*HEADER    METAL BINDING PROTEIN                   20-NOV-03   1RJV              
*TITLE     SOLUTION STRUCTURE OF HUMAN ALPHA-PARVALBUMIN REFINED WITH            
*TITLE    2 A PARAMAGNETISM-BASED STRATEGY                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PARVALBUMIN ALPHA;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: PVALB;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PQE-30 XA                                 
*KEYWDS    CALCIUM, PARVALBUMIN, EF-HAND, NMR, LANTHANIDE                        
*EXPDTA    NMR, 19 STRUCTURES                                                    
*AUTHOR    I.BAIG, I.BERTINI, C.DEL BIANCO, Y.K.GUPTA, Y.M.LEE,                  
*AUTHOR   2 C.LUCHINAT, A.QUATTRONE                                              
*REVDAT   1   25-MAY-04 1RJV    0                                                


#13c_Parvalbumin.upl
  1 MET  
         HA      1 MET  QB      6.30  # m   2   205900.0*2    cleanJun1590
         HA      1 MET  QG      5.90  # i   1    59550.0*2    cleanJun4396
         HA      2 SER  HA      6.40  #     2    66480.0      cleanJun4391
         HA      2 SER  QB      6.90  # m   2   111150.0*2    cleanJun1592
         QB      1 MET  QG      6.20  # mm  1   247950.0*4    cleanJun4394
         QB      2 SER  HA      7.50  # m w 2    12380.0*2    cleanJun4837
         QB      6 LEU  HG      7.50  # m w 5    83900.0*2    cleanJun4392
         QB     46 LYS+ HB3     7.40  # m   5   384900.0*2    cleanJun3766
         QB     46 LYS+ HG2     7.40  # m   5   393200.0*2    cleanJun3765
         QG      5 ASP- QB      8.50  # mmw 5    37200.0*4    cleanJun4397
         QG      6 LEU  HG      7.50  # m w 5    44140.0*2    cleanJun4839
         QG      6 LEU  QD1     8.50  # m w 5M   39700.0*2    cleanJun4838
         QG     46 LYS+ HB3     7.10  # m   5   523000.0*2    cleanJun4840
  2 SER  
         HA      2 SER  QB      5.80  # m   2   377350.0*2    cleanJun2736
         HA      3 MET  HA      5.20  #     2   226900.0      cleanJun3351
         HA      3 MET  QB      6.90  # m   2   114600.0*2    cleanJun3930
         HA      4 THR  HB      4.90  #     3   418000.0      cleanJun4842
         HA      4 THR  QG2     7.50  #   w 5M  268800.0      cleanJun4843
         HA      5 ASP- QB      7.50  # m w 3    14515.0*2    cleanJun4841
         QB      3 MET  HA      6.20  # m   2   231450.0*2    cleanJun3768
         QB      4 THR  QG2     8.50  # m w 5M  139250.0*2    cleanJun3769
  3 MET  
         HA      3 MET  QB      5.70  # m   2   447450.0*2    cleanJun2737
         HA      3 MET  QG      4.00  # i   1   954000.0*2    cleanJun2738
         HA      4 THR  HB      5.40  #     2   193600.0      cleanJun3770
         HA      5 ASP- QB      7.50  # m w 3     4887.5*2    cleanJun4399
         HA      6 LEU  HB2     4.80  #     3   461700.0      cleanJun3771
         HA      6 LEU  HB3     5.40  #     3   236900.0      cleanJun3772
         HA      6 LEU  HG      6.50  #   w 5    48790.0      cleanJun4400
         HA      6 LEU  QD1     7.50  #   w 5M   24280.0      cleanJun4846
         HA      7 LEU  QB      6.90  # m   3   143200.0*2    cleanJun3775
         HA      7 LEU  HG      6.50  #   w 5   192100.0      cleanJun3774
         HA      7 LEU  QD1     7.50  #   w 5M  105600.0      cleanJun3936
         HA     47 VAL  QG1     7.50  #   w 5M   97810.0      cleanJun3940
         HB3     6 LEU  HB3     6.50  #   w 5    38620.0      cleanJun4851
         QB      3 MET  QG      5.60  # mm  1   619250.0*4    cleanJun2740
         QB      4 THR  HB      7.50  # m w 5    38900.0*2    cleanJun3931
         QB      4 THR  QG2     8.50  # m w 5M  139200.0*2    cleanJun3941
         QB      6 LEU  HG      7.50  # m w 5   150900.0*2    cleanJun3934
         QB      6 LEU  QD1     8.50  # m w 5M  111850.0*2    cleanJun3935
         QB      7 LEU  HG      7.50  # m w 5    56250.0*2    cleanJun4405
         QB      7 LEU  QD1     8.50  # m w 5M  206100.0*2    cleanJun3938
         QB     12 ILE  QD1     8.50  # m w 5M  282200.0*2    cleanJun3942
         QB     71 PHE  HA      7.50  # m w 5   114350.0*2    cleanJun3779
         QB     71 PHE  HB3     7.50  # m w 5   178150.0*2    cleanJun4408
         QG      4 THR  QG2     8.50  # m w 5M   24755.0*2    cleanJun3960
         QG      6 LEU  HB2     7.40  # m   5   371900.0*2    cleanJun3945
         QG      6 LEU  HG      7.50  # m w 5    48890.0*2    cleanJun3933
         QG      7 LEU  QB      8.50  # mmw 5    37650.0*4    cleanJun4848
         QG      7 LEU  HG      7.50  # m w 5    72600.0*2    cleanJun4406
         QG      7 LEU  QD1     8.50  # m w 5M   20725.0*2    cleanJun3939
         QG     12 ILE  QD1     8.50  # m w 5M  336900.0*2    cleanJun3944
         QG     47 VAL  HA      7.50  # m w 5    65450.0*2    cleanJun3947
         QG     47 VAL  QG1     8.50  # m w 5M  137200.0*2    cleanJun3946
         QG     47 VAL  QG2     8.50  # m w 5M  191200.0*2    cleanJun3948
         QG     71 PHE  HA      7.50  # m w 5   131900.0*2    cleanJun3780
         QG     71 PHE  HB2     7.50 ># m w 5    49290.0*2    cleanJun4849
         QG     71 PHE  HB3     7.50 <# m w 5   232000.0*2    cleanJun5096
         QG     71 PHE  QD      9.50  # mrw 5    17230.0*4    cleanJun5098
  4 THR  
         HA      4 THR  HB      4.10  #     2   971400.0      cleanJun1560
         HA      4 THR  QG2     3.40  #   s 1M 1011000.0      cleanJun2358
         HA      5 ASP- HA      5.70  #     2   141700.0      cleanJun4409
         HA      9 ALA  HA      3.50  #     4   163900.0      cleanJun3954
         HA     12 ILE  QD1     7.50  #   w 5M   75650.0      cleanJun3952
         HB      4 THR  QG2     3.40  #   s 1M  991000.0      cleanJun1559
         HB      9 ALA  HA      6.50  #   w 5    26130.0      cleanJun3949
         HB      9 ALA  QB      7.50  #   w 5M   47270.0      cleanJun4853
         HB     12 ILE  QD1     7.50  #   w 5M   25700.0      cleanJun4411
         QG2     9 ALA  HA      7.50  #     5M  431800.0      cleanJun3950
         QG2     9 ALA  QB      7.60  # m   5M  964600.0      cleanJun3955
         QG2    12 ILE  QG2     7.70  # m   5M  866700.0      cleanJun3957
         QG2    12 ILE  HG13    7.50  #   w 5M  112800.0    ! cleanJun3959
         QG2    12 ILE  QD1     7.90  # m   5M  738100.0      cleanJun3953
  5 ASP- 
         HA      5 ASP- QB      5.50  # i   2   339350.0*2    cleanJun3995
         HA      6 LEU  HA      5.10  #     2   257700.0      cleanJun4412
         QB      6 LEU  QD1     8.50  # m w 5M   23200.0*2    cleanJun4854
  6 LEU  
         HA      6 LEU  HB2     4.00  #     2  1203000.0      cleanJun2745
         HA      6 LEU  HB3     4.20  #     2   845900.0      cleanJun2744
         HA      6 LEU  HG      4.90  #     1    95680.0      cleanJun3354
         HA      6 LEU  QD1     3.90  #     1M  301000.0      cleanJun3961
         HB2     6 LEU  HG      3.40  #     1   890500.0      cleanJun2246
         HB2     6 LEU  QD1     3.80  #     1M  311300.0      cleanJun2154
         HB2     7 LEU  QB      7.50  # m w 5    83500.0*2    cleanJun3962
         HB2     7 LEU  HG      5.80 <#     5   667500.0      cleanJun3963
         HB2     7 LEU  QD1     7.50  #   w 5M  354000.0      cleanJun3964
         HB2    39 LYS+ QG      6.70  # m   5   789000.0*2    cleanJun4416
         HB2    46 LYS+ HG2     5.90  #     5   628900.0    ! cleanJun3967
         HB2    47 VAL  QG1     7.50  #   w 5M   36370.0      cleanJun3965
         HB3     6 LEU  HG      3.70  #     1   566400.0      cleanJun2244
         HB3     6 LEU  QD1     3.80  #     1M  352500.0      cleanJun2152
         HB3     7 LEU  QB      7.50  # m w 5    92700.0*2    cleanJun4413
         HB3     7 LEU  HG      6.50 >#   w 5   135400.0      cleanJun4414
         HB3     7 LEU  QD1     7.20  #     5M  579200.0      cleanJun4415
         HB3    47 VAL  QG2     7.50  #   w 5M  187800.0      cleanJun4855
         HG      6 LEU  QD1     3.40  #   s 1M41720000.0      cleanJun3360
         HG     46 LYS+ HB2     6.50  #   w 5   130000.0      cleanJun4417
         HG     47 VAL  QG1     7.20  #     5M  587700.0    ! cleanJun4418
         QD1     7 LEU  HG      7.50  #   w 5M  283000.0      cleanJun3971
         QD1    43 ASP- HA      7.50  #   w 5M  171500.0      cleanJun3972
         QD1    43 ASP- HB2     7.50  #   w 5M  234400.0      cleanJun3973
         QD1    46 LYS+ HB2     7.50  #   w 5M   64050.0      cleanJun4858
         QD1    46 LYS+ HB3     7.50  #   w 5M  257200.0      cleanJun3968
         QD1    46 LYS+ QD      8.50  # m w 5M   92600.0*2    cleanJun4856
         QD1    46 LYS+ QE      8.50  # m w 5M   68900.0*2    cleanJun3969
         QD1    47 VAL  HA      7.50  #   w 5M   79550.0      cleanJun4857
         QD1    47 VAL  QG2     7.40  # m   5M 1127000.0      cleanJun3970
  7 LEU  
         HA      7 LEU  QB      7.40  # m   2    67150.0*2    cleanJun2751
         HA      7 LEU  HG      6.50  #   w 1    13850.0      cleanJun2756
         HA      7 LEU  QD1     4.30  #     1M  159900.0      cleanJun2759
         HA      8 ASN  HA      5.00  #     2   298600.0      cleanJun4421
         HA     11 ASP- QB      6.30  # m   3   262850.0*2    cleanJun3975
         HA     34 VAL  QG2     7.50  #   w 5M  151400.0      cleanJun3980
         HA     39 LYS+ QD      7.50  # m w 5    41805.0*2    cleanJun4420
         HB3     7 LEU  QD1     4.60  #     1M  105900.0      cleanJun4430
         QB      7 LEU  HG      4.30  # m   1  1001000.0*2    cleanJun2755
         QB      7 LEU  QD1     4.40  # m s 1M  776000.0*2    cleanJun2757
         QB     11 ASP- QB      8.50  # mmw 5    56725.0*4    cleanJun4422
         QB     12 ILE  QG2     8.50  # m w 5M  103050.0*2    cleanJun3978
         QB     12 ILE  HG12    7.50 <# m w 5   277900.0*2    cleanJun4423
         QB     12 ILE  HG13    7.50 ># m w 5    80650.0*2    cleanJun4424
         QB     12 ILE  QD1     8.50  # m w 5M  286150.0*2    cleanJun3979
         QB     34 VAL  QG1     8.50  # m w 5M  211100.0*2    cleanJun3982
         QB     34 VAL  QG2     8.50  # m w 5M  285650.0*2    cleanJun3981
         QB     39 LYS+ QD      8.50  # mmw 5   158400.0*4    cleanJun4425
         QB     71 PHE  QE      9.50  # mrw 5     4860.0*4    cleanJun5099
         HG      7 LEU  QD1     3.40  #   s 1M  771500.0      cleanJun2754
         HG      8 ASN  QB      7.50  # m w 5   171750.0*2    cleanJun3974
         HG     12 ILE  QD1     7.50  #   w 5M  424100.0      cleanJun4426
         HG     34 VAL  QG1     7.50  #   w 5M  322400.0      cleanJun4427
         HG     36 LEU  QD2     6.70  #     5M  858700.0      cleanJun3984
         HG     39 LYS+ QD      7.50  # m w 5    80200.0*2    cleanJun4860
         HG     47 VAL  QG2     7.10  #     5M  616300.0      cleanJun4861
         HG     71 PHE  QD      8.50  # r w 5    12730.0*2    cleanJun5101
         HG     71 PHE  QE      8.50  # r w 5    12015.0*2    cleanJun5100
         QD1    11 ASP- QB      8.50  # m w 5M   26245.0*2    cleanJun4432
         QD1    12 ILE  HG12    5.80  #     5M 2015000.0      cleanJun3985
         QD1    34 VAL  HA      7.50  #   w 5M  231800.0      cleanJun4864
         QD1    34 VAL  QG1     8.50  # m w 5M  274800.0      cleanJun4862
         QD1    36 LEU  HG      6.70  #     5M  878700.0      cleanJun3986
         QD1    36 LEU  QD2     8.50  # m w 5M  182100.0      cleanJun4863
         QD1    47 VAL  QG2     7.10  # m   5M 1547000.0      cleanJun4429
  8 ASN  
         HA      8 ASN  QB      4.80  # i   2   870500.0*2    cleanJun2761
         HA      9 ALA  HA      5.70  #     2   129600.0      cleanJun3361
         HA      9 ALA  QB      6.80  #     2M   16710.0      cleanJun1699
         HA     10 GLU- QB      7.50  # m w 3    40175.0*2    cleanJun4434
         HA     11 ASP- QB      7.50  # m   3    77100.0*2    cleanJun4433
         QB     11 ASP- HA      7.50  # m w 3    48275.0*2    cleanJun4435
         QB     11 ASP- QB      7.50  # mm  5   999750.0*4    cleanJun3363
         QB     12 ILE  HG12    7.50  # m w 5   111250.0*2    cleanJun4085
  9 ALA  
         HA      9 ALA  QB      3.40  #   s 2M 1563000.0      cleanJun1700
         HA     10 GLU- HA      5.90  #     2   110100.0      cleanJun4436
         HA     10 GLU- QG      7.50  # m w 5    45155.0*2    cleanJun4437
         HA     12 ILE  HB      5.00  #     3   386900.0      cleanJun4086
         HA     12 ILE  QG2     7.50  #   w 5M  321700.0      cleanJun4088
         HA     12 ILE  HG12    6.10 <#     5   483400.0      cleanJun4089
         HA     12 ILE  HG13    6.50 >#   w 5     5778.0      cleanJun4865
         HA     12 ILE  QD1     6.60  #     5M  968000.0      cleanJun4090
         HA     13 LYS+ QB      6.30  # m   3   277050.0*2    cleanJun4091
         QB     10 GLU- HA      5.00  #     2M  112600.0      cleanJun4866
         QB     10 GLU- QG      8.50  # m w 5M   42150.0*2    cleanJun4094
         QB     12 ILE  HB      7.50  #   w 5M  152800.0      cleanJun4093
         QB     12 ILE  QG2     8.50  # m w 5M   90600.0      cleanJun4439
         QB     12 ILE  QD1     8.50  # m w 5M  310200.0      cleanJun4440
         QB     13 LYS+ QB      8.50  # m w 5M   69700.0*2    cleanJun4095
 10 GLU- 
         HA     10 GLU- QB      5.40  # m   2   641500.0*2    cleanJun2763
         HA     10 GLU- QG      4.80  # i   1   255450.0*2    cleanJun2764
         HA     11 ASP- HA      4.90  #     2   332400.0      cleanJun3365
         HA     13 LYS+ QB      6.00  # m   3   361150.0*2    cleanJun4096
         HA     13 LYS+ HG2     6.40  #     5   375400.0      cleanJun4097
         HA     13 LYS+ HG3     6.50  #   w 5   294000.0      cleanJun4099
         HA     13 LYS+ QE      7.50  # m w 5    46180.0*2    cleanJun3384
         HA     14 LYS+ QD      7.50  # m w 5   143250.0*2    cleanJun4167
         QB     10 GLU- QG      5.40  # mm  1   893750.0*4    cleanJun2765
         QB     11 ASP- HA      7.50  # m w 2    52350.0*2    cleanJun3366
         QB     13 LYS+ QB      8.10  # mm  5   492250.0*4    cleanJun4100
         QB     14 LYS+ QG      8.50  # mmw 5    41700.0*4    cleanJun4169
         QB     14 LYS+ QD      8.50  # mmw 5    25475.0*4    cleanJun4168
         QG     13 LYS+ QE      8.50  # mmw 5    45450.0*4    cleanJun4172
 11 ASP- 
         HA     11 ASP- QB      4.80  # i   2   893000.0*2    cleanJun2768
         HA     14 LYS+ HB2     4.90  #     3   412400.0      cleanJun4173
         HA     14 LYS+ QD      7.50  # m w 5    29120.0*2    cleanJun4174
         HA     34 VAL  HA      3.40  #     4   202200.0    ! cleanJun4176
         QB     12 ILE  HA      6.90  # m   2   110850.0*2    cleanJun4178
         QB     12 ILE  HB      7.50  # m w 5    41500.0*2    cleanJun4177
         QB     12 ILE  HG13    7.50  # m w 5    36430.0*2    cleanJun4179
         QB     34 VAL  HA      7.50  # m   5   341300.0*2    cleanJun4175
         QB     34 VAL  QG2     8.50  # m w 5M   92750.0*2    cleanJun4180
         QB     38 LYS+ QE      8.50  # mmw 5    66775.0*4    cleanJun4181
 12 ILE  
         HA     12 ILE  HB      5.40  #     2   187100.0      cleanJun3402
         HA     12 ILE  QG2     3.40  #   s 1M 1007000.0    ! cleanJun1934
         HA     12 ILE  HG12    3.80  #     1   463400.0      cleanJun1716
         HA     12 ILE  HG13    3.50  #     1   728600.0      cleanJun3401
         HA     12 ILE  QD1     3.40  #     1M  693100.0    ! cleanJun1718
         HA     13 LYS+ HA      5.40  #     2   183300.0      cleanJun4182
         HA     15 ALA  QB      3.40  #   s 3M  526600.0      cleanJun4184
         HA     16 VAL  QG1     7.50  #   w 5M   36590.0      cleanJun4186
         HA     16 VAL  QG2     7.50  #   w 5M   15500.0      cleanJun2636
         HA     34 VAL  HA      3.60  #     4   131800.0    ! cleanJun4188
         HA     34 VAL  QG1     7.50 >#   w 5M   82710.0      cleanJun4187
         HA     34 VAL  QG2     7.00 <#     5M  683700.0      cleanJun2135
         HA     71 PHE  HB2     6.50 >#   w 5    13880.0      cleanJun4189
         HA     71 PHE  HB3     6.50 <#   w 5    97260.0      cleanJun3426
         HA     71 PHE  QD      8.50  # r w 5     7280.0*2    cleanJun5102
         HB     12 ILE  QG2     3.40  #   s 1M 1430000.0      cleanJun3394
         HB     12 ILE  HG12    4.20  #     1   258800.0      cleanJun3415
         HB     12 ILE  HG13    3.80  #     1   435600.0      cleanJun3418
         HB     12 ILE  QD1     3.40  #     1M  714500.0      cleanJun1613
         HB     13 LYS+ HA      5.90  #     2   112000.0      cleanJun4190
         HB     16 VAL  QG2     7.50  #   w 5M  104300.0      cleanJun4191
         HB     71 PHE  HB3     6.50  #   w 5    66450.0      cleanJun4192
         QG2    12 ILE  HG12    3.70 >#     1M  386200.0      cleanJun3396
         QG2    12 ILE  HG13    3.40 <#   s 1M 3029000.0      cleanJun3409
         QG2    12 ILE  QD1     4.40  # m s 1M19470000.0    ! cleanJun3391
         QG2    13 LYS+ HA      7.50  #   w 5M  226600.0      cleanJun3431
         QG2    16 VAL  HA      7.50  #   w 5M   46820.0      cleanJun3838
         QG2    16 VAL  QG2     7.10  # m   5M 1485000.0      cleanJun3432
         QG2    34 VAL  HA      7.50  #   w 5M   54240.0      cleanJun1935
         QG2    71 PHE  HA      7.50  #   w 5M   45340.0      cleanJun4195
         QG2    71 PHE  HB2     7.50  #   w 5M  229100.0      cleanJun4196
         QG2    71 PHE  HB3     7.50  #   w 5M  405100.0      cleanJun4197
         QG2    72 SER  HA      7.50  #   w 5M   11390.0      cleanJun4959
         QG2    72 SER  QB      8.50  # m w 5M   17400.0*2    cleanJun4803
         HG12   12 ILE  QD1     3.40 >#   s 1M  832300.0      cleanJun3411
         HG12   13 LYS+ HA      6.50  #   w 5   225600.0      cleanJun3943
         HG13   12 ILE  QD1     3.40 <#   s 1M 9737000.0      cleanJun3414
         HG13   15 ALA  HA      6.40  #     5   390900.0    ! cleanJun4185
         HG13   16 VAL  QG2     7.50  #   w 5M  144400.0      cleanJun4194
         QD1    13 LYS+ HA      7.50  #   w 5M   65320.0      cleanJun3778
         QD1    34 VAL  QG1     8.50  # m w 5M  228000.0      cleanJun3434
         QD1    71 PHE  HA      7.50  #   w 5M  186900.0      cleanJun4199
         QD1    71 PHE  HB2     7.50 >#   w 5M    6395.0      cleanJun4947
         QD1    71 PHE  HB3     7.50 <#   w 5M   99370.0      cleanJun4202
 13 LYS+ 
         HA     13 LYS+ QB      5.70  # m   2   422750.0*2    cleanJun3372
         HA     13 LYS+ HG2     4.40 >#     1   192000.0      cleanJun3369
         HA     13 LYS+ HG3     3.40 <#     1   827900.0    ! cleanJun2377
         HA     13 LYS+ QD      6.20  # m   1    70700.0*2    cleanJun3371
         HA     13 LYS+ QE      5.90  # m   1    96400.0*2    cleanJun3379
         HA     16 VAL  HB      5.20  #     3   294200.0      cleanJun3437
         HA     16 VAL  QG1     7.50 >#   w 5M   60870.0      cleanJun4893
         HA     16 VAL  QG2     7.50 <#   w 5M  279500.0      cleanJun4203
         HA     72 SER  QB      7.50  # m w 5   233800.0*2    cleanJun4204
         HB2    13 LYS+ HG3     2.90  #     1  2329000.0      cleanJun2772
         QB     13 LYS+ HG2     4.10 <# m   1  1603500.0*2    cleanJun2181
         QB     13 LYS+ HG3     5.00 ># m   1   355800.0*2    cleanJun3377
         QB     13 LYS+ QD      8.10  # mm  1    25625.0*4    cleanJun3375
         QB     13 LYS+ QE      6.80  # mm  1   115575.0*4    cleanJun2778
         HG2    13 LYS+ QD      5.30  # m   1   208600.0*2    cleanJun3376
         HG2    13 LYS+ QE      4.30  # m   1   995500.0*2    cleanJun2777
         HG2    16 VAL  HB      6.50  #   w 5   273700.0      cleanJun3440
         HG2    16 VAL  QG2     7.50  #   w 5M   23460.0      cleanJun4895
         HG2    17 GLY  HA2     6.50  #   w 5     6209.0      cleanJun4897
         HG3    13 LYS+ QD      5.30  # m   1   215750.0*2    cleanJun3378
         HG3    13 LYS+ QE      4.40  # m   1   855000.0*2    cleanJun2776
         HG3    14 LYS+ QG      7.50  # m w 5    98150.0*2    cleanJun4205
         HG3    14 LYS+ QD      5.70  # m   5  2449000.0*2    cleanJun4206
         HG3    16 VAL  QG2     7.50  #   w 5M   44720.0      cleanJun4896
         QD     13 LYS+ QE      7.10  # mm  1    76275.0*4    cleanJun3380
 14 LYS+ 
         HA     14 LYS+ HB2     3.90  #     2  1290000.0      cleanJun4000
         HA     14 LYS+ HB3     4.40  #     2   618800.0      cleanJun4007
         HA     14 LYS+ QG      5.00  # i   1   182300.0*2    cleanJun4012
         HA     14 LYS+ QD      5.30  # m   1   211850.0*2    cleanJun3996
         HA     14 LYS+ QE      6.60  # m   1    42930.0*2    cleanJun4001
         HA     15 ALA  HA      4.80  #     2   377200.0      cleanJun4054
         HB2    14 LYS+ QG      4.90 <# m   1   387650.0*2    cleanJun4005
         HB2    14 LYS+ QD      4.50 ># m   1   759000.0*2    cleanJun4019
         HB2    14 LYS+ QE      5.40  # m   1   189700.0*2    cleanJun4002
         HB2    33 MET  HG3     6.50  #   w 5   248300.0      cleanJun4207
         HB3    14 LYS+ QG      5.70 ># m   1   123900.0*2    cleanJun4014
         HB3    14 LYS+ QD      3.80 <# m   1  2950500.0*2    cleanJun4018
         HB3    14 LYS+ QE      5.90  # m   1    94350.0*2    cleanJun4008
         QG     14 LYS+ QD      5.60  # mm  1   629750.0*4    cleanJun4013
         QD     14 LYS+ QE      6.90  # mm  1    99375.0*4    cleanJun4020
 15 ALA  
         HA     15 ALA  QB      3.40  #   s 2M 1504000.0      cleanJun2780
         HA     16 VAL  HA      5.40  #     2   180400.0      cleanJun3441
         HA     18 ALA  QB      3.90  #     3M  102100.0      cleanJun1653
         HA     30 PHE  HA      3.00  #     4   401100.0      cleanJun3443
         HA     33 MET  QB      7.50  # m w 5   261800.0*2    cleanJun3445
         HA     33 MET  HG2     5.80 <#     5   677200.0      cleanJun3444
         HA     33 MET  HG3     6.50 >#   w 5    18190.0      cleanJun3446
         QB     16 VAL  HA      4.60  #     2M  182100.0    ! cleanJun3448
         QB     16 VAL  HB      7.20  #     5M  565000.0      cleanJun3452
         QB     16 VAL  QG1     7.10  # m   5M 1626000.0      cleanJun3456
         QB     19 PHE  QD      9.50  # r w 5M   17235.0*2    cleanJun5005
         QB     19 PHE  QE      9.50  # r w 5M    2396.5*2    cleanJun5006
         QB     30 PHE  HA      7.50  #   w 5M   66860.0      cleanJun4209
         QB     30 PHE  QE      9.50  # r w 5M   87650.0*2    cleanJun4989
         QB     30 PHE  HZ      7.50  #   w 5M    1038.0      cleanJun4997
         QB     33 MET  QB      8.50  # m w 5M  260900.0*2    cleanJun2845
         QB     33 MET  HG3     7.50  #   w 5M   80060.0      cleanJun4210
         QB     34 VAL  HA      7.50  #   w 5M  192500.0      cleanJun4211
         QB     34 VAL  QG1     8.50 ># m w 5M  312800.0      cleanJun4213
         QB     34 VAL  QG2     7.70 <# m   5M  871800.0      cleanJun4212
 16 VAL  
         HA     16 VAL  HB      4.80  #     2   370700.0      cleanJun3436
         HA     16 VAL  QG1     3.40  #     1M  697300.0      cleanJun1588
         HA     16 VAL  QG2     3.50  #     1M  556800.0      cleanJun2637
         HA     17 GLY  HA1     4.50  #     2   536900.0    ! cleanJun3457
         HA     19 PHE  QB      7.50  # m w 3    19360.0*2    cleanJun3458
         HA     30 PHE  QE      8.50  # r w 5     7555.0*2    cleanJun4991
         HA     68 LEU  QD1     7.50  #   w 5M  105000.0      cleanJun4214
         HA     75 ALA  QB      7.50  #   w 5M  257500.0      cleanJun2105
         HB     16 VAL  QG1     3.40  #   s 1M  976900.0      cleanJun2417
         HB     16 VAL  QG2     3.40  #   s 1M  977800.0      cleanJun2418
         HB     68 LEU  HB3     5.90  #     5   597200.0      cleanJun4953
         HB     75 ALA  HA      6.50  #   w 5    83830.0      cleanJun4867
         HB     75 ALA  QB      7.50  #   w 5M  234700.0      cleanJun2102
         QG1    20 SER  HA      7.50  #   w 5M  168500.0      cleanJun4217
         QG1    30 PHE  QE      9.50  # r w 5M   36115.0*2    cleanJun4992
         QG1    68 LEU  HB2     7.50  #   w 5M  160500.0      cleanJun4868
         QG1    68 LEU  QD1     8.50  # m w 5M  255900.0      cleanJun3464
         QG1    71 PHE  HB2     7.50  #   w 5M   26670.0      cleanJun4949
         QG1    71 PHE  HB3     7.50  #   w 5M  101500.0      cleanJun4950
         QG1    72 SER  QB      8.50  # m w 5M   13795.0*2    cleanJun4869
         QG1    75 ALA  HA      7.50  #   w 5M   71740.0      cleanJun4871
         QG1    75 ALA  QB      6.90  # m   5M 1991000.0      cleanJun2100
         QG2    30 PHE  QD      9.50  # r w 5M       0.0*2    cleanJun4994
         QG2    30 PHE  QE      9.50  # r w 5M   59300.0*2    cleanJun4993
         QG2    30 PHE  HZ      7.50  #   w 5M   10500.0      cleanJun5001
         QG2    68 LEU  HB3     7.50  #   w 5M  136000.0      cleanJun3462
         QG2    68 LEU  QD1     8.50  # m w 5M   73370.0      cleanJun4218
         QG2    71 PHE  HB2     7.50  #   w 5M   94110.0      cleanJun2723
         QG2    71 PHE  HB3     7.50  #   w 5M  113200.0      cleanJun3460
 17 GLY  
         HA1    20 SER  HA      5.80  #     3   152800.0      cleanJun4757
         HA1    20 SER  QB      7.50  # m w 3    63800.0*2    cleanJun4872
 18 ALA  
         HA     18 ALA  QB      3.40  #   s 2M 1793000.0      cleanJun2786
         HA     19 PHE  HA      6.50  #   w 2        0.0      cleanJun3465
         QB     33 MET  HG3     7.50  #   w 5M   62370.0      cleanJun4760
 19 PHE  
         HA     19 PHE  QB      6.50  # m   2   167000.0*2    cleanJun2787
         HA     19 PHE  QD      7.50  # m w 1     3408.5*2    cleanJun5004
         HA     25 PHE  HA      3.30  #     4   223600.0      cleanJun4220
         HA     68 LEU  QD1     7.50  #   w 5M       0.0      cleanJun4875
         QB     19 PHE  QD      9.50  # mrw 1     6282.5*4    cleanJun5002
         QB     19 PHE  QE      9.50  # mrw 1        0.0*4    cleanJun5003
         QB     24 SER  QB      8.50  # mmw 5     9662.5*4    cleanJun4873
         QB     25 PHE  QB      8.50  # mmw 5   168975.0*4    cleanJun4221
         QB     25 PHE  QD      9.50  # mrw 5     2900.0*4    cleanJun5012
         QB     25 PHE  QE      9.50  # mrw 5        0.0*4    cleanJun5023
         QB     30 PHE  QD      9.50  # mrw 5     3160.0*4    cleanJun4995
         QD     30 PHE  HA      8.50  # r w 5    15800.0*2    cleanJun5009
         QD     30 PHE  QB      9.50  # rmw 5    11242.5*4    cleanJun5007
         QE     30 PHE  QB      9.50  # rmw 5     7017.5*4    cleanJun5008
         QE     98 ILE  QG2     9.50  # r w 5M  144800.0*2  ! cleanJun4737
         QE    106 LEU  QD1     9.50  # r w 5M   90400.0*2    cleanJun4465
 20 SER  
         HA     20 SER  QB      5.30  # m   2   762000.0*2    cleanJun2788
         HA     21 ALA  HA      6.50  #   w 2    32020.0      cleanJun3466
         HA     76 ARG+ QD      7.50  # m w 5    13810.0*2    cleanJun4877
         QB     21 ALA  HA      7.50  # m w 2    33905.0*2    cleanJun4876
         QB     76 ARG+ QD      8.50  # mmw 5    18225.0*4    cleanJun4824
 21 ALA  
         HA     21 ALA  QB      3.40  #   s 2M 1340000.0      cleanJun1554
         HA     22 THR  HA      4.90  #     2   339500.0      cleanJun3477
         HA     22 THR  HB      6.30  #     2    75450.0      cleanJun4222
         HA     22 THR  QG2     7.50  #   w 5M   27350.0      cleanJun4878
         HA     76 ARG+ QD      7.50  # m w 5     2013.0*2    cleanJun4879
         QB     24 SER  HA      5.90  #     3M    7898.0      cleanJun4880
         QB     24 SER  QB      8.50  # m w 5M   19030.0*2    cleanJun4881
 22 THR  
         HA     22 THR  HB      4.00  #     2  1140000.0      cleanJun2791
         HA     22 THR  QG2     3.50  #     1M  546100.0      cleanJun3479
         HA     23 ASP- HA      6.50  #   w 2        0.0      cleanJun3483
         HA     79 SER  QB      7.50  # m w 5    28285.0*2    cleanJun4761
         HB     22 THR  QG2     3.40  #   s 1M  976800.0      cleanJun3478
         HB     23 ASP- HA      6.50  #     2    58380.0      cleanJun4882
         HB     23 ASP- QB      7.50  # m w 5   240650.0*2    cleanJun4490
         HB     79 SER  QB      7.50  # m w 5   291000.0*2    cleanJun4883
         HB     81 LYS+ HG3     6.50  #   w 5   115600.0      cleanJun4512
         QG2    23 ASP- HA      7.50  #   w 5M  131000.0      cleanJun4502
         QG2    76 ARG+ QD      8.50  # m w 5M   10980.0*2    cleanJun4885
         QG2    79 SER  QB      8.50  # m w 5M   19795.0*2    cleanJun4884
 23 ASP- 
         HA     23 ASP- QB      5.40  # i   2   388350.0*2    cleanJun2793
         HA     25 PHE  HA      6.50  #   w 3    51620.0      cleanJun4491
         HA     25 PHE  QB      7.50  # m w 3    36310.0*2    cleanJun3487
         HA     79 SER  QB      7.50  # m w 5    86650.0*2    cleanJun4513
         HA     81 LYS+ HB2     6.50  #   w 5    56090.0      cleanJun4763
         HA     81 LYS+ HG2     6.50  #   w 5   157000.0      cleanJun4503
         HA     81 LYS+ QD      7.50  # m w 5    35055.0*2    cleanJun4764
         HA     82 GLU- HA      3.30  #     4   244100.0      cleanJun4514
         HA     82 GLU- QB      7.50  # m w 5   171250.0*2    cleanJun4765
         HA     82 GLU- QG      7.50  # m w 5   198350.0*2    cleanJun3899
         QB     25 PHE  HA      7.50  # m w 3    60000.0*2    cleanJun4781
         QB     79 SER  QB      8.50  # mmw 5    42825.0*4    cleanJun4493
         QB     80 ALA  QB      8.50  # m w 5M   58400.0*2    cleanJun4494
         QB     81 LYS+ HB2     6.90  # m   5   607500.0*2    cleanJun4886
         QB     81 LYS+ QD      8.50  # mmw 5    15005.0*4    cleanJun4766
         QB     82 GLU- QG      8.50  # mmw 5   128325.0*4    cleanJun4767
 24 SER  
         HA     24 SER  QB      5.60  # m   2   509000.0*2    cleanJun2795
         HA     82 GLU- QB      7.50  # m w 5   113650.0*2    cleanJun4504
         QB     25 PHE  QB      8.50  # mmw 5    28325.0*4    cleanJun4830
 25 PHE  
         HA     25 PHE  QB      6.10  # m   2   261450.0*2    cleanJun2797
         HA     25 PHE  QD      5.70  # m   1   128050.0*2    cleanJun5010
         HA     25 PHE  QE      7.10  # i w 1        0.0*2    cleanJun5011
         HA     26 ASP- HA      5.70  #     2   137200.0      cleanJun3498
         HA     26 ASP- QB      7.50  # m w 2     3024.0*2    cleanJun4888
         QB     25 PHE  QD      9.40  # mr  1    19532.5*4    cleanJun5013
         QB     78 LEU  QD1     8.50  # m w 5M   32890.0*2    cleanJun4509
         QB     82 GLU- HA      7.50  # m w 5    22050.0*2    cleanJun4889
         QB     82 GLU- QB      8.50  # mmw 5    29675.0*4    cleanJun4890
         QB     82 GLU- QG      8.50  # mmw 5    47800.0*4    cleanJun4511
         QD     30 PHE  QB      9.50  # rmw 5     4972.5*4    cleanJun5014
         QD     68 LEU  HG      8.50  # r w 5     3168.5*2    cleanJun5032
         QD     68 LEU  QD1     9.50  # r w 5M    9210.0*2    cleanJun5016
         QD     78 LEU  QD1     9.50  # r w 5M    4467.5*2    cleanJun5017
         QD     86 LEU  HG      8.50  # r w 5        0.0*2    cleanJun5021
         QD     86 LEU  QD1     9.50  # r w 5M    1035.5*2    cleanJun5022
         QE     30 PHE  QB      9.50  # rmw 5     5315.0*4    cleanJun5025
         QE     67 ILE  QG2     9.50  # r w 5M       0.0*2    cleanJun5029
         QE     67 ILE  QD1     9.50  # r w 5M    3462.5*2    cleanJun5026
         QE     68 LEU  QD1     9.50  # r w 5M   42820.0*2    cleanJun5030
         QE     86 LEU  HG      8.50  # r w 5    12045.0*2    cleanJun5018
         QE     86 LEU  QD1     9.50  # r w 5M   15375.0*2    cleanJun5019
         HZ     27 HIS+ HA      6.50  #   w 5        0.0      cleanJun5024
         HZ     30 PHE  QB      7.50  # m w 5        0.0*2    cleanJun5033
         HZ     67 ILE  QG2     7.50  #   w 5M    3888.0      cleanJun5081
         HZ     67 ILE  QD1     7.50  #   w 5M   11050.0      cleanJun5027
         HZ     68 LEU  QD1     7.50  #   w 5M       0.0    ! cleanJun5031
         HZ     86 LEU  HG      6.50  #   w 5        0.0      cleanJun5020
 26 ASP- 
         HA     26 ASP- QB      5.00  # i   2   675000.0*2    cleanJun2602
         HA     27 HIS+ HA      6.50  #   w 2        0.0      cleanJun3504
         HA     27 HIS+ HB2     6.50  #   w 2    32450.0      cleanJun3505
         QB     28 LYS+ QB      8.50  # mmw 5    24095.0*4    cleanJun4230
         QB     29 LYS+ HB2     7.50  # m w 5   290250.0*2    cleanJun3506
         QB     29 LYS+ HB3     7.50  # m w 5   192500.0*2    cleanJun4229
         QB     30 PHE  QB      8.50  # mmw 5   308500.0*4    cleanJun4231
 27 HIS+ 
         HA     27 HIS+ HB2     4.30  #     2   749100.0      cleanJun2801
         HA     27 HIS+ HB3     4.10  #     2   997500.0      cleanJun2802
         HA     28 LYS+ HA      5.60  #     2   142800.0      cleanJun4891
         HA     30 PHE  QB      7.00  # m   3   130750.0*2    cleanJun3525
         HA     31 PHE  QD      8.50  # r w 5    20245.0*2    cleanJun4975
         HA     31 PHE  QE      8.50  # r w 5    13840.0*2    cleanJun4974
         HB2    28 LYS+ HA      5.50  #     2   174600.0      cleanJun3522
         HB2    30 PHE  QB      7.00 <# m   5   567000.0*2    cleanJun3523
         HB2    86 LEU  QD1     7.50  #   w 5M  105900.0      cleanJun3524
         HB2   106 LEU  QB      7.50  # m w 5   121500.0*2    cleanJun4722
         HB3    30 PHE  QB      7.50 ># m w 5    14125.0*2    cleanJun4892
         HB3   106 LEU  QB      7.50  # m w 5        0.0*2    cleanJun4721
 28 LYS+ 
         HA     28 LYS+ QB      6.50  # m   2   163000.0*2    cleanJun2808
         HA     28 LYS+ HG2     3.80 <#     1   465400.0      cleanJun2807
         HA     28 LYS+ HG3     5.20 >#     1    70360.0      cleanJun2817
         HA     28 LYS+ QD      5.00  # m   1   324450.0*2    cleanJun2822
         HA     28 LYS+ QE      6.30  # m   1    62400.0*2    cleanJun2809
         HA     31 PHE  HB2     6.50  #   w 3    60440.0      cleanJun2528
         HA     31 PHE  HB3     6.50  #   w 3    64350.0      cleanJun3527
         HA     31 PHE  QD      8.50  # r w 5    34210.0*2    cleanJun4977
         HA     31 PHE  QE      8.50  # r w 5   164500.0*2    cleanJun4976
         HA     32 GLN  QB      6.80  # m   3   156600.0*2    cleanJun3528
         HA     32 GLN  QG      7.50  # m w 5   265650.0*2    cleanJun4235
