB3  GLN  70          2HB       GLN  70  12.514   1.623   2.316
  234    HG2  GLN  70          1HG       GLN  70  11.267   4.309   1.856
  235    HG3  GLN  70          2HG       GLN  70  11.577   3.483   3.382
  236   HE21  GLN  70          1HE2      GLN  70  14.327   5.901   1.748
  237   HE22  GLN  70          2HE2      GLN  70  12.753   5.663   1.078
  238    H    ARG  71           H        ARG  71  11.225   0.879  -0.740
  239    HA   ARG  71           HA       ARG  71  12.759  -1.533  -0.594
  240    HB2  ARG  71          1HB       ARG  71  10.238  -0.966  -2.164
  241    HB3  ARG  71          2HB       ARG  71  10.896  -2.554  -1.794
  242    HG2  ARG  71          1HG       ARG  71  10.231  -2.475   0.396
  243    HG3  ARG  71          2HG       ARG  71  10.255  -0.711   0.452
  244    HD2  ARG  71          1HD       ARG  71   8.209  -0.538  -0.683
  245    HD3  ARG  71          2HD       ARG  71   8.280  -2.210  -1.239
  246    HE   ARG  71           HE       ARG  71   7.278  -2.837   0.709
  247   HH11  ARG  71          1HH1      ARG  71   8.715   0.302   1.161
  248   HH12  ARG  71          2HH1      ARG  71   8.067   0.513   2.754
  249   HH21  ARG  71          1HH2      ARG  71   6.420  -2.571   2.806
  250   HH22  ARG  71          2HH2      ARG  71   6.763  -1.122   3.689
  251    H    GLN  72           H        GLN  72  12.629   1.072  -2.769
  252    HA   GLN  72           HA       GLN  72  14.674   0.092  -4.408
  253    HB2  GLN  72          1HB       GLN  72  11.997  -0.726  -5.176
  254    HB3  GLN  72          2HB       GLN  72  12.771   0.221  -6.440
  255    HG2  GLN  72          1HG       GLN  72  14.516  -1.806  -5.287
  256    HG3  GLN  72          2HG       GLN  72  13.065  -2.469  -6.038
  257   HE21  GLN  72          1HE2      GLN  72  16.105  -1.099  -8.268
  258   HE22  GLN  72          2HE2      GLN  72  16.147  -1.159  -6.542
  Start of MODEL   18
    1    H    ILE  40           H        ILE  40   2.239  -1.698  -1.878
    2    HA   ILE  40           HA       ILE  40   3.180  -0.336  -4.061
    3    HB   ILE  40           HB       ILE  40   5.234   0.067  -2.855
    4   HG12  ILE  40          1HG1      ILE  40   5.245  -1.250  -0.506
    5   HG13  ILE  40          2HG1      ILE  40   4.492  -2.477  -1.519
    6   HG21  ILE  40          1HG2      ILE  40   3.774   0.139  -0.440
    7   HG22  ILE  40          2HG2      ILE  40   4.042   1.445  -1.593
    8   HG23  ILE  40          3HG2      ILE  40   2.628   0.403  -1.753
    9   HD11  ILE  40          1HD1      ILE  40   6.373  -2.644  -2.899
   10   HD12  ILE  40          2HD1      ILE  40   7.059  -1.138  -2.290
   11   HD13  ILE  40          3HD1      ILE  40   7.010  -2.566  -1.257
   12    H    ALA  41           H        ALA  41   3.737  -3.646  -3.218
   13    HA   ALA  41           HA       ALA  41   5.999  -3.975  -4.984
   14    HB1  ALA  41          1HB       ALA  41   4.715  -6.445  -4.214
   15    HB2  ALA  41          2HB       ALA  41   6.335  -5.854  -3.844
   16    HB3  ALA  41          3HB       ALA  41   4.973  -5.393  -2.822
   17    H    LEU  42           H        LEU  42   2.858  -3.454  -5.596
   18    HA   LEU  42           HA       LEU  42   2.839  -5.225  -7.952
   19    HB2  LEU  42          1HB       LEU  42   0.433  -5.207  -7.880
   20    HB3  LEU  42          2HB       LEU  42   1.072  -5.742  -6.328
   21    HG   LEU  42           HG       LEU  42   0.291  -2.881  -6.692
   22   HD11  LEU  42          1HD1      LEU  42  -1.602  -4.180  -7.545
   23   HD12  LEU  42          2HD1      LEU  42  -1.983  -3.394  -6.014
   24   HD13  LEU  42          3HD1      LEU  42  -1.624  -5.120  -6.053
   25   HD21  LEU  42          1HD2      LEU  42   0.605  -2.796  -4.493
   26   HD22  LEU  42          2HD2      LEU  42   1.299  -4.414  -4.601
   27   HD23  LEU  42          3HD2      LEU  42  -0.413  -4.211  -4.226
   28    HA   PRO  43           HA       PRO  43   2.762  -1.690 -10.555
   29    HB2  PRO  43          1HB       PRO  43   1.294  -2.621 -12.641
   30    HB3  PRO  43          2HB       PRO  43   2.953  -3.143 -12.325
   31    HG2  PRO  43          1HG       PRO  43   0.376  -4.509 -11.650
   32    HG3  PRO  43          2HG       PRO  43   1.870  -5.201 -12.309
   33    HD2  PRO  43          1HD       PRO  43   1.211  -5.383  -9.689
   34    HD3  PRO  43          2HD       PRO  43   2.894  -5.275 -10.245
   35    H    ALA  44           H        ALA  44   1.136  -1.044  -8.594
   36    HA   ALA  44           HA       ALA  44  -1.468  -0.389  -9.800
   37    HB1  ALA  44          1HB       ALA  44  -0.625  -0.587  -6.916
   38    HB2  ALA  44          2HB       ALA  44  -2.182   0.055  -7.440
   39    HB3  ALA  44          3HB       ALA  44  -1.759  -1.622  -7.783
   40    H    PHE  45           H        PHE  45   1.517   0.924  -8.881
   41    HA   PHE  45           HA       PHE  45   0.688   3.540  -8.144
   42    HB2  PHE  45          1HB       PHE  45   3.270   2.257  -8.911
   43    HB3  PHE  45          2HB       PHE  45   3.172   4.014  -8.953
   44    HD1  PHE  45           HD1      PHE  45   1.559   1.652  -6.587
   45    HD2  PHE  45           HD2      PHE  45   4.483   4.691  -7.160
   46    HE1  PHE  45           HE1      PHE  45   1.952   1.726  -4.159
   47    HE2  PHE  45           HE2      PHE  45   4.882   4.769  -4.733
   48    HZ   PHE  45           HZ       PHE  45   3.616   3.286  -3.229
   49    H    SER  46           H        SER  46   0.664   1.922 -11.088
   50    HA   SER  46           HA       SER  46   1.343   3.972 -12.895
   51    HB2  SER  46          1HB       SER  46   0.203   1.316 -13.027
   52    HB3  SER  46          2HB       SER  46  -0.619   2.403 -14.145
   53    HG   SER  46           HG       SER  46   2.176   1.931 -13.984
   54    H    GLN  47           H        GLN  47  -1.958   2.724 -12.469
   55    HA   GLN  47           HA       GLN  47  -3.033   5.321 -13.171
   56    HB2  GLN  47          1HB       GLN  47  -4.021   2.562 -13.064
   57    HB3  GLN  47          2HB       GLN  47  -5.194   3.755 -12.523
   58    HG2  GLN  47          1HG       GLN  47  -5.643   3.589 -14.776
   59    HG3  GLN  47          2HG       GLN  47  -4.589   5.000 -14.698
   60   HE21  GLN  47          1HE2      GLN  47  -3.327   1.548 -16.466
   61   HE22  GLN  47          2HE2      GLN  47  -4.689   1.559 -15.403
   62    H    VAL  48           H        VAL  48  -2.392   6.547 -11.348
   63    HA   VAL  48           HA       VAL  48  -3.898   5.932  -8.888
   64    HB   VAL  48           HB       VAL  48  -1.397   5.871  -8.666
   65   HG11  VAL  48          1HG1      VAL  48  -1.456   8.860  -8.829
   66   HG12  VAL  48          2HG1      VAL  48  -0.075   7.764  -8.903
   67   HG13  VAL  48          3HG1      VAL  48  -1.180   7.887 -10.273
   68   HG21  VAL  48          1HG2      VAL  48  -2.095   6.175  -6.565
   69   HG22  VAL  48          2HG2      VAL  48  -1.643   7.866  -6.784
   70   HG23  VAL  48          3HG2      VAL  48  -3.310   7.358  -7.049
   71    H    ASP  49           H        ASP  49  -3.064   8.335 -11.271
   72    HA   ASP  49           HA       ASP  49  -3.963  10.361 -11.785
   73    HB2  ASP  49          1HB       ASP  49  -6.146   9.620 -11.835
   74    HB3  ASP  49          2HB       ASP  49  -6.121   9.102 -10.152