         HA    107 VAL  QG1     7.50  #   w 5M  177100.0      cleanJun2022
         HA    108 ALA  QB      7.50  #   w 5M  283500.0      cleanJun4236
         HA    110 SER  HA      4.70  #     4    28940.0      cleanJun4724
         HA    110 SER  QB      7.50  # m w 5    29040.0*2    cleanJun4723
         QB     28 LYS+ HG2     5.10  # m   1   274050.0*2    cleanJun2381
         QB     28 LYS+ HG3     5.70  # m   1   125700.0*2    cleanJun2805
         QB     28 LYS+ QD      4.80  # mm  1  2857500.0*4    cleanJun3532
         QB     28 LYS+ QE      6.80  # mm  1   106525.0*4    cleanJun2382
         QB     29 LYS+ HA      6.40  # m   2   177400.0*2    cleanJun3529
         QB     29 LYS+ HB2     6.90  # m   5   613000.0*2    cleanJun3530
         QB     31 PHE  HB3     7.50  # m w 5    31990.0*2    cleanJun4232
         QB     32 GLN  QB      8.50  # mmw 5   125825.0*4    cleanJun3531
         QB     32 GLN  QG      8.50  # mmw 5    11795.0*4    cleanJun4237
         QB    108 ALA  HA      7.50  # m w 5    12660.0*2    cleanJun4238
         HG2    28 LYS+ QD      4.60 <# m   1   657000.0*2    cleanJun2820
         HG2    28 LYS+ QE      5.70  # m   1   133450.0*2    cleanJun2824
         HG3    28 LYS+ QD      6.30 ># m   1    61700.0*2    cleanJun3535
         HG3    28 LYS+ QE      5.50  # m   1   169700.0*2    cleanJun2823
         HG3   110 SER  HA      6.50  #   w 5    45850.0      cleanJun4768
         QD     28 LYS+ QE      5.40  # mm  1   911500.0*4    cleanJun2821
         QD    110 SER  HA      7.50  # m w 5    75350.0*2    cleanJun4769
         QE    110 SER  HA      7.50  # m w 5    20730.0*2    cleanJun4770
 29 LYS+ 
         HA     29 LYS+ HB2     4.40 <#     2   658600.0      cleanJun2828
         HA     29 LYS+ HB3     5.40 >#     2   178900.0      cleanJun3520
         HA     29 LYS+ QG      5.90  # i   1    58700.0*2    cleanJun3509
         HA     29 LYS+ QD      7.50  # m w 1    10775.0*2    cleanJun3510
         HA     29 LYS+ QE      7.50  # m   1    18000.0*2    cleanJun3511
         HA     32 GLN  QG      7.50  # m w 5    59200.0*2    cleanJun3536
         HA     33 MET  QB      6.80  # m   3   154500.0*2    cleanJun4239
         HA     33 MET  HG3     6.50  #   w 5    40980.0      cleanJun4240
         HA    110 SER  QB      7.50  # m w 5    49475.0*2    cleanJun4725
         HB2    29 LYS+ QG      5.70  # m   1   127200.0*2    cleanJun3513
         HB2    29 LYS+ QD      5.40  # m   1   186700.0*2    cleanJun3514
         HB2    29 LYS+ QE      6.20  # m   1    66700.0*2    cleanJun3516
         HB2    30 PHE  HA      5.90  #     2   114000.0      cleanJun3537
         HB2    33 MET  HG3     5.90  #     5   625300.0      cleanJun3538
         HB3    29 LYS+ QD      6.00  # m   1    81500.0*2    cleanJun3519
         HB3    29 LYS+ QE      5.80  # m   1   113600.0*2    cleanJun3517
 30 PHE  
         HA     30 PHE  QB      6.60  # m   2   142850.0*2    cleanJun2829
         HA     30 PHE  QD      5.90  # m   1    96900.0*2    cleanJun4982
         HA     31 PHE  HA      5.70  #     2   129700.0      cleanJun3539
         HA     33 MET  QB      7.10  # m   3   111100.0*2    cleanJun3542
         QB     30 PHE  QD      8.90  # mr  1    33000.0*4    cleanJun4980
         QB     31 PHE  QD      9.50  # mrw 5    11110.0*4    cleanJun4979
         QB     31 PHE  QE      9.50  # mrw 5    21160.0*4    cleanJun4978
         QB     33 MET  QB      8.50  # mmw 5    23202.5*4    cleanJun3544
         QD     31 PHE  HA      8.50  # r w 5     3548.0*2    cleanJun4983
         QD     34 VAL  QG1     9.50  # r w 5M    5360.0*2    cleanJun4986
         QD     68 LEU  QD1     9.50  # r w 5M   21365.0*2    cleanJun4988
         QE     34 VAL  QG1     9.50 <# r w 5M   35675.0*2    cleanJun4985
         QE     34 VAL  QG2     9.50 ># r w 5M    9080.0*2    cleanJun4984
         QE     67 ILE  QD1     9.50  # r w 5M    2575.5*2    cleanJun4996
         QE     68 LEU  QD1     9.50  # r w 5M   19110.0*2    cleanJun4987
         HZ     34 VAL  QG1     7.50  #   w 5M    8327.0      cleanJun4999
         HZ     34 VAL  QG2     7.50  #   w 5M   11300.0      cleanJun4998
         HZ     68 LEU  QD1     7.50  #   w 5M   17200.0      cleanJun5000
         HZ     71 PHE  HB2     6.50  #   w 5     2569.0      cleanJun5103
 31 PHE  
         HA     31 PHE  HB2     5.70 >#     2   136800.0      cleanJun3545
         HA     31 PHE  HB3     4.60 <#     2   476300.0      cleanJun2833
         HA     31 PHE  QD      5.30  # m   1   229700.0*2    cleanJun4970
         HA     32 GLN  HA      5.70  #     2   133800.0      cleanJun4242
         HA     34 VAL  HA      6.40  #     3    83870.0      cleanJun4771
         HA     34 VAL  QG1     7.30 <#     5M  503200.0      cleanJun3548
         HA     34 VAL  QG2     7.50 >#   w 5M  151000.0      cleanJun3547
         HA     36 LEU  QD2     7.50  #   w 5M   22010.0      cleanJun5113
         HA     37 LYS+ QG      7.50  # m w 5    65100.0*2    cleanJun4773
         HB2    31 PHE  QD      8.10  # r   1    25930.0*2    cleanJun4971
         HB2   107 VAL  QG1     7.50  #   w 5M   32160.0      cleanJun4726
         HB3    31 PHE  QD      7.30  # r   1    61050.0*2    cleanJun4973
         HB3    34 VAL  HB      6.50  #   w 5    68300.0    ! cleanJun4774
         HB3    34 VAL  QG1     7.50  #   w 5M   40570.0      cleanJun3553
         HB3    34 VAL  QG2     7.50  #   w 5M  235900.0      cleanJun3550
         HB3    36 LEU  HG      5.40  #     5  1055000.0      cleanJun3552
         HB3    36 LEU  QD2     7.20  #     5M  589000.0      cleanJun3551
         HB3    37 LYS+ QG      7.50  # m w 5     6900.0*2    cleanJun4776
         HB3   107 VAL  QG1     7.50  #   w 5M   16260.0      cleanJun4778
         HB3   110 SER  QB      7.50  # m w 5    20860.0*2  ! cleanJun4779
         QD     36 LEU  QB      9.50  # rmw 5    20307.5*4    cleanJun5114
         QD    103 PHE  QB      9.50  # rmw 5        0.0*4    cleanJun4752
         QD    107 VAL  HA      8.50  # r w 5    10080.0*2    cleanJun5078
         QD    110 SER  QB      9.50  # rmw 5     2279.0*4    cleanJun5079
         QE     67 ILE  QD1     9.50  # r w 5M    8630.0*2    cleanJun5084
 32 GLN  
         HA     32 GLN  QB      5.20  # m   2   801500.0*2    cleanJun2834
         HA     32 GLN  QG      5.00  # i   1   174450.0*2    cleanJun2839
         HA     34 VAL  QG1     7.50  #   w 5M   77300.0      cleanJun4788
         HA     37 LYS+ HB3     6.50  #   w 5   326900.0      cleanJun3554
         HA     37 LYS+ QG      7.50  # m w 5   179700.0*2    cleanJun3555
         HA     37 LYS+ QD      7.50  # m w 5    84650.0*2    cleanJun4784
         QB     32 GLN  QG      6.10  # mm  1   290250.0*4    cleanJun2835
         QB     33 MET  HA      6.90  # m   2   105500.0*2    cleanJun3558
         QB     33 MET  HG2     7.50  # m w 5   195400.0*2    cleanJun3563
         QB     33 MET  HG3     7.50  # m w 5   111800.0*2    cleanJun3559
         QB     37 LYS+ HB3     7.50  # m w 5    69650.0*2    cleanJun4244
         QB     37 LYS+ QG      8.50  # mmw 5    21847.5*4    cleanJun3564
         QG     37 LYS+ HB2     7.50  # m w 5    74450.0*2    cleanJun3565
         QG     37 LYS+ HB3     7.50  # m w 5    36860.0*2    cleanJun4246
         QG    108 ALA  QB      8.50  # m w 5M     918.5*2    cleanJun4247
 33 MET  
         HA     33 MET  QB      5.70  # m   2   431100.0*2    cleanJun2850
         HA     33 MET  HG2     3.80  #     1   486800.0      cleanJun3562
         HA     33 MET  HG3     3.90  #     1   373300.0      cleanJun2851
         HA     34 VAL  HA      6.40  #     2    68370.0      cleanJun3566
         HB3    33 MET  QB      5.20  # m   2   904000.0*2    cleanJun4055
         QB     33 MET  HG2     4.80  # m   1   422950.0*2    cleanJun3561
         QB     33 MET  HG3     5.20  # m   1   235950.0*2    cleanJun2853
         QB     34 VAL  HA      7.50  # m w 2    25375.0*2    cleanJun3567
         QB     34 VAL  HB      7.50  # m w 5    31775.0*2    cleanJun3449
         QB     34 VAL  QG2     8.50  # m w 5M  192400.0*2    cleanJun3451
 34 VAL  
         HA     34 VAL  HB      4.00  #     2  1168000.0      cleanJun2856
         HA     34 VAL  QG1     4.00 >#     1M  245700.0      cleanJun2854
         HA     34 VAL  QG2     3.40 <#   s 1M  825100.0      cleanJun2855
         HB     34 VAL  QG1     3.40  #   s 1M 1323000.0      cleanJun2865
         HB     34 VAL  QG2     3.40  #   s 1M  796400.0      cleanJun2861
         HB     36 LEU  HG      5.90  #     5   631000.0      cleanJun3569
         HB     71 PHE  QE      8.50  # r w 5     8670.0*2    cleanJun5104
         QG1    36 LEU  QB      8.50  # m w 5M   96650.0*2    cleanJun3570
         QG2    35 GLY  HA1     7.50  #   w 5M       0.0      cleanJun3572
         QG2    35 GLY  HA2     7.50  #   w 5M   45660.0      cleanJun3573
         QG2    36 LEU  HG      7.50  #   w 5M   63880.0      cleanJun5115
         QG2    36 LEU  QD2     8.50  # m w 5M  269300.0      cleanJun3576
 35 GLY  
         HA1    36 LEU  HA      4.30 <#     2   702700.0    ! cleanJun3577
         HA1    37 LYS+ HB3     5.30  #     3   255200.0      cleanJun3579
         HA1    38 LYS+ QG      7.50  # m w 5    13045.0*2    cleanJun5123
         HA1    38 LYS+ QD      7.50  # m w 5    21695.0*2    cleanJun5124
         HA1    38 LYS+ QE      7.50  # m w 5   204550.0*2    cleanJun3581
         HA2    36 LEU  HA      5.70 >#     2   134300.0      cleanJun5116
         HA2    36 LEU  HG      6.50  #   w 5   251900.0      cleanJun3582
         HA2    38 LYS+ HA      5.30  #     3   279300.0    ! cleanJun4248
         HA2    38 LYS+ HB2     5.80  #     3   148100.0      cleanJun4249
         HA2    38 LYS+ HB3     4.80  #     3   513600.0      cleanJun3580
         HA2    38 LYS+ QE      7.50  # m w 5   118200.0*2    cleanJun3583
 36 LEU  
         HA     36 LEU  QB      5.80  # m   2   397050.0*2    cleanJun2876
         HA     36 LEU  HG      3.80  #     1   431000.0      cleanJun2875
         HA     36 LEU  QD2     3.80  #     1M  349900.0      cleanJun2874
         HA     37 LYS+ HA      6.30  #     2    70310.0      cleanJun5117
         HA     38 LYS+ QG      7.50  # m w 5    15125.0*2    cleanJun5118
         HA     39 LYS+ HB2     5.00  #     3   400600.0      cleanJun4905
         HA     39 LYS+ HB3     5.70  #     3   167000.0      cleanJun4906
         HA     39 LYS+ QG      7.50  # m w 5   118700.0*2    cleanJun3614
         HA     39 LYS+ QD      7.50  # m w 5    81500.0*2    cleanJun3586
         HA     44 VAL  QQG     8.90  #   w 5M   23275.0*2    cleanJun4250
         HA     47 VAL  QG1     7.50 <#   w 5M  396000.0      cleanJun3587
         HA     47 VAL  QG2     7.50 >#   w 5M  113000.0      cleanJun4252
         QB     36 LEU  HG      3.50  # m   1  5815000.0*2    cleanJun2872
         QB     36 LEU  QD2     4.40  # m s 1M 2366000.0*2    cleanJun2884
         QB     37 LYS+ HA      7.50  # m w 2    44225.0*2    cleanJun5120
         QB     37 LYS+ QG      8.50  # mmw 5   100925.0*4    cleanJun5121
         QB     44 VAL  QQG     9.90  # m w 5M   17910.0*4    cleanJun5119
         QB    107 VAL  QG1     8.50  # m w 5M   93450.0*2    cleanJun5077
         HG     36 LEU  QD2     3.40  #   s 1M 5419000.0      cleanJun2883
         HG     47 VAL  QG1     7.50  #   w 5M  333700.0      cleanJun4256
         HG     47 VAL  QG2     7.50  #   w 5M  221300.0      cleanJun4257
         HG     71 PHE  QE      8.50  # r w 5     9175.0*2    cleanJun5105
         QD2    39 LYS+ HB2     7.50  #   w 5M  146000.0      cleanJun4263
         QD2    39 LYS+ HB3     7.50  #   w 5M   51840.0      cleanJun4262
         QD2    39 LYS+ QG      8.50  # m w 5M   96250.0*2    cleanJun4265
         QD2    39 LYS+ QD      8.50  # m w 5M  137450.0*2    cleanJun4266
         QD2    44 VAL  QQG     9.90  # q w 5M  278250.0*2    cleanJun4264
         QD2    47 VAL  HB      7.50  #   w 5M   54080.0      cleanJun4258
         QD2    47 VAL  QG1     8.50  # m w 5M  244300.0      cleanJun4259
         QD2    47 VAL  QG2     8.50  # m w 5M  169400.0      cleanJun4260
         QD2    51 LEU  QD1     8.50  # m w 5M  103000.0      cleanJun4261
         QD2   107 VAL  QG1     8.50  # m w 5M  175100.0      cleanJun4727
 37 LYS+ 
         HA     37 LYS+ HB2     4.70  #     2   421700.0      cleanJun2889
         HA     37 LYS+ HB3     4.50  #     2   536200.0      cleanJun2888
         HA     37 LYS+ QG      5.20  # i   1   150550.0*2    cleanJun2890
         HA     37 LYS+ QD      5.50  # m   1   157250.0*2    cleanJun2891
         HA     37 LYS+ QE      7.50  # m w 1     2096.5*2    cleanJun2887
         HA     38 LYS+ HA      6.50  #   w 2    53520.0      cleanJun3588
         HA    105 THR  QG2     7.50  #   w 5M   76100.0    ! cleanJun2344
         HA    107 VAL  QG1     7.50  #   w 5M   33870.0      cleanJun4728
         HA    108 ALA  QB      7.00  #     5M  655500.0      cleanJun3589
         HB2    37 LYS+ QG      4.40  # m   1   905000.0*2    cleanJun2901
         HB2    37 LYS+ QE      5.80 ># m   1   105300.0*2    cleanJun2894
         HB2    38 LYS+ HB3     6.50  #   w 5   323600.0      cleanJun4267
         HB3    37 LYS+ QG      4.30  # m   1  1044500.0*2    cleanJun2896
         HB3    37 LYS+ QD      5.60  # m   1   142000.0*2    cleanJun2897
         HB3    37 LYS+ QE      4.60 <# m   1   684000.0*2    cleanJun2898
         HB3    38 LYS+ HA      5.70  #     2   139100.0      cleanJun3590
         HB3    38 LYS+ HB3     5.70  #     5   797400.0      cleanJun3591
         HB3    38 LYS+ QG      7.20  # m   5   474600.0*2    cleanJun3592
         HB3   108 ALA  QB      7.50  #   w 5M  331800.0      cleanJun4268
         QG     37 LYS+ QD      7.20  # mm  1    66650.0*4    cleanJun2900
         QG     37 LYS+ QE      6.60  # mm  1   143075.0*4    cleanJun2904
         QG    105 THR  QG2     8.50  # m w 5M  218350.0*2    cleanJun3593
         QG    107 VAL  QG1     8.50  # m w 5M   10260.0*2    cleanJun5122
         QG    108 ALA  QB      5.90  # m   5M 5585000.0*2    cleanJun3594
         QD    105 THR  QG2     8.50  # m w 5M   68100.0*2    cleanJun3596
 38 LYS+ 
         HA     38 LYS+ HB2     4.40  #     2   618200.0      cleanJun2917
         HA     38 LYS+ HB3     5.00  #     2   289300.0      cleanJun2905
         HA     38 LYS+ QG      4.70  # i   1   300200.0*2    cleanJun2184
         HA     38 LYS+ QD      5.80  # m   1   107850.0*2    cleanJun2924
         HA     38 LYS+ QE      6.50  # m   1    46870.0*2    cleanJun2918
         HA     39 LYS+ HA      4.80  #     2   390200.0    ! cleanJun3608
         HB2    38 LYS+ QG      4.80 ># m   1   474250.0*2    cleanJun2922
         HB2    38 LYS+ QD      4.40  # m   1   872000.0*2    cleanJun2926
         HB2    38 LYS+ QE      4.30  # m   1  1169000.0*2    cleanJun2929
         HB2    39 LYS+ HA      5.90  #     2   112800.0      cleanJun3609
         HB2    39 LYS+ QD      7.50  # m w 5   326350.0*2    cleanJun3610
         HB3    38 LYS+ QG      3.90 <# m   1  2525000.0*2    cleanJun2923
         HB3    39 LYS+ HB2     5.50  #     5   987200.0    ! cleanJun4271
         QG     38 LYS+ QD      5.30  # mm  1  1059250.0*4    cleanJun2927
         QG     38 LYS+ QE      6.10  # mm  1   273250.0*4    cleanJun2928
         QG     39 LYS+ HB2     7.50  # m w 5   159700.0*2    cleanJun3612
         QG     39 LYS+ QG      8.50  # mmw 5   144450.0*4    cleanJun3613
         QG     39 LYS+ QD      8.50  # mmw 5   174550.0*4    cleanJun3611
         QD     38 LYS+ QE      6.20  # mm  1   231350.0*4    cleanJun2925
         QD     39 LYS+ QD      8.50  # mmw 5    17552.5*4    cleanJun4276
         QE     39 LYS+ HB3     7.50  # m w 5    49495.0*2    cleanJun4275
 39 LYS+ 
         HA     39 LYS+ HB2     5.00  #     2   292200.0      cleanJun2933
         HA     39 LYS+ HB3     5.00  #     2   281200.0      cleanJun2934
         HA     39 LYS+ QG      7.10  # i w 1    14100.0*2    cleanJun2943
         HA     39 LYS+ QD      4.80  # m   1   436200.0*2    cleanJun2944
         HA     40 SER  QB      7.50  # m w 2    29085.0*2    cleanJun3629
         HA     43 ASP- HB2     5.90  #     3   135700.0      cleanJun3619
         HA     43 ASP- HB3     5.20  #     3   309300.0      cleanJun3620
         HB2    39 LYS+ QG      4.20  # m   1  1264500.0*2    cleanJun2940
         HB2    39 LYS+ QD      5.80  # m   1   109050.0*2    cleanJun2945
         HB2    43 ASP- HB2     6.30  #     5   400900.0      cleanJun3621
         HB2    43 ASP- HB3     6.50  #   w 5   272000.0      cleanJun3623
         HB2    44 VAL  HA      6.50  #   w 5    43820.0      cleanJun4908
         HB2    44 VAL  QQG     8.90 <#   w 5M  290400.0*2    cleanJun2121
         HB3    39 LYS+ QG      4.50  # m   1   691500.0*2    cleanJun2938
         HB3    39 LYS+ QD      6.00  # m   1    89550.0*2    cleanJun2946
         HB3    40 SER  HA      5.30  #     2   212200.0      cleanJun4280
         HB3    43 ASP- HA      5.30  #     3   258400.0      cleanJun4281
         HB3    43 ASP- HB2     6.40  #     5   371300.0      cleanJun4279
         HB3    43 ASP- HB3     6.50  #   w 5   170600.0      cleanJun4910
         HB3    44 VAL  QQG     8.90 >#   w 5M   79450.0*2    cleanJun4911
         QG     43 ASP- HA      7.50  # m w 5   287050.0*2    cleanJun1829
         QG     43 ASP- HB2     7.50  # m w 5   135350.0*2    cleanJun3622
         QG     43 ASP- HB3     7.50  # m w 5   144350.0*2    cleanJun3624
         QG     44 VAL  HA      7.50  # m w 5    28350.0*2    cleanJun3625
         QG     44 VAL  QQG     9.90  # m w 5M   72050.0*4    cleanJun3626
         QG     47 VAL  QG1     8.50  # m w 5M  136200.0*2    cleanJun3628
         QG     47 VAL  QG2     8.50  # m w 5M  107350.0*2    cleanJun3627
         QD     43 ASP- HB2     7.50  # m w 5    46075.0*2    cleanJun4912
         QD     43 ASP- HB3     7.50  # m w 5    51350.0*2    cleanJun4913
 40 SER  
         HA     40 SER  QB      5.00  # m   2  1180000.0*2    cleanJun2948
         HA     43 ASP- HB2     5.00  #     3   386900.0      cleanJun4283
         HA     43 ASP- HB3     5.60  #     3   197600.0      cleanJun3637
         HA     44 VAL  QQG     8.90  #   w 5M   89350.0*2    cleanJun4284
 41 ALA  
         HA     41 ALA  QB      3.40  #   s 2M 6176000.0      cleanJun2950
         HA     42 ASP- HA      5.00  #     2   299400.0      cleanJun3639
         HA     44 VAL  HB      5.30  #     3   271200.0      cleanJun3638
         HA     44 VAL  QQG     8.90  #   w 5M    5055.0*2    cleanJun4898
         HA     45 LYS+ HG2     6.50  #   w 5    49800.0      cleanJun4899
         QB     42 ASP- HA      4.60  #     2M  186700.0      cleanJun4286
         QB     42 ASP- QB      8.50  # m w 5M   61000.0*2    cleanJun4902
         QB     44 VAL  HB      7.50  #   w 5M  231500.0      cleanJun3642
         QB     45 LYS+ HB2     7.50  #   w 5M  176900.0      cleanJun4287
         QB     45 LYS+ HG2     7.50  #   w 5M   25570.0      cleanJun4901
         QB     45 LYS+ QE      8.50  # m w 5M   47260.0*2    cleanJun4900
 42 ASP- 
         HA     42 ASP- QB      5.70  # i   2   256700.0*2    cleanJun2952
         HA     43 ASP- HA      5.70  #     2   139400.0      cleanJun3660
         HA     45 LYS+ HB2     5.50  #     3   212300.0      cleanJun4288
         HA     45 LYS+ HB3     5.60  #     3   191200.0      cleanJun3661
         HA     45 LYS+ HG3     6.50  #   w 5    65360.0      cleanJun3663
         HA     46 LYS+ QD      7.50  # m w 5    50500.0*2    cleanJun4289
         QB     43 ASP- HA      7.50  # m w 2    57450.0*2    cleanJun3664
         QB     43 ASP- HB2     7.10  # m   5   482450.0*2    cleanJun3665
         QB     43 ASP- HB3     6.70  # m   5   745000.0*2    cleanJun4290
 43 ASP- 
         HA     43 ASP- HB2     4.30  #     2   752500.0      cleanJun2953
         HA     43 ASP- HB3     3.90  #     2  1417000.0      cleanJun2954
         HA     44 VAL  HA      6.50  #   w 2    39430.0      cleanJun4292
         HA     46 LYS+ HB2     5.70  #     3   172500.0      cleanJun3667
         HA     46 LYS+ HB3     5.60  #     3   183000.0      cleanJun3668
         HA     46 LYS+ QD      7.50  # m w 5   215100.0*2    cleanJun3669
         HA     46 LYS+ QE      7.50  # m w 5   310250.0*2    cleanJun4293
         HB2    44 VAL  HB      6.10 <#     5   498700.0      cleanJun3670
         HB2    44 VAL  QQG     8.90  #   w 5M   59100.0*2    cleanJun3671
         HB2    46 LYS+ QD      7.50 ># m w 5    92600.0*2    cleanJun4298
         HB3    44 VAL  HA      5.20  #     2   235500.0      cleanJun3666
         HB3    44 VAL  HB      6.50 >#   w 5   135500.0      cleanJun4296
         HB3    44 VAL  QQG     8.90  #   w 5M  108700.0*2    cleanJun3673
         HB3    46 LYS+ HB2     5.90  #     5   623700.0      cleanJun3674
         HB3    46 LYS+ QD      7.10 <# m   5   531000.0*2    cleanJun4299
         HB3    47 VAL  QG2     7.50  #   w 5M  412300.0      cleanJun3675
 44 VAL  
         HA     44 VAL  HB      4.90  #     2   353100.0      cleanJun1571
         HA     44 VAL  QQG     4.00  # i s 1M 1204500.0*2    cleanJun1570
         HA     45 LYS+ HA      6.40  #     2    66540.0      cleanJun3676
         HA     46 LYS+ HB2     6.50  #   w 3    60430.0      cleanJun3677
         HA     47 VAL  HB      5.20  #     3   287300.0      cleanJun4300
         HA     47 VAL  QG1     7.50  #     5M  436800.0      cleanJun3679
         HB     44 VAL  QQG     4.80  #   s 1M  862500.0*2    cleanJun2122
         HB     45 LYS+ HA      6.30  #     2    72910.0      cleanJun3680
         HB     45 LYS+ HB2     6.50  #   w 5    95780.0      cleanJun3681
         QQG    47 VAL  HB      8.90  #   w 5M   56500.0*2    cleanJun3687
         QQG   105 THR  HA      8.90  #   w 5M  201350.0*2    cleanJun2126
         QQG   105 THR  QG2     9.10  # q   5M  910500.0*2    cleanJun3686
         QQG   106 LEU  QD1     9.90  # q w 5M   17165.0*2  ! cleanJun4304
         QQG   107 VAL  QG1     9.90  # m w 5M  322200.0*2    cleanJun4755
         QQG   107 VAL  QG2     9.90  # m w 5M  410000.0*2    cleanJun4754
 45 LYS+ 
         HA     45 LYS+ HB2     3.90  #     2  1441000.0      cleanJun2965
         HA     45 LYS+ HB3     4.20  #     2   851900.0      cleanJun2962
         HA     45 LYS+ HG2     4.40 >#     1   188900.0      cleanJun3646
         HA     45 LYS+ HG3     3.70 <#     1   493300.0      cleanJun3645
         HA     45 LYS+ QD      7.50  # m w 1     7365.0*2    cleanJun5034
         HA     45 LYS+ QE      6.40  # m   1    54450.0*2    cleanJun3647
         HA     46 LYS+ HA      5.70  #     2   135500.0      cleanJun3688
         HB2    45 LYS+ HG2     3.70  #     1   529200.0      cleanJun2964
         HB2    45 LYS+ HG3     3.60  #     1   646200.0      cleanJun3658
         HB2    45 LYS+ QE      5.80 <# m   1   116300.0*2    cleanJun3648
         HB2    46 LYS+ HG3     5.80  #     5   660800.0      cleanJun3693
         HB2   100 VAL  QG1     7.50  #   w 5M  210400.0      cleanJun4729
         HB3    45 LYS+ HG2     4.30  #     1   226300.0      cleanJun2959
         HB3    45 LYS+ HG3     4.10  #     1   298400.0      cleanJun2960
         HB3    45 LYS+ QD      4.90  # m   1   380550.0*2    cleanJun4312
         HB3    45 LYS+ QE      6.90 ># m   1    30480.0*2    cleanJun2961
         HB3    46 LYS+ HB2     4.90  #     5  1884000.0    ! cleanJun3695
         HG2    45 LYS+ QD      5.40 ># m   1   197750.0*2    cleanJun4310
         HG2    45 LYS+ QE      6.20  # m   1    65450.0*2    cleanJun3654
         HG3    45 LYS+ QD      4.70 <# m   1   518500.0*2    cleanJun4311
         HG3    45 LYS+ QE      5.70  # m   1   130800.0*2    cleanJun3657
 46 LYS+ 
         HA     46 LYS+ HB2     4.10  #     2  1040000.0      cleanJun2427
         HA     46 LYS+ HB3     4.00  #     2  1181000.0      cleanJun2969
         HA     46 LYS+ HG3     3.70  #     1   534100.0      cleanJun2972
         HA     48 PHE  QB      6.20  # m   3   308100.0*2    cleanJun3697
         HB2    46 LYS+ HG3     3.60  #     1   614400.0      cleanJun2975
         HB2    47 VAL  HA      4.90  #     2   331500.0      cleanJun3698
         HB2    47 VAL  HB      6.00  #     5   578500.0      cleanJun4313
         HB2    47 VAL  QG1     7.50  #   w 5M  401600.0      cleanJun3703
         HB2    47 VAL  QG2     7.50  #   w 5M  417000.0      cleanJun4314
         HB3    46 LYS+ HG3     3.00  #     1  2019000.0      cleanJun2974
         HB3    47 VAL  HA      5.10  #     2   267900.0      cleanJun3699
         HB3    47 VAL  QG1     7.50  #   w 5M  340300.0      cleanJun3702
         HG2    46 LYS+ QE      4.70  # m   1   500500.0*2    cleanJun2982
         HG3    46 LYS+ QD      3.90  # m   1  2201000.0*2    cleanJun2979
         HG3    46 LYS+ QE      4.70  # m   1   509500.0*2    cleanJun2981
         QD     46 LYS+ QE      5.90  # mm  1   384000.0*4    cleanJun2978
 47 VAL  
         HA     47 VAL  HB      4.40  #     2   606500.0      cleanJun2987
         HA     47 VAL  QG1     3.40  #     1M  712600.0      cleanJun2171
         HA     47 VAL  QG2     3.40  #   s 1M  769800.0      cleanJun2165
         HA     48 PHE  QB      7.50  # m w 2    32965.0*2    cleanJun3704
         HB     47 VAL  QG1     3.40  #   s 1M 1411000.0      cleanJun2986
         HB     47 VAL  QG2     3.40  #   s 1M 1139000.0      cleanJun2988
         HB     48 PHE  QB      7.50  # m w 5   101550.0*2    cleanJun3705
         QG1    51 LEU  QD1     8.50  # m w 5M  298700.0      cleanJun3708
         QG2    48 PHE  HA      7.50  #   w 5M  410500.0      cleanJun4318
         QG2    48 PHE  QB      8.50  # m w 5M   58750.0*2    cleanJun3707
         QG2    51 LEU  HB2     7.50  #   w 5M  249400.0      cleanJun3710
         QG2    51 LEU  HG      7.50  #   w 5M  298000.0      cleanJun3712
         QG2    51 LEU  QD1     8.00  # m   5M  670100.0      cleanJun3709
         QG2   107 VAL  QG1     8.50  # m w 5M  343900.0    ! cleanJun4306
         QG2   107 VAL  QG2     8.50  # m w 5M  364300.0    ! cleanJun4305
 48 PHE  
         HN     98 ILE  QG2     7.50  #   w 5M   12560.0    ! cleanJun5057
         HA     48 PHE  QB      5.90  # m   2   357000.0*2    cleanJun1804
         HA     59 ILE  QD1     7.50  #   w 5M    5718.0      cleanJun4944
         QB     48 PHE  QD      8.30  # mr  1    61725.0*4    cleanJun4499
         QB    100 VAL  QG1     8.50  # m w 5M    5080.0*2    cleanJun4731
         QB    101 ASP- HB2     7.50  # m w 5   196600.0*2  ! cleanJun2529
         QD     52 ASP- HA      8.50  # r w 5    16390.0*2    cleanJun5035
         QD     52 ASP- QB      9.50  # rmw 5     3120.0*4    cleanJun5045
         QD     59 ILE  QG1     9.50  # rmw 5     3980.0*4    cleanJun5042
         QD     59 ILE  QD1     9.50  # r w 5M   32185.0*2    cleanJun5041
         QD     98 ILE  QG2     9.50  # r w 5M    7695.0*2    cleanJun4732
         QD     98 ILE  QD1     9.50  # r w 5M    3751.5*2    cleanJun5043
         QD     99 GLY  HA1     8.50  # r w 5     4627.5*2    cleanJun5054
         QD    100 VAL  HA      8.50  # r w 5    15775.0*2    cleanJun5036
         QD    100 VAL  HB      8.50  # r w 5     2481.5*2    cleanJun5037
         QD    100 VAL  QG1     9.50  # r w 5M    8965.0*2    cleanJun5038
         QD    103 PHE  HA      8.50  # r w 5    46715.0*2    cleanJun5039
         QD    103 PHE  QB      9.50  # rmw 5    13140.0*4    cleanJun5040
         QE     52 ASP- QB      9.50  # rmw 5     4340.0*4    cleanJun5044
         QE     57 GLY  HA1     8.50  # r w 5     6520.0*2    cleanJun5047
         QE     57 GLY  HA2     8.50  # r w 5     6705.0*2    cleanJun5046
         QE     58 PHE  HA      8.50  # r w 5    15825.0*2    cleanJun5048
         QE     59 ILE  QG1     9.50  # rmw 5     8597.5*4    cleanJun5049
         QE     98 ILE  QG2     9.50  # r w 5M   10640.0*2    cleanJun5053
         QE     99 GLY  HA1     8.50  # r w 5     1929.0*2    cleanJun5055
         QE    100 VAL  HA      8.50  # r w 5     6835.0*2    cleanJun5051
         QE    100 VAL  HB      8.50  # r w 5     3821.5*2    cleanJun5050
         QE    100 VAL  QG1     9.50  # r w 5M    4460.0*2    cleanJun5052
         HZ     58 PHE  HA      6.50  #   w 5     6309.0      cleanJun5056
         HZ    100 VAL  HA      6.50  #   w 5    10700.0      cleanJun5058
         HZ    100 VAL  QG1     7.50  #   w 5M   16130.0      cleanJun5059
 51 LEU  
         HA     51 LEU  HB2     4.80  #     2   365400.0      cleanJun2992
         HA     51 LEU  HB3     4.90  #     2   356300.0      cleanJun2991
         HA     51 LEU  HG      3.90  #     1   402400.0      cleanJun2993
         HA     51 LEU  QD1     3.40  #   s 1M  750300.0    ! cleanJun2147
         HA     52 ASP- HA      6.50  #   w 2    49450.0      cleanJun3713
         HA     53 LYS+ HA      6.50  #   w 3    44200.0      cleanJun4516
         HA     53 LYS+ HG2     6.50  #   w 5    38280.0      cleanJun4320
         HA     53 LYS+ QD      7.50  # m w 5   123750.0*2    cleanJun4321
         HA     59 ILE  QG2     7.50  #   w 5M  413400.0      cleanJun3731
         HA     59 ILE  QD1     7.50  #   w 5M    9811.0      cleanJun3714
         HA     63 GLU- HB3     6.50  #   w 5    73300.0      cleanJun4322
         HA     67 ILE  HA      3.70  #     4   111800.0      cleanJun3718
         HA     67 ILE  QG2     7.50  #   w 5M   69020.0      cleanJun4331
         HA     67 ILE  HG13    6.50  #   w 5   177500.0      cleanJun2300
         HA     67 ILE  QD1     7.50  #   w 5M   16090.0      cleanJun4332
         HA     70 GLY  HA2     3.30  #     4   239900.0      cleanJun3722
         HB2    51 LEU  HG      2.80 <#     1  3023000.0      cleanJun3005
         HB2    51 LEU  QD1     4.40  #     1M  131800.0      cleanJun2606
         HB2    52 ASP- HA      4.50 <#     2   601700.0      cleanJun3723
         HB2    52 ASP- QB      6.50  # m   5   921000.0*2    cleanJun3724
         HB2    59 ILE  HA      6.50  #   w 5   134800.0      cleanJun4327
         HB2    59 ILE  QG2     7.30  #     5M  521900.0      cleanJun3730
         HB2    59 ILE  QG1     7.50 ># m w 5    76250.0*2    cleanJun4325
         HB2    59 ILE  QD1     7.20 <#     5M  571500.0      cleanJun3726
         HB2    63 GLU- HB3     6.50  #   w 5    43720.0      cleanJun4517
         HB2    67 ILE  HG13    6.50  #   w 5    94020.0      cleanJun3733
         HB2    67 ILE  QD1     7.50  #   w 5M  404000.0      cleanJun3732
         HB3    51 LEU  HG      3.60 >#     1   599300.0      cleanJun3004
         HB3    51 LEU  QD1     3.60  #     1M  433000.0      cleanJun3011
         HB3    52 ASP- HA      6.50 >#   w 2    50470.0      cleanJun3725
         HB3    59 ILE  QG1     7.50 <# m w 5   217100.0*2    cleanJun4519
         HB3    59 ILE  QD1     7.50 >#   w 5M   51430.0      cleanJun3728
         HB3    63 GLU- HB3     5.90  #     5   620000.0      cleanJun4520
         HB3    67 ILE  HG13    6.50  #   w 5   119600.0      cleanJun5083
         HG     51 LEU  QD1     3.40  #     1M  622800.0      cleanJun3003
         HG     59 ILE  QD1     7.50  #   w 5M  203300.0      cleanJun4521
         HG     67 ILE  HG13    6.30  #     5   404000.0      cleanJun3737
         HG     67 ILE  QD1     7.50  #   w 5M   83620.0      cleanJun4328
         HG     71 PHE  QE      8.50  # r w 5    21920.0*2    cleanJun5106
         QD1    59 ILE  QG1     8.50  # m w 5M   70750.0*2    cleanJun3734
         QD1    59 ILE  QD1     8.50  # m w 5M  389800.0      cleanJun3735
         QD1    67 ILE  HA      7.50  #   w 5M  139800.0      cleanJun4329
         QD1    67 ILE  HB      7.50  #   w 5M   43460.0      cleanJun3740
         QD1    67 ILE  HG12    7.50  #   w 5M  403800.0      cleanJun4166
         QD1    67 ILE  HG13    7.50  #   w 5M  235300.0      cleanJun3736
         QD1    70 GLY  HA1     7.50  #   w 5M  363700.0      cleanJun3720
         QD1    70 GLY  HA2     7.40  #     5M  493000.0      cleanJun3721
         QD1    71 PHE  HA      7.50  #   w 5M  138700.0      cleanJun4333
 52 ASP- 
         HA     52 ASP- QB      5.40  # i   2   390400.0*2    cleanJun3014
         HA     53 LYS+ HA      5.80  #     2   121300.0      cleanJun4334
         HA     53 LYS+ HB2     5.50  #     2   171400.0      cleanJun4335
         HA     59 ILE  QG2     7.50  #   w 5M   46590.0      cleanJun3744
         HA     59 ILE  QG1     7.50  # m w 5     7035.0*2    cleanJun3745
         HA     59 ILE  QD1     7.50  #   w 5M  176700.0      cleanJun4495
         HA     63 GLU- HB2     6.50  #   w 5   138300.0      cleanJun4337
         HA     63 GLU- HB3     6.50  #   w 5    74930.0      cleanJun4338
         HA     63 GLU- QG      7.50  # m w 5    27840.0*2    cleanJun4524
         QB     55 LYS+ HA      7.50  # m w 3     8255.0*2    cleanJun4914
         QB     55 LYS+ QB      8.50  # mmw 5    48200.0*4    cleanJun4340
         QB     55 LYS+ QG      8.50  # mmw 5   164025.0*4    cleanJun4790
         QB     55 LYS+ QD      8.50  # mmw 5    11065.0*4    cleanJun4791
         QB     55 LYS+ QE      8.50  # mmw 5    37350.0*4    cleanJun4792
         QB     58 PHE  QD      9.50  # mrw 5    34175.0*4    cleanJun5060
         QB     59 ILE  HB      7.50  # m w 5    11505.0*2    cleanJun3742
         QB     59 ILE  QG2     8.50  # m w 5M  334950.0*2    cleanJun3741
         QB     59 ILE  QD1     8.50  # m w 5M   16750.0*2    cleanJun3743
 53 LYS+ 
         HA     53 LYS+ HB2     4.20  #     2   871600.0      cleanJun3025
         HA     53 LYS+ HB3     4.30  #     2   759900.0      cleanJun3026
         HA     53 LYS+ HG2     3.50  #     1   780000.0      cleanJun3023
         HA     53 LYS+ HG3     3.80  #     1   441000.0      cleanJun3016
         HA     53 LYS+ QD      4.90  # m   1   406100.0*2    cleanJun3749
         HA     53 LYS+ QE      5.20  # m   1   231600.0*2    cleanJun3750
         HA     54 ASP- HA      5.40  #     2   177800.0      cleanJun3748
         HA     55 LYS+ QD      7.50  # m w 5    99500.0*2    cleanJun4526
         HA     55 LYS+ QE      7.50  # m w 5   168700.0*2    cleanJun4525
         HA     63 GLU- QG      7.50  # m w 5    24805.0*2    cleanJun4344
         HB2    53 LYS+ HG2     3.20  #     1  1187000.0      cleanJun3027
         HB2    53 LYS+ HG3     3.50  #     1   704200.0      cleanJun3018
         HB2    53 LYS+ QD      4.30  # m   1   982500.0*2    cleanJun3751