   75    HA   PRO  50           HA       PRO  50  -2.198  12.866  -8.590
   76    HB2  PRO  50          1HB       PRO  50  -2.516  15.259  -9.832
   77    HB3  PRO  50          2HB       PRO  50  -1.269  14.096 -10.295
   78    HG2  PRO  50          1HG       PRO  50  -3.936  14.614 -11.551
   79    HG3  PRO  50          2HG       PRO  50  -2.366  14.345 -12.330
   80    HD2  PRO  50          1HD       PRO  50  -4.237  12.400 -12.115
   81    HD3  PRO  50          2HD       PRO  50  -2.496  12.057 -12.087
   82    H    GLU  51           H        GLU  51  -5.363  13.519  -9.997
   83    HA   GLU  51           HA       GLU  51  -6.243  15.479  -8.206
   84    HB2  GLU  51          1HB       GLU  51  -7.797  13.373  -9.715
   85    HB3  GLU  51          2HB       GLU  51  -8.543  14.700  -8.836
   86    HG2  GLU  51          1HG       GLU  51  -7.937  16.253 -10.375
   87    HG3  GLU  51          2HG       GLU  51  -6.474  15.386 -10.839
   88    H    VAL  52           H        VAL  52  -6.389  11.950  -8.024
   89    HA   VAL  52           HA       VAL  52  -7.778  11.982  -5.495
   90    HB   VAL  52           HB       VAL  52  -7.566  10.111  -7.470
   91   HG11  VAL  52          1HG1      VAL  52  -5.242   9.610  -6.723
   92   HG12  VAL  52          2HG1      VAL  52  -5.905   9.070  -5.179
   93   HG13  VAL  52          3HG1      VAL  52  -6.328   8.223  -6.667
   94   HG21  VAL  52          1HG2      VAL  52  -8.470  10.053  -4.635
   95   HG22  VAL  52          2HG2      VAL  52  -9.409   9.921  -6.122
   96   HG23  VAL  52          3HG2      VAL  52  -8.465   8.545  -5.550
   97    H    PHE  53           H        PHE  53  -4.484  11.751  -6.620
   98    HA   PHE  53           HA       PHE  53  -3.257  10.671  -4.358
   99    HB2  PHE  53          1HB       PHE  53  -2.338  11.404  -6.753
  100    HB3  PHE  53          2HB       PHE  53  -1.843  12.830  -5.846
  101    HD1  PHE  53           HD1      PHE  53  -0.773  12.116  -3.437
  102    HD2  PHE  53           HD2      PHE  53  -0.720   9.816  -7.018
  103    HE1  PHE  53           HE1      PHE  53   1.217  10.914  -2.632
  104    HE2  PHE  53           HE2      PHE  53   1.269   8.610  -6.218
  105    HZ   PHE  53           HZ       PHE  53   2.240   9.157  -4.022
  106    H    ALA  54           H        ALA  54  -3.724  14.099  -5.214
  107    HA   ALA  54           HA       ALA  54  -2.697  15.102  -2.771
  108    HB1  ALA  54          1HB       ALA  54  -3.713  17.240  -3.475
  109    HB2  ALA  54          2HB       ALA  54  -2.747  16.489  -4.747
  110    HB3  ALA  54          3HB       ALA  54  -4.508  16.397  -4.806
  111    H    ALA  55           H        ALA  55  -5.702  13.710  -3.623
  112    HA   ALA  55           HA       ALA  55  -7.416  15.019  -1.809
  113    HB1  ALA  55          1HB       ALA  55  -7.875  12.153  -2.428
  114    HB2  ALA  55          2HB       ALA  55  -9.000  13.511  -2.444
  115    HB3  ALA  55          3HB       ALA  55  -7.861  13.294  -3.772
  116    H    LEU  56           H        LEU  56  -5.304  12.211  -1.475
  117    HA   LEU  56           HA       LEU  56  -6.190  11.633   1.202
  118    HB2  LEU  56          1HB       LEU  56  -4.064  10.564  -0.608
  119    HB3  LEU  56          2HB       LEU  56  -4.051  10.156   1.106
  120    HG   LEU  56           HG       LEU  56  -6.375   9.605  -0.734
  121   HD11  LEU  56          1HD1      LEU  56  -5.057   8.030  -1.617
  122   HD12  LEU  56          2HD1      LEU  56  -5.295   7.183  -0.089
  123   HD13  LEU  56          3HD1      LEU  56  -3.857   8.175  -0.333
  124   HD21  LEU  56          1HD2      LEU  56  -5.855   8.157   1.807
  125   HD22  LEU  56          2HD2      LEU  56  -7.383   8.550   1.019
  126   HD23  LEU  56          3HD2      LEU  56  -6.500   9.796   1.902
  127    HA   PRO  57           HA       PRO  57  -3.464  14.155   3.537
  128    HB2  PRO  57          1HB       PRO  57  -2.771  12.513   5.586
  129    HB3  PRO  57          2HB       PRO  57  -4.381  13.226   5.428
  130    HG2  PRO  57          1HG       PRO  57  -3.444  10.480   4.692
  131    HG3  PRO  57          2HG       PRO  57  -4.941  10.970   5.506
  132    HD2  PRO  57          1HD       PRO  57  -4.850  10.356   2.870
  133    HD3  PRO  57          2HD       PRO  57  -5.968  11.567   3.530
  134    H    ALA  58           H        ALA  58  -1.325  14.679   3.754
  135    HA   ALA  58           HA       ALA  58   0.587  13.550   2.127
  136    HB1  ALA  58          1HB       ALA  58   1.077  15.060   4.692
  137    HB2  ALA  58          2HB       ALA  58   2.239  14.824   3.385
  138    HB3  ALA  58          3HB       ALA  58   0.784  15.782   3.109
  139    H    GLU  59           H        GLU  59  -0.303  12.670   5.395
  140    HA   GLU  59           HA       GLU  59   1.931  11.120   6.072
  141    HB2  GLU  59          1HB       GLU  59  -0.959  10.949   6.921
  142    HB3  GLU  59          2HB       GLU  59   0.293   9.919   7.601
  143    HG2  GLU  59          1HG       GLU  59   0.497  12.911   7.635
  144    HG3  GLU  59          2HG       GLU  59  -0.333  12.006   8.900
  145    H    LEU  60           H        LEU  60  -0.982  10.338   4.253
  146    HA   LEU  60           HA       LEU  60  -0.200   7.555   3.979
  147    HB2  LEU  60          1HB       LEU  60  -2.517   9.100   2.825
  148    HB3  LEU  60          2HB       LEU  60  -2.267   7.366   2.636
  149    HG   LEU  60           HG       LEU  60  -2.657   8.716   5.302
  150   HD11  LEU  60          1HD1      LEU  60  -4.849   7.072   4.387
  151   HD12  LEU  60          2HD1      LEU  60  -4.568   8.437   3.307
  152   HD13  LEU  60          3HD1      LEU  60  -4.861   8.717   5.023
  153   HD21  LEU  60          1HD2      LEU  60  -2.586   6.656   6.238
  154   HD22  LEU  60          2HD2      LEU  60  -1.567   6.316   4.839
  155   HD23  LEU  60          3HD2      LEU  60  -3.273   5.865   4.820
  156    H    GLN  61           H        GLN  61  -0.427  10.464   1.992
  157    HA   GLN  61           HA       GLN  61   0.221   9.244  -0.471
  158    HB2  GLN  61          1HB       GLN  61  -0.238  11.292  -1.224
  159    HB3  GLN  61          2HB       GLN  61  -0.396  11.838   0.441
  160    HG2  GLN  61          1HG       GLN  61   1.888  12.508   0.519
  161    HG3  GLN  61          2HG       GLN  61   2.218  11.754  -1.041
  162   HE21  GLN  61          1HE2      GLN  61  -0.257  14.994  -1.244
  163   HE22  GLN  61          2HE2      GLN  61  -0.564  13.710  -0.130
  164    H    ARG  62           H        ARG  62   2.151  10.370   2.200
  165    HA   ARG  62           HA       ARG  62   4.632  10.294   0.730
  166    HB2  ARG  62          1HB       ARG  62   5.677  10.996   2.726
  167    HB3  ARG  62          2HB       ARG  62   4.122  11.816   2.707
  168    HG2  ARG  62          1HG       ARG  62   3.275   9.914   4.166
  169    HG3  ARG  62          2HG       ARG  62   4.972   9.475   4.376
  170    HD2  ARG  62          1HD       ARG  62   5.346  11.882   5.099
  171    HD3  ARG  62          2HD       ARG  62   3.590  12.020   5.183
  172    HE   ARG  62           HE       ARG  62   3.638  10.848   7.141
  173   HH11  ARG  62          1HH1      ARG  62   6.633  10.325   5.445
  174   HH12  ARG  62          2HH1      ARG  62   7.368   9.447   6.746