         HB2    53 LYS+ QE      4.90 <# m   1   371700.0*2    cleanJun3754
         HB2    54 ASP- HB2     6.10  #     5   519800.0      cleanJun4345
         HB2    54 ASP- HB3     6.50  #   w 5   173500.0      cleanJun4917
         HB2    55 LYS+ QE      7.50  # m w 5   123350.0*2  ! cleanJun4793
         HB2    63 GLU- HA      6.50  #     5   333400.0      cleanJun4346
         HB2    63 GLU- HB3     6.50  #   w 5   112400.0      cleanJun4527
         HB2    63 GLU- QG      7.50  # m w 5    81750.0*2    cleanJun4916
         HB3    53 LYS+ HG2     3.00  #     1  1937000.0      cleanJun3019
         HB3    53 LYS+ HG3     3.00  #     1  2022000.0      cleanJun3020
         HB3    53 LYS+ QD      4.00  # m   1  2042000.0*2    cleanJun3756
         HB3    53 LYS+ QE      5.60 ># m   1   138050.0*2    cleanJun3755
         HB3    54 ASP- HB3     6.50  #   w 5   129300.0      cleanJun4918
         HB3    63 GLU- HB2     6.50  #   w 5   311600.0      cleanJun4349
         HB3    63 GLU- HB3     5.10  #     5  1491000.0      cleanJun4347
         HB3    63 GLU- QG      7.50  # m w 5   170550.0*2    cleanJun4348
         HG2    53 LYS+ QD      3.70  # m   1  3457500.0*2    cleanJun3031
         HG2    63 GLU- HB2     6.50  #   w 5   191400.0      cleanJun4351
         HG2    63 GLU- HB3     5.50  #     5   982300.0      cleanJun4529
         HG2    63 GLU- QG      7.50  # m w 5    30145.0*2    cleanJun4350
         HG3    53 LYS+ QD      4.10  # m   1  1527500.0*2    cleanJun3032
         HG3    54 ASP- HA      6.50  #   w 5    96150.0      cleanJun3747
         QD     53 LYS+ QE      7.90  # mm  1    31750.0*4    cleanJun3761
         QD     63 GLU- HA      7.50  # m w 5   144000.0*2    cleanJun4353
         QD     63 GLU- QG      8.50  # mmw 5    31600.0*4    cleanJun4354
         QD     66 PHE  QB      8.50  # mmw 5    17827.5*4    cleanJun4355
         QD     69 LYS+ QB      8.50  # mmw 5    34125.0*4    cleanJun4356
         QE     54 ASP- HA      7.50  # m w 5    36230.0*2    cleanJun4919
 54 ASP- 
         HA     54 ASP- HB2     3.90  #     2  1363000.0      cleanJun3034
         HA     54 ASP- HB3     3.80  #     2  1568000.0      cleanJun3033
         HA     55 LYS+ HA      6.30  #     2    74790.0      cleanJun4530
         HB2    56 SER  QB      7.50  # m w 5   134800.0*2    cleanJun4358
 55 LYS+ 
         HA     55 LYS+ QB      6.40  # m   2   193400.0*2    cleanJun3042
         HA     55 LYS+ QG      4.60  # i   1   335300.0*2    cleanJun3041
         HA     55 LYS+ QD      5.00  # m   1   308950.0*2    cleanJun3051
         HA     56 SER  HA      5.10  #     2   262300.0      cleanJun4531
         HA     57 GLY  HA1     5.10  #     3   342200.0    ! cleanJun3782
         QB     55 LYS+ QG      6.40  # mm  1   190800.0*4    cleanJun3045
         QB     55 LYS+ QD      5.50  # mm  1   784500.0*4    cleanJun3049
         QB     55 LYS+ QE      6.60  # mm  1   139100.0*4    cleanJun3052
         QG     55 LYS+ QD      5.30  # mm  1  1022250.0*4    cleanJun3050
         QG     55 LYS+ QE      6.70  # mm  1   118325.0*4    cleanJun3054
         QD     55 LYS+ QE      6.10  # mm  1   279000.0*4    cleanJun3053
         QE     57 GLY  HA1     7.50  # m w 5   165850.0*2    cleanJun4794
 56 SER  
         HA     56 SER  QB      4.70  # m   2  1887000.0*2    cleanJun3056
         HA     57 GLY  HA2     5.90  #     2   107200.0      cleanJun4920
 57 GLY  
         HA1    58 PHE  QD      8.50  # r w 5     3084.0*2    cleanJun5061
         HA2    58 PHE  QD      8.50  # r w 5     2028.5*2    cleanJun5062
 58 PHE  
         HA     58 PHE  HB2     5.30  #     2   216400.0      cleanJun3060
         HA     58 PHE  HB3     4.70  #     2   418700.0      cleanJun3059
         HA     58 PHE  QD      6.70  # m   1    39940.0*2    cleanJun4936
         HA     59 ILE  HB      6.50  #   w 2     4560.0      cleanJun4532
         HA     59 ILE  QG1     7.50  # m w 5        0.0*2    cleanJun4923
         HA     99 GLY  HA1     3.80  #     4    92440.0      cleanJun4924
         HB2    58 PHE  QD      6.60  # r   1   147950.0*2    cleanJun4498
         HB2    60 GLU- HA      6.40  #     3    82480.0      cleanJun3785
         HB2    60 GLU- QB      7.50  # m w 5    10225.0*2    cleanJun3789
         HB2    60 GLU- QG      7.00 <# m   5   583500.0*2    cleanJun4360
         HB2    97 LYS+ HB2     6.50  #   w 5    29780.0      cleanJun4620
         HB2    97 LYS+ HB3     6.50  #   w 5    16320.0      cleanJun4619
         HB2    97 LYS+ QG      7.50  # m w 5    18010.0*2    cleanJun4927
         HB2    97 LYS+ HD2     6.50  #   w 5    31330.0      cleanJun4929
         HB2    97 LYS+ HD3     6.50  #   w 5   114600.0      cleanJun4615
         HB2    97 LYS+ QE      7.50 ># m w 5    21140.0*2    cleanJun4933
         HB3    58 PHE  QD      6.30  # r   1   207550.0*2    cleanJun4621
         HB3    59 ILE  HA      6.50  #   w 2    21260.0      cleanJun4921
         HB3    60 GLU- HA      6.50  #   w 3    34940.0      cleanJun4535
         HB3    60 GLU- QB      7.50  # m w 5     8090.0*2    cleanJun4359
         HB3    60 GLU- QG      7.50 ># m w 5    43255.0*2    cleanJun4534
         HB3    97 LYS+ HB2     6.50  #   w 5    35470.0      cleanJun4925
         HB3    97 LYS+ HB3     6.50  #   w 5    18110.0      cleanJun4617
         HB3    97 LYS+ QG      7.50  # m w 5    11060.0*2    cleanJun4926
         HB3    97 LYS+ HD2     6.50  #   w 5    30150.0      cleanJun4928
         HB3    97 LYS+ HD3     6.50  #   w 5   102500.0      cleanJun4614
         HB3    97 LYS+ QE      7.50 <# m w 5    52900.0*2    cleanJun4932
         QD     97 LYS+ HB3     8.50  # r w 5        0.0*2    cleanJun5063
         QD     97 LYS+ HD2     8.50  # r w 5        0.0*2    cleanJun5064
         QD     97 LYS+ HD3     8.50  # r w 5     2981.0*2    cleanJun5065
         QD     97 LYS+ QE      9.50  # rmw 5      231.0*4    cleanJun5066
         QD     98 ILE  QG2     9.50  # r w 5M    5115.0*2    cleanJun5067
         QD     99 GLY  HA1     8.50  # r w 5   128900.0*2    cleanJun4934
 59 ILE  
         HA     59 ILE  HB      5.80  #     2   120500.0      cleanJun3065
         HA     59 ILE  QG2     3.60  #     1M  484000.0      cleanJun1662
         HA     59 ILE  QG1     5.50  # i   1   101650.0*2    cleanJun3066
         HA     59 ILE  QD1     4.80  #     1M   86120.0      cleanJun1602
         HA     63 GLU- HB2     6.50  #   w 3     6634.0      cleanJun4937
         HB     59 ILE  QG2     3.40  #   s 1M 1276000.0      cleanJun3072
         HB     59 ILE  QG1     5.20  # m   1   250450.0*2    cleanJun3076
         HB     59 ILE  QD1     3.50  #     1M  600800.0      cleanJun3069
         HB     64 LEU  QB      7.50  # m w 5   153000.0*2    cleanJun4538
         HB     64 LEU  HG      6.50  #   w 5    26240.0      cleanJun4364
         HB     64 LEU  QD1     7.50  #   w 5M   68810.0      cleanJun4539
         HB     67 ILE  HB      6.50  #   w 5   216000.0      cleanJun4373
         HB     97 LYS+ QG      7.50  # m w 5    91850.0*2    cleanJun4622
         HB     98 ILE  HA      6.50  #   w 5    71130.0      cleanJun4537
         HB     98 ILE  HB      5.80  #     5   717000.0      cleanJun4733
         HB     98 ILE  QG2     7.50  #   w 5M  202800.0      cleanJun4541
         HB     98 ILE  HG12    6.00 >#     5   579400.0      cleanJun4543
         HB     98 ILE  HG13    4.00 <#     5  6823000.0      cleanJun4542
         HB     98 ILE  QD1     7.50  #   w 5M  266400.0      cleanJun4544
         HB    103 PHE  QE      8.50  # r w 5        0.0*2    cleanJun5071
         QG2    59 ILE  QG1     4.70  # m   1M  399800.0*2    cleanJun3075
         QG2    59 ILE  QD1     4.40  # m s 1M 1398000.0      cleanJun1655
         QG2    63 GLU- HB2     7.50  #   w 5M  336700.0      cleanJun4365
         QG2    63 GLU- HB3     7.50  #   w 5M  147400.0      cleanJun4938
         QG2    63 GLU- QG      8.50  # m w 5M    9435.0*2    cleanJun4942
         QG2    64 LEU  HA      7.50  #   w 5M  162000.0      cleanJun3806
         QG2    64 LEU  QB      8.50  # m w 5M   35360.0*2    cleanJun3808
         QG2    64 LEU  QD1     8.50  # m w 5M  244700.0      cleanJun3809
         QG2    67 ILE  HB      7.50  #   w 5M  109500.0      cleanJun3811
         QG2    67 ILE  HG13    7.50  #   w 5M  329400.0      cleanJun4369
         QG2    67 ILE  QD1     7.80  # m   5M  797100.0      cleanJun3812
         QG2    98 ILE  HB      7.50  #   w 5M   32210.0      cleanJun4940
         QG2    98 ILE  QG2     8.50  # m w 5M  209400.0      cleanJun4547
         QG2    98 ILE  HG12    7.50  #   w 5M   33370.0      cleanJun4941
         QG2    98 ILE  QD1     8.50  # m w 5M  245200.0      cleanJun4548
         QG1    59 ILE  QD1     4.40  # m s 1M 1046500.0*2    cleanJun3074
         QG1    63 GLU- HB2     7.50  # m w 5   127550.0*2    cleanJun4549
         QG1    63 GLU- HB3     7.50  # m w 5   216700.0*2    cleanJun4545
         QG1    64 LEU  QB      8.50  # mmw 5    17535.0*4    cleanJun4366
         QG1    67 ILE  HG12    7.50  # m w 5   143100.0*2    cleanJun4546
         QG1    67 ILE  QD1     8.50  # m w 5M  110750.0*2    cleanJun4367
         QG1    98 ILE  HB      7.50  # m w 5    54750.0*2    cleanJun4552
         QG1    98 ILE  QG2     8.50  # m w 5M  121150.0*2    cleanJun4554
         QD1    64 LEU  HG      7.50  #   w 5M  126800.0      cleanJun3815
         QD1    67 ILE  QG2     8.50  # m w 5M  251400.0      cleanJun3816
         QD1    67 ILE  HG13    7.50  #   w 5M  233700.0      cleanJun4371
         QD1    67 ILE  QD1     8.50  # m w 5M  184500.0      cleanJun4943
         QD1    98 ILE  HB      7.50  #   w 5M   90060.0      cleanJun4550
         QD1    98 ILE  QG2     8.50  # m w 5M  216400.0      cleanJun4553
         QD1    98 ILE  QD1     8.50  # m w 5M   41130.0      cleanJun4556
         QD1   103 PHE  QB      8.50  # m w 5M   26685.0*2    cleanJun4557
         QD1   103 PHE  QD      9.50  # r w 5M   14510.0*2    cleanJun5072
         QD1   103 PHE  QE      9.50  # r w 5M   13050.0*2    cleanJun5073
 60 GLU- 
         HA     60 GLU- QB      6.60  # m   2   145350.0*2    cleanJun3082
         HA     60 GLU- QG      4.30  # i   1   579500.0*2    cleanJun3085
         HA     61 GLU- HA      6.50  #     2    63050.0      cleanJun4362
         HA     61 GLU- HG2     6.50  #     5   341500.0      cleanJun3823
         HA     63 GLU- HB3     5.10  #     3   345400.0      cleanJun4374
         HA     97 LYS+ HA      3.60  #     4   148700.0      cleanJun4623
         HA     97 LYS+ HB3     6.50  #   w 5    72130.0      cleanJun4625
         HA     97 LYS+ QG      7.50  # m w 5        0.0*2    cleanJun4624
         QB     60 GLU- QG      6.50  # mm  1   157925.0*4    cleanJun3080
         QB     61 GLU- HA      7.30  # m   2    72900.0*2    cleanJun4562
         QB     61 GLU- QB      8.50  # mmw 5   131050.0*4    cleanJun4563
         QB     61 GLU- HG2     7.50  # m w 5    71900.0*2    cleanJun3824
         QB     61 GLU- HG3     7.50  # m w 5   137000.0*2    cleanJun3825
         QB     62 ASP- HB3     7.50  # m w 5    45925.0*2    cleanJun3826
         QB     63 GLU- HB2     7.50  # m w 5    63950.0*2    cleanJun4561
         QB     63 GLU- QG      8.50  # mmw 5    16570.0*4    cleanJun4560
         QG     97 LYS+ QG      8.50  # mmw 5    29525.0*4    cleanJun4627
         QG     97 LYS+ HD2     7.50  # m w 5    61200.0*2    cleanJun4626
 61 GLU- 
         HA     61 GLU- QB      5.20  # m   2   830000.0*2    cleanJun1780
         HA     61 GLU- HG2     5.60 >#     1    44580.0      cleanJun3836
         HA     61 GLU- HG3     4.60 <#     1   142100.0      cleanJun3086
         HA     62 ASP- HB2     5.40  #     2   179800.0    ! cleanJun3833
         HA     64 LEU  QB      6.10  # m   3   318300.0*2    cleanJun3828
         HA     64 LEU  HG      6.50  #   w 5   179400.0      cleanJun1779
         HA     64 LEU  QD1     7.50  #   w 5M  245900.0      cleanJun3830
         HA     64 LEU  QD2     7.50  #   w 5M  191200.0      cleanJun3829
         QB     61 GLU- HG2     3.70  # m   1  3629000.0*2    cleanJun3090
         QB     61 GLU- HG3     3.50  # m   1  5310000.0*2    cleanJun3089
         QB     64 LEU  QB      7.70  # mm  5   739500.0*4    cleanJun3831
         QB     64 LEU  QD1     8.50  # m w 5M  241650.0*2    cleanJun3834
         HG2    62 ASP- HB2     6.50  #   w 5   293100.0      cleanJun3835
 62 ASP- 
         HA     62 ASP- HB2     3.90  #     2  1431000.0      cleanJun2552
         HA     62 ASP- HB3     4.20  #     2   914100.0      cleanJun4160
         HA     63 GLU- HB3     5.40  #     2   176500.0    ! cleanJun4375
         HA     65 GLY  HA1     6.00  #     3   124800.0      cleanJun4376
         HB3    66 PHE  QD      8.50  # r w 5     4587.0*2    cleanJun5070
 63 GLU- 
         HA     63 GLU- HB2     4.50  #     2   598800.0      cleanJun4031
         HA     63 GLU- HB3     4.40  #     2   621900.0      cleanJun4034
         HA     63 GLU- QG      5.10  # i   1   160650.0*2    cleanJun4026
         HA     64 LEU  HA      6.50  #   w 2    48970.0      cleanJun4058
         HA     66 PHE  QD      8.50  # r w 5    27910.0*2    cleanJun4057
         HB2    63 GLU- QG      3.90 <# m   1  2166500.0*2    cleanJun4030
         HB2    64 LEU  QB      7.50 ># m w 5     3442.0*2    cleanJun4059
         HB2    67 ILE  HA      5.20  #     3   298900.0      cleanJun4378
         HB3    63 GLU- QG      5.10 ># m   1   295550.0*2    cleanJun4035
         HB3    64 LEU  QB      7.50 <# m w 5    34405.0*2    cleanJun4377
 64 LEU  
         HA     64 LEU  QB      6.30  # m   2   210500.0*2    cleanJun3794
         HA     64 LEU  HG      4.10  #     1   308000.0      cleanJun3793
         HA     64 LEU  QD1     6.10 >#     1M   18360.0      cleanJun3791
         HA     64 LEU  QD2     5.10 <#     1M   56470.0      cleanJun3792
         HA     67 ILE  HB      6.00  #     3   128000.0      cleanJun3837
         HA     67 ILE  QG2     7.50  #   w 5M  283900.0      cleanJun4380
         HB2    64 LEU  QD1     3.80  #     1M  338400.0      cleanJun3854
         QB     64 LEU  HG      4.50  # m   1   740000.0*2    cleanJun3099
         QB     64 LEU  QD1     5.10 <# m   1M  225850.0*2    cleanJun3805
         QB     64 LEU  QD2     5.90 ># m   1M   70400.0*2    cleanJun3100
         QB     65 GLY  HA1     7.50  # m w 2    14990.0*2    cleanJun4390
         QB     87 MET  HA      7.50  # m w 5   328200.0*2    cleanJun3842
         QB     87 MET  QB      8.20  # mm  5   438750.0*4    cleanJun3843
         HG     64 LEU  QD1     5.30  #     1M   43340.0      cleanJun3798
         HG     64 LEU  QD2     5.10  #     1M   57630.0      cleanJun3799
         HG     65 GLY  HA1     6.50  #   w 5    62920.0      cleanJun4388
         HG     65 GLY  HA2     6.50  #   w 5   157300.0      cleanJun4796
         HG     67 ILE  HB      6.50  #   w 5     9533.0      cleanJun5085
         HG     67 ILE  QG2     7.50  #   w 5M  274000.0      cleanJun3845
         HG     67 ILE  QD1     7.50  #   w 5M   21140.0      cleanJun5086
         HG     78 LEU  HG      6.50  #   w 5    39940.0      cleanJun3846
         HG     78 LEU  QD1     7.50  #   w 5M  138200.0      cleanJun3847
         HG     86 LEU  HB2     6.10  #     5   481500.0      cleanJun3849
         HG     86 LEU  HB3     5.60  #     5   826200.0      cleanJun3848
         HG     86 LEU  HG      6.50  #   w 5   248700.0      cleanJun3850
         HG     86 LEU  QD1     7.40  #     5M  491400.0      cleanJun3852
         HG     87 MET  QB      7.50  # m w 5    64750.0*2    cleanJun3844
         QD1    65 GLY  HA1     7.50  #   w 5M  114300.0      cleanJun4387
         QD1    65 GLY  HA2     7.50  #   w 5M   72530.0      cleanJun4389
         QD1    67 ILE  HB      7.50  #   w 5M  343000.0      cleanJun3840
         QD1    67 ILE  QG2     8.20  # m   5M  553300.0      cleanJun4382
         QD1    67 ILE  QG1     8.50  # m w 5M  124750.0*2    cleanJun4384
         QD1    67 ILE  QD1     7.30  # m   5M 1286000.0    ! cleanJun3853
         QD1    78 LEU  HG      7.50  #   w 5M   31120.0      cleanJun4799
         QD1    78 LEU  QD1     8.50  # m w 5M   17370.0      cleanJun4385
         QD1    86 LEU  QD1     6.00  # m   5M 5103000.0      cleanJun3855
         QD1    87 MET  HA      7.10  #     5M  616400.0      cleanJun3841
         QD2    67 ILE  HB      7.10  #     5M  639500.0      cleanJun3839
         QD2    67 ILE  QG2     8.50  # m w 5M  342900.0      cleanJun4383
 65 GLY  
         HA1    66 PHE  QB      5.60  # m   2   514000.0*2    cleanJun4060
         HA1    78 LEU  QB      7.50  # m w 5   197500.0*2    cleanJun4795
         HA1    78 LEU  HG      6.50  #   w 5   115300.0      cleanJun4801
         HA2    67 ILE  QG2     7.50  #   w 5M   32610.0      cleanJun4386
         HA2    78 LEU  QB      7.50  # m w 5   180650.0*2    cleanJun4797
         HA2    78 LEU  HG      6.50  #   w 5    98400.0      cleanJun4802
 66 PHE  
         HA     66 PHE  QB      6.40  # m   2   184050.0*2    cleanJun3102
         HA     66 PHE  QD      6.80  # m   1    36250.0*2    cleanJun5068
         HA     69 LYS+ QG      7.50  # m w 5    33470.0*2    cleanJun3857
         QB     66 PHE  QD      8.90  # mr  1    31325.0*4    cleanJun4497
         QB     66 PHE  QE      9.50  # mrw 1        0.0*4    cleanJun5069
         QB     67 ILE  HA      7.50  # m w 2     6000.0*2    cleanJun5087
         QB     69 LYS+ QG      8.50  # mmw 5    33425.0*4    cleanJun2705
 67 ILE  
         HA     67 ILE  HB      4.40  #     2   643300.0      cleanJun2514
         HA     67 ILE  QG2     4.70  #     1M   91230.0      cleanJun1582
         HA     67 ILE  HG12    3.70  #     1   505600.0      cleanJun1583
         HA     67 ILE  QD1     4.00  #     1M  249400.0      cleanJun3113
         HA     68 LEU  HB3     6.50  #   w 2    38700.0      cleanJun4952
         HA     69 LYS+ QB      7.50  # m w 3     3689.5*2    cleanJun5088
         HA     70 GLY  HA2     6.50  #   w 3    24490.0      cleanJun4957
         HA     71 PHE  QE      8.50  # r w 5     4693.5*2    cleanJun5107
         HB     67 ILE  QG2     3.40  #   s 1M  936900.0      cleanJun2508
         HB     67 ILE  HG12    2.90 <#     1  2322000.0      cleanJun3105
         HB     67 ILE  HG13    4.10 >#     1   304800.0      cleanJun2299
         HB     67 ILE  QG1     4.30  # m   1  1177500.0*2    cleanJun3103
         HB     67 ILE  QD1     4.60  #     1M  104400.0      cleanJun3112
         QG2    67 ILE  HG12    3.70  #     1M  368000.0      cleanJun1640
         QG2    67 ILE  HG13    3.50  #     1M  535100.0      cleanJun4370
         QG2    67 ILE  QD1     4.40  # m s 1M 1140000.0      cleanJun1636
         QG2    68 LEU  HA      7.50  #   w 5M    6891.0      cleanJun5090
         QG2    68 LEU  HB2     7.50  #   w 5M    4977.0      cleanJun5091
         QG2    68 LEU  HG      7.50  #   w 5M  157400.0      cleanJun5089
         QG2    68 LEU  QD1     8.50  # m w 5M  286700.0      cleanJun1632
         QG2    78 LEU  HG      7.50  #   w 5M  277500.0      cleanJun3858
         QG2    78 LEU  QD1     8.50  # m w 5M   47070.0      cleanJun3859
         QG2    86 LEU  QD1     8.50  # m w 5M  144800.0      cleanJun3860
         HG12   67 ILE  QD1     3.40  #   s 1M 1215000.0      cleanJun3111
         HG12   68 LEU  HA      6.50  #   w 5   250800.0      cleanJun5092
         HG12   86 LEU  HG      6.50  #   w 5   327300.0      cleanJun3861
         HG12   86 LEU  QD1     7.50  #   w 5M  123600.0      cleanJun3862
         HG13   67 ILE  QD1     3.40  #   s 1M 1337000.0      cleanJun3110
         HG13   70 GLY  HA2     6.50  #   w 5     4213.0      cleanJun5093
         QD1    68 LEU  QD1     8.50  # m w 5M  119600.0      cleanJun4330
         QD1    71 PHE  HA      7.50  #   w 5M   19570.0      cleanJun3864
         QD1    71 PHE  HB2     7.50  #   w 5M  140300.0      cleanJun3863
         QD1    71 PHE  QE      9.50  # r w 5M    6710.0*2    cleanJun5108
         QD1    78 LEU  HG      7.50  #   w 5M   83540.0      cleanJun4798
         QD1    78 LEU  QD1     8.50  # m w 5M    2182.0      cleanJun5094
         QD1    86 LEU  QD1     8.50  # m w 5M   96630.0      cleanJun5095
 68 LEU  
         HA     68 LEU  HB2     4.40 >#     2   664400.0      cleanJun3116
         HA     68 LEU  HB3     3.60 <#     2  2254000.0      cleanJun3117
         HA     68 LEU  HG      4.10  #     1   270500.0      cleanJun3135
         HA     68 LEU  QD1     4.00  #     1M  243600.0      cleanJun3114
         HA     69 LYS+ QG      7.50  # m w 5    65900.0*2    cleanJun3865
         HA     71 PHE  HB2     6.50  #   w 3    12440.0      cleanJun4951
         HA     71 PHE  HB3     6.50  #   w 3    24160.0      cleanJun3866
         HA     75 ALA  QB      7.50  #   w 5M   58130.0      cleanJun4954
         HB2    68 LEU  HG      4.40  #     1   175100.0      cleanJun3133
         HB2    68 LEU  QD1     4.50  #     1M  119600.0      cleanJun3128
         HB2    69 LYS+ QG      7.50  # m w 5    94750.0*2    cleanJun3868
         HB2    71 PHE  HA      6.50  #   w 3    64050.0    ! cleanJun3871
         HB2    75 ALA  HA      6.50  #   w 5    41640.0      cleanJun4812
         HB2    75 ALA  QB      7.50  #   w 5M  165500.0      cleanJun3869
         HB2    76 ARG+ HG2     6.50  #   w 5   143700.0      cleanJun4955
         HB3    68 LEU  HG      4.90  #     1    97900.0      cleanJun3126
         HB3    68 LEU  QD1     4.30  #     1M  157300.0      cleanJun3129
         HB3    75 ALA  QB      7.50  #   w 5M  318600.0      cleanJun3867
         HB3    78 LEU  HG      6.50  #   w 5    17420.0      cleanJun3873
         HG     68 LEU  QD1     3.60  #     1M  459700.0      cleanJun3131
         HG     75 ALA  QB      7.50  #     5M  431700.0      cleanJun2099
         QD1    75 ALA  QB      8.50  # m w 5M   74740.0      cleanJun4216
 69 LYS+ 
         HA     69 LYS+ QB      7.50  # m w 2    13530.0*2    cleanJun3138
         HA     69 LYS+ QG      5.40  # i   1   116850.0*2    cleanJun3137
         HA     69 LYS+ QD      5.60  # m   1   142350.0*2    cleanJun3136
         HA     73 PRO  HA      6.50  #   w 3    53000.0      cleanJun4956
         HA     75 ALA  QB      7.00  #     5M  650400.0      cleanJun3874
         QB     69 LYS+ QG      7.00  # mm  1    85450.0*4    cleanJun3144
         QB     69 LYS+ QD      8.50  # mmw 1    11150.0*4    cleanJun3139
         QB     75 ALA  QB      8.50  # m w 5M  157400.0*2    cleanJun4816
         QG     69 LYS+ QD      6.00  # mm  1   332750.0*4    cleanJun3143
         QG     73 PRO  HA      7.50  # m w 5     8330.0*2    cleanJun3875
         QG     75 ALA  QB      8.50  # m w 5M   84600.0*2    cleanJun4815
         QG     77 ASP- HA      7.50  # m w 5    52300.0*2    cleanJun3876
 70 GLY  
         HA1    71 PHE  HA      6.50 >#   w 2     5018.0      cleanJun5109
         HA1    72 SER  QB      6.70  # m   3   165400.0*2  ! cleanJun4805
         HA1    75 ALA  QB      7.50  #   w 5M  121200.0      cleanJun2104
         HA2    71 PHE  HA      6.40 <#     2    64440.0      cleanJun4946
         HA2    71 PHE  QD      8.50  # r w 5    17060.0*2    cleanJun5111
 71 PHE  
         HA     71 PHE  HB2     5.40  #     2   184200.0      cleanJun3150
         HA     71 PHE  HB3     4.80  #     2   404700.0      cleanJun3149
         HB3    71 PHE  QD      8.50  # r w 1    14170.0*2    cleanJun5097
         HB3    72 SER  QB      7.50  # m w 5     5690.0*2    cleanJun5112
 72 SER  
         HA     72 SER  QB      5.30  # m   2   744000.0*2    cleanJun4041
         HA     73 PRO  HA      6.50  #   w 2    50720.0      cleanJun4958
         HA     73 PRO  HB2     6.00  #     2    95600.0      cleanJun4063
         HA     73 PRO  HB3     5.60  #     2   146700.0      cleanJun4631
         HA     73 PRO  HG3     6.50  #   w 5    67320.0      cleanJun4634
         HA     73 PRO  HD2     6.20 >#     5   449800.0      cleanJun4632
         HA     73 PRO  HD3     4.50 <#     5  3374000.0      cleanJun4633
         QB     73 PRO  HB2     7.50  # m w 5    60100.0*2    cleanJun4804
         QB     73 PRO  HG2     7.50 ># m w 5     3330.5*2    cleanJun4636
         QB     73 PRO  HG3     7.50 <# m w 5    12340.0*2    cleanJun4635
         QB     75 ALA  QB      8.50  # m w 5M    1590.0*2    cleanJun4960
 73 PRO  
         HA     73 PRO  HB2     4.30  #     2   736500.0      cleanJun3152
         HA     73 PRO  HB3     4.30  #     2   714100.0      cleanJun3155
         HA     73 PRO  HG2     4.60  #     1   151600.0      cleanJun2207
         HA     73 PRO  HG3     4.80  #     1   117200.0      cleanJun2202
         HA     74 ASP- HA      5.90  #     2   111600.0      cleanJun4637
         HA     74 ASP- QB      6.50  # m   2   170750.0*2    cleanJun4807
         HA     75 ALA  QB      5.80  #     3M    8308.0      cleanJun4806
         HB2    73 PRO  HG2     3.70  #     1   524300.0      cleanJun2204
         HB2    73 PRO  HG3     3.10  #     1  1731000.0      cleanJun2198
         HB2    74 ASP- QB      7.50  # m w 5   166250.0*2    cleanJun3884
         HB3    74 ASP- QB      7.50  # m   5   351100.0*2    cleanJun4638
         QB     74 ASP- HA      7.50  # m w 2    11880.0*2    cleanJun4808
         HG2    73 PRO  HD2     4.20  #     1   266000.0      cleanJun3158
         HG2    73 PRO  HD3     3.90  #     1   386700.0      cleanJun3156
         HG2    75 ALA  QB      7.50  #   w 5M  343500.0    ! cleanJun3883
         HG3    73 PRO  HD2     4.00  #     1   347800.0      cleanJun3159
         HG3    73 PRO  HD3     4.60  #     1   135400.0      cleanJun3157
 74 ASP- 
         HA     74 ASP- QB      4.60  # i   2  1138500.0*2    cleanJun3162
         HA     75 ALA  HA      5.60  #     2   146200.0      cleanJun4809
         HA     75 ALA  QB      6.10  #     2M   33320.0      cleanJun4817
         QB     75 ALA  HA      7.50  # m w 2     1026.5*2    cleanJun4961
         QB     76 ARG+ HG2     7.50  # m w 5    37045.0*2    cleanJun4822
         QB     76 ARG+ QD      8.50  # mmw 5   150775.0*4    cleanJun4823
 75 ALA  
         HA     75 ALA  QB      3.40  #     2M 1073000.0      cleanJun2106
         HA     76 ARG+ HA      5.90  #     2   113100.0      cleanJun4639
         HA     76 ARG+ HB2     6.40  #     2    69550.0      cleanJun4819
         HA     76 ARG+ HG2     6.50  #   w 5    65240.0      cleanJun3886
         QB     76 ARG+ HA      6.20  #     2M   30310.0      cleanJun3887
         QB     76 ARG+ HB2     7.50  #   w 5M   58460.0      cleanJun3888
         QB     76 ARG+ HG2     6.70  #     5M  907100.0      cleanJun4640
         QB     76 ARG+ HG3     6.80  #     5M  818900.0      cleanJun4820
 76 ARG+ 
         HA     76 ARG+ HB2     4.90 >#     2   321100.0      cleanJun3475
         HA     76 ARG+ HB3     4.20 <#     2   846000.0      cleanJun3167
         HA     76 ARG+ HG2     4.30  #     1   210700.0      cleanJun3169
         HA     76 ARG+ HG3     4.90  #     1    98530.0      cleanJun3170
         HA     76 ARG+ QD      6.60  # m   1    44920.0*2    cleanJun3171
         HA     77 ASP- HA      5.30  #     2   213100.0      cleanJun4642
         HA     77 ASP- HB2     5.20 <#     2   229600.0      cleanJun3889
         HA     77 ASP- HB3     6.50 >#   w 2    37140.0      cleanJun4646
         HB2    76 ARG+ HG2     3.40  #     1   970800.0      cleanJun3180
         HB2    76 ARG+ HG3     3.50  #     1   717000.0      cleanJun3177
         HB2    76 ARG+ QD      5.70  # m   1   127800.0*2    cleanJun3185
         HB3    76 ARG+ HG2     3.60  #     1   615900.0      cleanJun3179
         HB3    76 ARG+ HG3     4.20  #     1   254700.0      cleanJun3166
         HB3    76 ARG+ QD      6.20  # m   1    64500.0*2    cleanJun3186
         HB3    77 ASP- HA      6.40  #     2    66390.0      cleanJun4644
         HB3    77 ASP- HB2     6.50  #   w 5    52620.0      cleanJun4643
         HG2    76 ARG+ QD      5.80  # m   1   106050.0*2    cleanJun3181
         HG2    78 LEU  QD1     7.50  #   w 5M  191900.0    ! cleanJun3891
         HG3    76 ARG+ QD      5.70  # m   1   123950.0*2    cleanJun3178
 77 ASP- 
         HA     77 ASP- HB2     3.50 <#     2  2459000.0      cleanJun3856
         HA     77 ASP- HB3     5.10 >#     2   267600.0      cleanJun3189
 78 LEU  
         HA     78 LEU  QD1     4.20  #     1M  194300.0      cleanJun4510
         HA     79 SER  HA      5.80  #     2   125000.0      cleanJun4648
         HA     79 SER  QB      5.40  # m   2   623000.0*2    cleanJun4647
         HA     82 GLU- QB      7.50  # m w 3    38515.0*2    cleanJun4649
         HB3    79 SER  HA      5.40  #     2   192000.0      cleanJun3893
         QB     78 LEU  HG      6.20  # m   1    70550.0*2    cleanJun2081
         QB     78 LEU  QD1     5.90  # m   1M   67700.0*2    cleanJun2010
         QB     82 GLU- QB      8.50  # mmw 5    26425.0*4    cleanJun4650
         HG     78 LEU  QD1     3.60  #     1M  442000.0      cleanJun2005
         HG     86 LEU  QD1     7.50  #   w 5M  175800.0      cleanJun4800
         QD1    82 GLU- QB      8.50  # m w 5M    6795.0*2    cleanJun4651
 79 SER  
         HA     79 SER  QB      5.30  # m   2   709500.0*2    cleanJun3195
         HA     80 ALA  HA      4.40  #     2   633500.0      cleanJun3895
         HA     80 ALA  QB      4.90  #     2M  123500.0    ! cleanJun4653
         HA     81 LYS+ HG2     6.50  #   w 5   188300.0      cleanJun3896
         HA     81 LYS+ QD      7.50  # m w 5    75550.0*2    cleanJun4654
         HA     82 GLU- QG      7.50  # m w 5    44500.0*2    cleanJun4655
         QB     80 ALA  QB      8.50  # m w 5M  304900.0*2    cleanJun4656
         QB     81 LYS+ HB2     7.50  # m w 5    60900.0*2    cleanJun4657
         QB     81 LYS+ HG2     7.50  # m w 5    29065.0*2    cleanJun3897
         QB     81 LYS+ QD      8.50  # mmw 5   145925.0*4    cleanJun4658
 80 ALA  
         HA     80 ALA  QB      3.40  #   s 2M 2768000.0      cleanJun3197
         HA     81 LYS+ HA      4.90  #     2   351400.0      cleanJun3900
         QB     81 LYS+ HA      4.90  #     2M  115900.0      cleanJun3901
         QB     81 LYS+ HG3     7.50  #   w 5M  358100.0      cleanJun3902
         QB     81 LYS+ QD      8.50  # m w 5M  295350.0*2    cleanJun3903
 81 LYS+ 
         HA     81 LYS+ HB2     4.50  #     2   552500.0      cleanJun1854
         HA     81 LYS+ HB3     4.70  #     2   411200.0      cleanJun1853
         HA     81 LYS+ HG2     4.30  #     1   213400.0      cleanJun3205
         HA     81 LYS+ HG3     4.50  #     1   163000.0      cleanJun3199
         HA     81 LYS+ QE      7.50  # m w 1     7225.0*2    cleanJun1855
         HB2    81 LYS+ HG2     3.20  #     1  1182000.0      cleanJun3206
         HB2    81 LYS+ HG3     3.40  #     1   885500.0      cleanJun3207
         HB2    81 LYS+ QD      4.10  # m   1  1604000.0*2    cleanJun3204
         HB2    82 GLU- HA      4.50  #     2   537600.0      cleanJun3905
         HB2    82 GLU- QB      7.50  # m w 5   230050.0*2    cleanJun3906
         HB2    82 GLU- QG      7.50 <# m w 5   211550.0*2    cleanJun3907
         HB3    81 LYS+ HG2     3.20  #     1  1206000.0      cleanJun3203
         HB3    82 GLU- HA      5.10  #     2   267900.0      cleanJun3908
         HB3    82 GLU- QG      7.50 ># m w 5    62300.0*2    cleanJun3909
         HG2    81 LYS+ QD      5.10  # m   1   278000.0*2    cleanJun3209
         HG3    82 GLU- QG      7.50  # m w 5     7735.0*2  ! cleanJun3910
 82 GLU- 
         HA     82 GLU- QB      6.30  # m   2   200600.0*2    cleanJun3213
         HA     82 GLU- QG      4.40  # i   1   488300.0*2    cleanJun3212
         HA     85 MET  QB      6.30  # m   3   274100.0*2    cleanJun3911
         QB     82 GLU- QG      5.60  # mm  1   664750.0*4    cleanJun3491
         QB     85 MET  QB      8.50  # mmw 5   160450.0*4    cleanJun3914
         QB     86 LEU  QD1     8.50  # m w 5M  145650.0*2    cleanJun2156
 85 MET  
         HA     85 MET  QB      5.00  # m   2  1163000.0*2    cleanJun1862
         HA     85 MET  QG      4.80  # i   1   244350.0*2    cleanJun1863
         HA     86 LEU  HA      6.50  #   w 2    48700.0      cleanJun3915
         HA     87 MET  QG      7.50  # m w 5   184550.0*2    cleanJun3916
         HA     88 ALA  QB      3.40  #   s 3M  252000.0      cleanJun3917
         QB     86 LEU  HA      6.80  # m   2   122400.0*2    cleanJun3918
 86 LEU  
         HA     86 LEU  HB2     4.60  #     2   491900.0      cleanJun3226
         HA     86 LEU  HB3     4.70  #     2   438000.0      cleanJun1879
         HA     86 LEU  HG      4.20  #     1   239400.0      cleanJun3225
         HA     86 LEU  QD1     3.70  #     1M  392800.0    ! cleanJun2158
         HA     87 MET  HA      5.00  #     2   299800.0      cleanJun3919
         HB2    86 LEU  HG      3.40  #     1   857000.0      cleanJun3234
         HB2    86 LEU  QD1     4.00  #     1M  237500.0      cleanJun3218
         HB2    87 MET  HA      4.50  #     2   571700.0      cleanJun3921
         HB3    86 LEU  HG      3.10  #     1  1577000.0      cleanJun3231
         HB3    86 LEU  QD1     3.40  #     1M  632300.0      cleanJun2153
         HG     87 MET  HA      6.10  #     5   525900.0      cleanJun3922
         HG     89 ALA  QB      7.50  #   w 5M  199900.0      cleanJun3924
         HG     90 GLY  HA1     6.50  #   w 5   130900.0      cleanJun4381
         HG     90 GLY  HA2     6.50  #   w 5   151500.0      cleanJun3923
         QD1   106 LEU  QD1     7.30  # m   5M 1268000.0    ! cleanJun4834
 87 MET  
         HA     87 MET  QB      5.80  # m   2   402850.0*2    cleanJun3239
         HA     87 MET  QG      4.90  # i   1   229800.0*2    cleanJun3238
         HA     88 ALA  HA      6.10  #     2    93680.0      cleanJun3925
         HA     90 GLY  HA2     4.40  #     3   767200.0      cleanJun3927
         HA     98 ILE  QD1     7.50  #   w 5M  345900.0      cleanJun4740
         QB     87 MET  QG      5.30  # mm  1  1096500.0*4    cleanJun3237
         QG     98 ILE  QD1     8.50  # m w 5M   31400.0*2    cleanJun4741
 88 ALA  
         HA     88 ALA  QB      3.50  #     2M  939000.0      cleanJun3242
         HA     89 ALA  HA      5.40  #     2   178900.0      cleanJun3987
 89 ALA  
         HA     89 ALA  QB      3.40  #   s 2M 2363000.0      cleanJun3244
         QB     90 GLY  HA2     6.40  #     2M   23300.0      cleanJun3989