  175   HH21  ARG  62          1HH2      ARG  62   4.594   9.694   8.860
  176   HH22  ARG  62          2HH2      ARG  62   6.206   9.088   8.688
  177    H    GLU  63           H        GLU  63   2.726   8.120   2.632
  178    HA   GLU  63           HA       GLU  63   4.799   6.281   3.287
  179    HB2  GLU  63          1HB       GLU  63   2.802   6.252   4.605
  180    HB3  GLU  63          2HB       GLU  63   1.796   6.011   3.184
  181    HG2  GLU  63          1HG       GLU  63   2.090   3.801   3.202
  182    HG3  GLU  63          2HG       GLU  63   3.813   3.937   3.550
  183    H    LEU  64           H        LEU  64   2.726   6.750   0.526
  184    HA   LEU  64           HA       LEU  64   3.383   4.186  -0.646
  185    HB2  LEU  64          1HB       LEU  64   1.858   4.688  -2.312
  186    HB3  LEU  64          2HB       LEU  64   1.183   5.490  -0.895
  187    HG   LEU  64           HG       LEU  64   2.585   7.530  -1.937
  188   HD11  LEU  64          1HD1      LEU  64   2.319   5.551  -4.072
  189   HD12  LEU  64          2HD1      LEU  64   3.375   6.958  -3.949
  190   HD13  LEU  64          3HD1      LEU  64   1.709   7.153  -4.492
  191   HD21  LEU  64          1HD2      LEU  64  -0.016   6.972  -1.490
  192   HD22  LEU  64          2HD2      LEU  64  -0.019   7.112  -3.248
  193   HD23  LEU  64          3HD2      LEU  64   0.555   8.454  -2.257
  194    H    LYS  65           H        LYS  65   4.394   7.523  -0.909
  195    HA   LYS  65           HA       LYS  65   5.980   7.075  -3.277
  196    HB2  LYS  65          1HB       LYS  65   5.912   9.429  -1.379
  197    HB3  LYS  65          2HB       LYS  65   6.735   9.395  -2.933
  198    HG2  LYS  65          1HG       LYS  65   4.756   9.437  -4.131
  199    HG3  LYS  65          2HG       LYS  65   3.803   8.842  -2.770
  200    HD2  LYS  65          1HD       LYS  65   3.204  11.018  -2.614
  201    HD3  LYS  65          2HD       LYS  65   4.718  11.138  -1.715
  202    HE2  LYS  65          1HE       LYS  65   5.863  12.041  -3.547
  203    HE3  LYS  65          2HE       LYS  65   4.631  11.513  -4.691
  204    HZ1  LYS  65          1HZ       LYS  65   4.800  13.945  -3.228
  205    HZ2  LYS  65          2HZ       LYS  65   3.326  13.171  -2.933
  206    HZ3  LYS  65          3HZ       LYS  65   3.783  13.541  -4.519
  207    H    ALA  66           H        ALA  66   6.567   7.488   0.189
  208    HA   ALA  66           HA       ALA  66   9.401   7.381   0.008
  209    HB1  ALA  66          1HB       ALA  66   7.782   6.648   2.433
  210    HB2  ALA  66          2HB       ALA  66   9.412   7.321   2.366
  211    HB3  ALA  66          3HB       ALA  66   8.027   8.318   1.919
  212    H    ALA  67           H        ALA  67   6.902   4.959   0.652
  213    HA   ALA  67           HA       ALA  67   8.491   2.804   1.362
  214    HB1  ALA  67          1HB       ALA  67   6.625   1.418   0.291
  215    HB2  ALA  67          2HB       ALA  67   6.183   2.517   1.599
  216    HB3  ALA  67          3HB       ALA  67   5.863   2.965  -0.077
  217    H    TYR  68           H        TYR  68   7.794   4.117  -1.823
  218    HA   TYR  68           HA       TYR  68   8.928   1.957  -3.290
  219    HB2  TYR  68          1HB       TYR  68   7.756   4.566  -3.876
  220    HB3  TYR  68          2HB       TYR  68   9.102   4.173  -4.939
  221    HD1  TYR  68           HD1      TYR  68   6.460   2.012  -3.426
  222    HD2  TYR  68           HD2      TYR  68   8.208   3.555  -6.985
  223    HE1  TYR  68           HE1      TYR  68   4.975   0.583  -4.768
  224    HE2  TYR  68           HE2      TYR  68   6.727   2.131  -8.337
  225    HH   TYR  68           HH       TYR  68   5.291  -0.418  -7.423
  226    H    ASP  69           H        ASP  69  10.213   4.746  -1.706
  227    HA   ASP  69           HA       ASP  69  12.755   4.608  -3.108
  228    HB2  ASP  69          1HB       ASP  69  11.466   6.715  -2.084
  229    HB3  ASP  69          2HB       ASP  69  12.429   6.285  -0.672
  230    H    GLN  70           H        GLN  70  11.401   3.822   0.047
  231    HA   GLN  70           HA       GLN  70  13.722   3.284   1.462
  232    HB2  GLN  70          1HB       GLN  70  11.013   1.960   1.607
  233    HB3  GLN  70          2HB       GLN  70  12.298   1.672   2.772
  234    HG2  GLN  70          1HG       GLN  70  10.761   4.194   2.271
  235    HG3  GLN  70          2HG       GLN  70  10.908   3.269   3.764
  236   HE21  GLN  70          1HE2      GLN  70  13.545   6.164   2.842
  237   HE22  GLN  70          2HE2      GLN  70  12.207   5.755   1.829
  238    H    ARG  71           H        ARG  71  11.781   1.033  -0.499
  239    HA   ARG  71           HA       ARG  71  13.511  -1.176  -0.149
  240    HB2  ARG  71          1HB       ARG  71  11.583  -0.646  -2.417
  241    HB3  ARG  71          2HB       ARG  71  12.267  -2.206  -1.977
  242    HG2  ARG  71          1HG       ARG  71  10.402  -0.546  -0.293
  243    HG3  ARG  71          2HG       ARG  71   9.984  -2.008  -1.189
  244    HD2  ARG  71          1HD       ARG  71  11.945  -1.813   1.095
  245    HD3  ARG  71          2HD       ARG  71  10.324  -2.500   1.172
  246    HE   ARG  71           HE       ARG  71  11.980  -3.748  -0.805
  247   HH11  ARG  71          1HH1      ARG  71  11.139  -3.691   2.572
  248   HH12  ARG  71          2HH1      ARG  71  11.617  -5.332   2.853
  249   HH21  ARG  71          1HH2      ARG  71  12.613  -5.911  -0.448
  250   HH22  ARG  71          2HH2      ARG  71  12.456  -6.594   1.135
  251    H    GLN  72           H        GLN  72  13.694   1.616  -2.123
  252    HA   GLN  72           HA       GLN  72  15.200   2.338  -3.666
  253    HB2  GLN  72          1HB       GLN  72  16.665   0.381  -2.037
  254    HB3  GLN  72          2HB       GLN  72  17.352   0.643  -3.635
  255    HG2  GLN  72          1HG       GLN  72  17.455   3.046  -3.192
  256    HG3  GLN  72          2HG       GLN  72  16.783   2.773  -1.585
  257   HE21  GLN  72          1HE2      GLN  72  20.053   2.721  -0.425
  258   HE22  GLN  72          2HE2      GLN  72  18.516   3.509  -0.445
  Start of MODEL   19
    1    H    ILE  40           H        ILE  40   3.845  -1.453  -0.482
    2    HA   ILE  40           HA       ILE  40   3.306  -0.419  -2.915
    3    HB   ILE  40           HB       ILE  40   5.651  -0.403  -3.429
    4   HG12  ILE  40          1HG1      ILE  40   6.044  -2.823  -2.949
    5   HG13  ILE  40          2HG1      ILE  40   7.285  -1.765  -2.285
    6   HG21  ILE  40          1HG2      ILE  40   4.629   0.270  -0.816
    7   HG22  ILE  40          2HG2      ILE  40   6.355  -0.082  -0.755
    8   HG23  ILE  40          3HG2      ILE  40   5.747   1.160  -1.850
    9   HD11  ILE  40          1HD1      ILE  40   6.883  -3.281  -0.583
   10   HD12  ILE  40          2HD1      ILE  40   5.917  -1.882  -0.114
   11   HD13  ILE  40          3HD1      ILE  40   5.142  -3.280  -0.858
   12    H    ALA  41           H        ALA  41   3.822  -3.773  -2.198
   13    HA   ALA  41           HA       ALA  41   4.390  -4.687  -4.814
   14    HB1  ALA  41          1HB       ALA  41   3.942  -6.887  -3.979
   15    HB2  ALA  41          2HB       ALA  41   4.792  -5.981  -2.727
   16    HB3  ALA  41          3HB       ALA  41   3.052  -6.236  -2.603
   17    H    LEU  42           H        LEU  42   1.565  -3.432  -3.450
   18    HA   LEU  42           HA       LEU  42  -0.393  -4.945  -4.830
   19    HB2  LEU  42          1HB       LEU  42  -1.832  -2.903  -4.389
   20    HB3  LEU  42          2HB       LEU  42  -1.157  -3.729  -2.986
   21    HG   LEU  42           HG       LEU  42   0.480  -1.505  -3.971
   22   HD11  LEU  42          1HD1      LEU  42  -2.094  -0.916  -4.220
   23   HD12  LEU  42          2HD1      LEU  42  -0.919   0.251  -3.616
   24   HD13  LEU  42          3HD1      LEU  42  -1.936  -0.641  -2.485
   25   HD21  LEU  42          1HD2      LEU  42   0.993  -1.271  -1.764
   26   HD22  LEU  42          2HD2      LEU  42   0.485  -2.960  -1.756
   27   HD23  LEU  42          3HD2      LEU  42  -0.630  -1.701  -1.224
   28    HA   PRO  43           HA       PRO  43  -0.284  -3.334  -8.911
   29    HB2  PRO  43          1HB       PRO  43  -2.919  -3.316  -9.562
   30    HB3  PRO  43          2HB       PRO  43  -1.976  -4.803  -9.417
   31    HG2  PRO  43          1HG       PRO  43  -3.839  -3.542  -7.442
   32    HG3  PRO  43          2HG       PRO  43  -3.673  -5.250  -7.892
   33    HD2  PRO  43          1HD       PRO  43  -2.581  -4.224  -5.636
   34    HD3  PRO  43          2HD       PRO  43  -1.832  -5.557  -6.539
   35    H    ALA  44           H        ALA  44   0.234  -1.236  -7.412
   36    HA   ALA  44           HA       ALA  44  -1.662   0.840  -8.299
   37    HB1  ALA  44          1HB       ALA  44  -1.161   2.133  -6.344
   38    HB2  ALA  44          2HB       ALA  44  -1.628   0.510  -5.834
   39    HB3  ALA  44          3HB       ALA  44   0.072   0.977  -5.839
   40    H    PHE  45           H        PHE  45  -0.155   3.066  -7.709
   41    HA   PHE  45           HA       PHE  45   1.431   4.439  -8.587
   42    HB2  PHE  45          1HB       PHE  45   3.060   1.891  -8.684
   43    HB3  PHE  45          2HB       PHE  45   3.706   3.516  -8.887
   44    HD1  PHE  45           HD1      PHE  45   4.378   4.760  -7.041
   45    HD2  PHE  45           HD2      PHE  45   1.910   1.338  -6.479
   46    HE1  PHE  45           HE1      PHE  45   4.687   4.941  -4.607
   47    HE2  PHE  45           HE2      PHE  45   2.214   1.515  -4.044
   48    HZ   PHE  45           HZ       PHE  45   3.603   3.319  -3.105
   49    H    SER  46           H        SER  46  -0.503   3.256 -10.341
   50    HA   SER  46           HA       SER  46   0.869   3.716 -12.861
   51    HB2  SER  46          1HB       SER  46   0.319   1.083 -11.993
   52    HB3  SER  46          2HB       SER  46  -0.861   1.451 -13.251
   53    HG   SER  46           HG       SER  46   1.426   0.619 -13.774
   54    H    GLN  47           H        GLN  47  -2.167   2.965 -11.207
   55    HA   GLN  47           HA       GLN  47  -3.562   4.684 -13.153
   56    HB2  GLN  47          1HB       GLN  47  -4.207   2.244 -13.154
   57    HB3  GLN  47          2HB       GLN  47  -4.815   2.476 -11.520
   58    HG2  GLN  47          1HG       GLN  47  -6.744   3.179 -12.328
   59    HG3  GLN  47          2HG       GLN  47  -5.926   4.504 -13.154
   60   HE21  GLN  47          1HE2      GLN  47  -5.608   2.613 -16.225
   61   HE22  GLN  47          2HE2      GLN  47  -4.632   3.559 -15.159
   62    H    VAL  48           H        VAL  48  -2.343   5.973 -11.139
   63    HA   VAL  48           HA       VAL  48  -4.537   6.616  -9.276
   64    HB   VAL  48           HB       VAL  48  -2.174   7.611  -8.154
   65   HG11  VAL  48          1HG1      VAL  48  -3.187   5.017  -7.176
   66   HG12  VAL  48          2HG1      VAL  48  -2.931   6.536  -6.315
   67   HG13  VAL  48          3HG1      VAL  48  -4.372   6.317  -7.309
   68   HG21  VAL  48          1HG2      VAL  48  -1.779   4.730  -8.945
   69   HG22  VAL  48          2HG2      VAL  48  -0.973   6.090  -9.728
   70   HG23  VAL  48          3HG2      VAL  48  -0.673   5.749  -8.024
   71    H    ASP  49           H        ASP  49  -5.389   8.219 -10.629
   72    HA   ASP  49           HA       ASP  49  -4.055  10.227 -11.959
   73    HB2  ASP  49          1HB       ASP  49  -6.772   9.816 -10.948
   74    HB3  ASP  49          2HB       ASP  49  -6.317  11.515 -11.045
   75    HA   PRO  50           HA       PRO  50  -2.361  13.015  -9.029
   76    HB2  PRO  50          1HB       PRO  50  -2.882  15.433 -10.150
   77    HB3  PRO  50          2HB       PRO  50  -1.679  14.313 -10.799
   78    HG2  PRO  50          1HG       PRO  50  -4.493  14.798 -11.697
   79    HG3  PRO  50          2HG       PRO  50  -3.028  14.589 -12.673
   80    HD2  PRO  50          1HD       PRO  50  -4.816  12.593 -12.284
   81    HD3  PRO  50          2HD       PRO  50  -3.077  12.293 -12.484
   82    H    GLU  51           H        GLU  51  -5.600  13.999 -10.133
   83    HA   GLU  51           HA       GLU  51  -6.225  15.694  -8.003
   84    HB2  GLU  51          1HB       GLU  51  -7.811  14.153 -10.002
   85    HB3  GLU  51          2HB       GLU  51  -8.662  14.829  -8.620
   86    HG2  GLU  51          1HG       GLU  51  -6.845  16.564 -10.224
   87    HG3  GLU  51          2HG       GLU  51  -8.457  16.184 -10.828
   88    H    VAL  52           H        VAL  52  -5.960  12.283  -8.116
   89    HA   VAL  52           HA       VAL  52  -7.599  11.855  -5.751
   90    HB   VAL  52           HB       VAL  52  -5.867   9.709  -6.888
   91   HG11  VAL  52          1HG1      VAL  52  -7.134   9.016  -5.046
   92   HG12  VAL  52          2HG1      VAL  52  -8.568   9.888  -5.591
   93   HG13  VAL  52          3HG1      VAL  52  -8.041   8.435  -6.442
   94   HG21  VAL  52          1HG2      VAL  52  -7.662   9.221  -8.562
   95   HG22  VAL  52          2HG2      VAL  52  -8.338  10.812  -8.216
   96   HG23  VAL  52          3HG2      VAL  52  -6.719  10.672  -8.901
   97    H    PHE  53           H        PHE  53  -4.194  11.726  -6.706
   98    HA   PHE  53           HA       PHE  53  -3.088  10.719  -4.374
   99    HB2  PHE  53          1HB       PHE  53  -2.062  11.566  -6.718
  100    HB3  PHE  53          2HB       PHE  53  -1.603  12.921  -5.692
  101    HD1  PHE  53           HD1      PHE  53  -0.615   9.798  -6.892
  102    HD2  PHE  53           HD2      PHE  53  -0.512  12.212  -3.388
  103    HE1  PHE  53           HE1      PHE  53   1.313   8.511  -6.066
  104    HE2  PHE  53           HE2      PHE  53   1.416  10.930  -2.557
  105    HZ   PHE  53           HZ       PHE  53   2.332   9.078  -3.897
  106    H    ALA  54           H        ALA  54  -3.663  14.128  -5.226
  107    HA   ALA  54           HA       ALA  54  -2.783  15.166  -2.742
  108    HB1  ALA  54          1HB       ALA  54  -2.798  16.624  -4.614
  109    HB2  ALA  54          2HB       ALA  54  -4.511  16.331  -4.913
  110    HB3  ALA  54          3HB       ALA  54  -4.008  17.234  -3.485
  111    H    ALA  55           H        ALA  55  -5.682  13.630  -3.714
  112    HA   ALA  55           HA       ALA  55  -7.517  14.827  -1.938
  113    HB1  ALA  55          1HB       ALA  55  -7.932  13.242  -3.939
  114    HB2  ALA  55          2HB       ALA  55  -7.716  11.954  -2.753
  115    HB3  ALA  55          3HB       ALA  55  -8.997  13.147  -2.536
  116    H    LEU  56           H        LEU  56  -5.298  12.102  -1.588