         QB    106 LEU  QD1     8.50  # m w 5M  283400.0      cleanJun4742
 90 GLY  
         HA1    98 ILE  QD1     7.50  #   w 5M  364300.0      cleanJun4743
         HA1   106 LEU  QD1     7.50  #   w 5M  342600.0      cleanJun4745
         HA2   106 LEU  QD1     7.50  #   w 5M  423800.0      cleanJun4744
 91 ASP- 
         HA     91 ASP- HB2     4.20 <#     2   801200.0      cleanJun4050
         HA     91 ASP- HB3     5.10 >#     2   252300.0      cleanJun4044
         HA     92 LYS+ HA      6.50  #   w 2    41300.0      cleanJun4064
         HA     96 GLY  HA2     4.90  #     4    21270.0    ! cleanJun4065
         HA     98 ILE  HA      5.00  #     4    18230.0      cleanJun4066
         HA     98 ILE  QG2     7.50  #   w 5M   58560.0      cleanJun4067
         HA     98 ILE  QD1     7.50  #   w 5M   17840.0      cleanJun4068
         HB2    98 ILE  QD1     7.50 >#   w 5M   62050.0      cleanJun4748
         HB3    98 ILE  QD1     7.50 <#   w 5M  178400.0      cleanJun4747
 92 LYS+ 
         HA     92 LYS+ QB      5.60  # m   2   491600.0*2    cleanJun3248
         HA     92 LYS+ QG      4.50  # i   1   411350.0*2    cleanJun1859
         HA     92 LYS+ QD      5.00  # m   1   357100.0*2    cleanJun3251
         HA     92 LYS+ QE      6.00  # m   1    91150.0*2    cleanJun1864
         HA     94 GLY  HA2     6.10  #     3   113300.0      cleanJun4069
         QB     92 LYS+ QD      5.30  # mm  1  1011250.0*4    cleanJun3252
         QB     93 ASP- HA      7.50  # m w 2    26555.0*2    cleanJun4660
         QB     93 ASP- QB      8.50  # mmw 5    34550.0*4    cleanJun4659
         QB    102 GLU- QG      8.50  # mmw 5   188575.0*4    cleanJun4662
         QB    106 LEU  QD1     8.50  # m w 5M   59950.0*2    cleanJun4084
         QG     98 ILE  HG12    7.50  # m w 5     9415.0*2    cleanJun4074
         QG     98 ILE  QD1     8.50  # m w 5M   19580.0*2    cleanJun4073
         QG    102 GLU- HA      7.50  # m w 5    65750.0*2    cleanJun4664
         QD    102 GLU- QG      8.50  # mmw 5    25000.0*4    cleanJun4663
 93 ASP- 
         HA     93 ASP- QB      6.10  # i   2   169100.0*2    cleanJun3254
         HA     94 GLY  HA2     5.90  #     2   111700.0      cleanJun4666
         QB     95 ASP- HB3     7.50  # m w 5   156200.0*2    cleanJun4667
 94 GLY  
         HA2    95 ASP- HA      5.80  #     2   117900.0      cleanJun4668
 95 ASP- 
         HA     95 ASP- HB2     4.10  #     2   959000.0      cleanJun3260
         HA     95 ASP- HB3     3.90  #     2  1301000.0      cleanJun3258
         HB2    97 LYS+ HB2     5.90  #     5   651200.0      cleanJun4669
 96 GLY  
         HA1    97 LYS+ QG      7.50  # m w 5    57100.0*2    cleanJun4670
         HA2    97 LYS+ QG      7.50  # m w 5    71850.0*2    cleanJun4671
 97 LYS+ 
         HA     97 LYS+ HB2     6.50 >#   w 2    12990.0      cleanJun4567
         HA     97 LYS+ HB3     6.50 <#   w 2    48110.0      cleanJun4566
         HA     97 LYS+ QG      7.10  # i   1    17565.0*2    cleanJun4564
         HA     97 LYS+ HD2     5.40  #     1    51260.0      cleanJun4583
         HA     97 LYS+ HD3     6.10  #     1    26490.0      cleanJun4596
         HA     97 LYS+ QE      5.50  # m   1   155700.0*2    cleanJun4604
         HA     98 ILE  HA      6.50  #   w 2    49690.0      cleanJun4672
         HA     98 ILE  HG12    6.50 <#   w 5    14470.0      cleanJun4628
         HA     98 ILE  HG13    6.50 >#   w 5     2393.0      cleanJun4673
         HB2    97 LYS+ QG      6.30  # m   1    58650.0*2    cleanJun4580
         HB2    97 LYS+ HD2     4.30  #     1   219400.0      cleanJun4585
         HB2    97 LYS+ HD3     4.20  #     1   250200.0      cleanJun4594
         HB2    97 LYS+ QE      4.20 <# m   1  1370500.0*2    cleanJun4602
         HB2    98 ILE  HB      6.50  #   w 5   277300.0      cleanJun4674
         HB2    98 ILE  HG12    6.50  #     5   336200.0      cleanJun4630
         HB3    97 LYS+ QG      6.20  # m   1    67650.0*2    cleanJun4573
         HB3    97 LYS+ HD2     4.60  #     1   134200.0      cleanJun4586
         HB3    97 LYS+ HD3     4.40  #     1   194100.0      cleanJun4574
         HB3    97 LYS+ QE      5.60 ># m   1   140550.0*2    cleanJun4601
         QG     97 LYS+ HD2     4.50  # m   1   697000.0*2    cleanJun4578
         QG     97 LYS+ HD3     4.70  # m   1   553000.0*2    cleanJun4589
         QG     97 LYS+ QE      8.50  # mmw 1    12242.5*4    cleanJun4599
         HD2    97 LYS+ QE      5.90  # m   1    93050.0*2    cleanJun4600
         HD3    97 LYS+ QE      6.00  # m   1    81700.0*2    cleanJun4598
 98 ILE  
         HA     98 ILE  HB      6.00  #     2    95990.0      cleanJun3268
         HA     98 ILE  QG2     3.70  #     1M  383100.0      cleanJun3286
         HA     98 ILE  HG12    4.40  #     1   181400.0      cleanJun3265
         HA     98 ILE  HG13    4.90  #     1    96070.0      cleanJun3267
         HA     98 ILE  QD1     5.70  #     1M   27800.0      cleanJun4104
         HA     99 GLY  HA1     5.80  #     2   115500.0      cleanJun4103
         HA    102 GLU- QB      7.50  # m w 3    23365.0*2    cleanJun2669
         HB     98 ILE  QG2     3.40  #     1M  705700.0      cleanJun3285
         HB     98 ILE  HG12    4.50 >#     1   167500.0      cleanJun3269
         HB     98 ILE  HG13    3.20 <#     1  1237000.0      cleanJun3275
         HB     98 ILE  QD1     3.60  #     1M  461200.0      cleanJun2692
         HB    102 GLU- QB      7.50  # m w 5    44500.0*2    cleanJun4676
         QG2    98 ILE  HG12    3.40 <#     1M  715100.0      cleanJun3282
         QG2    98 ILE  HG13    4.10 >#     1M  204400.0      cleanJun3284
         QG2    98 ILE  QD1     4.40  # m s 1M  723800.0      cleanJun3289
         QG2    99 GLY  HA1     7.50  #   w 5M   44330.0      cleanJun4110
         QG2   102 GLU- QB      8.50  # m w 5M  176800.0*2    cleanJun4677
         QG2   103 PHE  HA      7.50  #   w 5M  219400.0      cleanJun4678
         QG2   103 PHE  QB      8.50  # m w 5M  363400.0*2    cleanJun1952
         QG2   103 PHE  QD      9.50  # r w 5M    1304.0*2    cleanJun5074
         QG2   103 PHE  QE      9.50  # r w 5M    8940.0*2    cleanJun5075
         QG2   106 LEU  HG      7.50  #   w 5M  112500.0      cleanJun4682
         QG2   106 LEU  QD1     8.50  # m w 5M  242100.0      cleanJun4681
         HG12   98 ILE  QD1     3.40  #   s 1M 1452000.0      cleanJun3290
         HG13   98 ILE  QD1     3.40  #   s 1M 1711000.0      cleanJun3273
         HG13  102 GLU- QB      7.50  # m w 5    13730.0*2    cleanJun4111
         QD1   106 LEU  HG      7.50  #   w 5M   81600.0      cleanJun4683
 99 GLY  
         HA1   100 VAL  QG1     7.50  #   w 5M    6187.0      cleanJun4686
         HA1   100 VAL  QG2     7.50  #   w 5M   15360.0      cleanJun1922
         HA1   101 ASP- HB2     5.40  #     3   233700.0      cleanJun4115
         HA1   101 ASP- HB3     5.00  #     3   374300.0      cleanJun4116
         HA1   102 GLU- QB      7.50  # m w 3    17485.0*2    cleanJun4112
         HA1   102 GLU- QG      7.50  # m w 5   189250.0*2    cleanJun4113
         HA2   100 VAL  QG1     7.50  #   w 5M   45700.0      cleanJun4685
100 VAL  
         HA    100 VAL  HB      4.20  #     2   817700.0      cleanJun3296
         HA    100 VAL  QG1     3.40 <#     1M  719700.0      cleanJun1731
         HA    100 VAL  QG2     4.00 >#     1M  254600.0      cleanJun3303
         HA    101 ASP- HA      4.90  #     2   354900.0      cleanJun4117
         HA    103 PHE  QB      6.50  # m   3   212200.0*2    cleanJun4121
         HA    103 PHE  QD      8.50  # r w 5    29255.0*2    cleanJun4449
         HA    103 PHE  QE      8.50  # r w 5    34900.0*2    cleanJun4450
         HB    100 VAL  QG1     3.40  #   s 1M 1281000.0      cleanJun3300
         HB    100 VAL  QG2     3.40  #   s 1M 1274000.0      cleanJun3302
         HB    103 PHE  QB      7.50  # m w 5    65050.0*2    cleanJun4118
         HB    103 PHE  QD      8.50  # r w 5        0.0*2    cleanJun4966
         HB    103 PHE  QE      8.50  # r w 5     6425.0*2    cleanJun4967
         QG1   103 PHE  QD      9.50  # r w 5M   48765.0*2    cleanJun4446
         QG1   103 PHE  QE      9.50  # r w 5M   61450.0*2    cleanJun4466
         QG2   101 ASP- HA      7.50  #   w 5M   73040.0      cleanJun1923
         QG2   103 PHE  QD      9.50  # r w 5M       0.0*2    cleanJun4964
101 ASP- 
         HA    101 ASP- HB2     4.60 >#     2   518800.0      cleanJun3313
         HA    101 ASP- HB3     3.80 <#     2  1674000.0      cleanJun3314
         HA    102 GLU- HA      6.10  #     2    88140.0      cleanJun4126
         HA    104 SER  QB      6.30  # m   3   257100.0*2    cleanJun4453
         HB2   102 GLU- HA      4.40  #     2   639100.0      cleanJun4131
         HB2   102 GLU- QG      7.50 ># m w 5   178900.0*2    cleanJun4455
         HB2   104 SER  QB      7.50  # m w 5    89450.0*2    cleanJun4456
         HB3   102 GLU- QB      5.60  # m   5  2859000.0*2    cleanJun4691
         HB3   102 GLU- QG      6.10 <# m   5  1494500.0*2    cleanJun4692
         HB3   105 THR  QG2     7.50  #   w 5M  253900.0      cleanJun4457
102 GLU- 
         HA    102 GLU- QB      5.30  # m   2   694000.0*2    cleanJun3307
         HA    102 GLU- QG      4.20  # i   1   679500.0*2    cleanJun3306
         HA    103 PHE  HA      5.00  #     2   308400.0      cleanJun4693
         HA    105 THR  HB      6.50  #   w 3    41560.0      cleanJun4133
         HA    105 THR  QG2     7.50  #   w 5M  163200.0      cleanJun4694
         HA    106 LEU  QB      5.90  # m   3   445900.0*2    cleanJun4459
         HA    106 LEU  QD1     7.50  #   w 5M   77020.0      cleanJun4135
         QB    102 GLU- QG      5.70  # mm  1   573750.0*4    cleanJun3308
         QB    103 PHE  QB      8.50  # mmw 5    74150.0*4    cleanJun4460
         QG    105 THR  QG2     8.50  # m w 5M   32625.0*2    cleanJun4462
103 PHE  
         HA    103 PHE  QB      6.00  # m   2   314850.0*2    cleanJun3316
         HA    103 PHE  QD      7.50  # m w 1        0.0*2    cleanJun4963
         HA    104 SER  HA      5.30  #     2   205400.0      cleanJun4696
         HA    106 LEU  QB      6.20  # m   3   303150.0*2    cleanJun1803
         HA    106 LEU  HG      6.50  #   w 5   173300.0      cleanJun4697
         HA    106 LEU  QD1     7.50  #   w 5M  142500.0      cleanJun1800
         QB    103 PHE  QD      8.50  # mr  1    46800.0*4    cleanJun4447
         QB    103 PHE  QE      7.80  # mr  1   107650.0*4    cleanJun4448
         QB    104 SER  HA      7.50  # m w 2     2172.5*2    cleanJun4137
         QB    107 VAL  QG1     8.50  # m w 5M   67250.0*2    cleanJun4138
         QE    106 LEU  QD1     9.50  # r w 5M    1088.0*2    cleanJun5076
104 SER  
         HA    104 SER  QB      5.10  # m   2  1018500.0*2    cleanJun4052
         HA    105 THR  QG2     7.50  #   w 5M  251300.0      cleanJun4469
         HA    106 LEU  QB      7.50  # m w 3    46865.0*2    cleanJun4468
         HA    107 VAL  HB      6.30  #     3    93570.0      cleanJun4143
         HA    107 VAL  QG1     7.50 >#   w 5M    3184.0      cleanJun1792
         HA    107 VAL  QG2     7.50 <#   w 5M  153300.0      cleanJun2001
         QB    107 VAL  QG2     8.50  # m w 5M   24290.0*2    cleanJun2002
105 THR  
         HA    105 THR  HB      4.30  #     2   764200.0      cleanJun3317
         HA    105 THR  QG2     3.40  #   s 1M  845800.0      cleanJun1576
         HA    106 LEU  HA      5.40  #     2   186400.0      cleanJun4471
         HA    107 VAL  QG1     6.90  #     5M  714900.0      cleanJun2021
         HA    108 ALA  HA      6.00  #     3   122200.0      cleanJun4144
         HA    108 ALA  QB      3.40  #   s 3M  750100.0      cleanJun4145
         HB    105 THR  QG2     3.40  #   s 1M  994300.0      cleanJun3319
         HB    106 LEU  HA      5.50  #     2   170000.0      cleanJun4700
         HB    108 ALA  QB      7.50  #   w 5M  150700.0      cleanJun4702
         HB    109 GLU- QG      7.50  # m w 5     2276.5*2    cleanJun4703
         QG2   106 LEU  QD1     8.20  # m   5M  561600.0    ! cleanJun4463
         QG2   108 ALA  QB      8.50  # m w 5M  249400.0      cleanJun4473
         QG2   109 GLU- QG      8.50  # m w 5M  109000.0*2    cleanJun4474
106 LEU  
         HA    106 LEU  QB      6.60  # m   2   152700.0*2    cleanJun3599
         HA    106 LEU  HG      4.80  #     1   116200.0      cleanJun3602
         HA    106 LEU  QD1     3.50  #     1M  576500.0      cleanJun3605
         HA    107 VAL  HA      6.50  #   w 2    20000.0      cleanJun4706
         HA    109 GLU- HB2     5.70  #     3   173700.0      cleanJun4148
         HA    109 GLU- HB3     5.60  #     3   196400.0      cleanJun4707
         HA    109 GLU- QG      7.50  # m w 5   115300.0*2    cleanJun4149
         QB    106 LEU  HG      4.10  # m   1  1642500.0*2    cleanJun3601
         QB    106 LEU  QD1     5.00  # m   1M  255050.0*2    cleanJun3603
         QB    107 VAL  HA      7.50  # m w 2    37085.0*2    cleanJun4708
         QB    107 VAL  QG2     8.50  # m w 5M  153600.0*2    cleanJun4710
         QB    109 GLU- HB3     6.80  # m   5   722500.0*2    cleanJun4150
         HG    106 LEU  QD1     3.40  #     1M  653800.0      cleanJun3600
         QD1   107 VAL  QG1     8.50  # m w 5M  163000.0      cleanJun4711
         QD1   107 VAL  QG2     8.50  # m w 5M   35980.0      cleanJun4147
107 VAL  
         HA    107 VAL  HB      5.10  #     2   253800.0      cleanJun3331
         HA    107 VAL  QG1     3.40  #     1M  644200.0      cleanJun2019
       # HA    107 VAL  QG2     3.40  #   s 1M  817500.0      cleanJun2000
         HA    108 ALA  HA      6.50  #   w 2    12220.0      cleanJun4968
         HA    110 SER  QB      7.50  # m w 3     4187.0*2    cleanJun4712
         HB    107 VAL  QG1     3.40  #   s 1M 1670000.0      cleanJun2017
         HB    107 VAL  QG2     3.40  #   s 1M  880900.0      cleanJun2379
         HB    108 ALA  HA      5.80  #     2   126400.0      cleanJun4713
         HB    110 SER  HA      4.80  #     3   490600.0    ! cleanJun4154
         HB    110 SER  QB      7.50  # m w 5    33515.0*2    cleanJun4155
         QG1   108 ALA  HA      7.50 <#   w 5M   56760.0      cleanJun4714
         QG1   108 ALA  QB      8.50 <# m w 5M  427200.0      cleanJun4475
         QG2   108 ALA  HA      7.50 >#   w 5M   17400.0      cleanJun4715
         QG2   108 ALA  QB      8.50 ># m w 5M   34430.0      cleanJun4082
108 ALA  
         HA    108 ALA  QB      3.40  #   s 2M 1591000.0      cleanJun3332
         HA    109 GLU- HA      4.90  #     2   346000.0      cleanJun4716
         QB    109 GLU- HA      5.70  #     2M   49520.0      cleanJun4157
         QB    109 GLU- HB3     7.50  #   w 5M  375900.0      cleanJun4159
         QB    109 GLU- QG      8.50  # m w 5M  182300.0*2    cleanJun4158
109 GLU- 
         HA    109 GLU- HB2     4.80  #     2   372000.0      cleanJun3343
         HA    109 GLU- HB3     4.50  #     2   557900.0      cleanJun3342
         HA    109 GLU- QG      5.00  # i   1   195250.0*2    cleanJun3347
         HA    110 SER  HA      6.50  #   w 2    25880.0      cleanJun4719
         HA    110 SER  QB      6.30  # m   2   216350.0*2    cleanJun4720
         HB2   109 GLU- QG      4.00 <# m   1  1808500.0*2    cleanJun3346
         HB3   109 GLU- QG      4.60 ># m   1   595000.0*2    cleanJun3340
110 SER  
         HA    110 SER  QB      3.80  # m   2 10790000.0*2    cleanJun3334

#dyparva.rdc
  9 ALA  HN     21.10  0.50  0.10
 10 GLU- HN     12.92  0.50  0.10
 11 ASP- HN     16.48  0.50  0.10
 14 LYS+ HN     16.46  0.50  0.10
 15 ALA  HN     16.34  0.50  0.10
 16 VAL  HN     21.86  0.50  0.10
 17 GLY  HN     19.77  0.50  0.10
 18 ALA  HN     17.14  0.50  0.10
 19 PHE  HN     18.18  0.50  0.10
 21 ALA  HN     -3.87  0.50  0.10
 28 LYS+ HN     19.61  0.50  0.10
 29 LYS+ HN     22.97  0.50  0.10
 30 PHE  HN     18.22  0.50  0.10
 34 VAL  HN     16.91  0.50  0.10
 35 GLY  HN     15.51  0.50  0.10
 36 LEU  HN     10.31  0.50  0.10
 41 ALA  HN     -6.51  0.50  0.10
 42 ASP- HN      3.23  0.50  0.10
 43 ASP- HN     -6.96  0.50  0.10
 44 VAL  HN    -13.07  0.50  0.10
 45 LYS+ HN     -1.12  0.50  0.10
 46 LYS+ HN      5.65  0.50  0.10
 57 GLY  HN     -9.33  0.50  0.10
 69 LYS+ HN     22.05  0.50  0.10
 70 GLY  HN     14.12  0.50  0.10
 71 PHE  HN     20.56  0.50  0.10
 72 SER  HN     15.18  0.50  0.10
 75 ALA  HN      3.51  0.50  0.10
 76 ARG+ HN     -1.28  0.50  0.10
 82 GLU- HN    -18.66  0.50  0.10
  1 MET  HN      8.03  0.50  0.10
  2 SER  HN     14.28  0.50  0.10
  3 MET  HN      5.91  0.50  0.10
  4 THR  HN    -12.40  0.50  0.10
  5 ASP- HN     -2.64  0.50  0.10
  6 LEU  HN      0.83  0.50  0.10
  7 LEU  HN    -17.34  0.50  0.10
  8 ASN  HN      6.52  0.50  0.10
 22 THR  HN      0.51  0.50  0.10
 37 LYS+ HN     18.19  0.50  0.10
 38 LYS+ HN      6.37  0.50  0.10
 39 LYS+ HN     12.71  0.50  0.10
 40 SER  HN      2.52  0.50  0.10
 67 ILE  HN      4.07  0.50  0.10
 74 ASP- HN    -17.02  0.50  0.10
 78 LEU  HN      9.49  0.50  0.10
109 GLU- HN     -9.87  0.50  0.10
150 LTNS 

#dyparva.pcs
  1 MET  N       0.34 1   0.10  0.50
  1 MET  HN      0.41 1   0.10  0.50
  2 SER  N       0.32 1   0.10  0.50
  2 SER  HN      0.30 1   0.10  0.50
  3 MET  N      -0.10 1   0.10  0.50
  3 MET  HN     -0.26 1   0.10  0.50
  4 THR  N       0.03 1   0.10  0.50
  4 THR  HN      0.09 1   0.10  0.50
  5 ASP- N       0.20 1   0.10  0.50
  5 ASP- HN      0.26 1   0.10  0.50
  6 LEU  N       0.26 1   0.10  0.50
  6 LEU  HN      0.34 1   0.10  0.50
  7 LEU  N       0.16 1   0.10  0.50
  7 LEU  HN      0.06 1   0.10  0.50
  8 ASN  N       0.03 1   0.10  0.50
  8 ASN  HN      0.02 1   0.10  0.50
  9 ALA  N       0.01 1   0.10  0.50
  9 ALA  HN      0.04 1   0.10  0.50
 10 GLU- N       0.00 1   0.10  0.50
 10 GLU- HN      0.00 1   0.10  0.50
 11 ASP- N      -0.02 1   0.10  0.50
 11 ASP- HN      0.00 1   0.10  0.50
 12 ILE  N      -0.15 1   0.10  0.50
 12 ILE  HN     -0.10 1   0.10  0.50
 13 LYS+ N      -0.29 1   0.10  0.50
 13 LYS+ HN     -0.17 1   0.10  0.50
 14 LYS+ N      -0.27 1   0.10  0.50
 14 LYS+ HN     -0.18 1   0.10  0.50
 15 ALA  N      -0.33 1   0.10  0.50
 15 ALA  HN     -0.26 1   0.10  0.50
 16 VAL  N      -0.46 1   0.10  0.50
 16 VAL  HN     -0.41 1   0.10  0.50
 17 GLY  N      -0.44 1   0.10  0.50
 17 GLY  HN     -0.42 1   0.10  0.50
 18 ALA  N      -0.47 1   0.10  0.50
 18 ALA  HN     -0.42 1   0.10  0.50
 19 PHE  N      -0.51 1   0.10  0.50
 19 PHE  HN     -0.56 1   0.10  0.50
 20 SER  N      -0.48 1   0.10  0.50
 20 SER  HN     -0.55 1   0.10  0.50
 21 ALA  N      -0.61 1   0.10  0.50
 21 ALA  HN     -0.51 1   0.10  0.50
 22 THR  N      -0.18 1   0.10  0.50
 22 THR  HN     -0.11 1   0.10  0.50
 28 LYS+ N      -0.60 1   0.10  0.50
 28 LYS+ HN     -0.67 1   0.10  0.50
 29 LYS+ N      -0.37 1   0.10  0.50
 29 LYS+ HN     -0.42 1   0.10  0.50
 30 PHE  N      -0.53 1   0.10  0.50
 30 PHE  HN     -0.57 1   0.10  0.50
 33 MET  N      -0.10 1   0.10  0.50
 33 MET  HN     -0.13 1   0.10  0.50
 34 VAL  N      -0.17 1   0.10  0.50
 34 VAL  HN     -0.12 1   0.10  0.50
 35 GLY  N       0.12 1   0.10  0.50
 35 GLY  HN      0.10 1   0.10  0.50
 36 LEU  N       0.09 1   0.10  0.50
 36 LEU  HN      0.08 1   0.10  0.50
 37 LYS+ N       0.30 1   0.10  0.50
 37 LYS+ HN      0.19 1   0.10  0.50
 38 LYS+ N       0.24 1   0.10  0.50
 38 LYS+ HN      0.38 1   0.10  0.50
 39 LYS+ N       0.70 1   0.10  0.50
 39 LYS+ HN      0.65 1   0.10  0.50
 40 SER  N       0.79 1   0.10  0.50
 40 SER  HN      0.74 1   0.10  0.50
 41 ALA  N       1.49 1   0.10  0.50
 41 ALA  HN      1.48 1   0.10  0.50
 42 ASP- N       2.16 1   0.10  0.50
 42 ASP- HN      1.95 1   0.10  0.50
 43 ASP- N       1.62 1   0.10  0.50
 43 ASP- HN      1.57 1   0.10  0.50
 44 VAL  N       2.12 1   0.10  0.50
 44 VAL  HN      1.97 1   0.10  0.50
 45 LYS+ N       3.27 1   0.10  0.50
 45 LYS+ HN      3.11 1   0.10  0.50
 46 LYS+ N       2.40 1   0.10  0.50
 46 LYS+ HN      2.32 1   0.10  0.50
 57 GLY  N      -3.82 1   0.10  0.50
 57 GLY  HN     -3.64 1   0.10  0.50
 61 GLU- N      -3.22 1   0.10  0.50
 61 GLU- HN     -3.74 1   0.10  0.50
 67 ILE  N      -1.64 1   0.10  0.50
 67 ILE  HN     -1.49 1   0.10  0.50
 68 LEU  N      -1.75 1   0.10  0.50
 68 LEU  HN     -1.87 1   0.10  0.50
 69 LYS+ N      -1.32 1   0.10  0.50
 69 LYS+ HN     -1.04 1   0.10  0.50
 70 GLY  N      -1.21 1   0.10  0.50
 70 GLY  HN     -1.38 1   0.10  0.50
 71 PHE  N      -0.67 1   0.10  0.50
 71 PHE  HN     -0.85 1   0.10  0.50
 72 SER  N      -0.54 1   0.10  0.50
 72 SER  HN     -0.69 1   0.10  0.50
 74 ASP- N      -0.37 1   0.10  0.50
 74 ASP- HN     -0.38 1   0.10  0.50
 75 ALA  N      -0.78 1   0.10  0.50
 75 ALA  HN     -0.72 1   0.10  0.50
 76 ARG+ N      -0.78 1   0.10  0.50
 76 ARG+ HN     -0.80 1   0.10  0.50
 78 LEU  N      -1.10 1   0.10  0.50
 78 LEU  HN     -0.85 1   0.10  0.50
 82 GLU- N       0.21 1   0.10  0.50
 82 GLU- HN      0.29 1   0.10  0.50
109 GLU- N      -1.59 1   0.10  0.50
109 GLU- HN     -1.83 1   0.10  0.50
  8 ASN  ND2     0.08 1   0.10  0.50
  8 ASN  HD21    0.12 1   0.10  0.50
  8 ASN  HD22    0.11 1   0.10  0.50
 32 GLN  NE2    -0.52 1   0.10  0.50
 32 GLN  HE21   -0.46 1   0.10  0.50
 32 GLN  HE22   -0.41 1   0.10  0.50
150 LTNS PCN


#15n_Parvalbumin.upl
#
  1 MET  
         HN      1 MET  HA      5.50  #     2  1132000.0      cleanJun 734
         HN      1 MET  QB      5.50  # i   2  2310000.0*2    cleanJun 736
         HN      1 MET  QG      7.10  # m   1   385400.0*2    cleanJun 737
         HN      2 SER  HN      6.50  #   w 2   113300.0      cleanJun1342
         HA      2 SER  HN      4.80  #     2  2355000.0      cleanJun 738
         QB      2 SER  HN      6.10  # m   2  1827000.0*2    cleanJun1000
         QG      2 SER  HN      7.50  # m w 5   742500.0*2    cleanJun1168
  2 SER  
         HN      2 SER  HA      3.90  #     2  9280000.0      cleanJun   4
         HN      2 SER  QB      5.30  # i   2  2798500.0*2    cleanJun 274
         HN      4 THR  HN      6.50  #   w 3   283700.0      cleanJun1172
         HN      5 ASP- HN      6.30  #     3  1094000.0      cleanJun1395
         HN      5 ASP- QB      6.80  # m   3  1698500.0*2    cleanJun1071
         HA      3 MET  HN      3.70  #     2 12180000.0      cleanJun 275
         HA      4 THR  HN      5.90  #     3  1585000.0      cleanJun2066
         HA      5 ASP- HN      6.50  #   w 3   473200.0      cleanJun2067
         QB      3 MET  HN      6.10  # m   2  1713500.0*2    cleanJun 840
         QB      4 THR  HN      6.40  # m   3  2831000.0*2    cleanJun1322
         QB      5 ASP- HN      7.30  # m   3  1093500.0*2    cleanJun1323
  3 MET  
         HN      3 MET  HA      4.50  #     2  3623000.0      cleanJun 276
         HN      3 MET  QB      5.00  # i   2  4485500.0*2    cleanJun 277
         HN      3 MET  QG      6.60  # m   1   656000.0*2    cleanJun 278
         HN      4 THR  HN      4.70  #     2  2894000.0      cleanJun 279
         HN      4 THR  HB      5.80  #     2   798200.0      cleanJun1803
         HN      5 ASP- HN      5.70  #     3  2065000.0      cleanJun 308
         HN      6 LEU  HG      6.50  #   w 5   358400.0      cleanJun1802
         HN     50 MET  HB2     6.50  #   w 5   419300.0      cleanJun1804
         HA      4 THR  HN      4.90  #     2  2342000.0      cleanJun 281
         HA      5 ASP- HN      6.50  #   w 3   611400.0      cleanJun2068
         HA      7 LEU  HN      6.50  #   w 3   463400.0      cleanJun2069
         QB      4 THR  HN      5.60  # m   2  3154500.0*2    cleanJun 841
         QG      4 THR  HN      7.50  # m w 5   338800.0*2    cleanJun 842
         QG      7 LEU  HN      7.50  # m w 5   263900.0*2    cleanJun2070
  4 THR  
         HN      4 THR  HA      4.50  #     2  3962000.0      cleanJun   6
         HN      4 THR  HB      4.90  #     2  2191000.0      cleanJun1324
         HN      4 THR  QG2     4.80  #     1M 1636000.0      cleanJun 282
         HN      5 ASP- QB      7.50  # m w 2   110950.0*2    cleanJun2071
         HN      6 LEU  HN      5.80  #     3  1789000.0      cleanJun 931
         HN      7 LEU  HN      5.50  #     3  2442000.0      cleanJun 843
         HN      7 LEU  HG      6.50  #   w 5   429100.0      cleanJun1563
         HN     12 ILE  QD1     6.90  #     5M 1257000.0      cleanJun1562
         HA      5 ASP- HN      3.70  #     2 11890000.0      cleanJun1321
         HA      6 LEU  HN      5.40  #     3  2812000.0      cleanJun1564
         HA      7 LEU  HN      6.50  #   w 3   344400.0      cleanJun2072
         HA      9 ALA  HN      3.00  #     4 14950000.0      cleanJun1542
         HB      5 ASP- HN      4.90  #     2  2138000.0      cleanJun1565
         QG2     5 ASP- HN      7.50  #   w 5M  875400.0      cleanJun1173
         QG2     9 ALA  HN      5.90  #     5M 2426000.0      cleanJun1036
  5 ASP- 
         HN      5 ASP- HA      5.50  #     2  1093000.0      cleanJun   8
         HN      5 ASP- QB      4.40  # i   2  9715000.0*2    cleanJun 283
         HN      6 LEU  HN      3.40  #     2 20150000.0      cleanJun 289
         HN      6 LEU  HB2     5.80  #     2   779200.0      cleanJun1074
         HN      6 LEU  QD1     7.50  #   w 5M  681000.0      cleanJun1397
         HN      7 LEU  HN      4.60  #     3  7299000.0      cleanJun 799
         HA      6 LEU  HN      4.60  #     2  3200000.0      cleanJun 739
         QB      6 LEU  HN      5.80  # m   2  2387500.0*2    cleanJun 844
  6 LEU  
         HN      6 LEU  HA      4.30  #     2  4643000.0      cleanJun 210
         HN      6 LEU  HB2     3.70  #     2 11720000.0      cleanJun 285
         HN      6 LEU  HB3     3.90  #     2  8300000.0      cleanJun 286
         HN      6 LEU  HG      5.20  #     1   947100.0      cleanJun 287
         HN      6 LEU  QD1     4.00  #     1M 4742000.0      cleanJun 288
         HN      7 LEU  HN      3.30  #     2 24590000.0      cleanJun 291
         HN      7 LEU  QB      5.50  # m   2  3902500.0*2    cleanJun1174
         HN      7 LEU  HG      6.50  #   w 5    85610.0      cleanJun2073
         HA      7 LEU  HN      5.10  #     2  1637000.0      cleanJun 740
         HB2     7 LEU  HN      4.00  #     2  7394000.0      cleanJun 846
         HB3     7 LEU  HN      4.30  #     2  4836000.0      cleanJun 845
         HB3     8 ASN  HN      6.50  #   w 3   577200.0      cleanJun1571
         HG      7 LEU  HN      6.20  #     5  1170000.0      cleanJun1566
         QD1    46 LYS+ HN      7.50  #   w 5M  408500.0      cleanJun1567
         QD1    47 VAL  HN      6.70  #     5M 1434000.0      cleanJun1568
  7 LEU  
         HN      7 LEU  HA      3.70  #     2 11700000.0      cleanJun 155
         HN      7 LEU  QB      4.40  # i   2  9835000.0*2    cleanJun 292
         HN      7 LEU  HG      4.50  #     1  2486000.0      cleanJun 294
         HN      7 LEU  QD1     4.00  #     1M 5047000.0    ! cleanJun 293
         HN      8 ASN  HN      5.50  #     2  1071000.0      cleanJun 295
         HN     12 ILE  QD1     6.10  #     5M 2116000.0      cleanJun1569
         HA      8 ASN  HN      3.70  #     2 11610000.0      cleanJun 741
         HA      8 ASN  HD21    6.50  #     5   847700.0      cleanJun1999
         HA      8 ASN  HD22    6.50  #   w 5   361700.0      cleanJun2074
         QB      8 ASN  HN      5.00  # m   2  7085000.0*2    cleanJun1548
         QB     12 ILE  HN      7.40  # m   5   943500.0*2    cleanJun1400
         HG      8 ASN  HN      6.20  #     5  1165000.0      cleanJun 849
         QD1     8 ASN  HN      4.90  #     5M 5194000.0    ! cleanJun 848
         QD1    36 LEU  HN      5.00  #     5M 4644000.0    ! cleanJun1570
  8 ASN  
         HN      8 ASN  HA      5.70  #     2   899800.0      cleanJun 212
         HN      8 ASN  QB      4.80  # i   2  5390000.0*2    cleanJun 296
         HN      9 ALA  HN      5.80  #     2   772800.0      cleanJun 300
         HN     10 GLU- HN      5.60  #     3  2311000.0      cleanJun 800
         HN     11 ASP- HN      5.90  #     3  1575000.0      cleanJun 932
         HN     11 ASP- QB      5.90  # m   3  4987500.0*2    cleanJun1572
         HN     12 ILE  QG1     7.50  # m w 5   626000.0*2    cleanJun1573
         HN     12 ILE  QD1     7.50  #   w 5M  698100.0      cleanJun2075
         HA      9 ALA  HN      5.20  #     2  1536000.0      cleanJun 298
         HA     10 GLU- HN      6.50  #   w 3    87370.0      cleanJun2077
         HA     11 ASP- HN      6.50  #   w 3   286700.0      cleanJun2078
         QB      8 ASN  HD21    6.00 <# m   1  1263500.0*2    cleanJun1990
         QB      8 ASN  HD22    7.30 ># m   1   308350.0*2    cleanJun1991
         QB      9 ALA  HN      6.30  # m   2  1350000.0*2    cleanJun 850
         QB     10 GLU- HN      6.60  # m   3  2227000.0*2    cleanJun1040
         QB     11 ASP- HN      5.90  # m   3  5100000.0*2    cleanJun1805
  9 ALA  
         HN      9 ALA  HA      4.00  #     2  7113000.0      cleanJun 297
         HN      9 ALA  QB      3.40  #   s 2M18930000.0      cleanJun 742
         HN     10 GLU- HN      4.20  #     2  5519000.0      cleanJun 301
         HN     10 GLU- QB      7.30  # m   2   479050.0*2    cleanJun1076
         HN     11 ASP- HN      6.50  #   w 3   401800.0      cleanJun1398
         HN     12 ILE  QG1     7.50  # m w 5   207100.0*2    cleanJun1806
         HN     12 ILE  QD1     7.50  #   w 5M  869800.0      cleanJun1037
         HA     10 GLU- HN      5.40  #     2  1278000.0      cleanJun 743
         HA     12 ILE  HN      5.40  #     3  2690000.0      cleanJun1575
         QB     10 GLU- HN      3.55  #   s 2M11830000.0      cleanJun 851
 10 GLU- 
         HN     10 GLU- HA      4.00  #     2  7895000.0      cleanJun 216
         HN     10 GLU- QB      4.30  # i   2 11395000.0*2    cleanJun 302
         HN     10 GLU- QG      5.20  # m   1  3763000.0*2    cleanJun 303
         HN     11 ASP- HN      3.50  #     2 15710000.0      cleanJun 304
         HN     11 ASP- QB      7.20  # m   2   517500.0*2    cleanJun2079
         HN     12 ILE  HN      5.30  #     3  3022000.0      cleanJun 801
         HN     12 ILE  HB      6.50  #   w 3   212600.0      cleanJun2080
         HN     13 LYS+ HN      6.50  #   w 3   352300.0      cleanJun1077
         HA     11 ASP- HN      4.60  #     2  3269000.0      cleanJun 305
         HA     12 ILE  HN      5.00  #     3  4535000.0      cleanJun1176
         HA     13 LYS+ HN      5.50  #     3  2423000.0      cleanJun1177
         HA     14 LYS+ HN      6.50  #   w 3    70440.0      cleanJun2010
         QB     11 ASP- HN      5.20  # m   2  5375000.0*2    cleanJun 852
         QG     11 ASP- HN      7.50  # m w 5   392200.0*2    cleanJun1001
 11 ASP- 
         HN     11 ASP- HA      4.00  #     2  7603000.0      cleanJun 236
         HN     11 ASP- QB      4.20  # i   2 13455000.0*2    cleanJun 306
         HN     12 ILE  HN      3.60  #     2 15120000.0      cleanJun 311
         HN     12 ILE  HB      4.60  #     2  3166000.0      cleanJun1044
         HN     12 ILE  QG1     7.50  # m   5   864000.0*2    cleanJun1042
         HN     13 LYS+ HN      5.90  #     3  1587000.0      cleanJun 803
         HN     13 LYS+ HG2     5.80  #     5  1641000.0    ! cleanJun1043
         HN     14 LYS+ HN      5.90  #     3  1583000.0      cleanJun 920
         HA     12 ILE  HN      5.00  #     2  1881000.0      cleanJun 312
         HA     14 LYS+ HN      5.60  #     3  2116000.0      cleanJun1577
         HA     15 ALA  HN      5.30  #     3  2953000.0      cleanJun1284
         QB     12 ILE  HN      5.40  # m   2  4512000.0*2    cleanJun 853
         QB     14 LYS+ HN      7.50  # m w 3   232000.0*2    cleanJun1406
 12 ILE  
         HN     12 ILE  HA      4.30  #     2  4688000.0      cleanJun  24
         HN     12 ILE  HB      3.30  #     2 25380000.0      cleanJun 315
         HN     12 ILE  QG2     4.50  #     1M 2329000.0      cleanJun 745
         HN     12 ILE  QG1     5.40  # m   1  2777000.0*2    cleanJun 314
         HN     12 ILE  QD1     3.90  #     1M 5998000.0      cleanJun 815
         HN     13 LYS+ HN      4.20  #     2  5710000.0      cleanJun 310
         HN     14 LYS+ HN      5.00  #     3  4426000.0      cleanJun1078
         HN     34 VAL  QG1     7.50  #   w 5M  211600.0      cleanJun1411
         HA     13 LYS+ HN      5.00  #     2  1948000.0      cleanJun 313
         HA     14 LYS+ HN      6.50  #   w 3   166700.0      cleanJun1002
         HA     15 ALA  HN      5.50  #     3  2458000.0      cleanJun1180
         HA     16 VAL  HN      6.50  #   w 3   673200.0      cleanJun1181
         QG2    72 SER  HN      5.90  #     5M 2328000.0      cleanJun1974
 13 LYS+ 
         HN     13 LYS+ HA      3.70  #     2 12110000.0      cleanJun  26
         HN     13 LYS+ QB      4.60  # i   2  7480000.0*2    cleanJun 319
         HN     13 LYS+ HG2     3.50 <#     1 10160000.0    ! cleanJun 746
         HN     13 LYS+ HG3     5.00 >#     1  1278000.0      cleanJun 747
         HN     13 LYS+ QD      5.10  # m   1  4085500.0*2    cleanJun 816
         HN     14 LYS+ HN      3.40  #     2 20900000.0      cleanJun 804
         HN     14 LYS+ HB2     5.40  #     2  1292000.0      cleanJun2012
         HN     14 LYS+ QG      7.50  # m w 5   362550.0*2    cleanJun2013
         HN     15 ALA  HN      5.10  #     3  3842000.0      cleanJun 921
         HN     16 VAL  HN      5.10  #     3  3737000.0      cleanJun1579
         HA     14 LYS+ HN      4.20  #     2  5540000.0      cleanJun 748
         HA     15 ALA  HN      5.90  #     3  1567000.0      cleanJun2020
         HA     16 VAL  HN      5.60  #     3  2171000.0      cleanJun1580
         HA     17 GLY  HN      6.30  #     3  1131000.0      cleanJun1954
         QB     14 LYS+ HN      5.50  # m   2  3780000.0*2    cleanJun2014
         HG2    14 LYS+ HN      5.20  #     5  3317000.0      cleanJun2015
         HG2    15 ALA  HN      6.50  #   w 5   278400.0      cleanJun1582
         QD     14 LYS+ HN      7.50  # m w 5   312600.0*2    cleanJun1353
         QD     15 ALA  HN      7.50  # m w 5   426350.0*2    cleanJun1583
 14 LYS+ 
         HN     14 LYS+ HA      3.90  #     2  8507000.0      cleanJun  28
         HN     14 LYS+ HB2     4.00  #     2  8130000.0      cleanJun 322
         HN     14 LYS+ HB3     4.10  #     2  6250000.0      cleanJun 323