  117    HA   LEU  56           HA       LEU  56  -6.239  11.453   1.056
  118    HB2  LEU  56          1HB       LEU  56  -4.080  10.459  -0.745
  119    HB3  LEU  56          2HB       LEU  56  -4.017  10.065   0.971
  120    HG   LEU  56           HG       LEU  56  -6.584   9.496  -0.355
  121   HD11  LEU  56          1HD1      LEU  56  -4.578   8.905  -1.957
  122   HD12  LEU  56          2HD1      LEU  56  -5.933   7.799  -1.735
  123   HD13  LEU  56          3HD1      LEU  56  -4.420   7.524  -0.871
  124   HD21  LEU  56          1HD2      LEU  56  -6.112   7.311   0.915
  125   HD22  LEU  56          2HD2      LEU  56  -6.418   8.773   1.853
  126   HD23  LEU  56          3HD2      LEU  56  -4.766   8.192   1.640
  127    HA   PRO  57           HA       PRO  57  -3.639  14.007   3.498
  128    HB2  PRO  57          1HB       PRO  57  -2.923  12.346   5.523
  129    HB3  PRO  57          2HB       PRO  57  -4.554  13.004   5.352
  130    HG2  PRO  57          1HG       PRO  57  -3.508  10.310   4.574
  131    HG3  PRO  57          2HG       PRO  57  -5.036  10.729   5.371
  132    HD2  PRO  57          1HD       PRO  57  -4.878  10.177   2.725
  133    HD3  PRO  57          2HD       PRO  57  -6.049  11.333   3.391
  134    H    ALA  58           H        ALA  58  -1.543  14.636   3.638
  135    HA   ALA  58           HA       ALA  58   0.432  13.525   2.071
  136    HB1  ALA  58          1HB       ALA  58   1.719  14.813   4.246
  137    HB2  ALA  58          2HB       ALA  58   1.413  15.435   2.624
  138    HB3  ALA  58          3HB       ALA  58   0.224  15.684   3.903
  139    H    GLU  59           H        GLU  59  -0.370  12.830   5.421
  140    HA   GLU  59           HA       GLU  59   1.909  11.412   6.169
  141    HB2  GLU  59          1HB       GLU  59   0.131  12.086   7.736
  142    HB3  GLU  59          2HB       GLU  59  -0.950  10.905   7.010
  143    HG2  GLU  59          1HG       GLU  59   0.013  10.123   9.120
  144    HG3  GLU  59          2HG       GLU  59   0.454   9.095   7.758
  145    H    LEU  60           H        LEU  60  -0.952  10.370   4.394
  146    HA   LEU  60           HA       LEU  60  -0.012   7.628   4.263
  147    HB2  LEU  60          1HB       LEU  60  -2.410   8.994   3.054
  148    HB3  LEU  60          2HB       LEU  60  -2.058   7.274   2.897
  149    HG   LEU  60           HG       LEU  60  -2.549   8.664   5.528
  150   HD11  LEU  60          1HD1      LEU  60  -4.772   8.049   5.454
  151   HD12  LEU  60          2HD1      LEU  60  -4.507   6.842   4.197
  152   HD13  LEU  60          3HD1      LEU  60  -4.477   8.558   3.791
  153   HD21  LEU  60          1HD2      LEU  60  -1.271   6.336   5.127
  154   HD22  LEU  60          2HD2      LEU  60  -2.938   5.761   5.157
  155   HD23  LEU  60          3HD2      LEU  60  -2.289   6.657   6.532
  156    H    GLN  61           H        GLN  61  -0.396  10.409   2.121
  157    HA   GLN  61           HA       GLN  61   0.300   9.128  -0.282
  158    HB2  GLN  61          1HB       GLN  61  -0.010  11.160  -1.182
  159    HB3  GLN  61          2HB       GLN  61  -0.498  11.659   0.433
  160    HG2  GLN  61          1HG       GLN  61   1.684  12.497   0.910
  161    HG3  GLN  61          2HG       GLN  61   2.327  11.817  -0.584
  162   HE21  GLN  61          1HE2      GLN  61  -0.346  14.842  -1.171
  163   HE22  GLN  61          2HE2      GLN  61  -0.731  13.497  -0.158
  164    H    ARG  62           H        ARG  62   2.223  10.403   2.333
  165    HA   ARG  62           HA       ARG  62   4.700  10.336   0.872
  166    HB2  ARG  62          1HB       ARG  62   5.745  10.938   2.959
  167    HB3  ARG  62          2HB       ARG  62   4.286  11.899   2.761
  168    HG2  ARG  62          1HG       ARG  62   3.597  11.229   4.751
  169    HG3  ARG  62          2HG       ARG  62   3.553   9.565   4.164
  170    HD2  ARG  62          1HD       ARG  62   5.494   9.018   5.179
  171    HD3  ARG  62          2HD       ARG  62   6.220  10.595   4.867
  172    HE   ARG  62           HE       ARG  62   4.750   9.788   7.213
  173   HH11  ARG  62          1HH1      ARG  62   5.887  12.459   5.292
  174   HH12  ARG  62          2HH1      ARG  62   5.826  13.594   6.599
  175   HH21  ARG  62          1HH2      ARG  62   4.665  11.273   8.942
  176   HH22  ARG  62          2HH2      ARG  62   5.132  12.918   8.675
  177    H    GLU  63           H        GLU  63   2.835   8.123   2.763
  178    HA   GLU  63           HA       GLU  63   4.961   6.328   3.403
  179    HB2  GLU  63          1HB       GLU  63   3.006   6.272   4.777
  180    HB3  GLU  63          2HB       GLU  63   1.960   6.020   3.387
  181    HG2  GLU  63          1HG       GLU  63   2.488   3.803   3.212
  182    HG3  GLU  63          2HG       GLU  63   4.068   4.006   3.967
  183    H    LEU  64           H        LEU  64   2.814   6.751   0.693
  184    HA   LEU  64           HA       LEU  64   3.464   4.186  -0.477
  185    HB2  LEU  64          1HB       LEU  64   1.883   4.652  -2.088
  186    HB3  LEU  64          2HB       LEU  64   1.258   5.515  -0.684
  187    HG   LEU  64           HG       LEU  64   2.667   7.491  -1.848
  188   HD11  LEU  64          1HD1      LEU  64   1.761   7.122  -4.347
  189   HD12  LEU  64          2HD1      LEU  64   2.168   5.458  -3.927
  190   HD13  LEU  64          3HD1      LEU  64   3.400   6.717  -3.836
  191   HD21  LEU  64          1HD2      LEU  64   0.646   8.445  -2.120
  192   HD22  LEU  64          2HD2      LEU  64   0.072   7.002  -1.284
  193   HD23  LEU  64          3HD2      LEU  64   0.008   7.085  -3.045
  194    H    LYS  65           H        LYS  65   4.494   7.508  -0.738
  195    HA   LYS  65           HA       LYS  65   6.010   7.073  -3.157
  196    HB2  LYS  65          1HB       LYS  65   6.017   9.412  -1.241
  197    HB3  LYS  65          2HB       LYS  65   6.782   9.383  -2.824
  198    HG2  LYS  65          1HG       LYS  65   4.762   9.453  -3.947
  199    HG3  LYS  65          2HG       LYS  65   3.854   8.846  -2.560
  200    HD2  LYS  65          1HD       LYS  65   3.333  10.955  -2.075
  201    HD3  LYS  65          2HD       LYS  65   5.035  11.226  -1.690
  202    HE2  LYS  65          1HE       LYS  65   5.458  11.831  -4.028
  203    HE3  LYS  65          2HE       LYS  65   3.755  11.570  -4.401
  204    HZ1  LYS  65          1HZ       LYS  65   4.950  13.680  -2.705
  205    HZ2  LYS  65          2HZ       LYS  65   3.302  13.307  -2.640
  206    HZ3  LYS  65          3HZ       LYS  65   3.986  13.863  -4.084
  207    H    ALA  66           H        ALA  66   6.668   7.395   0.299
  208    HA   ALA  66           HA       ALA  66   9.502   7.293   0.049
  209    HB1  ALA  66          1HB       ALA  66   8.557   8.292   2.004
  210    HB2  ALA  66          2HB       ALA  66   7.684   6.811   2.403
  211    HB3  ALA  66          3HB       ALA  66   9.444   6.852   2.504
  212    H    ALA  67           H        ALA  67   7.006   4.878   0.737
  213    HA   ALA  67           HA       ALA  67   8.591   2.705   1.378
  214    HB1  ALA  67          1HB       ALA  67   6.025   2.690  -0.208
  215    HB2  ALA  67          2HB       ALA  67   6.738   1.304   0.618
  216    HB3  ALA  67          3HB       ALA  67   6.158   2.683   1.551
  217    H    TYR  68           H        TYR  68   7.849   4.066  -1.776
  218    HA   TYR  68           HA       TYR  68   8.932   1.919  -3.297
  219    HB2  TYR  68          1HB       TYR  68   7.757   4.527  -3.814
  220    HB3  TYR  68          2HB       TYR  68   9.122   4.206  -4.878
  221    HD1  TYR  68           HD1      TYR  68   6.348   2.106  -3.496
  222    HD2  TYR  68           HD2      TYR  68   8.423   3.480  -6.947
  223    HE1  TYR  68           HE1      TYR  68   4.907   0.705  -4.912
  224    HE2  TYR  68           HE2      TYR  68   6.986   2.084  -8.374
  225    HH   TYR  68           HH       TYR  68   5.411  -0.364  -7.561
  226    H    ASP  69           H        ASP  69  10.279   4.702  -1.727
  227    HA   ASP  69           HA       ASP  69  12.805   4.506  -3.148
  228    HB2  ASP  69          1HB       ASP  69  11.624   6.664  -2.230
  229    HB3  ASP  69          2HB       ASP  69  12.408   6.212  -0.719
  230    H    GLN  70           H        GLN  70  11.427   3.649  -0.043
  231    HA   GLN  70           HA       GLN  70  13.676   3.160   1.469
  232    HB2  GLN  70          1HB       GLN  70  11.053   1.673   1.361
  233    HB3  GLN  70          2HB       GLN  70  12.288   1.346   2.569
  234    HG2  GLN  70          1HG       GLN  70  10.655   3.828   2.189
  235    HG3  GLN  70          2HG       GLN  70  10.773   2.790   3.609
  236   HE21  GLN  70          1HE2      GLN  70  13.344   5.843   3.031
  237   HE22  GLN  70          2HE2      GLN  70  12.108   5.440   1.893
  238    H    ARG  71           H        ARG  71  12.018   0.842  -0.671
  239    HA   ARG  71           HA       ARG  71  13.786  -1.286  -0.334
  240    HB2  ARG  71          1HB       ARG  71  12.825  -2.236  -2.302
  241    HB3  ARG  71          2HB       ARG  71  11.546  -1.362  -1.470
  242    HG2  ARG  71          1HG       ARG  71  12.632   0.505  -3.210
  243    HG3  ARG  71          2HG       ARG  71  12.602  -1.000  -4.131
  244    HD2  ARG  71          1HD       ARG  71  10.178  -1.185  -3.148
  245    HD3  ARG  71          2HD       ARG  71  10.347   0.559  -2.956
  246    HE   ARG  71           HE       ARG  71  11.076   0.175  -5.520
  247   HH11  ARG  71          1HH1      ARG  71   8.316  -0.863  -3.670
  248   HH12  ARG  71          2HH1      ARG  71   7.244  -0.873  -5.030
  249   HH21  ARG  71          1HH2      ARG  71   9.674   0.167  -7.319
  250   HH22  ARG  71          2HH2      ARG  71   8.018  -0.288  -7.106
  251    H    GLN  72           H        GLN  72  14.144   1.655  -2.091
  252    HA   GLN  72           HA       GLN  72  16.300   0.680  -3.757
  253    HB2  GLN  72          1HB       GLN  72  14.522   2.802  -3.928
  254    HB3  GLN  72          2HB       GLN  72  16.056   3.576  -3.553
  255    HG2  GLN  72          1HG       GLN  72  16.701   3.365  -5.653
  256    HG3  GLN  72          2HG       GLN  72  16.507   1.616  -5.559
  257   HE21  GLN  72          1HE2      GLN  72  13.529   1.515  -7.353
  258   HE22  GLN  72          2HE2      GLN  72  14.671   0.665  -6.374
  Start of MODEL   20
    1    H    ILE  40           H        ILE  40   4.755  -3.050  -0.241
    2    HA   ILE  40           HA       ILE  40   2.720  -1.085   0.476
    3    HB   ILE  40           HB       ILE  40   3.900   0.224  -1.603
    4   HG12  ILE  40          1HG1      ILE  40   6.184  -0.619   0.179
    5   HG13  ILE  40          2HG1      ILE  40   5.837  -1.420  -1.350
    6   HG21  ILE  40          1HG2      ILE  40   4.707   0.766   1.236
    7   HG22  ILE  40          2HG2      ILE  40   4.373   1.916  -0.057
    8   HG23  ILE  40          3HG2      ILE  40   3.052   1.009   0.679
    9   HD11  ILE  40          1HD1      ILE  40   6.118   1.529  -1.368
   10   HD12  ILE  40          2HD1      ILE  40   7.573   0.554  -1.164
   11   HD13  ILE  40          3HD1      ILE  40   6.559   0.338  -2.591
   12    H    ALA  41           H        ALA  41   4.405  -1.748  -2.577
   13    HA   ALA  41           HA       ALA  41   3.605  -2.327  -4.635
   14    HB1  ALA  41          1HB       ALA  41   3.545  -4.485  -3.319
   15    HB2  ALA  41          2HB       ALA  41   1.810  -4.221  -3.140
   16    HB3  ALA  41          3HB       ALA  41   2.511  -4.418  -4.746
   17    H    LEU  42           H        LEU  42   2.544  -0.062  -4.364
   18    HA   LEU  42           HA       LEU  42  -0.375  -0.343  -4.642
   19    HB2  LEU  42          1HB       LEU  42   1.302   1.990  -3.747
   20    HB3  LEU  42          2HB       LEU  42  -0.410   2.125  -4.146
   21    HG   LEU  42           HG       LEU  42   0.705   0.381  -1.951
   22   HD11  LEU  42          1HD1      LEU  42   1.001   2.850  -1.604
   23   HD12  LEU  42          2HD1      LEU  42   0.009   2.032  -0.397
   24   HD13  LEU  42          3HD1      LEU  42  -0.756   2.995  -1.660
   25   HD21  LEU  42          1HD2      LEU  42  -1.307  -0.557  -1.983
   26   HD22  LEU  42          2HD2      LEU  42  -1.862   0.556  -3.234
   27   HD23  LEU  42          3HD2      LEU  42  -1.990   1.006  -1.533
   28    HA   PRO  43           HA       PRO  43   1.301   0.745  -8.831
   29    HB2  PRO  43          1HB       PRO  43  -0.270  -1.017 -10.172
   30    HB3  PRO  43          2HB       PRO  43   1.297  -1.459  -9.483
   31    HG2  PRO  43          1HG       PRO  43  -1.451  -1.914  -8.385
   32    HG3  PRO  43          2HG       PRO  43  -0.065  -3.019  -8.425
   33    HD2  PRO  43          1HD       PRO  43  -0.759  -1.634  -6.205
   34    HD3  PRO  43          2HD       PRO  43   0.926  -2.046  -6.586
   35    H    ALA  44           H        ALA  44  -0.061   2.667  -7.934
   36    HA   ALA  44           HA       ALA  44  -2.315   2.999  -9.763
   37    HB1  ALA  44          1HB       ALA  44  -2.475   3.320  -6.781
   38    HB2  ALA  44          2HB       ALA  44  -3.597   4.129  -7.876
   39    HB3  ALA  44          3HB       ALA  44  -3.512   2.367  -7.844
   40    H    PHE  45           H        PHE  45  -0.589   4.694  -7.136
   41    HA   PHE  45           HA       PHE  45  -0.924   7.275  -8.136
   42    HB2  PHE  45          1HB       PHE  45   0.809   7.948  -6.613
   43    HB3  PHE  45          2HB       PHE  45  -0.124   6.674  -5.836
   44    HD1  PHE  45           HD1      PHE  45   0.809   4.317  -5.876
   45    HD2  PHE  45           HD2      PHE  45   3.115   7.750  -6.884
   46    HE1  PHE  45           HE1      PHE  45   2.876   3.038  -5.491
   47    HE2  PHE  45           HE2      PHE  45   5.185   6.477  -6.501
   48    HZ   PHE  45           HZ       PHE  45   5.067   4.117  -5.804
   49    H    SER  46           H        SER  46   1.135   4.738  -9.184
   50    HA   SER  46           HA       SER  46   3.291   6.052 -10.297
   51    HB2  SER  46          1HB       SER  46   3.482   4.168 -11.839
   52    HB3  SER  46          2HB       SER  46   3.029   3.588 -10.236
   53    HG   SER  46           HG       SER  46   1.795   2.659 -11.978
   54    H    GLN  47           H        GLN  47   0.058   5.583 -11.657
   55    HA   GLN  47           HA       GLN  47   0.054   7.970 -13.104
   56    HB2  GLN  47          1HB       GLN  47   1.427   5.789 -14.417
   57    HB3  GLN  47          2HB       GLN  47   0.024   6.294 -15.350
   58    HG2  GLN  47          1HG       GLN  47   0.864   8.394 -15.739