         HN     14 LYS+ QG      5.80  # m   1  1523000.0*2    cleanJun 324
         HN     14 LYS+ QD      5.70  # m   1  1940500.0*2    cleanJun 325
         HN     15 ALA  HN      3.80  #     2  9880000.0      cleanJun 328
         HN     16 VAL  HN      5.70  #     3  1894000.0      cleanJun 338
         HN     17 GLY  HN      6.10  #     3  1255000.0      cleanJun1559
         HA     15 ALA  HN      4.90  #     2  2093000.0      cleanJun 320
         HA     16 VAL  HN      6.20  #     3  1210000.0      cleanJun2017
         HA     18 ALA  HN      5.20  #     3  3378000.0      cleanJun2018
         HB2    15 ALA  HN      4.30  #     2  4910000.0      cleanJun1560
         HB2    16 VAL  HN      6.50  #   w 3   544500.0      cleanJun1591
         HB2    18 ALA  HN      6.40  #     3  1001000.0      cleanJun1273
         HB3    15 ALA  HN      4.10  #     2  6301000.0      cleanJun1561
         QG     15 ALA  HN      7.10  # m   5  1197500.0*2    cleanJun2019
 15 ALA  
         HN     15 ALA  HA      3.80  #     2  9667000.0      cleanJun  30
         HN     15 ALA  QB      3.70  #     2M 6418000.0      cleanJun1588
         HN     16 VAL  HN      4.00  #     2  7728000.0      cleanJun 333
         HN     16 VAL  QG1     7.50 >#   w 5M  843700.0      cleanJun1586
         HN     16 VAL  QG2     4.50 <#     5M 7213000.0    ! cleanJun1585
         HN     17 GLY  HN      4.20  #     3 13040000.0      cleanJun 321
         HN     18 ALA  HN      6.50  #   w 3   522600.0      cleanJun1543
         HA     16 VAL  HN      5.50  #     2  1068000.0      cleanJun 749
         HA     18 ALA  HN      5.50  #     3  2491000.0      cleanJun1587
         QB     16 VAL  HN      4.20  #     2M 2783000.0      cleanJun2021
         QB     33 MET  HN      7.50  #     5M  893200.0      cleanJun1590
         QB     34 VAL  HN      4.30  #     5M 8866000.0      cleanJun1589
 16 VAL  
         HN     16 VAL  HA      5.00  #     2  2074000.0      cleanJun 234
         HN     16 VAL  HB      3.70  #     2 11890000.0      cleanJun 335
         HN     16 VAL  QG1     4.90 >#     1M 1372000.0      cleanJun 337
         HN     16 VAL  QG2     3.40 <#     1M12490000.0      cleanJun 336
         HN     17 GLY  HN      3.80  #     2 10840000.0      cleanJun 331
         HN     18 ALA  HN      6.50  #   w 3   715200.0      cleanJun 858
         HA     17 GLY  HN      3.80  #     2 10200000.0      cleanJun 334
         HB     17 GLY  HN      4.00  #     2  7632000.0      cleanJun 856
         QG1    17 GLY  HN      6.50  #     5M 1597000.0      cleanJun2023
         QG1    72 SER  HN      6.90  #     5M 1274000.0      cleanJun1975
         QG2    17 GLY  HN      5.60  #     5M 2865000.0      cleanJun1190
         QG2    18 ALA  HN      7.50  #   w 5M  771400.0      cleanJun1191
         QG2    19 PHE  HN      7.50  #   w 5M  169600.0      cleanJun1192
 17 GLY  
         HN     17 GLY  HA1     3.80  #     2 10680000.0      cleanJun  20
         HN     17 GLY  HA2     3.70  #     2 11730000.0      cleanJun  19
         HN     18 ALA  HN      3.60  #     2 13330000.0      cleanJun 340
         HN     18 ALA  QB      5.20  #     2M  799400.0      cleanJun1272
         HN     19 PHE  HB2     6.50  #   w 3    85930.0      cleanJun1415
         HA1    18 ALA  HN      4.50  #     2  3765000.0      cleanJun 343
         HA1    19 PHE  HN      6.50  #   w 3   419700.0      cleanJun1079
         HA2    18 ALA  HN      4.60  #     2  3456000.0      cleanJun1809
         HA2    19 PHE  HN      6.50  #   w 3   659200.0      cleanJun1810
 18 ALA  
         HN     18 ALA  HA      4.20  #     2  5390000.0      cleanJun 232
         HN     18 ALA  QB      3.40  #   s 2M28530000.0      cleanJun 342
         HN     19 PHE  HN      3.30  #     2 23030000.0      cleanJun1080
         HN     19 PHE  HB2     6.50  #   w 2   381700.0      cleanJun1417
         HN     19 PHE  QD      8.50  # r w 5   188900.0*2    cleanJun1745
         HN     19 PHE  QE      8.50  # r w 5   179000.0*2    cleanJun1744
         HN     20 SER  HN      4.70  #     3  6001000.0      cleanJun1592
         HA     19 PHE  HN      4.70  #     2  2865000.0      cleanJun 341
         HA     20 SER  HN      6.50  #   w 3   786800.0      cleanJun1595
         QB     19 PHE  HN      3.70  #     2M 5686000.0      cleanJun 857
 19 PHE  
         HN     19 PHE  HA      4.20  #     2  5969000.0      cleanJun 238
         HN     19 PHE  HB2     4.40  #     2  4363000.0      cleanJun 348
         HN     19 PHE  HB3     3.90  #     2  8424000.0      cleanJun1268
         HN     19 PHE  QD      7.80  # r   1   514500.0*2    cleanJun1742
         HN     19 PHE  QE      6.70  # m   1   542000.0*2    cleanJun1743
         HN     20 SER  HN      3.50  #     2 18490000.0      cleanJun 345
         HN     20 SER  QB      7.30  # m   2   477700.0*2    cleanJun2025
         HA     20 SER  HN      4.30  #     2  5087000.0      cleanJun 344
         HA     21 ALA  HN      6.00  #     3  1467000.0      cleanJun1281
         HB2    20 SER  HN      6.00 >#     2   667800.0      cleanJun1419
         HB3    20 SER  HN      4.60 <#     2  3385000.0      cleanJun1420
         HB3    24 SER  HN      6.50  #   w 5   115700.0    ! cleanJun1596
         HB3    25 PHE  HN      6.50  #   w 5   472800.0    ! cleanJun1812
         QD     24 SER  HN      8.50  # r w 5    10225.0*2    cleanJun2026
         QD     25 PHE  HN      8.50  # r w 5   457600.0*2    cleanJun1746
         QD     27 HIS+ HN      8.50  # r w 5    64950.0*2    cleanJun2115
         QD     30 PHE  HN      8.50  # r w 5   311650.0*2    cleanJun2027
         QE     20 SER  HN      8.50  # r w 5   168350.0*2    cleanJun1947
         QE     27 HIS+ HN      8.50  # r w 5    88450.0*2    cleanJun2116
         HZ     29 LYS+ HN      6.50  #   w 5    31940.0      cleanJun2117
 20 SER  
         HN     20 SER  HA      4.30  #     2  4738000.0      cleanJun 248
         HN     20 SER  QB      4.90  # i   2  4616500.0*2    cleanJun 354
         HN     21 ALA  HN      4.00  #     2  7492000.0      cleanJun 353
         HN     21 ALA  QB      7.50  #     2M   83150.0      cleanJun1597
         HA     21 ALA  HN      5.30  #     2  1348000.0      cleanJun 351
         QB     21 ALA  HN      5.40  # m   2  4040500.0*2    cleanJun1067
 21 ALA  
         HN     21 ALA  HA      3.90  #     2  8620000.0      cleanJun  38
         HN     21 ALA  QB      3.40  #   s 2M22140000.0      cleanJun 355
         HN     22 THR  HN      5.20  #     2  1546000.0      cleanJun 356
         HN     24 SER  QB      7.50  # m w 3   365500.0*2    cleanJun1813
         HN     76 ARG+ HG3     6.50  #   w 5   715400.0      cleanJun1980
         HA     22 THR  HN      4.10  #     2  6240000.0      cleanJun 357
         QB     22 THR  HN      5.10  #     2M  900700.0      cleanJun1598
         QB     24 SER  HN      4.10  #     3M  565600.0      cleanJun1599
 22 THR  
         HN     22 THR  HA      4.20  #     2  6011000.0      cleanJun  63
         HN     22 THR  HB      4.80  #     2  2466000.0      cleanJun 358
         HN     22 THR  QG2     3.70  #     1M 7742000.0      cleanJun 359
         HN     23 ASP- HN      5.50  #     2  1124000.0      cleanJun1814
         HA     23 ASP- HN      4.10  #     2  6500000.0      cleanJun1052
         HA     24 SER  HN      6.20  #     3  1186000.0      cleanJun1815
         HA     79 SER  HN      4.20  #     4  1915000.0      cleanJun1604
         HB     23 ASP- HN      6.00  #     2   672100.0      cleanJun1817
         HB     79 SER  HN      6.50  #   w 5   638900.0      cleanJun2028
         QG2    23 ASP- HN      7.50  #   w 5M  334500.0      cleanJun1818
         QG2    24 SER  HN      7.10  #     5M 1165000.0      cleanJun1056
 23 ASP- 
         HN     23 ASP- HA      3.80  #     2 10540000.0      cleanJun 240
         HN     23 ASP- QB      5.40  # i   2  2489000.0*2    cleanJun 360
         HN     24 SER  HN      4.10  #     2  6152000.0      cleanJun 363
         HN     25 PHE  HN      6.50  #   w 3   249200.0      cleanJun1778
         HN     25 PHE  QB      7.50  # m w 3   176700.0*2    cleanJun1053
         HN     78 LEU  HA      6.50  #     4   145500.0      cleanJun1601
         HN     79 SER  HN      6.40  #     4   149700.0      cleanJun1602
         HN     79 SER  QB      7.50  # m w 5   292950.0*2    cleanJun1054
         HN     81 LYS+ HG3     5.80  #     5  1682000.0    ! cleanJun1741
         HN     82 GLU- QB      7.50  # m w 5   206800.0*2    cleanJun1605
         HA     24 SER  HN      4.60  #     2  3464000.0      cleanJun 362
         HA     25 PHE  HN      6.10  #     3  1336000.0      cleanJun1819
         HA     79 SER  HN      5.40  #     4   449700.0      cleanJun1603
         HA     82 GLU- HN      4.60  #     4  1214000.0      cleanJun1498
         QB     24 SER  HN      6.20  # m   2  1459000.0*2    cleanJun 859
         QB     25 PHE  HN      6.90  # m   3  1683000.0*2    cleanJun1064
 24 SER  
         HN     24 SER  HA      4.50  #     2  3853000.0      cleanJun  44
         HN     24 SER  QB      5.80  # i   2  1534500.0*2    cleanJun 365
         HN     25 PHE  HN      3.90  #     2  8452000.0      cleanJun 364
         HN     25 PHE  HA      6.50  #   w 2   242100.0      cleanJun2029
         HN     25 PHE  QB      7.50  # m w 2   268150.0*2    cleanJun1057
         HN     25 PHE  QD      8.50  # r w 5   549000.0*2    cleanJun1780
         HN     82 GLU- QG      7.50  # m w 5    12770.0*2    cleanJun2030
         HA     25 PHE  HN      4.80  #     2  2428000.0      cleanJun 367
         QB     25 PHE  HN      7.50  # m w 2    42725.0*2    cleanJun1822
         QB     26 ASP- HN      7.50  # m   3   884500.0*2    cleanJun1958
 25 PHE  
         HN     25 PHE  HA      4.40  #     2  4392000.0      cleanJun 368
         HN     25 PHE  QB      5.80  # i   2  1601500.0*2    cleanJun 369
         HN     25 PHE  QD      8.50  # r w 1   197350.0*2    cleanJun1779
         HN     25 PHE  QE      7.50  # m w 1    18710.0*2    cleanJun2119
         HN     78 LEU  QD1     7.50  #   w 5M  378100.0      cleanJun1424
         HN     82 GLU- QB      6.90  # m   5  1477000.0*2    cleanJun1607
         HN     82 GLU- QG      7.20  # m   5  1164500.0*2    cleanJun1606
         HA     27 HIS+ HN      6.20  #     3  1150000.0      cleanJun1611
         QB     27 HIS+ HN      6.80  # m   3  1832000.0*2    cleanJun1280
         QD     29 LYS+ HN      8.50  # r w 5   233550.0*2    cleanJun1782
         QE     27 HIS+ HN      8.50  # r w 5    79450.0*2    cleanJun2118
 26 ASP- 
         HN     26 ASP- HA      4.40  #     2  4105000.0      cleanJun1784
 27 HIS+ 
         HN     27 HIS+ HA      3.80  #     2 10600000.0      cleanJun 242
         HN     27 HIS+ HB2     4.20 <#     2  5788000.0      cleanJun 371
         HN     27 HIS+ HB3     6.40 >#     2   460100.0      cleanJun1288
         HN     28 LYS+ HN      4.70  #     2  2953000.0      cleanJun 372
         HN     28 LYS+ QB      7.50  # m w 2   128800.0*2    cleanJun1828
         HN     28 LYS+ HG3     6.50  #   w 5   355200.0      cleanJun1827
         HN     28 LYS+ QE      7.50  # m w 5   795000.0*2    cleanJun1278
         HN     29 LYS+ HN      6.40  #     3   940700.0      cleanJun1823
         HN     30 PHE  HN      6.50  #     3   882400.0      cleanJun1608
         HN     30 PHE  QB      7.50  # m w 3   684500.0*2    cleanJun1610
         HN     31 PHE  HN      6.50  #   w 3   328600.0      cleanJun1826
         HN     86 LEU  QD1     6.30  #     5M 1903000.0    ! cleanJun1087
         HA     28 LYS+ HN      6.00  #     2   657400.0      cleanJun 373
         HA     29 LYS+ HN      6.50  #   w 3   201000.0      cleanJun1831
         HA     30 PHE  HN      6.50  #   w 3   171900.0      cleanJun1832
         HB2    31 PHE  HN      6.50  #   w 3   259400.0      cleanJun1833
         HB3    28 LYS+ HN      4.40  #     2  4460000.0      cleanJun1830
 28 LYS+ 
         HN     28 LYS+ HA      4.20  #     2  5987000.0      cleanJun 252
         HN     28 LYS+ QB      5.10  # i   2  3566000.0*2    cleanJun 374
         HN     28 LYS+ HG2     4.20 >#     1  3874000.0      cleanJun 375
         HN     28 LYS+ HG3     3.40 <#     1 12640000.0      cleanJun 376
         HN     28 LYS+ QD      5.40  # m   1  2614000.0*2    cleanJun 824
         HN     28 LYS+ QE      7.00  # m   1   430050.0*2    cleanJun 377
         HN     29 LYS+ HN      3.80  #     2 10570000.0      cleanJun1834
         HN     30 PHE  HN      5.90  #     3  1647000.0      cleanJun1835
         HN     30 PHE  QB      7.50  # m w 3   249000.0*2    cleanJun1836
         HN     31 PHE  HN      6.50  #   w 3   141700.0      cleanJun2032
         HN     31 PHE  HB3     6.50  #   w 3   151400.0      cleanJun1837
         HA     29 LYS+ HN      4.20  #     2  5916000.0      cleanJun 378
         HA     30 PHE  HN      5.50  #     3  2559000.0      cleanJun1838
         HA     31 PHE  HN      5.80  #     3  1740000.0      cleanJun1839
         HA     32 GLN  HN      4.70  #     3  6334000.0      cleanJun1840
         HA     32 GLN  HE21    6.50  #   w 5   480400.0      cleanJun1995
         HA    110 SER  HN      5.30  #     4   476800.0      cleanJun2034
         QB     29 LYS+ HN      6.80  # m   2   810500.0*2    cleanJun2035
         QB     30 PHE  HN      7.50  # m   3   863000.0*2    cleanJun1613
         QB     31 PHE  HN      7.50  # m w 3    59000.0*2    cleanJun1841
         QB     32 GLN  HN      7.50  # m w 3   502000.0*2    cleanJun1842
         QB     32 GLN  HE21    7.50 <# m w 5   778000.0*2    cleanJun1993
         QB     32 GLN  HE22    7.50 ># m w 5   196500.0*2    cleanJun1992
         HG2    30 PHE  HN      6.20  #     5  1110000.0      cleanJun1614
         HG2   110 SER  HN      6.50  #   w 5   458500.0      cleanJun2037
         HG3   108 ALA  HN      6.50  #   w 5   316900.0      cleanJun1612
         QD     29 LYS+ HN      6.50  # m   5  2212000.0*2    cleanJun2038
         QE     29 LYS+ HN      7.50  # m w 5   799500.0*2    cleanJun2036
         QE     30 PHE  HN      6.80  # m   5  1640500.0*2    cleanJun1292
 29 LYS+ 
         HN     29 LYS+ HA      4.40  #     2  4202000.0      cleanJun  49
         HN     29 LYS+ HB2     3.70 <#     2 11420000.0      cleanJun 383
         HN     29 LYS+ HB3     4.40 >#     2  4245000.0      cleanJun 382
         HN     29 LYS+ QG      5.80  # m   1  1631500.0*2    cleanJun 750
         HN     29 LYS+ QD      5.10  # m   1  4284000.0*2    cleanJun 381
         HN     29 LYS+ QE      6.10  # m   1  1087000.0*2    cleanJun1007
         HN     30 PHE  HN      4.40  #     2  4137000.0      cleanJun 386
         HN     31 PHE  HN      6.50  #   w 3   235200.0      cleanJun 922
         HN     32 GLN  HN      6.50  #   w 3   213800.0      cleanJun1089
         HN     32 GLN  HE21    6.50  #   w 5   426000.0      cleanJun1996
         HA     30 PHE  HN      4.00  #     2  8067000.0      cleanJun 385
         HA     31 PHE  HN      6.50  #   w 3   687700.0      cleanJun2039
         HA     32 GLN  HN      6.50  #   w 3   201100.0      cleanJun2040
         HB3    30 PHE  HN      3.60  #     2 14340000.0      cleanJun1197
         HB3    31 PHE  HN      6.50  #   w 3   460400.0      cleanJun1198
         HB3    33 MET  HN      6.00  #     3  1460000.0      cleanJun2041
 30 PHE  
         HN     30 PHE  HA      4.40  #     2  4344000.0      cleanJun  51
         HN     30 PHE  QB      4.90  # i   2  4907500.0*2    cleanJun 387
         HN     30 PHE  QD      8.50  # r w 1   193450.0*2    cleanJun2045
         HN     31 PHE  HN      3.90  #     2  9020000.0      cleanJun 388
         HN     31 PHE  QD      8.50  # r w 5   796500.0*2    cleanJun1774
         HN     32 GLN  HN      5.70  #     3  1971000.0      cleanJun1090
         HN     32 GLN  QB      6.10  # m   3  3924000.0*2    cleanJun1282
         HN     33 MET  HN      5.20  #     3  3414000.0      cleanJun 391
         HA     31 PHE  HN      4.80  #     2  2570000.0      cleanJun 389
         HA     32 GLN  HN      5.60  #     3  2284000.0      cleanJun2042
         QB     31 PHE  HN      5.80  # m   2  2514000.0*2    cleanJun 860
         QD     31 PHE  HN      8.50  # r w 5   702000.0*2    cleanJun2046
 31 PHE  
         HN     31 PHE  HA      4.60  #     2  3200000.0      cleanJun 103
         HN     31 PHE  HB2     3.70  #     2 11520000.0      cleanJun 393
         HN     31 PHE  HB3     4.10  #     2  6590000.0      cleanJun 394
         HN     31 PHE  QD      7.00  # r   1  1201000.0*2    cleanJun1773
         HN     31 PHE  QE      7.50  # m w 1    25615.0*2    cleanJun2113
         HN     32 GLN  HN      3.50  #     2 18620000.0      cleanJun 392
         HN     32 GLN  QB      6.00  # m   2  1978500.0*2    cleanJun1092
         HN     33 MET  HN      4.60  #     3  6831000.0      cleanJun1556
         HN     34 VAL  HN      5.10  #     3  4011000.0      cleanJun1093
         HN     34 VAL  QG1     7.50  #   w 5M  241100.0      cleanJun1094
         HN     37 LYS+ QE      7.50  # m w 5   131900.0*2    cleanJun1966
         HA     32 GLN  HN      5.40  #     2  1226000.0      cleanJun 390
         HA     34 VAL  HN      6.50  #   w 3   667600.0      cleanJun2049
         HA     35 GLY  HN      6.50  #   w 3   440200.0      cleanJun2050
         HA     36 LEU  HN      4.20  #     4  1866000.0      cleanJun1615
         HB2    32 GLN  HN      4.50  #     2  3683000.0      cleanJun 862
         HB2    36 LEU  HN      6.50 <#   w 5   230800.0      cleanJun2081
         HB3    32 GLN  HN      4.80  #     2  2602000.0      cleanJun 861
         HB3    36 LEU  HN      6.50 >#   w 5    51400.0      cleanJun2149
         HB3    37 LYS+ HN      6.50  #   w 5   137800.0      cleanJun2151
         QD     32 GLN  HN      8.50  # r w 5   462200.0*2    cleanJun1776
         QD     36 LEU  HN      8.50  # r w 5   219050.0*2    cleanJun1777
         QD    110 SER  HN      8.50  # r w 5   255300.0*2    cleanJun2051
         QE     32 GLN  HN      8.50  # r w 5    29980.0*2    cleanJun2114
 32 GLN  
         HN     32 GLN  HA      4.50  #     2  3607000.0      cleanJun 269
         HN     32 GLN  QB      4.10  # i   2 16215000.0*2    cleanJun 396
         HN     32 GLN  QG      5.90  # m   1  1374000.0*2    cleanJun 397
         HN     33 MET  HN      4.00  #     2  7919000.0      cleanJun 398
         HN     34 VAL  HN      5.50  #     3  2397000.0      cleanJun 923
         HN     34 VAL  QG1     7.50  #   w 5M  105400.0      cleanJun1096
         HN     37 LYS+ QB      7.50  # m w 5   592500.0*2    cleanJun1440
         HN     37 LYS+ QG      7.50  # m   5   812500.0*2    cleanJun1439
         HN     37 LYS+ QE      7.50  # m w 5   742500.0*2    cleanJun1967
         HA     33 MET  HN      4.80  #     2  2634000.0      cleanJun 399
         HA     34 VAL  HN      5.60  #     3  2258000.0      cleanJun1968
         HA     35 GLY  HN      5.00  #     3  4407000.0      cleanJun1969
         HA     36 LEU  HN      5.90  #     3  1617000.0      cleanJun2054
         HA     37 LYS+ HN      4.50  #     4  1400000.0      cleanJun2053
         QB     32 GLN  HE21    6.70 <# m   1   575500.0*2    cleanJun1983
         QB     32 GLN  HE22    7.50 ># m w 1   137000.0*2    cleanJun1985
         QB     33 MET  HN      5.20  # m   2  5400000.0*2    cleanJun1095
         QG     32 GLN  HE21    5.90 <# m   1  1342000.0*2    cleanJun1984
         QG     32 GLN  HE22    7.50 ># m w 1   207500.0*2    cleanJun1986
 33 MET  
         HN     33 MET  HA      3.60  #     2 13270000.0      cleanJun  61
         HN     33 MET  QB      4.80  # i   2  5605000.0*2    cleanJun 400
         HN     33 MET  HG2     3.80 <#     1  6537000.0      cleanJun 401
         HN     33 MET  HG3     4.60 >#     1  2182000.0      cleanJun 402
         HN     33 MET  QG      7.20  # m   1   330400.0*2    cleanJun2055
         HN     34 VAL  HN      4.30  #     2  4955000.0      cleanJun 403
         HN     34 VAL  HB      5.10  #     2  1792000.0      cleanJun1098
         HN     34 VAL  QG1     7.50  #   w 5M  413400.0      cleanJun1100
         HN     34 VAL  QG2     7.50  #   w 5M  510900.0      cleanJun1099
         HN     35 GLY  HN      6.50  #   w 3   301300.0      cleanJun1101
         HN     37 LYS+ QE      7.20  # m   5  1184500.0*2    cleanJun2056
         HA     34 VAL  HN      4.30  #     2  5169000.0      cleanJun 405
         HA     35 GLY  HN      4.60  #     3  6973000.0      cleanJun2057
         QB     34 VAL  HN      5.80  # m   2  2375000.0*2    cleanJun1008
         QB     35 GLY  HN      7.50  # m w 3   115300.0*2    cleanJun1201
 34 VAL  
         HN     34 VAL  HA      4.30  #     2  4699000.0      cleanJun  59
         HN     34 VAL  HB      3.40  #     2 20970000.0      cleanJun 407
         HN     34 VAL  QG1     5.90  #     1M  451400.0      cleanJun 409
         HN     34 VAL  QG2     6.20  #     1M  343700.0      cleanJun 408
         HN     35 GLY  HN      3.70  #     2 12130000.0      cleanJun 411
         HN     35 GLY  HA2     5.70  #     2   890800.0      cleanJun1103
         HN     36 LEU  HN      6.50  #   w 3   744700.0      cleanJun1617
         HN     36 LEU  HG      6.20  #     5  1091000.0      cleanJun1444
         HA     35 GLY  HN      4.70  #     2  2934000.0      cleanJun 410
         HB     35 GLY  HN      4.50  #     2  3706000.0      cleanJun 863
         HB     36 LEU  HN      6.20  #     3  1138000.0      cleanJun2082
         QG1    35 GLY  HN      4.90  #     5M 4945000.0      cleanJun 865
         QG1    36 LEU  HN      3.70 <#     5M15540000.0      cleanJun1018
         QG1    37 LYS+ HN      7.50  #   w 5M  627600.0      cleanJun1448
         QG2    35 GLY  HN      5.90  #     5M 2387000.0      cleanJun 864
         QG2    36 LEU  HN      6.00 >#     5M 2224000.0      cleanJun1019
 35 GLY  
         HN     35 GLY  HA1     3.80  #     2 10450000.0      cleanJun  65
         HN     35 GLY  HA2     4.10  #     2  6319000.0      cleanJun  66
         HN     36 LEU  HN      3.40  #     2 20780000.0      cleanJun 414
         HN     36 LEU  QB      7.50  # m w 2    27855.0*2    cleanJun2150
         HN     36 LEU  HG      6.30  #     5  1051000.0      cleanJun1105
         HN     37 LYS+ QE      7.50  # m w 5   263600.0*2    cleanJun1107
         HN     38 LYS+ QG      7.50  # m w 5   112350.0*2    cleanJun2155
         HA1    36 LEU  HN      4.40  #     2  4377000.0      cleanJun 412
         HA1    38 LYS+ HN      6.50  #   w 3   211800.0      cleanJun2156
         HA2    36 LEU  HN      4.90  #     2  2158000.0      cleanJun 413
         HA2    37 LYS+ HN      6.00  #     3  1435000.0      cleanJun1203
 36 LEU  
         HN     36 LEU  HA      4.20  #     2  5712000.0      cleanJun  68
         HN     36 LEU  QB      5.20  # i   2  3128000.0*2    cleanJun1204
         HN     36 LEU  HG      3.80  #     1  6471000.0      cleanJun 416
         HN     36 LEU  QD2     3.60  #     1M 8886000.0    ! cleanJun 415
         HN     37 LYS+ HN      3.90  #     2  9539000.0      cleanJun 419
         HN     37 LYS+ QG      6.30  # m   5  3077500.0*2    cleanJun1109
         HN     37 LYS+ QE      7.50  # m w 5   179950.0*2    cleanJun1279
         HN     38 LYS+ HN      5.50  #     3  2545000.0      cleanJun1446
         HN     39 LYS+ QD      7.20  # m   5  1154000.0*2    cleanJun1618
         HA     37 LYS+ HN      4.40  #     2  4148000.0      cleanJun 418
         HA     38 LYS+ HN      5.60  #     3  2261000.0      cleanJun1619
         QB     37 LYS+ HN      6.80  # m   2   790000.0*2    cleanJun2152
         QB     39 LYS+ HN      5.80  # m   3  5590000.0*2    cleanJun1620
 37 LYS+ 
         HN     37 LYS+ HA      4.00  #     2  7096000.0      cleanJun  70
         HN     37 LYS+ HB2     3.50 <#     2 16420000.0      cleanJun 426
         HN     37 LYS+ HB3     4.10 >#     2  6484000.0      cleanJun1624
         HN     37 LYS+ QG      4.80  # m   1  6605000.0*2    cleanJun 428
         HN     37 LYS+ QD      7.30  # m   1   326600.0*2    cleanJun1616
         HN     37 LYS+ QE      7.00  # m   1   414500.0*2    cleanJun 425
         HN     38 LYS+ HN      3.80  #     2 11020000.0      cleanJun 423
         HN     38 LYS+ QG      7.50  # m w 5   537000.0*2    cleanJun2153
         HN     39 LYS+ HN      4.50  #     3  8634000.0      cleanJun 429
         HN     47 VAL  QG1     7.50  #   w 5M  730700.0      cleanJun2129
         HN     47 VAL  QG2     7.50  #   w 5M  482900.0      cleanJun1447
         HA     38 LYS+ HN      4.20  #     2  5889000.0      cleanJun 424
         HA     39 LYS+ HN      6.50  #   w 3   461700.0      cleanJun2154
         QG     39 LYS+ HN      6.50  # m   5  2325500.0*2    cleanJun1623
         QG    110 SER  HN      7.50  # m w 5   665500.0*2    cleanJun1942
         QD    108 ALA  HN      7.10  # m   5  1220000.0*2    cleanJun1625
         QD    110 SER  HN      7.50  # m w 5    78000.0*2    cleanJun1943
         QE    110 SER  HN      7.50  # m w 5   132600.0*2    cleanJun1941
 38 LYS+ 
         HN     38 LYS+ HA      4.00  #     2  8028000.0      cleanJun  72
         HN     38 LYS+ HB2     4.00  #     2  7127000.0      cleanJun 431
         HN     38 LYS+ HB3     3.80  #     2 10240000.0      cleanJun1317
         HN     38 LYS+ QG      4.80  # m   1  6470000.0*2    cleanJun 433
         HN     38 LYS+ QD      5.00  # m   1  5265000.0*2    cleanJun 432
         HN     39 LYS+ HN      3.00  #     2 47050000.0      cleanJun 434
         HN     39 LYS+ QB      7.50  # m w 2   199050.0*2    cleanJun2157
         HN     39 LYS+ QD      7.50  # m w 5   317600.0*2    cleanJun1450
 39 LYS+ 
         HN     39 LYS+ HA      3.70  #     2 11830000.0      cleanJun  74
         HN     39 LYS+ QB      4.30  # i   2 12255000.0*2    cleanJun 438
         HN     39 LYS+ QG      5.00  # m   1  4549500.0*2    cleanJun1326
         HN     39 LYS+ QD      5.90  # m   1  1463500.0*2    cleanJun 751
         HN     39 LYS+ QE      5.90  # m   1  1482500.0*2    cleanJun1293
         HN     40 SER  HN      5.40  #     2  1234000.0      cleanJun 436
         HA     40 SER  HN      4.40  #     2  4275000.0      cleanJun 437
         QG     40 SER  HN      6.30  # m   5  2856500.0*2    cleanJun1206
 40 SER  
         HN     40 SER  HA      3.70  #     2 12450000.0      cleanJun  77
         HN     40 SER  QB      5.10  # i   2  3674500.0*2    cleanJun 450
         HN     41 ALA  HN      5.70  #     2   920000.0      cleanJun 806
         HN     42 ASP- HN      6.50  #   w 3   409300.0      cleanJun 866
         HN     43 ASP- HN      6.20  #     3  1200000.0      cleanJun 924
         HN     43 ASP- HB2     5.10  #     3  3780000.0      cleanJun1113
         HN     43 ASP- HB3     4.80  #     3  5925000.0      cleanJun1295
         HN     44 VAL  QG1     7.50  #   w 5M  822000.0      cleanJun1114
         HA     41 ALA  HN      4.10  #     2  6162000.0      cleanJun 476
         HA     42 ASP- HN      6.10  #     3  1317000.0      cleanJun2083
         HA     43 ASP- HN      6.50  #   w 3   642200.0      cleanJun2084
         QB     41 ALA  HN      6.70  # m   2   863000.0*2    cleanJun2085
         QB     42 ASP- HN      7.50  # m w 3   123300.0*2    cleanJun2086
         QB     43 ASP- HN      7.50  # m w 3   108750.0*2    cleanJun2087
 41 ALA  
         HN     41 ALA  HA      3.50  #     2 17140000.0      cleanJun  79
         HN     41 ALA  QB      3.40  #   s 2M26070000.0      cleanJun 451
         HN     42 ASP- HN      4.00  #     2  7182000.0      cleanJun 440
         HN     42 ASP- QB      7.50  # m w 2   293350.0*2    cleanJun1115
         HN     43 ASP- HN      6.20  #     3  1230000.0      cleanJun 869
         HN     44 VAL  HN      6.30  #     3  1072000.0      cleanJun2095
         HN     44 VAL  HB      6.50  #   w 3   188900.0      cleanJun1457
         HN     44 VAL  QG2     7.50  #   w 5M  280000.0      cleanJun2088
         HA     42 ASP- HN      4.20  #     2  5964000.0      cleanJun 439
         HA     43 ASP- HN      6.00  #     3  1446000.0      cleanJun1209
         HA     44 VAL  HN      4.50  #     3  8153000.0      cleanJun1210
         HA     45 LYS+ HN      6.50  #   w 3    51320.0      cleanJun2089
         QB     42 ASP- HN      3.40  #   s 2M11580000.0      cleanJun 871
         QB     43 ASP- HN      5.20  #     3M  137700.0      cleanJun1211
         QB     45 LYS+ HN      6.20  #     3M   44760.0      cleanJun2090
 42 ASP- 
         HN     42 ASP- HA      3.50  #     2 17820000.0      cleanJun  81
         HN     42 ASP- QB      4.30  # i   2 12770000.0*2    cleanJun 446
         HN     43 ASP- HN      3.30  #     2 26020000.0      cleanJun 444
         HN     44 VAL  HN      4.60  #     3  7574000.0      cleanJun2092
         HN     44 VAL  QG1     7.50  #   w 5M  674900.0      cleanJun1117
         HN     45 LYS+ HN      5.00  #     3  4254000.0      cleanJun 459
         HA     43 ASP- HN      4.20  #     2  5903000.0      cleanJun 445
         HA     44 VAL  HN      6.50  #   w 3   769100.0      cleanJun1212
         HA     45 LYS+ HN      5.60  #     3  2234000.0      cleanJun1213
         QB     43 ASP- HN      5.20  # m   2  5600000.0*2    cleanJun 872
         QB     44 VAL  HN      7.50  # m w 3   152200.0*2    cleanJun2093
 43 ASP- 
         HN     43 ASP- HA      3.90  #     2  8338000.0      cleanJun  83
         HN     43 ASP- HB2     4.00  #     2  7998000.0      cleanJun 449
         HN     43 ASP- HB3     3.40  #     2 19050000.0      cleanJun1455
         HN     44 VAL  HN      3.70  #     2 12240000.0      cleanJun 808
         HN     44 VAL  HA      6.50  #   w 2   201300.0      cleanJun1118
         HN     44 VAL  HB      6.50  #   w 2   246000.0      cleanJun1119
         HN     44 VAL  QG2     5.60  #     5M 3067000.0    ! cleanJun1300
         HN     45 LYS+ HN      6.30  #     3  1063000.0      cleanJun2098
         HN     46 LYS+ HN      6.40  #     3   954200.0      cleanJun2097
         HN     46 LYS+ QG      7.50  # m w 5   774500.0*2    cleanJun1121
         HN     46 LYS+ QD      7.50  # m w 5    75450.0*2    cleanJun1123
         HA     44 VAL  HN      5.00  #     2  1900000.0      cleanJun 453
         HA     45 LYS+ HN      6.50  #   w 3   171100.0      cleanJun1215
         HA     46 LYS+ HN      5.50  #     3  2490000.0      cleanJun1463
         HB3    44 VAL  HN      4.50  #     2  3507000.0      cleanJun1961
 44 VAL  
         HN     44 VAL  HA      4.20  #     2  5799000.0      cleanJun 452
         HN     44 VAL  HB      3.70  #     2 12170000.0      cleanJun 456
         HN     44 VAL  QG1     4.20  #     1M 3641000.0      cleanJun 458
         HN     44 VAL  QG2     3.90  #     1M 6045000.0      cleanJun 457
         HN     45 LYS+ HN      4.90  #     2  2251000.0      cleanJun2100
         HN     45 LYS+ HB2     4.50 <#     2  3559000.0    ! cleanJun1460
         HN     45 LYS+ HB3     6.50 >#     2   397500.0      cleanJun1461
         HN     45 LYS+ HG2     5.90  #     5  1516000.0      cleanJun2103
         HN     46 LYS+ HB2     6.20  #     3  1181000.0      cleanJun1628
         HN     47 VAL  HN      4.90  #     3  4943000.0      cleanJun1629
         HN     47 VAL  QG2     4.50  #     5M 6932000.0    ! cleanJun1631
         HA     45 LYS+ HN      5.50  #     2  1118000.0      cleanJun 460
         HA     46 LYS+ HN      6.50  #   w 3   593900.0      cleanJun2102
         HA     47 VAL  HN      5.30  #     3  3102000.0      cleanJun1632
         HB     45 LYS+ HN      4.50  #     2  3573000.0      cleanJun 873
         QG1    45 LYS+ HN      7.50  #   w 5M  422600.0      cleanJun2104
         QG1    46 LYS+ HN      7.50  #   w 5M  820500.0      cleanJun1216
         QG1   102 GLU- HN      7.50  #   w 5M  236600.0      cleanJun1306
 45 LYS+ 
         HN     45 LYS+ HA      4.20  #     2  5532000.0      cleanJun  85
         HN     45 LYS+ HB2     3.60  #     2 13540000.0      cleanJun 461
         HN     45 LYS+ HB3     3.60  #     2 13640000.0      cleanJun 462
         HN     45 LYS+ HG2     4.30  #     1  3158000.0      cleanJun 463
         HN     45 LYS+ HG3     3.90  #     1  5421000.0      cleanJun 464
         HN     46 LYS+ HN      4.00  #     2  7346000.0      cleanJun1339
         HN     46 LYS+ HA      6.20  #     2   556500.0      cleanJun1464
         HN     46 LYS+ HB2     4.90  #     2  2329000.0      cleanJun1633
         HN     46 LYS+ QG      7.50  # m w 5   290100.0*2    cleanJun1635
         HN     47 VAL  HN      5.30  #     3  2920000.0      cleanJun1636
         HN     48 PHE  HN      5.20  #     3  3628000.0      cleanJun1637
         HA     48 PHE  HN      6.50  #   w 3   852500.0      cleanJun2105
         HB3    46 LYS+ HN      5.80  #     2   760200.0      cleanJun2106
         HG3    48 PHE  HN      5.40  #     5  2649000.0    ! cleanJun1218
 46 LYS+ 
         HN     46 LYS+ HA      4.80  #     2  2365000.0      cleanJun  87
         HN     46 LYS+ HB2     4.00  #     2  7595000.0      cleanJun1338
         HN     46 LYS+ HB3     3.90  #     2  9153000.0      cleanJun 467
         HN     46 LYS+ QG      6.50  # m   1   687500.0*2    cleanJun1634
         HN     46 LYS+ QD      6.20  # m   1  1009000.0*2    cleanJun1337
         HN     46 LYS+ QE      7.50  # m w 1    93300.0*2    cleanJun 468
         HN     48 PHE  HN      5.90  #     3  1546000.0      cleanJun1639
         HA     49 HIS+ HN      6.50  #   w 3   694100.0      cleanJun2107
         HB2    47 VAL  HN      4.00  #     2  7157000.0      cleanJun1362
         HB3    47 VAL  HN      4.00  #     2  7142000.0      cleanJun1363
 47 VAL  
         HN     47 VAL  HA      4.50  #     2  3952000.0      cleanJun 472
         HN     47 VAL  HB      3.50  #     2 17480000.0      cleanJun 817
         HN     47 VAL  QG1     6.00 >#     1M  410800.0      cleanJun 818
         HN     47 VAL  QG2     4.80 <#     1M 1571000.0      cleanJun 819
         HN     48 PHE  HN      3.70  #     2 12980000.0      cleanJun 475
         HN     48 PHE  QB      7.50  # m w 2   208550.0*2    cleanJun1126
         HN     50 MET  HN      6.50  #   w 3   113000.0      cleanJun2108
         HA     48 PHE  HN      5.30  #     2  1420000.0      cleanJun 474
         HB     48 PHE  HN      3.70  #     2 11610000.0      cleanJun1127
         QG1    48 PHE  HN      5.20  #     5M 4148000.0      cleanJun1640