   59    HG3  GLN  47          2HG       GLN  47   1.901   8.360 -14.314
   60   HE21  GLN  47          1HE2      GLN  47   4.375   6.291 -15.963
   61   HE22  GLN  47          2HE2      GLN  47   3.476   6.336 -14.488
   62    H    VAL  48           H        VAL  48  -2.018   7.999 -12.202
   63    HA   VAL  48           HA       VAL  48  -4.006   6.553 -13.768
   64    HB   VAL  48           HB       VAL  48  -3.875   6.413 -10.755
   65   HG11  VAL  48          1HG1      VAL  48  -6.016   4.877 -11.556
   66   HG12  VAL  48          2HG1      VAL  48  -6.107   6.471 -10.804
   67   HG13  VAL  48          3HG1      VAL  48  -6.155   6.320 -12.561
   68   HG21  VAL  48          1HG2      VAL  48  -2.513   4.773 -12.015
   69   HG22  VAL  48          2HG2      VAL  48  -3.803   4.023 -11.076
   70   HG23  VAL  48          3HG2      VAL  48  -3.980   4.216 -12.820
   71    H    ASP  49           H        ASP  49  -3.822   8.608 -10.854
   72    HA   ASP  49           HA       ASP  49  -5.160  10.773 -12.208
   73    HB2  ASP  49          1HB       ASP  49  -6.760   8.874 -10.910
   74    HB3  ASP  49          2HB       ASP  49  -6.674  10.238  -9.799
   75    HA   PRO  50           HA       PRO  50  -2.303  12.515  -9.205
   76    HB2  PRO  50          1HB       PRO  50  -2.293  14.993 -10.313
   77    HB3  PRO  50          2HB       PRO  50  -1.346  13.648 -10.959
   78    HG2  PRO  50          1HG       PRO  50  -3.985  14.719 -11.880
   79    HG3  PRO  50          2HG       PRO  50  -2.586  14.211 -12.844
   80    HD2  PRO  50          1HD       PRO  50  -4.758  12.634 -12.485
   81    HD3  PRO  50          2HD       PRO  50  -3.120  11.976 -12.671
   82    H    GLU  51           H        GLU  51  -5.490  13.618 -10.116
   83    HA   GLU  51           HA       GLU  51  -5.733  15.625  -8.107
   84    HB2  GLU  51          1HB       GLU  51  -7.237  14.778 -10.307
   85    HB3  GLU  51          2HB       GLU  51  -8.264  14.471  -8.914
   86    HG2  GLU  51          1HG       GLU  51  -7.941  16.812  -8.204
   87    HG3  GLU  51          2HG       GLU  51  -7.005  17.098  -9.670
   88    H    VAL  52           H        VAL  52  -6.145  12.190  -8.177
   89    HA   VAL  52           HA       VAL  52  -7.738  12.047  -5.783
   90    HB   VAL  52           HB       VAL  52  -7.052  10.253  -7.837
   91   HG11  VAL  52          1HG1      VAL  52  -5.089   9.615  -6.502
   92   HG12  VAL  52          2HG1      VAL  52  -6.152   9.215  -5.151
   93   HG13  VAL  52          3HG1      VAL  52  -6.248   8.294  -6.652
   94   HG21  VAL  52          1HG2      VAL  52  -8.815   8.964  -6.977
   95   HG22  VAL  52          2HG2      VAL  52  -8.530   9.516  -5.327
   96   HG23  VAL  52          3HG2      VAL  52  -9.210  10.621  -6.521
   97    H    PHE  53           H        PHE  53  -4.345  11.944  -6.602
   98    HA   PHE  53           HA       PHE  53  -3.356  10.812  -4.227
   99    HB2  PHE  53          1HB       PHE  53  -2.198  11.467  -6.532
  100    HB3  PHE  53          2HB       PHE  53  -1.766  12.911  -5.622
  101    HD1  PHE  53           HD1      PHE  53  -1.688   9.197  -5.346
  102    HD2  PHE  53           HD2      PHE  53   0.158  12.903  -4.357
  103    HE1  PHE  53           HE1      PHE  53   0.194   7.984  -4.326
  104    HE2  PHE  53           HE2      PHE  53   2.043  11.696  -3.337
  105    HZ   PHE  53           HZ       PHE  53   2.064   9.233  -3.321
  106    H    ALA  54           H        ALA  54  -3.767  14.218  -5.169
  107    HA   ALA  54           HA       ALA  54  -2.851  15.325  -2.750
  108    HB1  ALA  54          1HB       ALA  54  -4.829  16.531  -4.680
  109    HB2  ALA  54          2HB       ALA  54  -3.838  17.393  -3.502
  110    HB3  ALA  54          3HB       ALA  54  -3.076  16.580  -4.868
  111    H    ALA  55           H        ALA  55  -5.845  13.853  -3.623
  112    HA   ALA  55           HA       ALA  55  -7.533  15.072  -1.712
  113    HB1  ALA  55          1HB       ALA  55  -7.861  12.265  -2.732
  114    HB2  ALA  55          2HB       ALA  55  -9.109  13.408  -2.235
  115    HB3  ALA  55          3HB       ALA  55  -8.209  13.679  -3.728
  116    H    LEU  56           H        LEU  56  -5.388  12.282  -1.583
  117    HA   LEU  56           HA       LEU  56  -6.255  11.475   1.036
  118    HB2  LEU  56          1HB       LEU  56  -3.634  10.620  -0.070
  119    HB3  LEU  56          2HB       LEU  56  -4.841   9.691   0.817
  120    HG   LEU  56           HG       LEU  56  -4.942  10.471  -2.096
  121   HD11  LEU  56          1HD1      LEU  56  -3.401   8.615  -1.431
  122   HD12  LEU  56          2HD1      LEU  56  -4.683   8.149  -2.548
  123   HD13  LEU  56          3HD1      LEU  56  -4.812   7.739  -0.838
  124   HD21  LEU  56          1HD2      LEU  56  -7.011   9.495  -0.226
  125   HD22  LEU  56          2HD2      LEU  56  -6.940   8.708  -1.803
  126   HD23  LEU  56          3HD2      LEU  56  -7.169  10.454  -1.698
  127    HA   PRO  57           HA       PRO  57  -3.660  13.941   3.574
  128    HB2  PRO  57          1HB       PRO  57  -2.973  12.196   5.537
  129    HB3  PRO  57          2HB       PRO  57  -4.596  12.879   5.383
  130    HG2  PRO  57          1HG       PRO  57  -3.575  10.204   4.508
  131    HG3  PRO  57          2HG       PRO  57  -5.102  10.610   5.313
  132    HD2  PRO  57          1HD       PRO  57  -4.935  10.157   2.648
  133    HD3  PRO  57          2HD       PRO  57  -6.098  11.299   3.352
  134    H    ALA  58           H        ALA  58  -1.573  14.566   3.652
  135    HA   ALA  58           HA       ALA  58   0.398  13.443   2.092
  136    HB1  ALA  58          1HB       ALA  58   0.212  15.584   3.979
  137    HB2  ALA  58          2HB       ALA  58   1.738  14.728   4.205
  138    HB3  ALA  58          3HB       ALA  58   1.323  15.387   2.623
  139    H    GLU  59           H        GLU  59  -0.469  12.695   5.398
  140    HA   GLU  59           HA       GLU  59   1.823  11.307   6.191
  141    HB2  GLU  59          1HB       GLU  59   0.117  11.901   7.794
  142    HB3  GLU  59          2HB       GLU  59  -1.068  10.901   6.965
  143    HG2  GLU  59          1HG       GLU  59  -0.250   9.838   8.998
  144    HG3  GLU  59          2HG       GLU  59   0.159   8.900   7.564
  145    H    LEU  60           H        LEU  60  -1.009  10.236   4.380
  146    HA   LEU  60           HA       LEU  60  -0.017   7.514   4.226
  147    HB2  LEU  60          1HB       LEU  60  -2.295   7.445   4.363
  148    HB3  LEU  60          2HB       LEU  60  -2.504   8.935   3.445
  149    HG   LEU  60           HG       LEU  60  -1.481   6.603   1.942
  150   HD11  LEU  60          1HD1      LEU  60  -4.298   6.747   2.998
  151   HD12  LEU  60          2HD1      LEU  60  -3.115   5.471   3.282
  152   HD13  LEU  60          3HD1      LEU  60  -3.781   5.712   1.667
  153   HD21  LEU  60          1HD2      LEU  60  -2.173   7.834   0.226
  154   HD22  LEU  60          2HD2      LEU  60  -2.522   9.123   1.379
  155   HD23  LEU  60          3HD2      LEU  60  -3.791   7.991   0.909
  156    H    GLN  61           H        GLN  61  -0.408  10.320   2.127
  157    HA   GLN  61           HA       GLN  61   0.344   9.049  -0.282
  158    HB2  GLN  61          1HB       GLN  61  -0.123  11.045  -1.177