         QG2    48 PHE  HN      5.10  #     5M 4259000.0      cleanJun1217
 48 PHE  
         HN     48 PHE  HA      3.80  #     2 10490000.0      cleanJun 228
         HN     48 PHE  QB      4.60  # i   2  7240000.0*2    cleanJun 477
         HN     48 PHE  QD      8.30  # r   1   315950.0*2    cleanJun1766
         HN     48 PHE  QE      7.50  # m w 1   117550.0*2    cleanJun1765
         HN     49 HIS+ HN      4.20  #     2  5679000.0      cleanJun1787
         HN     50 MET  HN      4.60  #     3  7402000.0      cleanJun1790
         HN     51 LEU  HN      6.20  #     3  1207000.0      cleanJun1843
         HN    103 PHE  QE      8.50  # r w 5   121550.0*2    cleanJun1940
         HA     49 HIS+ HN      5.20  #     2  1460000.0      cleanJun1791
         HA     50 MET  HN      5.20  #     3  3425000.0      cleanJun1844
         HA     51 LEU  HN      5.80  #     3  1771000.0      cleanJun1845
         HA     52 ASP- HN      5.30  #     3  3039000.0      cleanJun1846
         QD     52 ASP- HN      8.50  # r w 5   118350.0*2    cleanJun1770
         QD    100 VAL  HN      8.50  # r w 5   476700.0*2    cleanJun2120
         QD    103 PHE  HN      8.40  # r   5   949500.0*2    cleanJun2121
         QE     57 GLY  HN      8.50  # r w 5    28130.0*2    cleanJun2122
         QE     58 PHE  HN      8.50  # r w 5    62850.0*2    cleanJun2002
         QE     59 ILE  HN      8.50  # r w 5   488400.0*2    cleanJun1768
         QE    100 VAL  HN      8.50  # r w 5   134850.0*2    cleanJun1807
         QE    101 ASP- HN      8.50  # r w 5   136200.0*2    cleanJun1769
         QE    103 PHE  HN      8.50  # r w 5    65350.0*2    cleanJun1944
         HZ    100 VAL  HN      6.50  #   w 5    92930.0      cleanJun2123
 49 HIS+ 
         HN     49 HIS+ HA      4.60  #     2  3073000.0      cleanJun1785
         HN     49 HIS+ QB      5.60  # i   2  1912000.0*2    cleanJun1798
         HN     50 MET  HN      4.10  #     2  6183000.0      cleanJun1788
         HN     50 MET  HB2     5.10  #     2  1726000.0      cleanJun1799
         HN     50 MET  HB3     5.50  #     2  1120000.0      cleanJun1800
         HN     50 MET  QG      7.40  # m   5   942500.0*2    cleanJun1801
         HA     50 MET  HN      5.70  #     2   931200.0      cleanJun1792
 50 MET  
         HN     50 MET  HA      4.20  #     2  5696000.0      cleanJun1786
         HN     50 MET  HB2     3.70  #     2 13230000.0      cleanJun1795
         HN     50 MET  HB3     4.10  #     2  6905000.0      cleanJun1796
         HN     50 MET  QG      6.10  # m   1  1149500.0*2    cleanJun1797
         HA     51 LEU  HN      5.20  #     2  1567000.0      cleanJun1793
         HA     52 ASP- HN      6.50  #   w 3        0.0      cleanJun1847
         HB2    51 LEU  HN      4.70 <#     2  2955000.0      cleanJun1848
         HB2    52 ASP- HN      6.50  #   w 3   268900.0      cleanJun1863
         HB3    51 LEU  HN      6.50 >#     2   398300.0      cleanJun1864
         QG     51 LEU  HN      6.70  # m   5  1927500.0*2    cleanJun1852
         QG     52 ASP- HN      7.50  # m w 5   622500.0*2    cleanJun1853
 51 LEU  
         HN     51 LEU  HA      4.20  #     2  5299000.0      cleanJun  93
         HN     51 LEU  HB2     3.50 <#     2 16100000.0      cleanJun 821
         HN     51 LEU  HB3     4.20 >#     2  5407000.0      cleanJun 820
         HN     51 LEU  HG      4.00  #     1  4955000.0      cleanJun 822
         HN     51 LEU  QQD     6.40  # q   1M 4674000.0*2    cleanJun 823
         HN     52 ASP- HN      3.50  #     2 16370000.0      cleanJun 479
         HN     52 ASP- QB      6.90  # m   2   726000.0*2    cleanJun1638
         HN     59 ILE  QD1     6.20  #     5M 1912000.0      cleanJun 875
         HA     52 ASP- HN      4.60  #     2  3107000.0      cleanJun  95
         HB2    52 ASP- HN      3.50 <#     2 17300000.0      cleanJun 879
         HB3    52 ASP- HN      5.80 >#     2   771000.0      cleanJun 878
         HB3    71 PHE  HN      6.50  #   w 5   687900.0      cleanJun1965
         HG     52 ASP- HN      5.30  #     5  2814000.0      cleanJun 880
         QQD    52 ASP- HN      8.60  #     5M 1106500.0*2    cleanJun 876
         QQD    53 LYS+ HN      8.90  #   w 5M   60500.0*2    cleanJun1219
         QQD    70 GLY  HN      8.90  #     5M  920500.0*2    cleanJun1641
         QQD    71 PHE  HN      8.90  #   w 5M  410700.0*2    cleanJun1642
 52 ASP- 
         HN     52 ASP- HA      4.10  #     2  6971000.0      cleanJun 480
         HN     52 ASP- QB      4.50  # i   2  9025000.0*2    cleanJun 481
         HN     53 LYS+ HN      5.50  #     2  1053000.0      cleanJun1854
         HN     59 ILE  QG1     7.50  # m w 5   269000.0*2    cleanJun1643
         HN     59 ILE  QD1     6.10  #     5M 2088000.0      cleanJun 877
         HA     53 LYS+ HN      3.70  #     2 13180000.0      cleanJun 484
         HA     54 ASP- HN      6.50  #   w 3   456800.0      cleanJun1644
         HA     55 LYS+ HN      6.50  #   w 3   446700.0      cleanJun1645
         HA     56 SER  HN      6.30  #     3  1039000.0      cleanJun1871
         HA     59 ILE  HN      6.50  #   w 4   131100.0      cleanJun1869
         HA     60 GLU- HN      6.50  #   w 4   111900.0      cleanJun1867
         QB     53 LYS+ HN      7.50  # m w 2   131850.0*2    cleanJun1855
         QB     58 PHE  HN      7.40  # m   5   976500.0*2    cleanJun1646
 53 LYS+ 
         HN     53 LYS+ HA      3.90  #     2  9017000.0      cleanJun 254
         HN     53 LYS+ HB2     4.30  #     2  4755000.0      cleanJun 487
         HN     53 LYS+ HB3     4.10  #     2  6958000.0      cleanJun 488
         HN     53 LYS+ QG      5.30  # m   1  2948500.0*2    cleanJun 489
         HN     53 LYS+ QD      5.50  # m   1  2450000.0*2    cleanJun1318
         HN     53 LYS+ QE      7.40  # m   1   293350.0*2    cleanJun 490
         HN     54 ASP- HN      4.10  #     2  6306000.0      cleanJun 491
         HN     55 LYS+ HN      6.50  #   w 3   740900.0      cleanJun1647
         HN     59 ILE  QD1     7.50  #   w 5M  125600.0      cleanJun1220
         HN     63 GLU- HA      5.40  #     4   437900.0      cleanJun2109
         HN     63 GLU- HB2     6.50  #   w 5   620100.0      cleanJun1652
         HN     63 GLU- HB3     6.50  #   w 5   438400.0      cleanJun1870
         HN     63 GLU- QG      7.50  # m w 5   708000.0*2    cleanJun1129
         HN     66 PHE  QD      8.50  # r   5   819000.0*2    cleanJun1757
         HA     54 ASP- HN      5.10  #     2  1787000.0      cleanJun  99
         HA     55 LYS+ HN      5.30  #     3  3146000.0      cleanJun1648
         HB2    54 ASP- HN      4.00 <#     2  7067000.0    ! cleanJun1650
         HB2    55 LYS+ HN      6.50 <#   w 3   811700.0      cleanJun1868
         HB3    54 ASP- HN      5.00 >#     2  1844000.0      cleanJun1649
         HB3    55 LYS+ HN      6.50 >#   w 3   178100.0      cleanJun1857
         QG     54 ASP- HN      7.30  # m   5  1073500.0*2    cleanJun1858
         QD     54 ASP- HN      7.50  # m w 5   718500.0*2    cleanJun1860
         QD     55 LYS+ HN      7.50  # m w 5   314650.0*2    cleanJun1861
         QE     54 ASP- HN      7.10  # m   5  1281500.0*2    cleanJun1862
 54 ASP- 
         HN     54 ASP- HA      4.00  #     2  7579000.0      cleanJun 492
         HN     54 ASP- HB2     4.30  #     2  5054000.0      cleanJun 493
         HN     54 ASP- HB3     4.20  #     2  5836000.0      cleanJun 494
         HN     55 LYS+ HN      3.40  #     2 18700000.0      cleanJun 501
         HN     55 LYS+ HA      5.10  #     2  1697000.0      cleanJun1872
         HN     55 LYS+ QG      6.20  # m   5  3170000.0*2    cleanJun1653
         HN     55 LYS+ QD      7.00  # m   5  1350000.0*2    cleanJun2058
         HN     56 SER  HN      5.40  #     3  2908000.0      cleanJun1654
         HN     63 GLU- QG      7.50  # m w 5    71350.0*2    cleanJun2059
         HA     55 LYS+ HN      4.90  #     2  2187000.0      cleanJun 500
         HA     56 SER  HN      6.50  #   w 3   178900.0      cleanJun1655
         HB2    55 LYS+ HN      6.50  #   w 2   124300.0      cleanJun1224
         HB2    56 SER  HN      6.50 >#   w 3    61220.0      cleanJun2064
         HB3    55 LYS+ HN      6.50  #   w 2    92990.0      cleanJun1223
         HB3    56 SER  HN      6.50 <#   w 3   185200.0      cleanJun2111
 55 LYS+ 
         HN     55 LYS+ HA      3.30  #     2 25570000.0      cleanJun 102
         HN     55 LYS+ QB      6.10  # i   2  1141500.0*2    cleanJun 497
         HN     55 LYS+ QG      5.50  # m   1  2307500.0*2    cleanJun 498
         HN     55 LYS+ QD      6.50  # m   1   711500.0*2    cleanJun 499
         HN     56 SER  HN      3.70  #     2 11330000.0      cleanJun1656
         HN     57 GLY  HN      6.50  #     3   920900.0      cleanJun1658
         HN     58 PHE  HN      6.50  #   w 3   105900.0      cleanJun 883
         HA     56 SER  HN      4.10  #     2  6295000.0      cleanJun 495
         HA     57 GLY  HN      5.10  #     3  3829000.0      cleanJun1370
         HA     58 PHE  HN      6.50  #   w 3   248400.0      cleanJun1473
         QB     56 SER  HN      6.90  # m   2   685500.0*2    cleanJun1010
         QG     56 SER  HN      7.50  # m w 5   248100.0*2    cleanJun1011
         QD     56 SER  HN      7.50  # m w 5    55000.0*2    cleanJun2065
 56 SER  
         HN     56 SER  HA      3.40  #     2 18670000.0      cleanJun  53
         HN     56 SER  QB      7.10  # i w 2   274200.0*2    cleanJun 496
         HN     57 GLY  HN      3.80  #     2 10050000.0      cleanJun 508
         HN     57 GLY  HA1     6.50 >#   w 2   243700.0      cleanJun2060
         HN     57 GLY  HA2     5.80 <#     2   763100.0      cleanJun2061
         HN     58 PHE  HN      5.50  #     3  2593000.0      cleanJun 766
         HA     57 GLY  HN      4.80  #     2  2559000.0      cleanJun 505
         HA     58 PHE  HN      5.20  #     3  3361000.0      cleanJun1225
         QB     57 GLY  HN      6.10  # m   2  1710500.0*2    cleanJun1873
         QB     58 PHE  HN      7.50  # m w 3   670500.0*2    cleanJun1874
 57 GLY  
         HN     57 GLY  HA1     3.80 <#     2 10450000.0      cleanJun 506
         HN     57 GLY  HA2     4.50 >#     2  3613000.0      cleanJun 107
         HN     58 PHE  HN      3.40  #     2 19220000.0      cleanJun 509
         HN     58 PHE  QD      8.50  # r w 5   124000.0*2    cleanJun1761
         HA1    58 PHE  HN      4.60  #     2  3199000.0      cleanJun 510
         HA2    58 PHE  HN      5.00  #     2  2009000.0      cleanJun 511
 58 PHE  
         HN     58 PHE  HA      4.40  #     2  4279000.0      cleanJun 244
         HN     58 PHE  HB2     4.00  #     2  7741000.0      cleanJun 512
         HN     58 PHE  HB3     4.40  #     2  4032000.0      cleanJun 513
         HN     58 PHE  QD      6.40  # r   1  2648500.0*2    cleanJun1759
         HN     59 ILE  HN      5.90  #     2   712300.0      cleanJun 961
         HN     59 ILE  HA      5.80  #     2   835400.0      cleanJun1131
         HA     59 ILE  HN      3.70  #     2 12990000.0      cleanJun 515
         HA     98 ILE  HN      4.60  #     4  1137000.0      cleanJun1659
         HA    100 VAL  HN      5.70  #     4   323500.0      cleanJun1938
         HB2    59 ILE  HN      4.90  #     2  2105000.0      cleanJun 882
         HB2    98 ILE  HN      6.50 >#   w 5    88800.0      cleanJun2000
         HB3    59 ILE  HN      4.30  #     2  5080000.0      cleanJun 881
         HB3    60 GLU- HN      5.20  #     3  3561000.0    ! cleanJun1660
         HB3    98 ILE  HN      6.50 <#   w 5   805200.0      cleanJun1876
         QD     59 ILE  HN      8.50  # r w 5   304000.0*2    cleanJun2124
         QD     98 ILE  HN      8.50  # r w 5    14255.0*2    cleanJun2126
         QD     99 GLY  HN      8.50  # r w 5   114450.0*2    cleanJun1762
         QD    100 VAL  HN      8.50  # r w 5   178950.0*2    cleanJun2001
 59 ILE  
         HN     59 ILE  HA      4.40  #     2  4451000.0      cleanJun 111
         HN     59 ILE  HB      3.90  #     2  8920000.0      cleanJun1663
         HN     59 ILE  QG2     4.90  #     1M 1371000.0      cleanJun 519
         HN     59 ILE  QG1     5.60  # m   1  1968000.0*2    cleanJun 517
         HN     59 ILE  QD1     5.10  #     1M 1113000.0      cleanJun 518
         HN     60 GLU- HN      6.50  #     2   402500.0      cleanJun 526
         HN     60 GLU- HA      6.50  #   w 2    76990.0      cleanJun2004
         HN     97 LYS+ HA      5.00  #     4   732800.0      cleanJun1661
         HN     97 LYS+ HB2     6.50 >#   w 5   288800.0      cleanJun2005
         HN     97 LYS+ HB3     5.90 <#     5  1544000.0      cleanJun1662
         HN     97 LYS+ HD2     6.50  #     5   848400.0      cleanJun2006
         HN     98 ILE  HN      4.30  #     4  1756000.0      cleanJun1764
         HN     98 ILE  HB      6.20  #     5  1098000.0      cleanJun1478
         HN     99 GLY  HN      5.30  #     4   466900.0      cleanJun1877
         HN    103 PHE  QE      8.50  # r w 5    93550.0*2    cleanJun1945
         HA     60 GLU- HN      3.30  #     2 26470000.0      cleanJun 521
         HB     60 GLU- HN      4.80  #     2  2644000.0      cleanJun1664
         HB     98 ILE  HN      5.20  #     5  3118000.0      cleanJun2007
         QG2    60 GLU- HN      6.10  #     5M 2080000.0      cleanJun 885
         QG2    63 GLU- HN      7.40  #     5M  980100.0      cleanJun1665
         QG2    64 LEU  HN      7.50  #   w 5M  634700.0      cleanJun2008
         QG2    98 ILE  HN      6.90  #     5M 1300000.0      cleanJun1880
         QG1    60 GLU- HN      7.50  # m w 5   317500.0*2    cleanJun 886
         QG1    64 LEU  HN      7.40  # m   5   894500.0*2    cleanJun1667
         QG1    98 ILE  HN      7.50  # m w 5   215200.0*2    cleanJun1879
         QD1    60 GLU- HN      6.10  #     5M 2048000.0      cleanJun 884
         QD1    98 ILE  HN      7.50  #   w 5M  357000.0      cleanJun1878
 60 GLU- 
         HN     60 GLU- HA      4.40  #     2  4214000.0      cleanJun  97
         HN     60 GLU- QB      6.00  # i   2  1181000.0*2    cleanJun 523
         HN     60 GLU- QG      6.10  # m   1  1146500.0*2    cleanJun 522
         HN     61 GLU- HN      6.00  #     2   666300.0      cleanJun 527
         HN     62 ASP- QB      7.50  # m w 3   780500.0*2    cleanJun1668
         HN     63 GLU- HN      5.00  #     3  4541000.0      cleanJun1136
         HN     63 GLU- HB2     5.90  #     3  1607000.0      cleanJun1881
         HN     63 GLU- HB3     5.60  #     3  2158000.0      cleanJun1882
         HN     63 GLU- QG      7.50  # m w 5   676000.0*2    cleanJun1669
         HN     64 LEU  HG      6.50  #   w 5   224400.0      cleanJun1474
         HN     97 LYS+ HA      5.30  #     4   501000.0      cleanJun1886
         HN     97 LYS+ HB3     6.50  #   w 5   132700.0      cleanJun2009
         HN     97 LYS+ HG3     6.50  #   w 5   242800.0      cleanJun1885
         HN     97 LYS+ HD2     6.00  #     5  1351000.0    ! cleanJun1883
         HA     61 GLU- HN      3.60  #     2 13270000.0      cleanJun 528
         HA     98 ILE  HN      5.80  #     4   282300.0      cleanJun1887
         QB     61 GLU- HN      5.40  # m   2  4144000.0*2    cleanJun1888
         QB     62 ASP- HN      7.50  # m w 3   558500.0*2    cleanJun1889
         QB     63 GLU- HN      7.40  # m   3   973500.0*2    cleanJun1890
 61 GLU- 
         HN     61 GLU- HA      4.10  #     2  6748000.0      cleanJun 271
         HN     61 GLU- QB      4.30  # i   2 13110000.0*2    cleanJun 529
         HN     61 GLU- HG2     3.80 >#     1  6917000.0      cleanJun 530
         HN     61 GLU- HG3     3.20 <#     1 20840000.0      cleanJun 531
         HN     62 ASP- HN      4.30  #     2  4595000.0      cleanJun 533
         HN     62 ASP- QB      6.60  # m   2   984500.0*2    cleanJun1276
         HN     63 GLU- HN      6.50  #   w 3   454900.0      cleanJun 925
         HN     97 LYS+ HA      6.50  #   w 4    76600.0      cleanJun1952
         HN     97 LYS+ HG2     6.50  #   w 5   112800.0      cleanJun1950
         HN     97 LYS+ HD2     6.50  #   w 5   165800.0      cleanJun1951
         HA     62 ASP- HN      5.40  #     2  1168000.0      cleanJun 532
         HA     65 GLY  HN      6.50  #   w 3   615900.0      cleanJun2130
         QB     62 ASP- HN      5.20  # m   2  6015000.0*2    cleanJun 889
         HG2    62 ASP- HN      6.20 >#     5  1170000.0      cleanJun 887
         HG2    65 GLY  HN      6.50  #   w 5   422700.0      cleanJun2131
         HG3    62 ASP- HN      4.70 <#     5  6092000.0      cleanJun 888
 62 ASP- 
         HN     62 ASP- HA      4.00  #     2  7717000.0      cleanJun 113
         HN     62 ASP- QB      4.90  # i   2  4838000.0*2    cleanJun1671
         HN     63 GLU- HN      3.80  #     2  9648000.0      cleanJun 537
         HN     63 GLU- HB2     5.50  #     2  1117000.0      cleanJun1672
         HN     63 GLU- QG      7.30  # m   5  1048000.0*2    cleanJun1673
         HN     64 LEU  HN      6.50  #   w 3   361900.0      cleanJun1674
         HN     65 GLY  HN      6.50  #   w 3   148200.0      cleanJun1675
         HA     63 GLU- HN      4.80  #     2  2374000.0      cleanJun 539
         HA     65 GLY  HN      5.80  #     3  1741000.0      cleanJun1376
 63 GLU- 
         HN     63 GLU- HA      4.30  #     2  5005000.0      cleanJun 115
         HN     63 GLU- HB2     3.20 <#     2 27770000.0      cleanJun 540
         HN     63 GLU- HB3     3.90 >#     2  8273000.0      cleanJun 541
         HN     63 GLU- QG      5.00  # m   1  4622500.0*2    cleanJun 542
         HN     64 LEU  HN      3.70  #     2 12130000.0      cleanJun 543
         HN     64 LEU  QB      7.50  # m   2   387300.0*2    cleanJun1138
         HN     64 LEU  HG      6.50  #   w 5   623500.0      cleanJun1480
         HN     64 LEU  QD1     5.40  #     5M 3480000.0    ! cleanJun1481
         HN     65 GLY  HN      5.20  #     3  3480000.0      cleanJun 772
         HN     66 PHE  HN      6.30  #     3  1072000.0      cleanJun1139
         HN     66 PHE  QD      8.50  # r w 5   762000.0*2    cleanJun2127
         HN     66 PHE  QE      8.20  # r   5  1127000.0*2    cleanJun1758
         HA     64 LEU  HN      5.10  #     2  1751000.0      cleanJun 544
 64 LEU  
         HN     64 LEU  HA      4.20  #     2  5365000.0      cleanJun 551
         HN     64 LEU  QB      5.70  # i   2  1823500.0*2    cleanJun 547
         HN     64 LEU  HG      4.20  #     1  3708000.0      cleanJun 826
         HN     64 LEU  QD1     4.80 <#     1M 1746000.0      cleanJun1482
         HN     64 LEU  QD2     6.70 >#     1M  219700.0      cleanJun1483
         HN     65 GLY  HN      4.00  #     2  7241000.0      cleanJun 549
         HN     66 PHE  HN      6.50  #   w 3   603600.0      cleanJun 970
         HA     65 GLY  HN      4.20  #     2  6058000.0      cleanJun 550
         HA     67 ILE  HN      6.50  #   w 3   851200.0      cleanJun2132
         QB     65 GLY  HN      5.60  # m   2  3195000.0*2    cleanJun 891
         QB     66 PHE  HN      7.50  # m w 3   180950.0*2    cleanJun1230
         HG     65 GLY  HN      5.20  #     5  3368000.0      cleanJun 890
         HG     67 ILE  HN      6.50  #   w 5    96370.0      cleanJun2133
         QD1    65 GLY  HN      6.40 >#     5M 1686000.0      cleanJun1373
         QD1    87 MET  HN      6.30 <#     5M 1858000.0      cleanJun1679
         QD2    65 GLY  HN      5.00 <#     5M 4543000.0      cleanJun1372
         QD2    67 ILE  HN      7.50  #   w 5M  386000.0      cleanJun2134
         QD2    87 MET  HN      7.50 >#   w 5M  658900.0      cleanJun1680
 65 GLY  
         HN     65 GLY  HA1     4.20 >#     2  5568000.0      cleanJun2135
         HN     65 GLY  HA2     3.40 <#     2 18880000.0      cleanJun 119
         HN     66 PHE  HN      3.30  #     2 24790000.0      cleanJun 553
         HN     78 LEU  HG      6.50  #   w 5   126000.0      cleanJun1375
         HA1    66 PHE  HN      4.00 <#     2  7885000.0      cleanJun 554
         HA1    67 ILE  HN      5.40 <#     3  2728000.0      cleanJun1484
         HA1    78 LEU  HN      4.40  #     4  1549000.0      cleanJun1494
         HA2    66 PHE  HN      5.00 >#     2  1914000.0      cleanJun2136
         HA2    67 ILE  HN      6.50 >#   w 3   324700.0      cleanJun2137
         HA2    78 LEU  HN      4.70  #     4  1019000.0      cleanJun2138
 66 PHE  
         HN     66 PHE  HA      4.10  #     2  6486000.0      cleanJun 559
         HN     66 PHE  QB      5.20  # i   2  3178500.0*2    cleanJun 555
         HN     66 PHE  QD      8.50  # r   1   267800.0*2    cleanJun1756
         HN     66 PHE  QE      6.40  # m   1   820500.0*2    cleanJun1755
         HN     67 ILE  HN      3.80  #     2 10990000.0      cleanJun 560
         HN     67 ILE  HA      5.20  #     2  1617000.0      cleanJun1378
         HN     67 ILE  HB      6.50  #   w 2   333500.0      cleanJun2139
         HN     67 ILE  QG2     7.50  #   w 5M  869700.0      cleanJun1686
         HN     78 LEU  HG      6.50  #   w 5   124900.0      cleanJun1683
         HA     67 ILE  HN      5.00  #     2  1845000.0      cleanJun 558
         HA     68 LEU  HN      6.50  #   w 3   468300.0      cleanJun1684
         HA     69 LYS+ HN      6.50  #   w 3   699000.0      cleanJun1379
         HA     78 LEU  HN      6.50  #     4   142000.0      cleanJun1495
         QB     67 ILE  HN      7.50  # m w 2    53750.0*2    cleanJun2140
         QD     69 LYS+ HN      7.50  # r   5  2345000.0*2    cleanJun 578
 67 ILE  
         HN     67 ILE  HA      3.90  #     2  8655000.0      cleanJun 124
         HN     67 ILE  HB      3.60  #     2 14040000.0      cleanJun 563
         HN     67 ILE  QG2     3.40  #   s 1M15210000.0      cleanJun 564
         HN     67 ILE  QG1     5.80  # m   1  1638000.0*2    cleanJun 565
         HN     67 ILE  QD1     4.90  #     1M 1425000.0      cleanJun 566
         HN     68 LEU  HN      4.60  #     2  3075000.0      cleanJun 573
         HN     68 LEU  HG      5.10  #     5  3690000.0      cleanJun1685
         HN     69 LYS+ HN      5.60  #     3  2308000.0      cleanJun 776
         HN     70 GLY  HN      5.80  #     3  1773000.0      cleanJun 779
         HN     78 LEU  HN      5.80  #     4   284900.0      cleanJun 974
         HN     78 LEU  HG      6.50  #   w 5   403000.0      cleanJun1142
         HN     78 LEU  QD1     7.50  #   w 5M  161700.0      cleanJun1141
         HA     68 LEU  HN      4.60  #     2  3213000.0      cleanJun 126
         HA     70 GLY  HN      6.50  #   w 3   398800.0      cleanJun2142
         HB     68 LEU  HN      6.50  #   w 2    68200.0      cleanJun2141
         QG2    68 LEU  HN      4.50  #     5M 7295000.0      cleanJun1689
         QG2    69 LYS+ HN      7.50  #   w 5M  430200.0      cleanJun2143
         QG2    70 GLY  HN      7.50  #   w 5M  637700.0      cleanJun1145
         QG2    78 LEU  HN      7.50  #   w 5M  444300.0      cleanJun1688
         QG1    68 LEU  HN      7.50  # m w 5   460000.0*2    cleanJun2144
 68 LEU  
         HN     68 LEU  HA      4.60  #     2  3359000.0      cleanJun 568
         HN     68 LEU  HB2     3.50  #     2 16950000.0      cleanJun 570
         HN     68 LEU  HB3     3.90  #     2  8822000.0      cleanJun 569
         HN     68 LEU  HG      3.40  #     1 12950000.0      cleanJun 571
         HN     68 LEU  QD1     4.10  #     1M 4435000.0      cleanJun 572
         HN     69 LYS+ HN      3.80  #     2 10870000.0      cleanJun 777
         HN     69 LYS+ QG      7.10  # m   5  1205500.0*2    cleanJun1690
         HN     70 GLY  HN      5.70  #     3  1915000.0      cleanJun 778
         HN     71 PHE  HN      6.50  #   w 3   334100.0      cleanJun2146
         HN     75 ALA  QB      6.40  #     5M 1761000.0      cleanJun1979
         HN     78 LEU  QD1     6.10  #     5M 2035000.0      cleanJun1691
         HA     69 LYS+ HN      5.10  #     2  1686000.0      cleanJun1340
         HA     70 GLY  HN      5.20  #     3  3418000.0      cleanJun1383
         HA     71 PHE  HN      6.00  #     3  1449000.0      cleanJun1234
         HB2    69 LYS+ HN      4.70  #     2  2791000.0      cleanJun1022
         HB2    70 GLY  HN      6.50  #     3   870600.0      cleanJun1146
         HB2    72 SER  HN      5.20  #     3  3414000.0      cleanJun1195
         HB2    76 ARG+ HN      6.50  #   w 5   402400.0      cleanJun1692
         HB3    71 PHE  HN      6.50  #   w 3    39170.0      cleanJun2062
         HG     69 LYS+ HN      6.00  #     5  1333000.0      cleanJun1021
 69 LYS+ 
         HN     69 LYS+ HA      5.40  #     2  1240000.0      cleanJun1981
         HN     69 LYS+ QB      6.20  # i   2   979500.0*2    cleanJun 829
         HN     69 LYS+ QG      5.10  # m   1  4405500.0*2    cleanJun 830
         HN     69 LYS+ QD      5.10  # m   1  4034500.0*2    cleanJun 831
         HN     70 GLY  HN      3.70  #     2 11750000.0      cleanJun 576
         HN     71 PHE  HN      5.70  #     3  1996000.0      cleanJun 780
         HN     72 SER  HN      6.50  #   w 3   736500.0      cleanJun 781
         HN     75 ALA  QB      4.90  #     5M 4930000.0      cleanJun1696
         HN     78 LEU  QD1     7.50  #   w 5M   83480.0      cleanJun1232
         HA     70 GLY  HN      6.50  #     2   404000.0      cleanJun 577
         HA     71 PHE  HN      6.50  #   w 3   691400.0      cleanJun1697
         QB     75 ALA  HN      7.50  # m w 5   687000.0*2    cleanJun1700
         QG     70 GLY  HN      6.40  # m   5  2601000.0*2    cleanJun1020
         QD     70 GLY  HN      7.50  # m w 5   547000.0*2    cleanJun1549
 70 GLY  
         HN     70 GLY  HA1     4.50 >#     2  3944000.0      cleanJun 131
         HN     70 GLY  HA2     3.80 <#     2 11080000.0      cleanJun 132
         HN     71 PHE  HN      4.00  #     2  7726000.0      cleanJun 581
         HN     71 PHE  HB3     5.60  #     2   937900.0      cleanJun1144
         HN     71 PHE  QD      8.50  # r w 5   454200.0*2    cleanJun2147
         HN     72 SER  HN      6.50  #   w 3   423000.0      cleanJun 782
         HN     72 SER  QB      7.50  # m w 3   534500.0*2    cleanJun1382
         HA1    71 PHE  HN      5.20 >#     2  1489000.0      cleanJun2063
         HA2    71 PHE  HN      4.40 <#     2  4155000.0      cleanJun 580
 71 PHE  
         HN     71 PHE  HA      4.70  #     2  3020000.0      cleanJun1687
         HN     71 PHE  HB2     4.30  #     2  5099000.0      cleanJun 582
         HN     71 PHE  HB3     4.30  #     2  4717000.0      cleanJun 583
         HN     71 PHE  QD      7.70  # r   1   544500.0*2    cleanJun2145
         HN     72 SER  HN      3.40  #     2 19600000.0      cleanJun 586
         HN     72 SER  QB      6.30  # m   2  1421000.0*2    cleanJun1384
         HA     72 SER  HN      5.30  #     2  1319000.0      cleanJun 584
         HB2    72 SER  HN      4.00 <#     2  7690000.0      cleanJun1023
         HB3    72 SER  HN      4.80 >#     2  2496000.0      cleanJun1024
         QD     72 SER  HN      8.50  # r w 5   171250.0*2    cleanJun2148
 72 SER  
         HN     72 SER  HA      4.30  #     2  5008000.0      cleanJun 136
         HN     72 SER  QB      5.20  # i   2  3307000.0*2    cleanJun 587
         HN     73 PRO  HA      5.00  #     2  1865000.0      cleanJun1154
         HN     73 PRO  QD      6.90  # m   5  1531500.0*2    cleanJun1155
         HN     74 ASP- HN      6.70  #   w 3    72950.0      cleanJun 926
         HN     75 ALA  HN      6.50  #   w 3   735600.0      cleanJun1701
         HN     75 ALA  QB      4.50  #     3M  323800.0      cleanJun1148
         HA     74 ASP- HN      6.60  #   w 3   267500.0      cleanJun1235
         QB     74 ASP- HN      7.30  # m   3  1063500.0*2    cleanJun1236
         QB     75 ALA  HN      7.50  # m w 3   711000.0*2    cleanJun1702
 73 PRO  
         HA     74 ASP- HN      5.30  #     2  1393000.0      cleanJun1152
         HB2    74 ASP- HN      3.50 <#     2 16060000.0      cleanJun1150
         HB3    74 ASP- HN      4.90 >#     2  2162000.0      cleanJun1149
         QG     74 ASP- HN      6.40  # m   5  2697000.0*2    cleanJun1153
         QD     74 ASP- HN      7.40  # m   5   941000.0*2    cleanJun1151
 74 ASP- 
         HN     74 ASP- HA      3.80  #     2 11190000.0      cleanJun 205
         HN     74 ASP- QB      4.80  # i   2  5310000.0*2    cleanJun 588
         HN     75 ALA  HN      3.60  #     2 15660000.0      cleanJun1892
         HN     75 ALA  HA      5.50  #     2  1070000.0      cleanJun1703
         HN     75 ALA  QB      5.20  #     2M  734300.0      cleanJun1976
         HN     76 ARG+ HG2     5.60  #     5  2093000.0      cleanJun1488
         HN     76 ARG+ HG3     6.10  #     5  1280000.0      cleanJun1977
         HA     75 ALA  HN      4.60  #     2  3138000.0      cleanJun 589
         QB     75 ALA  HN      6.90  # m   2   729500.0*2    cleanJun1237
 75 ALA  
         HN     75 ALA  HA      4.10  #     2  6755000.0      cleanJun 140
         HN     75 ALA  QB      3.40  #   s 2M21970000.0      cleanJun 591
         HN     76 ARG+ HN      4.60  #     2  3351000.0      cleanJun 598
         HN     76 ARG+ HG3     5.50  #     5  2233000.0      cleanJun1193
         HA     76 ARG+ HN      5.60  #     2  1037000.0      cleanJun 592
         QB     76 ARG+ HN      4.90  #     2M 1028000.0      cleanJun1704
 76 ARG+ 
         HN     76 ARG+ HA      4.10  #     2  6505000.0      cleanJun 142
         HN     76 ARG+ HB2     4.10  #     2  6415000.0      cleanJun1319
         HN     76 ARG+ HB3     4.30  #     2  4779000.0      cleanJun 593
         HN     76 ARG+ HG2     3.30 <#     1 16590000.0      cleanJun 595
         HN     76 ARG+ HG3     4.10 >#     1  4217000.0      cleanJun 596
         HN     76 ARG+ QD      6.40  # m   1   793000.0*2    cleanJun1492
         HN     77 ASP- HN      5.00  #     2  2025000.0      cleanJun 599
         HA     77 ASP- HN      3.40  #     2 21200000.0      cleanJun 600
         HB2    77 ASP- HN      4.00  #     2  7055000.0      cleanJun1694
         HB3    77 ASP- HN      3.80  #     2 10960000.0      cleanJun1239
         HG2    77 ASP- HN      5.70  #     5  1974000.0      cleanJun1026
         HG3    77 ASP- HN      5.40  #     5  2624000.0      cleanJun1025
         HG3    78 LEU  HN      6.50  #     5   816900.0    ! cleanJun1240
         QD     77 ASP- HN      7.50  # m w 5   532500.0*2    cleanJun1238
 77 ASP- 
         HN     77 ASP- HA      5.10  #     2  1714000.0      cleanJun 222
         HN     77 ASP- HB2     4.30  #     2  5155000.0      cleanJun 601
         HN     77 ASP- HB3     3.90  #     2  9472000.0      cleanJun 602
         HN     78 LEU  HN      6.50  #   w 2   152900.0      cleanJun1894
         HA     78 LEU  HN      3.70  #     2 12120000.0      cleanJun 603
         HB2    78 LEU  HN      4.30  #     2  4742000.0      cleanJun1028
         HB3    78 LEU  HN      5.00  #     2  2068000.0      cleanJun1027
 78 LEU  
         HN     78 LEU  HA      4.50  #     2  3584000.0      cleanJun 149
         HN     78 LEU  HB2     4.10  #     2  6808000.0      cleanJun 604
         HN     78 LEU  HB3     4.00  #     2  7777000.0      cleanJun1550
         HN     78 LEU  HG      4.80  #     1  1590000.0      cleanJun 605
         HN     78 LEU  QD1     4.60  #     1M 2221000.0      cleanJun 606
         HN     79 SER  HN      6.50  #   w 2   218900.0      cleanJun1895
         HA     79 SER  HN      3.90  #     2  9259000.0      cleanJun 607
         HB2    79 SER  HN      4.90  #     2  2219000.0      cleanJun1552
         HB3    79 SER  HN      4.60  #     2  3147000.0      cleanJun1551
         HB3    82 GLU- HN      4.30  #     3 11670000.0    ! cleanJun1707
         HG     79 SER  HN      6.50  #   w 5   440200.0      cleanJun1031
         QD1    79 SER  HN      6.80  #     5M 1372000.0      cleanJun1030
 79 SER  
         HN     79 SER  HA      4.40  #     2  3991000.0      cleanJun 151
         HN     79 SER  QB      5.90  # i   2  1322000.0*2    cleanJun 608
         HN     82 GLU- HN      6.30  #     3  1069000.0      cleanJun1499
         HN     82 GLU- QB      7.50  # m w 3   180650.0*2    cleanJun1157
         HN     82 GLU- QG      6.40  # m   5  2645000.0*2    cleanJun1158
         HA     80 ALA  HN      3.40  #     2 19190000.0      cleanJun 609
         HA     81 LYS+ HN      5.50  #     3  2499000.0      cleanJun1242
         QB     80 ALA  HN      6.00  # m   2  1943000.0*2    cleanJun1241
         QB     81 LYS+ HN      7.50  # m   3   918500.0*2    cleanJun1896
         QB     82 GLU- HN      6.00  # m   3  4390000.0*2    cleanJun1708
 80 ALA  
         HN     80 ALA  HA      4.10  #     2  6301000.0      cleanJun 610
         HN     80 ALA  QB      3.40  #   s 2M14630000.0      cleanJun 611
         HN     81 LYS+ HN      4.40  #     2  4161000.0      cleanJun 618
         HN     81 LYS+ HG3     6.50  #   w 5   328300.0      cleanJun1159
         HA     81 LYS+ HN      6.50  #     2   393800.0      cleanJun 612
 81 LYS+ 
         HN     81 LYS+ HA      4.50  #     2  3925000.0      cleanJun 153
         HN     81 LYS+ HB2     3.80  #     2 11200000.0      cleanJun 614
         HN     81 LYS+ HB3     3.90  #     2  9506000.0      cleanJun 615
         HN     81 LYS+ HG2     3.40 <#     1 12510000.0      cleanJun 616
         HN     81 LYS+ HG3     5.00 >#     1  1316000.0      cleanJun 617
         HN     82 GLU- HN      3.90  #     2  8940000.0      cleanJun1330
         HA     82 GLU- HN      5.10  #     2  1666000.0      cleanJun1331
         HA     85 MET  HN      4.20  #     3 12650000.0      cleanJun1709
         HB2    82 GLU- HN      3.30 <#     2 23840000.0      cleanJun1496
         HB3    82 GLU- HN      5.50 >#     2  1128000.0      cleanJun1497
 82 GLU- 
         HN     82 GLU- HA      4.50  #     2  3695000.0      cleanJun1329
         HN     82 GLU- QB      4.80  # i   2  5375000.0*2    cleanJun1333
         HN     82 GLU- QG      5.20  # m   1  3595000.0*2    cleanJun1332
 84 LYS+ 
         HN     84 LYS+ HA      4.40  #     2  4367000.0      cleanJun 258
         HN     84 LYS+ QB      5.40  # i   2  2416000.0*2    cleanJun 624
         HN     84 LYS+ HG2     5.00 >#     1  1218000.0      cleanJun 625
         HN     84 LYS+ HG3     4.10 <#     1  4220000.0      cleanJun 626
         HN     84 LYS+ QD      5.10  # m   1  3922500.0*2    cleanJun 628
         HN     85 MET  HN      4.10  #     2  6527000.0      cleanJun1553
         HN     87 MET  HN      5.80  #     3  1835000.0      cleanJun1710
         HA     85 MET  HN      5.90  #     2   741100.0      cleanJun 629
         HA     86 LEU  HN      6.30  #     3  1090000.0      cleanJun1247
         HA     87 MET  HN      6.00  #     3  1502000.0      cleanJun1503
 85 MET  
         HN     85 MET  HA      3.80  #     2 10720000.0      cleanJun 260
         HN     85 MET  QB      4.20  # i   2 13420000.0*2    cleanJun 631
         HN     85 MET  QG      5.30  # m   1  3228000.0*2    cleanJun 756
         HN     86 LEU  HB2     6.00  #     2   617300.0      cleanJun1160
         HN     86 LEU  HB3     6.50  #     2   408700.0      cleanJun1161
         HA     86 LEU  HN      4.70  #     2  3002000.0      cleanJun 632
         QB     86 LEU  HN      5.30  # m   2  4784500.0*2    cleanJun1248
 86 LEU  
         HN     86 LEU  HA      4.10  #     2  6365000.0      cleanJun 225
         HN     86 LEU  HB2     3.60  #     2 13730000.0      cleanJun 634
         HN     86 LEU  HB3     3.50  #     2 16910000.0      cleanJun 635
         HN     86 LEU  HG      4.60  #     1  2219000.0      cleanJun 636
         HN     86 LEU  QD1     4.20  #     1M 3923000.0    ! cleanJun 637
         HN     87 MET  HN      3.50  #     2 16160000.0      cleanJun1050
         HN     89 ALA  HN      4.70  #     3  6047000.0      cleanJun1714
         HA     87 MET  HN      4.70  #     2  2698000.0      cleanJun1713
         HB2    87 MET  HN      3.40 <#     2 19070000.0      cleanJun1048
         HB2    88 ALA  HN      5.90  #     3  1665000.0      cleanJun1715
         HB3    87 MET  HN      4.20 >#     2  5893000.0      cleanJun1502
         QD1    87 MET  HN      4.20  #     5M 9678000.0    ! cleanJun1047
         QD1    89 ALA  HN      7.50  #   w 5M  562400.0      cleanJun1545
         QD1    90 GLY  HN      4.80  #     5M 5547000.0    ! cleanJun1250
         QD1    91 ASP- HN      7.50  #   w 5M  195400.0      cleanJun1251
 87 MET  
         HN     87 MET  HA      4.30  #     2  4825000.0      cleanJun 159
         HN     87 MET  QB      5.00  # i   2  4525000.0*2    cleanJun1327
         HN     87 MET  QG      6.30  # m   1   929500.0*2    cleanJun1328
         HN     88 ALA  HN      3.90  #     2  8500000.0      cleanJun 983
         HN     89 ALA  HN      6.50  #   w 3   315100.0      cleanJun1712
         QB     88 ALA  HN      5.20  # m   2  5275000.0*2    cleanJun1504
         QB     89 ALA  HN      7.50  # m w 3   606000.0*2    cleanJun1716
 88 ALA  
         HN     88 ALA  HA      3.60  #     2 13850000.0      cleanJun 161
         HN     88 ALA  QB      3.40  #   s 2M34220000.0      cleanJun 638
         HN     89 ALA  HN      3.40  #     2 20540000.0      cleanJun 787
         HN     90 GLY  HN      6.10  #     3  1347000.0      cleanJun 786
         HN     91 ASP- HN      6.50  #   w 3   608300.0      cleanJun1162
         HA     89 ALA  HN      3.90  #     2  9484000.0      cleanJun 646
 89 ALA  
         HN     89 ALA  HA      3.90  #     2  8569000.0      cleanJun 643
         HN     89 ALA  QB      3.40  #   s 2M41600000.0      cleanJun 642
         HN     90 GLY  HN      3.60  #     2 14000000.0      cleanJun 649
         HN     91 ASP- HN      6.20  #     3  1244000.0      cleanJun 788
         HN    106 LEU  QD1     7.50  #   w 5M  534500.0      cleanJun1546
         HA     90 GLY  HN      3.80  #     2 10660000.0      cleanJun 647
         QB     90 GLY  HN      4.30  #     2M 2422000.0      cleanJun 892
 90 GLY  
         HN     90 GLY  HA1     4.10 >#     2  6256000.0      cleanJun 166
         HN     90 GLY  HA2     3.50 <#     2 18050000.0      cleanJun 165
         HN     91 ASP- HN      3.70  #     2 13180000.0      cleanJun 652
         HN     91 ASP- HB2     5.80  #     2   759200.0      cleanJun1164
         HN     91 ASP- HB3     6.20  #     2   528500.0      cleanJun1163
         HN     92 LYS+ HN      5.90  #     3  1594000.0      cleanJun1557
         HN     98 ILE  QD1     6.70  #     5M 1438000.0      cleanJun1936
         HN    106 LEU  QD1     5.60  #     5M 2973000.0      cleanJun1390
         HA1    91 ASP- HN      4.60  #     2  3311000.0      cleanJun 650
         HA2    91 ASP- HN      4.40  #     2  4501000.0      cleanJun 651
 91 ASP- 
         HN     91 ASP- HA      4.20  #     2  5439000.0      cleanJun1719
         HN     91 ASP- HB2     3.80 <#     2 10200000.0      cleanJun 653
         HN     91 ASP- HB3     5.30 >#     2  1438000.0      cleanJun 654
         HN     92 LYS+ HN      6.50  #     2   401900.0      cleanJun 927
         HN     92 LYS+ HA      5.80  #     2   774100.0      cleanJun1897
         HN     92 LYS+ QB      7.50  # m w 2   164550.0*2    cleanJun1718
         HN     93 ASP- HN      6.40  #     3  1001000.0      cleanJun 928
         HN     94 GLY  HN      6.50  #   w 3   155000.0      cleanJun1720
         HN     98 ILE  HG13    6.50  #     5   815100.0      cleanJun1508
         HN     98 ILE  QD1     7.50  #   w 5M  754100.0      cleanJun1934
         HN    106 LEU  QD1     7.50  #   w 5M  499200.0      cleanJun1898
         HA     92 LYS+ HN      3.70  #     2 11260000.0      cleanJun 661
         HA     93 ASP- HN      5.70  #     3  1960000.0      cleanJun1253
         HA     99 GLY  HN      4.00  #     4  2826000.0      cleanJun1937
         HB3    92 LYS+ HN      5.40  #     2  1250000.0      cleanJun1256
         HB3    93 ASP- HN      6.50  #   w 3   226800.0      cleanJun1257
         HB3    94 GLY  HN      6.50  #   w 3   220200.0      cleanJun1258
         QB     96 GLY  HN      7.50  # m w 5   214450.0*2    cleanJun1900
         QB     97 LYS+ HN      7.50  # m w 5   124450.0*2    cleanJun1901
 92 LYS+ 
         HN     92 LYS+ HA      4.10  #     2  6326000.0      cleanJun 655
         HN     92 LYS+ QB      4.70  # i   2  6840000.0*2    cleanJun 656
         HN     92 LYS+ QG      5.30  # m   1  3002500.0*2    cleanJun 657
         HN     92 LYS+ QD      5.80  # m   1  1626500.0*2    cleanJun 658
         HN     92 LYS+ QE      6.60  # m   1   670500.0*2    cleanJun 659
         HN     93 ASP- HN      4.10  #     2  6741000.0      cleanJun 791
         HN     94 GLY  HN      5.10  #     3  3692000.0      cleanJun1903
         HN     95 ASP- HN      6.50  #   w 3   139700.0      cleanJun1721
         HN    102 GLU- QB      7.50  # m w 5   560500.0*2    cleanJun1906
         HN    102 GLU- QG      7.50  # m   5   835000.0*2    cleanJun1905
         HA     93 ASP- HN      4.40  #     2  4437000.0      cleanJun 662
         HA     94 GLY  HN      6.30  #     3  1060000.0      cleanJun1254
         QB     93 ASP- HN      5.40  # m   2  4323500.0*2    cleanJun 893
         QB     94 GLY  HN      7.50  # m w 3   296250.0*2    cleanJun1260
         QB     95 ASP- HN      7.50  # m w 3   206800.0*2    cleanJun1261
         QG     93 ASP- HN      7.50  # m w 5   599500.0*2    cleanJun 895
         QD     93 ASP- HN      7.50  # m w 5   504000.0*2    cleanJun 894
 93 ASP- 
         HN     93 ASP- HA      4.00  #     2  7418000.0      cleanJun 170
         HN     93 ASP- QB      5.80  # i   2  1578000.0*2    cleanJun 664
         HN     94 GLY  HN      3.60  #     2 13780000.0      cleanJun 666
         HN     94 GLY  HA2     5.30  #     2  1413000.0      cleanJun1165
         HN     95 ASP- HN      4.10  #     3 13840000.0      cleanJun1724
         HN     95 ASP- HB2     6.50  #   w 3   148700.0      cleanJun1166
         HN    102 GLU- QB      7.50  # m w 5   321450.0*2    cleanJun1908
         HN    102 GLU- QG      7.50  # m w 5    51300.0*2    cleanJun1909
         HA     94 GLY  HN      4.50  #     2  3712000.0      cleanJun 665
         QB     94 GLY  HN      7.50  # m w 2   115250.0*2    cleanJun1262
 94 GLY  
         HN     94 GLY  HA1     3.70  #     2 11430000.0      cleanJun 172
         HN     94 GLY  HA2     3.60  #     2 14790000.0      cleanJun 173
         HN     95 ASP- HN      3.80  #     2 10350000.0      cleanJun 668
         HN     95 ASP- HB2     6.50  #   w 2   212300.0      cleanJun1167
         HN     96 GLY  HN      6.50  #     3   860400.0      cleanJun 811
         HA1    95 ASP- HN      5.20  #     2  1556000.0      cleanJun1911
         HA1    96 GLY  HN      6.50  #   w 3   471500.0      cleanJun1912
         HA2    95 ASP- HN      4.70  #     2  2719000.0      cleanJun 669
 95 ASP- 
         HN     95 ASP- HA      3.90  #     2  8660000.0      cleanJun 179
         HN     95 ASP- HB2     4.30  #     2  5080000.0      cleanJun 670
         HN     95 ASP- HB3     3.90  #     2  8788000.0      cleanJun 896
         HN     96 GLY  HN      3.60  #     2 13720000.0      cleanJun 671
         HN     96 GLY  HA2     5.00  #     2  1926000.0      cleanJun1913
         HN     97 LYS+ HN      6.50  #     3   904200.0      cleanJun 792
         HA     96 GLY  HN      5.10  #     2  1670000.0      cleanJun 678
         HA     97 LYS+ HN      6.50  #   w 3   409500.0      cleanJun1263
         HB2    96 GLY  HN      6.30  #     2   499200.0      cleanJun 898
         HB2    97 LYS+ HN      6.50  #   w 3   412100.0      cleanJun1265
         HB3    96 GLY  HN      6.30  #     2   469200.0      cleanJun 897
         HB3    97 LYS+ HN      6.50  #   w 3   271900.0      cleanJun1266
 96 GLY  
         HN     96 GLY  HA1     3.70  #     2 12910000.0      cleanJun 175
         HN     96 GLY  HA2     3.90  #     2  9466000.0      cleanJun 177
         HN     97 LYS+ HN      3.70  #     2 12450000.0      cleanJun 677
         HN     97 LYS+ HG2     6.50  #   w 5   110600.0      cleanJun1914
         HA1    97 LYS+ HN      4.60  #     2  3425000.0      cleanJun 674
         HA2    97 LYS+ HN      4.40  #     2  4533000.0      cleanJun 675
 97 LYS+ 
         HN     97 LYS+ HA      4.10  #     2  6784000.0      cleanJun 181
         HN     97 LYS+ HB2     5.20  #     2  1621000.0      cleanJun 833
         HN     97 LYS+ HB3     4.70  #     2  2735000.0      cleanJun 832
         HN     97 LYS+ HG2     4.70  #     1  1777000.0      cleanJun 835
         HN     97 LYS+ HG3     4.20  #     1  3531000.0      cleanJun 834
         HN     97 LYS+ HD2     4.80  #     1  1658000.0      cleanJun 837
         HN     97 LYS+ HD3     4.40  #     1  2853000.0      cleanJun 836
         HN     97 LYS+ QE      6.50  # m   1   737000.0*2    cleanJun 838
         HN     98 ILE  HN      5.00  #     2  1878000.0      cleanJun 681
         HB2    98 ILE  HN      4.40  #     2  4241000.0      cleanJun1915
         HB3    98 ILE  HN      4.20  #     2  5512000.0      cleanJun 899
         HG3    98 ILE  HN      6.50  #   w 5   237600.0      cleanJun1916
 98 ILE  
         HN     98 ILE  HA      4.50  #     2  3810000.0      cleanJun 183
         HN     98 ILE  HB      3.70  #     2 11930000.0      cleanJun 683
         HN     98 ILE  QG2     4.80  #     1M 1648000.0      cleanJun 684
         HN     98 ILE  HG12    4.60  #     1  2103000.0      cleanJun 686
         HN     98 ILE  HG13    4.40  #     1  2587000.0      cleanJun 685
         HN     98 ILE  QD1     6.40  #     1M  276500.0      cleanJun 687
         HN     99 GLY  HN      6.50  #   w 2   258200.0      cleanJun1763
         HA     99 GLY  HN      3.90  #     2  9546000.0      cleanJun 688
         HB     99 GLY  HN      6.50  #   w 2   267600.0      cleanJun1517
         QG2    99 GLY  HN      5.40  #     5M 3401000.0      cleanJun1033
         QG2   100 VAL  HN      7.20  #     5M 1092000.0      cleanJun1726
         QG2   102 GLU- HN      7.50  #   w 5M  446200.0      cleanJun1727
         HG12   99 GLY  HN      6.50  #   w 5   537700.0      cleanJun1515
         QD1    99 GLY  HN      7.50  #   w 5M  380600.0      cleanJun1032
 99 GLY  
         HN     99 GLY  HA1     3.90  #     2  9061000.0      cleanJun 268
         HN     99 GLY  HA2     3.90  #     2  8273000.0      cleanJun 263
         HN    100 VAL  HN      5.50  #     2  1084000.0      cleanJun 794
         HN    101 ASP- HN      6.50  #   w 3   326600.0      cleanJun1729
         HN    102 GLU- HN      6.10  #     3  1318000.0      cleanJun 795
         HN    102 GLU- QB      5.90  # m   3  5010000.0*2    cleanJun1392
         HN    102 GLU- QG      7.40  # m   5   921000.0*2    cleanJun1513
         HN    103 PHE  HN      6.50  #   w 3   175500.0      cleanJun1524
         HA1   100 VAL  HN      4.20  #     2  5702000.0      cleanJun 689
         HA1   101 ASP- HN      5.20  #     3  3391000.0      cleanJun 903
         HA2   101 ASP- HN      4.90  #     3  5102000.0      cleanJun 904
100 VAL  
         HN    100 VAL  HA      4.10  #     2  6456000.0      cleanJun 266
         HN    100 VAL  HB      4.50  #     2  3938000.0      cleanJun 691
         HN    100 VAL  QG1     4.90 >#     1M 1540000.0      cleanJun 693
         HN    100 VAL  QG2     3.60 <#     1M 9056000.0      cleanJun 692
         HN    101 ASP- HN      4.00  #     2  8073000.0      cleanJun 699
         HN    102 GLU- HN      5.00  #     3  4328000.0      cleanJun1731
         HN    103 PHE  QD      8.50  # r w 5    77300.0*2    cleanJun1771
         HN    103 PHE  QE      8.50  # r w 5   205450.0*2    cleanJun1751
         HA    101 ASP- HN      4.90  #     2  2322000.0      cleanJun 695
         HA    102 GLU- HN      5.70  #     3  2022000.0      cleanJun1730
         HA    103 PHE  HN      5.00  #     3  4268000.0      cleanJun1303
         HA    104 SER  HN      6.30  #     3  1068000.0      cleanJun1307
         HB    101 ASP- HN      4.40  #     2  4427000.0      cleanJun 900
         HB    102 GLU- HN      6.50  #     3   879300.0      cleanJun1302
         QG1   101 ASP- HN      5.70 >#     5M 2850000.0      cleanJun 902
         QG1   104 SER  HN      7.50  #   w 5M  328600.0      cleanJun1308
         QG2   101 ASP- HN      3.50 <#     5M18910000.0      cleanJun 901
         QG2   102 GLU- HN      7.50  #   w 5M  827700.0      cleanJun1301
101 ASP- 
         HN    101 ASP- HA      3.90  #     2  9320000.0      cleanJun 185
         HN    101 ASP- HB2     4.30 >#     2  4811000.0      cleanJun 696
         HN    101 ASP- HB3     3.70 <#     2 12900000.0      cleanJun 697
         HN    102 GLU- HN      3.50  #     2 15720000.0      cleanJun 704
         HN    102 GLU- QB      7.00  # m   2   646500.0*2    cleanJun1921
         HN    103 PHE  HN      5.90  #     3  1675000.0      cleanJun 796
         HN    104 SER  HN      4.80  #     3  5568000.0      cleanJun1732
         HA    102 GLU- HN      4.90  #     2  2122000.0      cleanJun 700
         HB2   102 GLU- HN      4.70  #     2  2742000.0      cleanJun1923
         HB3   102 GLU- HN      4.30  #     2  5068000.0      cleanJun1924
         HB3   103 PHE  HN      6.50  #   w 3   740900.0      cleanJun1922
102 GLU- 
         HN    102 GLU- HA      4.00  #     2  7308000.0      cleanJun 189
         HN    102 GLU- QB      4.40  # i   2  9720000.0*2    cleanJun 703
         HN    102 GLU- QG      5.40  # m   1  2809500.0*2    cleanJun 702
         HN    103 PHE  HN      3.90  #     2  8925000.0      cleanJun 761
         HN    103 PHE  QB      7.50  # m w 2   150450.0*2    cleanJun1925
         HN    104 SER  HN      6.50  #   w 3   798300.0      cleanJun 909
         HN    105 THR  HN      5.60  #     3  2104000.0      cleanJun1733
         HA    103 PHE  HN      4.60  #     2  3403000.0      cleanJun 759
         HA    104 SER  HN      4.80  #     3  5445000.0      cleanJun1737
         HA    105 THR  HN      4.40  #     3  9425000.0      cleanJun1926
         QB    103 PHE  HN      5.20  # m   2  5685000.0*2    cleanJun 906
103 PHE  
         HN    103 PHE  HA      4.10  #     2  6520000.0      cleanJun 758
         HN    103 PHE  QB      4.30  # i   2 12960000.0*2    cleanJun 757
         HN    103 PHE  QD      8.50  # r w 1   162650.0*2    cleanJun1748
         HN    103 PHE  QE      7.50  # m w 1    89500.0*2    cleanJun1749
         HN    104 SER  HN      3.80  #     2  9588000.0      cleanJun 762
         HN    106 LEU  QB      7.50  # m w 3   210050.0*2    cleanJun1521
         HA    104 SER  HN      3.60  #     2 13550000.0      cleanJun 706
         QB    104 SER  HN      5.00  # m   2  7090000.0*2    cleanJun 908
         QB    105 THR  HN      7.50  # m w 3   274600.0*2    cleanJun1739
         QD    104 SER  HN      8.50  # r w 5    51150.0*2    cleanJun1753
         QE    104 SER  HN      8.50  # r w 5    33785.0*2    cleanJun1754
         QE    106 LEU  HN      8.50  # r w 5   534000.0*2    cleanJun1808
104 SER  
         HN    104 SER  HA      3.60  #     2 15210000.0      cleanJun 226
         HN    104 SER  QB      5.90  # i   2  1400500.0*2    cleanJun 839
         HN    105 THR  HN      3.60  #     2 14380000.0      cleanJun 709
         HN    105 THR  QG2     6.40  #     5M 1734000.0      cleanJun1738
         HN    106 LEU  HN      5.60  #     3  2305000.0      cleanJun1927
         HN    107 VAL  HN      5.70  #     3  1973000.0      cleanJun 813
         HA    105 THR  HN      3.60  #     2 14700000.0    ! cleanJun 708
         QB    105 THR  HN      6.80  # m   2   836000.0*2    cleanJun1929
105 THR  
         HN    105 THR  HA      3.70  #     2 12740000.0      cleanJun 195
         HN    105 THR  HB      3.60  #     2 13740000.0      cleanJun 710
         HN    105 THR  QG2     4.40  #     1M 2975000.0      cleanJun 711
         HN    106 LEU  HN      3.80  #     2  9862000.0      cleanJun 712
         HN    106 LEU  QB      6.50  # m   2  1090500.0*2    cleanJun1311
         HN    107 VAL  HN      5.70  #     3  1969000.0      cleanJun1734
         HN    108 ALA  HN      6.50  #   w 3   704500.0      cleanJun1930
         HA    106 LEU  HN      3.80  #     2  9658000.0      cleanJun 713
         HB    106 LEU  HN      5.50  #     2  1045000.0      cleanJun 911
         HB    107 VAL  HN      5.50  #     3  2492000.0    ! cleanJun1931
         QG2   106 LEU  HN      4.80  #     5M 5757000.0    ! cleanJun 910
         QG2   108 ALA  HN      7.20  #     5M 1061000.0      cleanJun1932
106 LEU  
         HN    106 LEU  HA      5.00  #     2  2041000.0      cleanJun 197
         HN    106 LEU  QB      4.10  # i   2 16400000.0*2    cleanJun 714
         HN    106 LEU  HG      4.90  #     1  1499000.0      cleanJun 715
         HN    106 LEU  QD1     4.00  #     1M 5216000.0    ! cleanJun 716
         HN    107 VAL  HN      3.60  #     2 14950000.0      cleanJun 717
         HN    107 VAL  HA      6.10  #     2   579200.0      cleanJun1532
         HN    107 VAL  QG2     6.60  #     5M 1564000.0      cleanJun 913
         HA    107 VAL  HN      4.40  #     2  4104000.0      cleanJun 718
         HA    108 ALA  HN      4.50  #     3  8071000.0      cleanJun1535
         QD1   107 VAL  HN      6.90  #     5M 1277000.0      cleanJun1740
107 VAL  
         HN    107 VAL  HA      4.30  #     2  5049000.0      cleanJun 201
         HN    107 VAL  HB      4.20  #     2  5966000.0      cleanJun 719
         HN    107 VAL  QG1     4.10 <#     1M 4097000.0      cleanJun 720
         HN    107 VAL  QG2     5.20 >#     1M  988300.0      cleanJun 721
         HN    108 ALA  HN      3.60  #     2 15370000.0      cleanJun 725
         HN    109 GLU- HN      5.50  #     3  2426000.0      cleanJun 916
         HN    110 SER  HN      6.10  #     3  1382000.0      cleanJun 930
         HA    108 ALA  HN      4.80  #     2  2397000.0      cleanJun 723
         HA    110 SER  HN      6.50  #   w 3   445200.0      cleanJun 919
         HB    108 ALA  HN      4.00  #     2  7310000.0      cleanJun1034
         QG1   108 ALA  HN      5.90  #     5M 2353000.0      cleanJun1547
         QG2   108 ALA  HN      5.40  #     5M 3537000.0      cleanJun 912
108 ALA  
         HN    108 ALA  HA      3.70  #     2 12610000.0      cleanJun 203
         HN    108 ALA  QB      3.40  #   s 2M29190000.0      cleanJun 724
         HN    109 GLU- QG      7.50  # m w 5   159100.0*2    cleanJun1933
         HA    109 GLU- HN      3.70  #     2 11280000.0      cleanJun 726
         QB    109 GLU- HN      3.60  #     2M 6765000.0      cleanJun 915
109 GLU- 
         HN    109 GLU- HA      5.50  #     2  1116000.0      cleanJun 138
         HN    109 GLU- HB2     4.40 >#     2  3989000.0      cleanJun 728
         HN    109 GLU- HB3     3.70 <#     2 12030000.0      cleanJun 727
         HN    109 GLU- QG      5.20  # m   1  3892500.0*2    cleanJun 729
         HN    110 SER  HN      3.90  #     2  9048000.0      cleanJun 730
         HA    110 SER  HN      4.20  #     2  5498000.0      cleanJun 731
         HB2   110 SER  HN      5.80 >#     2   777300.0      cleanJun 918
         HB3   110 SER  HN      4.90 <#     2  2354000.0      cleanJun 917
         QG    110 SER  HN      7.50  # m w 5   454850.0*2    cleanJun1538
110 SER  
         HN    110 SER  HA      3.40  #     2 20800000.0      cleanJun 208
         HN    110 SER  QB      4.70  # i   2  6225000.0*2    cleanJun 732

#Parvalbumin.aco
#
   9 ALA  PHI       -70.0    -30   
  10 GLU- PHI       -70.0    -30 
  11 ASP- PHI       -70.0    -30 
  12 ILE  PHI       -70.0    -30 
  13 LYS+ PHI       -70.0    -30 
  14 LYS+ PHI       -70.0    -30    
  15 ALA  PHI       -70.0    -30 
  16 VAL  PHI       -70.0    -30   
  17 GLY  PHI       -70.0    -30 
  27 HIS+ PHI       -70.0    -30 
  28 LYS+ PHI       -70.0    -30 
  29 LYS+ PHI       -80.0    -10 
  30 PHE  PHI       -70.0    -30 
  31 PHE  PHI       -70.0    -30 
  32 GLN  PHI       -70.0    -30 
  33 MET  PHI       -70.0    -30 
  34 VAL  PHI       -70.0    -30 
  36 LEU  PHI       -70.0    -30 
  37 LYS+ PHI       -70.0    -30 
  38 LYS+ PHI       -70.0    -30 
  41 ALA  PHI       -70.0    -30 
  42 ASP- PHI       -70.0    -30 
  43 ASP- PHI       -70.0    -30 
  44 VAL  PHI       -70.0    -30 
  45 LYS+ PHI       -70.0    -30 
  46 LYS+ PHI       -70.0    -30 
  47 VAL  PHI       -70.0    -30 
  48 PHE  PHI       -70.0    -30          
  49 HIS+ PHI       -70.0    -30  
  50 MET  PHI       -70.0    -30 
  51 LEU  PHI       -70.0    -30 
  58 PHE  PHI      -155.0    -85
  59 ILE  PHI      -155.0    -85
  61 GLU- PHI       -70.0    -30 
  62 ASP- PHI       -80.0    -20 
  63 GLU- PHI       -80.0    -20 
  64 LEU  PHI       -70.0    -30 
  65 GLY  PHI       -70.0    -30 
  67 ILE  PHI       -80.0    -20 
  68 LEU  PHI       -70.0    -30 
  69 LYS+ PHI       -70.0    -30 
  70 GLY  PHI       -70.0    -30 
  71 PHE  PHI       -70.0    -30 
  80 ALA  PHI       -70.0    -30 
  81 LYS+ PHI       -70.0    -30 
  82 GLU- PHI       -70.0    -30 
  83 THR  PHI       -70.0    -30 
  84 LYS+ PHI       -70.0    -30 
  86 LEU  PHI       -70.0    -30 
  87 MET  PHI       -70.0    -30 
  88 ALA  PHI       -70.0    -30 
  89 ALA  PHI       -70.0    -30 
  90 GLY  PHI       -70.0    -30 
  98 ILE  PHI      -155.0    -85 
  99 GLY  PHI      -155.0    -85 
 100 VAL  PHI       -70.0    -30 
 102 GLU- PHI       -80.0    -20 
 103 PHE  PHI       -70.0    -30 
 104 SER  PHI       -70.0    -30 
 106 LEU  PHI       -70.0    -30 
 107 VAL  PHI       -70.0    -30
 108 ALA  PHI       -70.0    -30
 109 GLU- PHI       -70.0    -30    
   9 ALA  PSI       -60.0    -20
  10 GLU- PSI       -60.0    -20
  11 ASP- PSI       -60.0    -20
  12 ILE  PSI       -60.0    -20
  13 LYS+ PSI       -60.0    -20
  14 LYS+ PSI       -60.0    -20
  15 ALA  PSI       -60.0    -20
  16 VAL  PSI       -60.0    -20
  17 GLY  PSI       -60.0    -20
  27 HIS+ PSI       -60.0    -20
  28 LYS+ PSI       -60.0    -20
  29 LYS+ PSI       -60.0    -20
  30 PHE  PSI       -60.0    -20
  31 PHE  PSI       -60.0    -20
  32 GLN  PSI       -60.0    -20
  33 MET  PSI       -60.0    -20
  34 VAL  PSI       -60.0    -20
  36 LEU  PSI       -60.0    -20
  37 LYS+ PSI       -60.0    -20
  38 LYS+ PSI       -60.0    -20
  42 ASP- PSI       -60.0    -20
  43 ASP- PSI       -60.0    -20 
  44 VAL  PSI       -60.0    -20
  45 LYS+ PSI       -60.0    -20
  46 LYS+ PSI       -60.0    -20
  47 VAL  PSI       -60.0    -20
  48 PHE  PSI       -60.0    -20
  49 HIS+ PSI       -60.0    -20
  50 MET  PSI       -60.0    -20
  51 LEU  PSI       -60.0    -20
  58 PHE  PSI        60.0    175
  59 ILE  PSI        60.0    175
  61 GLU- PSI       -60.0    -20
  62 ASP- PSI       -60.0    -20
  63 GLU- PSI       -60.0    -20
  64 LEU  PSI       -60.0    -20
  65 GLY  PSI       -60.0    -20
  67 ILE  PSI       -60.0    -20
  68 LEU  PSI       -60.0    -20
  69 LYS+ PSI       -60.0    -20
  70 GLY  PSI       -60.0    -20
  71 PHE  PSI       -60.0    -20
  80 ALA  PSI       -60.0    -20
  81 LYS+ PSI       -60.0    -20
  82 GLU- PSI       -60.0    -20
  83 THR  PSI       -60.0    -20
  84 LYS+ PSI       -60.0    -20  
  85 MET  PSI       -60.0    -20
  86 LEU  PSI       -60.0    -20
  87 MET  PSI       -60.0    -20
  88 ALA  PSI       -60.0    -20
  89 ALA  PSI       -60.0    -20
  90 GLY  PSI       -60.0    -20
  98 ILE  PSI        50.0    185
  99 GLY  PSI        60.0    175
 100 VAL  PSI       -60.0    -20
 101 ASP- PSI       -60.0    -20
 102 GLU- PSI       -70.0    -10
 103 PHE  PSI       -60.0    -20
 104 SER  PSI       -70.0    -10
 105 THR  PSI       -60.0    -20
 106 LEU  PSI       -60.0    -20 
 107 VAL  PSI       -60.0    -20
 108 ALA  PSI       -60.0    -20
 109 GLU- PSI       -60.0    -20

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1   2.685  -2.043  14.223
    2   2H    MET   1           H2       MET   1   2.625  -3.560  13.623
    3   3H    MET   1           H3       MET   1   1.469  -2.454  13.176
    4    HA   MET   1           HA       MET   1   2.993  -2.758  11.397
    5   1HB   MET   1          2HB       MET   1   3.586  -0.476  11.011
    6   2HB   MET   1          3HB       MET   1   2.008  -0.549  11.769
    7   1HG   MET   1          2HG       MET   1   3.251  -0.091  14.001
    8   2HG   MET   1          3HG       MET   1   4.632   0.349  12.990
    9   1HE   MET   1          1HE       MET   1   4.651   2.743  14.184
   10   2HE   MET   1          2HE       MET   1   3.223   3.795  14.306
   11   3HE   MET   1          3HE       MET   1   3.259   2.244  15.174
   12    H    SER   2           H        SER   2   5.371  -1.603  10.926
   13    HA   SER   2           HA       SER   2   7.637  -1.377  11.626
   14   1HB   SER   2          2HB       SER   2   7.256  -3.905  13.239
   15   2HB   SER   2          3HB       SER   2   8.821  -3.218  12.807
   16    HG   SER   2           HG       SER   2   7.909  -2.513  14.859
   17    H    MET   3           H        MET   3   7.618  -1.397   9.437
   18    HA   MET   3           HA       MET   3   7.234  -3.748   7.888
   19   1HB   MET   3          2HB       MET   3   7.024  -0.956   7.523
   20   2HB   MET   3          3HB       MET   3   8.275  -1.440   6.384
   21   1HG   MET   3          2HG       MET   3   6.202  -1.708   5.278
   22   2HG   MET   3          3HG       MET   3   6.753  -3.338   5.677
   23   1HE   MET   3          1HE       MET   3   3.095  -3.861   5.815
   24   2HE   MET   3          2HE       MET   3   3.235  -2.189   5.226
   25   3HE   MET   3          3HE       MET   3   4.402  -3.441   4.707
   26    H    THR   4           H        THR   4   8.932  -4.846   9.044
   27    HA   THR   4           HA       THR   4  11.223  -5.494   7.370
   28    HB   THR   4           HB       THR   4  11.575  -3.662   9.758
   29    HG1  THR   4           1HG      THR   4  11.604  -3.099   7.453
   30   1HG2  THR   4          1HG       THR   4  13.643  -5.656   8.768
   31   2HG2  THR   4          2HG       THR   4  14.031  -4.186   9.693
   32   3HG2  THR   4          3HG       THR   4  13.037  -5.455  10.425
   33    H    ASP   5           H        ASP   5  10.019  -5.422  10.719
   34    HA   ASP   5           HA       ASP   5  11.064  -8.002  11.481
   35   1HB   ASP   5          2HB       ASP   5  10.828  -5.980  12.935
   36   2HB   ASP   5          3HB       ASP   5   9.079  -6.075  12.791
   37    H    LEU   6           H        LEU   6   7.754  -6.718  11.175
   38    HA   LEU   6           HA       LEU   6   6.289  -9.154  11.378
   39   1HB   LEU   6          2HB       LEU   6   5.762  -6.406  10.173
   40   2HB   LEU   6          3HB       LEU   6   4.552  -7.660  10.104
   41    HG   LEU   6           HG       LEU   6   4.291  -5.912  11.871
   42   1HD1  LEU   6          1HD1      LEU   6   4.309  -8.818  12.758
   43   2HD1  LEU   6          2HD1      LEU   6   3.466  -7.497  13.600
   44   3HD1  LEU   6          3HD1      LEU   6   2.990  -7.958  11.952
   45   1HD2  LEU   6          1HD2      LEU   6   6.630  -5.866  12.702
   46   2HD2  LEU   6          2HD2      LEU   6   5.433  -6.093  13.984
   47   3HD2  LEU   6          3HD2      LEU   6   6.390  -7.473  13.415
   48    H    LEU   7           H        LEU   7   7.372  -7.335   8.562
   49    HA   LEU   7           HA       LEU   7   6.440  -9.408   6.675
   50   1HB   LEU   7          2HB       LEU   7   7.568  -6.609   6.259
   51   2HB   LEU   7          3HB       LEU   7   7.131  -7.707   4.948
   52    HG   LEU   7           HG       LEU   7   5.436  -6.074   5.201
   53   1HD1  LEU   7          1HD1      LEU   7   4.403  -8.716   6.279
   54   2HD1  LEU   7          2HD1      LEU   7   3.480  -7.499   5.434
   55   3HD1  LEU   7          3HD1      LEU   7   4.757  -8.363   4.560
   56   1HD2  LEU   7          1HD2      LEU   7   5.823  -5.636   7.696
   57   2HD2  LEU   7          2HD2      LEU   7   4.156  -5.607   7.114
   58   3HD2  LEU   7          3HD2      LEU   7   4.731  -7.026   7.967
   59    H    ASN   8           H        ASN   8   9.169  -7.666   5.641
   60    HA   ASN   8           HA       ASN   8  11.393  -9.330   6.324
   61   1HB   ASN   8          2HB       ASN   8   9.772  -9.963   3.841
   62   2HB   ASN   8          3HB       ASN   8  11.533 -10.017   3.726
   63   1HD2  ASN   8          2HD2      ASN   8   9.879 -12.164   3.203
   64   2HD2  ASN   8          1HD2      ASN   8  10.606 -13.360   4.297
   65    H    ALA   9           H        ALA   9  12.900  -7.646   6.214
   66    HA   ALA   9           HA       ALA   9  12.579  -5.254   4.769
   67   1HB   ALA   9          1HB       ALA   9  15.137  -6.617   5.710
   68   2HB   ALA   9          2HB       ALA   9  15.005  -4.923   5.182
   69   3HB   ALA   9          3HB       ALA   9  14.129  -5.462   6.617
   70    H    GLU  10           H        GLU  10  14.263  -8.225   3.672
   71    HA   GLU  10           HA       GLU  10  15.326  -7.233   1.223
   72   1HB   GLU  10          2HB       GLU  10  14.419 -10.017   2.070
   73   2HB   GLU  10          3HB       GLU  10  15.296  -9.668   0.571
   74   1HG   GLU  10          2HG       GLU  10  17.184  -8.738   1.870
   75   2HG   GLU  10          3HG       GLU  10  16.326  -9.071   3.382
   76    H    ASP  11           H        ASP  11  12.249  -8.917   1.849
   77    HA   ASP  11           HA       ASP  11  11.203  -8.798  -0.774
   78   1HB   ASP  11          2HB       ASP  11   9.541  -8.802   1.763
   79   2HB   ASP  11          3HB       ASP  11   9.130  -9.412   0.163
   80    H    ILE  12           H        ILE  12  10.739  -6.579   2.025
   81    HA   ILE  12           HA       ILE  12   9.221  -4.570   0.668
   82    HB   ILE  12           HB       ILE  12  10.812  -4.738   3.188
   83   1HG1  ILE  12          2HG       ILE  12   8.694  -3.294   3.899
   84   2HG1  ILE  12          3HG       ILE  12   8.053  -3.763   2.330
   85   1HG2  ILE  12          1HG       ILE  12  10.187  -2.006   2.037
   86   2HG2  ILE  12          2HG       ILE  12  10.700  -2.379   3.701
   87   3HG2  ILE  12          3HG       ILE  12  11.814  -2.671   2.378
   88   1HD1  ILE  12          1HD1      ILE  12   8.979  -5.553   4.601
   89   2HD1  ILE  12          2HD1      ILE  12   7.306  -5.287   4.052
   90   3HD1  ILE  12          3HD1      ILE  12   8.447  -6.180   3.021
   91    H    LYS  13           H        LYS  13  12.790  -4.905   0.871
   92    HA   LYS  13           HA       LYS  13  13.441  -2.593  -0.597
   93   1HB   LYS  13          2HB       LYS  13  15.220  -3.623   0.470
   94   2HB   LYS  13          3HB       LYS  13  14.733  -5.233   0.006
   95   1HG   LYS  13          2HG       LYS  13  16.755  -4.773  -1.098
   96   2HG   LYS  13          3HG       LYS  13  15.480  -4.866  -2.293
   97   1HD   LYS  13          2HD       LYS  13  15.621  -2.101  -1.591
   98   2HD   LYS  13          3HD       LYS  13  17.292  -2.639  -1.586
   99   1HE   LYS  13          2HE       LYS  13  17.364  -2.516  -3.823
  100   2HE   LYS  13          3HE       LYS  13  16.130  -3.776  -3.926
  101   1HZ   LYS  13          1HZ       LYS  13  15.571  -0.877  -3.687
  102   2HZ   LYS  13          2HZ       LYS  13  15.396  -1.778  -5.056
  103   3HZ   LYS  13          3HZ       LYS  13  14.434  -2.072  -3.745
  104    H    LYS  14           H        LYS  14  12.544  -5.817  -1.868
  105    HA   LYS  14           HA       LYS  14  12.666  -4.959  -4.684
  106   1HB   LYS  14          2HB       LYS  14  11.400  -7.361  -3.301
  107   2HB   LYS  14          3HB       LYS  14  11.275  -7.059  -5.041
  108   1HG   LYS  14          2HG       LYS  14  13.744  -7.014  -5.233
  109   2HG   LYS  14          3HG       LYS  14  13.890  -7.362  -3.500
  110   1HD   LYS  14          2HD       LYS  14  12.773  -9.537  -3.813
  111   2HD   LYS  14          3HD       LYS  14  12.462  -9.156  -5.512
  112   1HE   LYS  14          2HE       LYS  14  14.352 -10.635  -5.439
  113   2HE   LYS  14          3HE       LYS  14  14.905  -9.035  -5.946
  114   1HZ   LYS  14          1HZ       LYS  14  15.157 -10.171  -3.216
  115   2HZ   LYS  14          2HZ       LYS  14  16.385  -9.974  -4.291
  116   3HZ   LYS  14          3HZ       LYS  14  15.631  -8.661  -3.642
  117    H    ALA  15           H        ALA  15  10.041  -5.159  -2.304
  118    HA   ALA  15           HA       ALA  15   7.889  -4.501  -3.984
  119   1HB   ALA  15          1HB       ALA  15   8.122  -3.552  -1.110
  120   2HB   ALA  15          2HB       ALA  15   6.735  -4.219  -1.990
  121   3HB   ALA  15          3HB       ALA  15   8.063  -5.280  -1.511
  122    H    VAL  16           H        VAL  16   9.865  -2.207  -1.973
  123    HA   VAL  16           HA       VAL  16   8.555   0.157  -2.915