  159    HB3  GLN  61          2HB       GLN  61  -0.557  11.566   0.445
  160    HG2  GLN  61          1HG       GLN  61   1.588  12.512   0.808
  161    HG3  GLN  61          2HG       GLN  61   2.229  11.775  -0.660
  162   HE21  GLN  61          1HE2      GLN  61  -0.548  14.681  -1.356
  163   HE22  GLN  61          2HE2      GLN  61  -0.874  13.380  -0.268
  164    H    ARG  62           H        ARG  62   2.151  10.238   2.408
  165    HA   ARG  62           HA       ARG  62   4.657  10.334   0.951
  166    HB2  ARG  62          1HB       ARG  62   5.631  11.155   2.942
  167    HB3  ARG  62          2HB       ARG  62   4.038  11.894   2.859
  168    HG2  ARG  62          1HG       ARG  62   3.753  11.203   4.949
  169    HG3  ARG  62          2HG       ARG  62   3.596   9.575   4.285
  170    HD2  ARG  62          1HD       ARG  62   5.954   9.173   4.601
  171    HD3  ARG  62          2HD       ARG  62   6.202  10.839   5.124
  172    HE   ARG  62           HE       ARG  62   4.329   9.785   6.844
  173   HH11  ARG  62          1HH1      ARG  62   7.607   9.061   5.923
  174   HH12  ARG  62          2HH1      ARG  62   8.030   8.388   7.462
  175   HH21  ARG  62          1HH2      ARG  62   4.873   8.902   8.876
  176   HH22  ARG  62          2HH2      ARG  62   6.474   8.297   9.141
  177    H    GLU  63           H        GLU  63   2.831   8.078   2.796
  178    HA   GLU  63           HA       GLU  63   5.001   6.403   3.595
  179    HB2  GLU  63          1HB       GLU  63   2.962   6.281   4.845
  180    HB3  GLU  63          2HB       GLU  63   2.028   5.930   3.398
  181    HG2  GLU  63          1HG       GLU  63   2.507   3.745   3.462
  182    HG3  GLU  63          2HG       GLU  63   4.179   4.021   3.946
  183    H    LEU  64           H        LEU  64   2.977   6.653   0.765
  184    HA   LEU  64           HA       LEU  64   3.851   4.117  -0.319
  185    HB2  LEU  64          1HB       LEU  64   2.429   4.575  -2.156
  186    HB3  LEU  64          2HB       LEU  64   1.576   5.079  -0.698
  187    HG   LEU  64           HG       LEU  64   2.654   7.428  -1.397
  188   HD11  LEU  64          1HD1      LEU  64   2.789   5.725  -3.790
  189   HD12  LEU  64          2HD1      LEU  64   3.682   7.190  -3.382
  190   HD13  LEU  64          3HD1      LEU  64   2.044   7.307  -4.024
  191   HD21  LEU  64          1HD2      LEU  64   0.201   6.561  -1.106
  192   HD22  LEU  64          2HD2      LEU  64   0.203   6.580  -2.870
  193   HD23  LEU  64          3HD2      LEU  64   0.522   8.064  -1.971
  194    H    LYS  65           H        LYS  65   4.486   7.548  -0.833
  195    HA   LYS  65           HA       LYS  65   6.150   7.214  -3.108
  196    HB2  LYS  65          1HB       LYS  65   6.031   9.473  -1.102
  197    HB3  LYS  65          2HB       LYS  65   6.868   9.536  -2.647
  198    HG2  LYS  65          1HG       LYS  65   4.871   9.504  -3.862
  199    HG3  LYS  65          2HG       LYS  65   3.934   8.946  -2.474
  200    HD2  LYS  65          1HD       LYS  65   3.407  11.077  -2.091
  201    HD3  LYS  65          2HD       LYS  65   5.093  11.340  -1.641
  202    HE2  LYS  65          1HE       LYS  65   5.643  11.952  -3.912
  203    HE3  LYS  65          2HE       LYS  65   4.008  11.566  -4.446
  204    HZ1  LYS  65          1HZ       LYS  65   3.213  13.333  -2.918
  205    HZ2  LYS  65          2HZ       LYS  65   4.172  13.910  -4.185
  206    HZ3  LYS  65          3HZ       LYS  65   4.822  13.766  -2.630
  207    H    ALA  66           H        ALA  66   6.784   7.437   0.361
  208    HA   ALA  66           HA       ALA  66   9.630   7.385   0.086
  209    HB1  ALA  66          1HB       ALA  66   8.194   8.260   2.054
  210    HB2  ALA  66          2HB       ALA  66   8.207   6.580   2.591
  211    HB3  ALA  66          3HB       ALA  66   9.726   7.456   2.399
  212    H    ALA  67           H        ALA  67   7.206   4.969   1.066
  213    HA   ALA  67           HA       ALA  67   8.845   2.825   1.597
  214    HB1  ALA  67          1HB       ALA  67   6.138   2.808   0.269
  215    HB2  ALA  67          2HB       ALA  67   6.936   1.391   0.952
  216    HB3  ALA  67          3HB       ALA  67   6.470   2.731   2.000
  217    H    TYR  68           H        TYR  68   7.627   3.901  -1.553
  218    HA   TYR  68           HA       TYR  68   8.656   1.782  -3.080
  219    HB2  TYR  68          1HB       TYR  68   7.532   4.439  -3.592
  220    HB3  TYR  68          2HB       TYR  68   8.716   3.937  -4.794
  221    HD1  TYR  68           HD1      TYR  68   5.678   2.684  -3.024
  222    HD2  TYR  68           HD2      TYR  68   8.034   2.605  -6.566
  223    HE1  TYR  68           HE1      TYR  68   3.965   1.306  -4.125
  224    HE2  TYR  68           HE2      TYR  68   6.327   1.227  -7.677
  225    HH   TYR  68           HH       TYR  68   4.513  -0.298  -7.073
  226    H    ASP  69           H        ASP  69  10.124   4.699  -1.843
  227    HA   ASP  69           HA       ASP  69  12.514   4.426  -3.439
  228    HB2  ASP  69          1HB       ASP  69  11.468   6.607  -2.487
  229    HB3  ASP  69          2HB       ASP  69  12.296   6.162  -0.997
  230    H    GLN  70           H        GLN  70  11.517   3.757  -0.123
  231    HA   GLN  70           HA       GLN  70  13.941   3.195   1.058
  232    HB2  GLN  70          1HB       GLN  70  11.266   1.849   1.450
  233    HB3  GLN  70          2HB       GLN  70  12.653   1.585   2.499
  234    HG2  GLN  70          1HG       GLN  70  11.059   4.093   2.110
  235    HG3  GLN  70          2HG       GLN  70  11.323   3.174   3.591
  236   HE21  GLN  70          1HE2      GLN  70  13.827   6.114   2.514
  237   HE22  GLN  70          2HE2      GLN  70  12.390   5.721   1.640
  238    H    ARG  71           H        ARG  71  11.832   0.899  -0.669
  239    HA   ARG  71           HA       ARG  71  14.063  -0.998  -0.782
  240    HB2  ARG  71          1HB       ARG  71  12.360  -2.638  -1.498
  241    HB3  ARG  71          2HB       ARG  71  11.975  -1.908   0.055
  242    HG2  ARG  71          1HG       ARG  71  10.692  -0.263  -1.734
  243    HG3  ARG  71          2HG       ARG  71  10.498  -1.867  -2.446
  244    HD2  ARG  71          1HD       ARG  71  10.034  -1.689   0.458
  245    HD3  ARG  71          2HD       ARG  71   8.867  -0.839  -0.554
  246    HE   ARG  71           HE       ARG  71   9.101  -3.654  -0.217
  247   HH11  ARG  71          1HH1      ARG  71   8.285  -1.186  -2.533
  248   HH12  ARG  71          2HH1      ARG  71   7.240  -2.215  -3.456
  249   HH21  ARG  71          1HH2      ARG  71   7.727  -5.018  -1.424
  250   HH22  ARG  71          2HH2      ARG  71   6.922  -4.394  -2.824
  251    H    GLN  72           H        GLN  72  14.419   1.195  -2.386
  252    HA   GLN  72           HA       GLN  72  13.780   0.224  -5.090
  253    HB2  GLN  72          1HB       GLN  72  13.297   2.692  -4.048
  254    HB3  GLN  72          2HB       GLN  72  14.867   2.948  -4.798
  255    HG2  GLN  72          1HG       GLN  72  13.172   1.513  -6.598
  256    HG3  GLN  72          2HG       GLN  72  12.340   2.955  -6.019
  257   HE21  GLN  72          1HE2      GLN  72  14.269   5.192  -7.832
  258   HE22  GLN  72          2HE2      GLN  72  13.010   4.936  -6.677