  124    HB   VAL  16           HB       VAL  16  11.361  -0.216  -1.811
  125   1HG1  VAL  16          1HG       VAL  16   9.851   2.383  -2.217
  126   2HG1  VAL  16          2HG       VAL  16  11.343   2.180  -1.278
  127   3HG1  VAL  16          3HG       VAL  16  11.357   1.901  -3.021
  128   1HG2  VAL  16          1HG       VAL  16   9.520  -0.821  -0.257
  129   2HG2  VAL  16          2HG       VAL  16  10.390   0.629   0.243
  130   3HG2  VAL  16          3HG       VAL  16   8.793   0.782  -0.514
  131    H    GLY  17           H        GLY  17  11.127  -1.767  -4.348
  132   1HA   GLY  17          2HA       GLY  17  11.735  -0.088  -6.623
  133   2HA   GLY  17          3HA       GLY  17  11.940  -1.842  -6.514
  134    H    ALA  18           H        ALA  18   9.384  -2.788  -6.165
  135    HA   ALA  18           HA       ALA  18   8.216  -2.694  -8.739
  136   1HB   ALA  18          1HB       ALA  18   6.891  -3.567  -6.143
  137   2HB   ALA  18          2HB       ALA  18   6.464  -4.067  -7.786
  138   3HB   ALA  18          3HB       ALA  18   8.023  -4.558  -7.090
  139    H    PHE  19           H        PHE  19   7.707  -0.400  -6.157
  140    HA   PHE  19           HA       PHE  19   5.570   0.908  -7.825
  141   1HB   PHE  19          2HB       PHE  19   6.244   1.317  -4.907
  142   2HB   PHE  19          3HB       PHE  19   5.078   2.266  -5.831
  143    HD1  PHE  19           HD1      PHE  19   4.444   0.939  -3.202
  144    HD2  PHE  19           HD2      PHE  19   3.842  -0.255  -7.313
  145    HE1  PHE  19           HE1      PHE  19   2.401  -0.311  -2.546
  146    HE2  PHE  19           HE2      PHE  19   1.785  -1.363  -6.636
  147    HZ   PHE  19           HZ       PHE  19   1.087  -1.454  -4.235
  148    H    SER  20           H        SER  20   8.814   1.049  -7.771
  149    HA   SER  20           HA       SER  20   9.297   3.873  -7.316
  150   1HB   SER  20          2HB       SER  20  11.036   2.234  -6.916
  151   2HB   SER  20          3HB       SER  20  10.982   1.708  -8.614
  152    HG   SER  20           HG       SER  20  11.517   3.824  -9.200
  153    H    ALA  21           H        ALA  21   7.318   4.283  -8.821
  154    HA   ALA  21           HA       ALA  21   8.296   5.309 -11.416
  155   1HB   ALA  21          1HB       ALA  21   5.890   3.444 -11.142
  156   2HB   ALA  21          2HB       ALA  21   6.403   4.264 -12.637
  157   3HB   ALA  21          3HB       ALA  21   7.439   3.026 -11.906
  158    H    THR  22           H        THR  22   6.363   6.625 -12.492
  159    HA   THR  22           HA       THR  22   5.370   8.532 -10.550
  160    HB   THR  22           HB       THR  22   4.269   9.542 -12.578
  161    HG1  THR  22           1HG      THR  22   3.944   8.173 -14.136
  162   1HG2  THR  22          1HG       THR  22   7.232   8.919 -12.917
  163   2HG2  THR  22          2HG       THR  22   6.338  10.263 -13.651
  164   3HG2  THR  22          3HG       THR  22   6.556  10.206 -11.890
  165    H    ASP  23           H        ASP  23   3.505   6.790 -12.990
  166    HA   ASP  23           HA       ASP  23   1.221   6.517 -11.172
  167   1HB   ASP  23          2HB       ASP  23   0.918   6.169 -14.101
  168   2HB   ASP  23          3HB       ASP  23  -0.110   7.004 -12.935
  169    H    SER  24           H        SER  24   3.538   4.409 -12.225
  170    HA   SER  24           HA       SER  24   1.782   2.286 -13.244
  171   1HB   SER  24          2HB       SER  24   4.086   2.985 -14.160
  172   2HB   SER  24          3HB       SER  24   4.761   2.008 -12.840
  173    HG   SER  24           HG       SER  24   4.472   0.712 -14.650
  174    H    PHE  25           H        PHE  25   0.975   2.663 -10.756
  175    HA   PHE  25           HA       PHE  25   2.443   1.162  -8.772
  176   1HB   PHE  25          2HB       PHE  25   1.130   3.226  -8.440
  177   2HB   PHE  25          3HB       PHE  25  -0.353   2.306  -8.569
  178    HD1  PHE  25           HD1      PHE  25  -1.002   0.768  -6.689
  179    HD2  PHE  25           HD2      PHE  25   2.532   3.208  -6.487
  180    HE1  PHE  25           HE1      PHE  25  -1.027   0.606  -4.208
  181    HE2  PHE  25           HE2      PHE  25   2.455   3.125  -4.026
  182    HZ   PHE  25           HZ       PHE  25   0.648   1.856  -2.872
  183    H    ASP  26           H        ASP  26   2.466  -0.861 -10.099
  184    HA   ASP  26           HA       ASP  26   0.152  -2.585 -10.151
  185   1HB   ASP  26          2HB       ASP  26   2.095  -2.830 -11.653
  186   2HB   ASP  26          3HB       ASP  26   3.066  -3.404 -10.294
  187    H    HIS  27           H        HIS  27  -0.584  -2.134  -8.044
  188    HA   HIS  27           HA       HIS  27   0.518  -2.918  -5.598
  189   1HB   HIS  27          2HB       HIS  27  -2.019  -3.130  -4.951
  190   2HB   HIS  27          3HB       HIS  27  -1.354  -1.578  -5.402
  191    HD1  HIS  27           HD1      HIS  27  -2.020  -0.630  -7.937
  192    HD2  HIS  27           HD2      HIS  27  -3.877  -4.180  -6.625
  193    HE1  HIS  27           HE1      HIS  27  -4.091  -0.930  -9.366
  194    H    LYS  28           H        LYS  28  -1.151  -4.880  -7.895
  195    HA   LYS  28           HA       LYS  28  -1.493  -7.354  -6.424
  196   1HB   LYS  28          2HB       LYS  28  -1.054  -6.756  -9.384
  197   2HB   LYS  28          3HB       LYS  28  -1.562  -8.295  -8.743
  198   1HG   LYS  28          2HG       LYS  28  -3.705  -7.429  -8.085
  199   2HG   LYS  28          3HG       LYS  28  -3.192  -5.755  -8.217
  200   1HD   LYS  28          2HD       LYS  28  -3.137  -7.530 -10.655
  201   2HD   LYS  28          3HD       LYS  28  -4.650  -6.787 -10.139
  202   1HE   LYS  28          2HE       LYS  28  -2.128  -5.122 -10.511
  203   2HE   LYS  28          3HE       LYS  28  -3.096  -5.612 -11.903
  204   1HZ   LYS  28          1HZ       LYS  28  -4.114  -4.005  -9.615
  205   2HZ   LYS  28          2HZ       LYS  28  -3.834  -3.480 -11.138
  206   3HZ   LYS  28          3HZ       LYS  28  -5.031  -4.568 -10.853
  207    H    LYS  29           H        LYS  29   1.132  -6.222  -8.661
  208    HA   LYS  29           HA       LYS  29   2.810  -8.493  -8.036
  209   1HB   LYS  29          2HB       LYS  29   2.691  -7.220 -10.146
  210   2HB   LYS  29          3HB       LYS  29   3.533  -5.863  -9.374
  211   1HG   LYS  29          2HG       LYS  29   5.536  -7.132  -9.116
  212   2HG   LYS  29          3HG       LYS  29   4.722  -8.671  -9.451
  213   1HD   LYS  29          2HD       LYS  29   4.990  -6.403 -11.472
  214   2HD   LYS  29          3HD       LYS  29   6.109  -7.773 -11.357
  215   1HE   LYS  29          2HE       LYS  29   4.774  -8.989 -12.686
  216   2HE   LYS  29          3HE       LYS  29   3.552  -8.960 -11.413
  217   1HZ   LYS  29          1HZ       LYS  29   3.800  -7.018 -13.635
  218   2HZ   LYS  29          2HZ       LYS  29   2.569  -8.088 -13.388
  219   3HZ   LYS  29          3HZ       LYS  29   2.773  -6.794 -12.393
  220    H    PHE  30           H        PHE  30   2.830  -5.097  -6.816
  221    HA   PHE  30           HA       PHE  30   5.098  -5.258  -5.088
  222   1HB   PHE  30          2HB       PHE  30   3.757  -3.242  -5.431
  223   2HB   PHE  30          3HB       PHE  30   2.395  -3.951  -4.575
  224    HD1  PHE  30           HD1      PHE  30   2.703  -4.554  -2.036
  225    HD2  PHE  30           HD2      PHE  30   5.421  -2.064  -4.266
  226    HE1  PHE  30           HE1      PHE  30   3.666  -3.718   0.075
  227    HE2  PHE  30           HE2      PHE  30   6.329  -1.165  -2.136
  228    HZ   PHE  30           HZ       PHE  30   5.507  -2.061   0.031
  229    H    PHE  31           H        PHE  31   1.667  -6.152  -4.250
  230    HA   PHE  31           HA       PHE  31   2.297  -7.225  -1.704
  231   1HB   PHE  31          2HB       PHE  31  -0.030  -7.374  -3.555
  232   2HB   PHE  31          3HB       PHE  31   0.070  -8.580  -2.300
  233    HD1  PHE  31           HD1      PHE  31  -1.051  -8.175  -0.328
  234    HD2  PHE  31           HD2      PHE  31   0.422  -4.827  -2.600
  235    HE1  PHE  31           HE1      PHE  31  -2.121  -6.623   1.274
  236    HE2  PHE  31           HE2      PHE  31  -0.632  -3.270  -0.974
  237    HZ   PHE  31           HZ       PHE  31  -1.918  -4.172   0.951
  238    H    GLN  32           H        GLN  32   2.761  -8.680  -4.799
  239    HA   GLN  32           HA       GLN  32   3.202 -11.397  -3.710
  240   1HB   GLN  32          2HB       GLN  32   3.392 -10.163  -6.484
  241   2HB   GLN  32          3HB       GLN  32   3.913 -11.823  -6.138
  242   1HG   GLN  32          2HG       GLN  32   1.741 -12.480  -5.401
  243   2HG   GLN  32          3HG       GLN  32   1.169 -10.825  -5.290
  244   1HE2  GLN  32          2HE       GLN  32   0.036 -10.000  -6.989
  245   2HE2  GLN  32          1HE       GLN  32  -0.356 -11.039  -8.397
  246    H    MET  33           H        MET  33   5.255  -8.860  -5.243
  247    HA   MET  33           HA       MET  33   7.770 -10.117  -4.817
  248   1HB   MET  33          2HB       MET  33   6.965  -7.197  -5.114
  249   2HB   MET  33          3HB       MET  33   8.639  -7.752  -5.148
  250   1HG   MET  33          2HG       MET  33   6.719  -9.110  -7.017
  251   2HG   MET  33          3HG       MET  33   7.129  -7.441  -7.365
  252   1HE   MET  33          1HE       MET  33   9.814  -6.649  -7.278
  253   2HE   MET  33          2HE       MET  33  10.621  -7.409  -8.672
  254   3HE   MET  33          3HE       MET  33   8.968  -6.780  -8.838
  255    H    VAL  34           H        VAL  34   5.943  -7.919  -2.710
  256    HA   VAL  34           HA       VAL  34   7.948  -7.766  -0.598
  257    HB   VAL  34           HB       VAL  34   6.068  -6.132  -1.258
  258   1HG1  VAL  34          1HG       VAL  34   4.458  -7.693   0.684
  259   2HG1  VAL  34          2HG       VAL  34   3.985  -6.298  -0.314
  260   3HG1  VAL  34          3HG       VAL  34   4.276  -7.887  -1.061
  261   1HG2  VAL  34          1HG       VAL  34   7.565  -5.906   0.758
  262   2HG2  VAL  34          2HG       VAL  34   5.966  -5.160   0.930
  263   3HG2  VAL  34          3HG       VAL  34   6.320  -6.713   1.716
  264    H    GLY  35           H        GLY  35   5.915 -10.334  -1.549
  265   1HA   GLY  35          2HA       GLY  35   5.251 -12.267  -0.554
  266   2HA   GLY  35          3HA       GLY  35   6.261 -11.848   0.831
  267    H    LEU  36           H        LEU  36   3.890  -9.446   0.321
  268    HA   LEU  36           HA       LEU  36   2.803  -9.591   2.827
  269   1HB   LEU  36          2HB       LEU  36   2.005  -8.280   0.273
  270   2HB   LEU  36          3HB       LEU  36   0.666  -8.501   1.383
  271    HG   LEU  36           HG       LEU  36   3.265  -7.240   2.311
  272   1HD1  LEU  36          1HD1      LEU  36   0.763  -5.663   1.666
  273   2HD1  LEU  36          2HD1      LEU  36   2.401  -5.078   1.980
  274   3HD1  LEU  36          3HD1      LEU  36   2.009  -5.875   0.443
  275   1HD2  LEU  36          1HD2      LEU  36   1.773  -8.185   4.036
  276   2HD2  LEU  36          2HD2      LEU  36   1.910  -6.425   4.043
  277   3HD2  LEU  36          3HD2      LEU  36   0.440  -7.209   3.397
  278    H    LYS  37           H        LYS  37   0.926 -10.608   0.082
  279    HA   LYS  37           HA       LYS  37  -1.101 -12.164   1.341
  280   1HB   LYS  37          2HB       LYS  37   0.205 -12.563  -1.378
  281   2HB   LYS  37          3HB       LYS  37  -1.213 -13.461  -0.823
  282   1HG   LYS  37          2HG       LYS  37  -2.431 -11.309  -0.472
  283   2HG   LYS  37          3HG       LYS  37  -1.071 -10.445  -1.203
  284   1HD   LYS  37          2HD       LYS  37  -2.602 -12.695  -2.588
  285   2HD   LYS  37          3HD       LYS  37  -3.036 -10.997  -2.738
  286   1HE   LYS  37          2HE       LYS  37  -0.908 -10.435  -3.760
  287   2HE   LYS  37          3HE       LYS  37  -0.268 -12.056  -3.434
  288   1HZ   LYS  37          1HZ       LYS  37  -2.421 -11.331  -5.337
  289   2HZ   LYS  37          2HZ       LYS  37  -0.957 -11.936  -5.716
  290   3HZ   LYS  37          3HZ       LYS  37  -2.040 -12.901  -4.942
  291    H    LYS  38           H        LYS  38   2.241 -13.046   1.328
  292    HA   LYS  38           HA       LYS  38   1.691 -15.910   1.906
  293   1HB   LYS  38          2HB       LYS  38   3.675 -16.314   0.974
  294   2HB   LYS  38          3HB       LYS  38   3.725 -14.641   0.469
  295   1HG   LYS  38          2HG       LYS  38   4.869 -14.196   2.795
  296   2HG   LYS  38          3HG       LYS  38   5.088 -15.932   2.860
  297   1HD   LYS  38          2HD       LYS  38   5.992 -14.771   0.276
  298   2HD   LYS  38          3HD       LYS  38   6.744 -14.005   1.664
  299   1HE   LYS  38          2HE       LYS  38   8.176 -15.773   0.989
  300   2HE   LYS  38          3HE       LYS  38   7.450 -16.214   2.539
  301   1HZ   LYS  38          1HZ       LYS  38   6.568 -17.193  -0.114
  302   2HZ   LYS  38          2HZ       LYS  38   7.416 -18.065   0.992
  303   3HZ   LYS  38          3HZ       LYS  38   5.872 -17.602   1.320
  304    H    LYS  39           H        LYS  39   2.007 -12.947   3.545
  305    HA   LYS  39           HA       LYS  39   2.878 -14.137   6.123
  306   1HB   LYS  39          2HB       LYS  39   2.159 -11.256   5.412
  307   2HB   LYS  39          3HB       LYS  39   2.887 -11.791   6.916
  308   1HG   LYS  39          2HG       LYS  39   4.269 -12.148   4.219
  309   2HG   LYS  39          3HG       LYS  39   4.421 -10.696   5.165
  310   1HD   LYS  39          2HD       LYS  39   5.591 -11.749   6.898
  311   2HD   LYS  39          3HD       LYS  39   5.108 -13.382   6.377
  312   1HE   LYS  39          2HE       LYS  39   6.473 -13.282   4.413
  313   2HE   LYS  39          3HE       LYS  39   6.774 -11.552   4.615
  314   1HZ   LYS  39          1HZ       LYS  39   7.773 -13.627   6.487
  315   2HZ   LYS  39          2HZ       LYS  39   8.672 -12.837   5.325
  316   3HZ   LYS  39          3HZ       LYS  39   8.066 -12.003   6.569
  317    H    SER  40           H        SER  40   1.413 -13.181   8.013
  318    HA   SER  40           HA       SER  40  -1.036 -14.692   7.665
  319   1HB   SER  40          2HB       SER  40   0.329 -14.672   9.745
  320   2HB   SER  40          3HB       SER  40  -0.184 -12.998  10.048
  321    HG   SER  40           HG       SER  40  -1.430 -14.845  11.006
  322    H    ALA  41           H        ALA  41  -3.209 -13.999   8.114
  323    HA   ALA  41           HA       ALA  41  -4.119 -11.527   6.953
  324   1HB   ALA  41          1HB       ALA  41  -5.465 -13.347   9.000
  325   2HB   ALA  41          2HB       ALA  41  -6.264 -12.112   8.015
  326   3HB   ALA  41          3HB       ALA  41  -5.555 -13.543   7.224
  327    H    ASP  42           H        ASP  42  -3.391 -12.524  10.302
  328    HA   ASP  42           HA       ASP  42  -4.163  -9.976  11.440
  329   1HB   ASP  42          2HB       ASP  42  -4.272 -11.950  12.814
  330   2HB   ASP  42          3HB       ASP  42  -2.562 -12.315  12.528
  331    H    ASP  43           H        ASP  43  -1.264 -11.132   9.832
  332    HA   ASP  43           HA       ASP  43   0.500  -9.013  10.805
  333   1HB   ASP  43          2HB       ASP  43   1.227 -11.231   9.704
  334   2HB   ASP  43          3HB       ASP  43   0.774 -10.491   8.162
  335    H    VAL  44           H        VAL  44  -1.560  -9.589   7.948
  336    HA   VAL  44           HA       VAL  44  -1.268  -7.171   6.613
  337    HB   VAL  44           HB       VAL  44  -3.024  -9.457   6.532
  338   1HG1  VAL  44          1HG       VAL  44  -4.345  -6.922   5.535
  339   2HG1  VAL  44          2HG       VAL  44  -4.921  -8.600   5.409
  340   3HG1  VAL  44          3HG       VAL  44  -4.858  -7.837   6.987
  341   1HG2  VAL  44          1HG       VAL  44  -1.259  -8.914   4.928
  342   2HG2  VAL  44          2HG       VAL  44  -2.833  -9.071   4.130
  343   3HG2  VAL  44          3HG       VAL  44  -2.151  -7.456   4.416
  344    H    LYS  45           H        LYS  45  -3.152  -7.663   9.522
  345    HA   LYS  45           HA       LYS  45  -4.369  -5.011   9.591
  346   1HB   LYS  45          2HB       LYS  45  -3.737  -7.106  11.671
  347   2HB   LYS  45          3HB       LYS  45  -4.260  -5.484  12.152
  348   1HG   LYS  45          2HG       LYS  45  -6.268  -5.691  10.738
  349   2HG   LYS  45          3HG       LYS  45  -5.783  -7.328  10.257
  350   1HD   LYS  45          2HD       LYS  45  -5.995  -8.132  12.551
  351   2HD   LYS  45          3HD       LYS  45  -6.266  -6.479  13.151
  352   1HE   LYS  45          2HE       LYS  45  -8.328  -6.313  11.780
  353   2HE   LYS  45          3HE       LYS  45  -8.084  -7.969  11.206
  354   1HZ   LYS  45          1HZ       LYS  45  -8.503  -7.186  14.034
  355   2HZ   LYS  45          2HZ       LYS  45  -9.636  -7.875  13.061
  356   3HZ   LYS  45          3HZ       LYS  45  -8.295  -8.725  13.495
  357    H    LYS  46           H        LYS  46  -1.239  -6.179  10.756
  358    HA   LYS  46           HA       LYS  46  -0.417  -3.571  11.821
  359   1HB   LYS  46          2HB       LYS  46   1.098  -6.185  11.300
  360   2HB   LYS  46          3HB       LYS  46   1.863  -4.730  11.877
  361   1HG   LYS  46          2HG       LYS  46   1.503  -5.841  13.851
  362   2HG   LYS  46          3HG       LYS  46   0.110  -4.758  13.810
  363   1HD   LYS  46          2HD       LYS  46  -1.309  -6.631  12.996
  364   2HD   LYS  46          3HD       LYS  46   0.118  -7.696  12.968
  365   1HE   LYS  46          2HE       LYS  46   0.369  -7.366  15.418
  366   2HE   LYS  46          3HE       LYS  46  -1.063  -6.322  15.415
  367   1HZ   LYS  46          1HZ       LYS  46  -1.078  -9.246  14.726
  368   2HZ   LYS  46          2HZ       LYS  46  -1.682  -8.567  16.066
  369   3HZ   LYS  46          3HZ       LYS  46  -2.352  -8.339  14.593
  370    H    VAL  47           H        VAL  47  -0.108  -5.278   8.793
  371    HA   VAL  47           HA       VAL  47   1.666  -3.561   7.380
  372    HB   VAL  47           HB       VAL  47  -0.708  -5.165   6.434
  373   1HG1  VAL  47          1HG       VAL  47   1.401  -4.133   4.541
  374   2HG1  VAL  47          2HG       VAL  47  -0.025  -5.107   4.181
  375   3HG1  VAL  47          3HG       VAL  47  -0.223  -3.444   4.700
  376   1HG2  VAL  47          1HG       VAL  47   1.316  -6.352   7.525
  377   2HG2  VAL  47          2HG       VAL  47   0.809  -6.919   5.951
  378   3HG2  VAL  47          3HG       VAL  47   2.208  -5.836   6.116
  379    H    PHE  48           H        PHE  48  -1.964  -3.436   6.868
  380    HA   PHE  48           HA       PHE  48  -2.199  -1.006   5.756
  381   1HB   PHE  48          2HB       PHE  48  -4.010  -2.514   6.046
  382   2HB   PHE  48          3HB       PHE  48  -3.898  -2.450   7.808
  383    HD1  PHE  48           HD1      PHE  48  -4.822  -0.601   9.080
  384    HD2  PHE  48           HD2      PHE  48  -4.877  -0.568   4.761
  385    HE1  PHE  48           HE1      PHE  48  -6.177   1.474   9.110
  386    HE2  PHE  48           HE2      PHE  48  -6.259   1.472   4.810
  387    HZ   PHE  48           HZ       PHE  48  -6.870   2.520   6.955
  388    H    HIS  49           H        HIS  49  -2.039  -1.469   9.309
  389    HA   HIS  49           HA       HIS  49  -2.404   1.216  10.062
  390   1HB   HIS  49          2HB       HIS  49  -1.725  -1.278  11.315
  391   2HB   HIS  49          3HB       HIS  49  -0.516  -0.131  11.830
  392    HD1  HIS  49           HD1      HIS  49  -1.429   0.019  14.305
  393    HD2  HIS  49           HD2      HIS  49  -4.281   0.844  11.315
  394    HE1  HIS  49           HE1      HIS  49  -3.528   0.865  15.495
  395    H    MET  50           H        MET  50   0.511  -0.168   8.633
  396    HA   MET  50           HA       MET  50   2.269   1.947   9.586
  397   1HB   MET  50          2HB       MET  50   2.892  -0.448   8.862
  398   2HB   MET  50          3HB       MET  50   2.665   0.102   7.207
  399   1HG   MET  50          2HG       MET  50   4.973   0.196   7.744
  400   2HG   MET  50          3HG       MET  50   4.385   1.839   7.552
  401   1HE   MET  50          1HE       MET  50   3.842   3.452   9.785
  402   2HE   MET  50          2HE       MET  50   5.360   3.620  10.688
  403   3HE   MET  50          3HE       MET  50   5.379   3.633   8.911
  404    H    LEU  51           H        LEU  51   0.100   1.526   6.822
  405    HA   LEU  51           HA       LEU  51   1.146   3.822   5.261
  406   1HB   LEU  51          2HB       LEU  51  -1.298   2.035   4.964
  407   2HB   LEU  51          3HB       LEU  51  -0.754   3.232   3.822
  408    HG   LEU  51           HG       LEU  51   0.074   1.467   2.777
  409   1HD1  LEU  51          1HD1      LEU  51   2.323   1.397   4.822
  410   2HD1  LEU  51          2HD1      LEU  51   2.388   0.937   3.115
  411   3HD1  LEU  51          3HD1      LEU  51   2.174   2.632   3.556
  412   1HD2  LEU  51          1HD2      LEU  51  -0.995  -0.167   4.118
  413   2HD2  LEU  51          2HD2      LEU  51   0.640  -0.712   3.705
  414   3HD2  LEU  51          3HD2      LEU  51   0.308  -0.069   5.324
  415    H    ASP  52           H        ASP  52  -1.762   2.956   7.177
  416    HA   ASP  52           HA       ASP  52  -3.017   5.574   6.980
  417   1HB   ASP  52          2HB       ASP  52  -4.267   3.492   7.362
  418   2HB   ASP  52          3HB       ASP  52  -3.440   3.244   8.897
  419    H    LYS  53           H        LYS  53  -1.063   6.839   7.444
  420    HA   LYS  53           HA       LYS  53   0.363   6.890   9.902
  421   1HB   LYS  53          2HB       LYS  53  -0.361   9.213   8.072
  422   2HB   LYS  53          3HB       LYS  53   0.829   9.231   9.374
  423   1HG   LYS  53          2HG       LYS  53   1.759   7.078   7.982
  424   2HG   LYS  53          3HG       LYS  53   0.992   7.962   6.652
  425   1HD   LYS  53          2HD       LYS  53   3.032   9.042   8.636
  426   2HD   LYS  53          3HD       LYS  53   3.389   8.572   6.964
  427   1HE   LYS  53          2HE       LYS  53   2.125  10.376   6.054
  428   2HE   LYS  53          3HE       LYS  53   1.285  10.681   7.575
  429   1HZ   LYS  53          1HZ       LYS  53   4.176  11.140   7.185
  430   2HZ   LYS  53          2HZ       LYS  53   3.018  12.316   7.177
  431   3HZ   LYS  53          3HZ       LYS  53   3.316  11.461   8.545
  432    H    ASP  54           H        ASP  54  -2.637   8.551   9.019
  433    HA   ASP  54           HA       ASP  54  -3.174  10.095  11.307
  434   1HB   ASP  54          2HB       ASP  54  -5.125   8.422   9.669
  435   2HB   ASP  54          3HB       ASP  54  -5.597   9.691  10.792
  436    H    LYS  55           H        LYS  55  -3.292   6.602  11.054
  437    HA   LYS  55           HA       LYS  55  -4.422   4.943  12.151
  438   1HB   LYS  55          2HB       LYS  55  -3.956   6.638  14.634
  439   2HB   LYS  55          3HB       LYS  55  -4.339   4.917  14.607
  440   1HG   LYS  55          2HG       LYS  55  -1.826   6.175  13.425
  441   2HG   LYS  55          3HG       LYS  55  -1.922   5.361  14.979
  442   1HD   LYS  55          2HD       LYS  55  -2.409   3.243  13.996
  443   2HD   LYS  55          3HD       LYS  55  -2.669   3.914  12.391
  444   1HE   LYS  55          2HE       LYS  55  -0.009   3.871  13.833
  445   2HE   LYS  55          3HE       LYS  55  -0.563   2.779  12.541
  446   1HZ   LYS  55          1HZ       LYS  55  -0.161   5.701  12.241
  447   2HZ   LYS  55          2HZ       LYS  55   0.703   4.460  11.513
  448   3HZ   LYS  55          3HZ       LYS  55  -0.859   4.730  11.125
  449    H    SER  56           H        SER  56  -5.991   6.887  10.875
  450    HA   SER  56           HA       SER  56  -8.469   7.088  12.478
  451   1HB   SER  56          2HB       SER  56  -9.434   8.253  10.629
  452   2HB   SER  56          3HB       SER  56  -7.882   8.977  11.043
  453    HG   SER  56           HG       SER  56  -8.405   8.669   8.779
  454    H    GLY  57           H        GLY  57  -6.976   4.730  10.490
  455   1HA   GLY  57          2HA       GLY  57  -7.708   2.582  10.271
  456   2HA   GLY  57          3HA       GLY  57  -9.371   3.040  10.646
  457    H    PHE  58           H        PHE  58  -8.095   5.094   8.255
  458    HA   PHE  58           HA       PHE  58  -8.954   3.463   5.905
  459   1HB   PHE  58          2HB       PHE  58 -10.119   6.224   6.394
  460   2HB   PHE  58          3HB       PHE  58 -10.578   5.017   5.210
  461    HD1  PHE  58           HD1      PHE  58 -12.034   3.093   5.839
  462    HD2  PHE  58           HD2      PHE  58 -10.971   6.172   8.665
  463    HE1  PHE  58           HE1      PHE  58 -13.873   2.362   7.341
  464    HE2  PHE  58           HE2      PHE  58 -12.785   5.428  10.167
  465    HZ   PHE  58           HZ       PHE  58 -14.250   3.525   9.508
  466    H    ILE  59           H        ILE  59  -7.553   3.901   4.188
  467    HA   ILE  59           HA       ILE  59  -5.842   6.357   4.409
  468    HB   ILE  59           HB       ILE  59  -5.524   4.051   2.517
  469   1HG1  ILE  59          2HG       ILE  59  -3.661   4.494   4.859
  470   2HG1  ILE  59          3HG       ILE  59  -5.147   3.594   5.116
  471   1HG2  ILE  59          1HG       ILE  59  -3.618   6.294   3.277
  472   2HG2  ILE  59          2HG       ILE  59  -3.237   4.964   2.175
  473   3HG2  ILE  59          3HG       ILE  59  -4.466   6.142   1.727
  474   1HD1  ILE  59          1HD1      ILE  59  -2.991   2.893   3.100
  475   2HD1  ILE  59          2HD1      ILE  59  -3.441   2.008   4.583
  476   3HD1  ILE  59          3HD1      ILE  59  -4.561   2.077   3.218
  477    H    GLU  60           H        GLU  60  -6.001   7.969   3.080
  478    HA   GLU  60           HA       GLU  60  -7.652   7.933   0.625
  479   1HB   GLU  60          2HB       GLU  60  -8.770   9.988   1.281
  480   2HB   GLU  60          3HB       GLU  60  -9.150   8.694   2.389
  481   1HG   GLU  60          2HG       GLU  60  -7.107  10.872   2.983
  482   2HG   GLU  60          3HG       GLU  60  -8.808  10.955   3.421
  483    H    GLU  61           H        GLU  61  -7.406  10.187  -0.487
  484    HA   GLU  61           HA       GLU  61  -5.012  10.034  -1.719
  485   1HB   GLU  61          2HB       GLU  61  -6.727  12.513  -1.660
  486   2HB   GLU  61          3HB       GLU  61  -5.443  12.143  -2.815
  487   1HG   GLU  61          2HG       GLU  61  -6.933   9.842  -2.992
  488   2HG   GLU  61          3HG       GLU  61  -8.193  11.009  -2.607
  489    H    ASP  62           H        ASP  62  -5.485  12.149   1.064
  490    HA   ASP  62           HA       ASP  62  -3.144  13.747   0.840
  491   1HB   ASP  62          2HB       ASP  62  -5.092  14.110   2.384
  492   2HB   ASP  62          3HB       ASP  62  -4.513  12.777   3.384
  493    H    GLU  63           H        GLU  63  -3.594  10.593   2.481
  494    HA   GLU  63           HA       GLU  63  -0.730  10.295   3.221
  495   1HB   GLU  63          2HB       GLU  63  -3.195   8.541   3.360
  496   2HB   GLU  63          3HB       GLU  63  -1.574   7.931   3.742
  497   1HG   GLU  63          2HG       GLU  63  -1.299   9.548   5.528
  498   2HG   GLU  63          3HG       GLU  63  -2.838  10.326   5.131
  499    H    LEU  64           H        LEU  64  -3.112   9.040   0.881
  500    HA   LEU  64           HA       LEU  64  -1.531   7.021  -0.223
  501   1HB   LEU  64          2HB       LEU  64  -4.083   7.460  -0.153
  502   2HB   LEU  64          3HB       LEU  64  -3.789   8.463  -1.568
  503    HG   LEU  64           HG       LEU  64  -2.456   6.014  -2.049
  504   1HD1  LEU  64          1HD1      LEU  64  -5.296   5.560  -1.011
  505   2HD1  LEU  64          2HD1      LEU  64  -4.307   4.369  -1.881
  506   3HD1  LEU  64          3HD1      LEU  64  -3.790   4.935  -0.288
  507   1HD2  LEU  64          1HD2      LEU  64  -3.462   7.394  -3.715
  508   2HD2  LEU  64          2HD2      LEU  64  -4.285   5.830  -3.823
  509   3HD2  LEU  64          3HD2      LEU  64  -5.096   7.197  -3.049
  510    H    GLY  65           H        GLY  65  -1.363  10.443  -0.956
  511   1HA   GLY  65          2HA       GLY  65   0.038  10.195  -3.472
  512   2HA   GLY  65          3HA       GLY  65   0.144  11.547  -2.347
  513    H    PHE  66           H        PHE  66   1.109   9.409  -0.199
  514    HA   PHE  66           HA       PHE  66   3.824   8.825  -1.245
  515   1HB   PHE  66          2HB       PHE  66   4.981  10.127   0.360
  516   2HB   PHE  66          3HB       PHE  66   3.908  11.166  -0.541
  517    HD1  PHE  66           HD1      PHE  66   1.729  12.008   0.576
  518    HD2  PHE  66           HD2      PHE  66   4.843   9.957   2.731
  519    HE1  PHE  66           HE1      PHE  66   0.918  12.991   2.693
  520    HE2  PHE  66           HE2      PHE  66   4.051  10.948   4.839
  521    HZ   PHE  66           HZ       PHE  66   2.050  12.493   4.822
  522    H    ILE  67           H        ILE  67   1.600   7.226  -0.301
  523    HA   ILE  67           HA       ILE  67   1.651   6.009   2.215
  524    HB   ILE  67           HB       ILE  67  -0.103   5.742   0.778
  525   1HG1  ILE  67          2HG       ILE  67   0.465   3.749   2.083
  526   2HG1  ILE  67          3HG       ILE  67  -0.644   3.511   0.743
  527   1HG2  ILE  67          1HG       ILE  67   1.726   4.663  -1.369
  528   2HG2  ILE  67          2HG       ILE  67  -0.044   4.500  -1.393
  529   3HG2  ILE  67          3HG       ILE  67   0.678   6.096  -1.418
  530   1HD1  ILE  67          1HD1      ILE  67   2.252   2.641   0.916
  531   2HD1  ILE  67          2HD1      ILE  67   0.809   1.626   0.762
  532   3HD1  ILE  67          3HD1      ILE  67   1.333   2.594  -0.602
  533    H    LEU  68           H        LEU  68   3.830   5.415  -0.492
  534    HA   LEU  68           HA       LEU  68   5.215   3.169   0.449
  535   1HB   LEU  68          2HB       LEU  68   5.955   5.572  -1.217
  536   2HB   LEU  68          3HB       LEU  68   7.196   4.393  -0.774
  537    HG   LEU  68           HG       LEU  68   4.645   3.383  -1.990
  538   1HD1  LEU  68          1HD1      LEU  68   7.040   4.443  -3.566
  539   2HD1  LEU  68          2HD1      LEU  68   5.581   3.679  -4.221
  540   3HD1  LEU  68          3HD1      LEU  68   5.472   5.257  -3.436
  541   1HD2  LEU  68          1HD2      LEU  68   6.433   1.836  -1.027
  542   2HD2  LEU  68          2HD2      LEU  68   6.345   1.643  -2.782
  543   3HD2  LEU  68          3HD2      LEU  68   7.626   2.599  -2.084
  544    H    LYS  69           H        LYS  69   5.466   6.468   1.803
  545    HA   LYS  69           HA       LYS  69   7.969   5.976   3.167
  546   1HB   LYS  69          2HB       LYS  69   5.824   8.042   3.345
  547   2HB   LYS  69          3HB       LYS  69   6.657   7.715   4.858
  548   1HG   LYS  69          2HG       LYS  69   8.863   7.961   3.627
  549   2HG   LYS  69          3HG       LYS  69   7.940   8.586   2.246
  550   1HD   LYS  69          2HD       LYS  69   7.146  10.471   3.567
  551   2HD   LYS  69          3HD       LYS  69   7.826   9.769   5.056
  552   1HE   LYS  69          2HE       LYS  69  10.105   9.900   4.067
  553   2HE   LYS  69          3HE       LYS  69   9.430  10.667   2.622
  554   1HZ   LYS  69          1HZ       LYS  69   9.299  11.774   5.369
  555   2HZ   LYS  69          2HZ       LYS  69  10.305  12.297   4.181
  556   3HZ   LYS  69          3HZ       LYS  69   8.682  12.496   4.023
  557    H    GLY  70           H        GLY  70   4.817   4.686   3.816
  558   1HA   GLY  70          2HA       GLY  70   5.604   3.785   6.524
  559   2HA   GLY  70          3HA       GLY  70   4.141   3.324   5.624
  560    H    PHE  71           H        PHE  71   5.641   2.523   3.189
  561    HA   PHE  71           HA       PHE  71   6.393  -0.142   4.054
  562   1HB   PHE  71          2HB       PHE  71   6.594   1.196   1.351
  563   2HB   PHE  71          3HB       PHE  71   7.068  -0.464   1.674
  564    HD1  PHE  71           HD1      PHE  71   5.016  -1.652   3.315
  565    HD2  PHE  71           HD2      PHE  71   4.594   1.132   0.051
  566    HE1  PHE  71           HE1      PHE  71   2.742  -2.526   2.850
  567    HE2  PHE  71           HE2      PHE  71   2.358   0.226  -0.420
  568    HZ   PHE  71           HZ       PHE  71   1.411  -1.592   0.976
  569    H    SER  72           H        SER  72   8.310   2.793   3.063
  570    HA   SER  72           HA       SER  72  10.360   2.268   4.921
  571   1HB   SER  72          2HB       SER  72  10.638   0.983   2.245
  572   2HB   SER  72          3HB       SER  72  12.102   1.736   2.892
  573    HG   SER  72           HG       SER  72  10.388  -0.099   4.196
  574    HA   PRO  73           HA       PRO  73  11.772   6.250   3.282
  575   1HB   PRO  73          2HB       PRO  73  14.521   6.120   3.344
  576   2HB   PRO  73          3HB       PRO  73  13.507   6.310   4.806
  577   1HG   PRO  73          2HG       PRO  73  14.646   3.739   3.659
  578   2HG   PRO  73          3HG       PRO  73  14.755   4.337   5.349
  579   1HD   PRO  73          2HD       PRO  73  12.878   2.552   4.648
  580   2HD   PRO  73          3HD       PRO  73  12.456   3.887   5.745
  581    H    ASP  74           H        ASP  74  12.959   7.173   1.498
  582    HA   ASP  74           HA       ASP  74  13.561   7.484  -0.644
  583   1HB   ASP  74          2HB       ASP  74  15.168   5.528  -0.163
  584   2HB   ASP  74          3HB       ASP  74  14.058   4.550  -1.136
  585    H    ALA  75           H        ALA  75  10.941   6.073   0.340
  586    HA   ALA  75           HA       ALA  75   9.224   5.105  -1.424
  587   1HB   ALA  75          1HB       ALA  75   9.023   7.315   0.655
  588   2HB   ALA  75          2HB       ALA  75   7.584   6.643  -0.105
  589   3HB   ALA  75          3HB       ALA  75   8.686   5.580   0.816
  590    H    ARG  76           H        ARG  76   9.522   8.612  -1.163
  591    HA   ARG  76           HA       ARG  76   9.155  10.398  -2.505
  592   1HB   ARG  76          2HB       ARG  76   8.836   8.641  -4.957
  593   2HB   ARG  76          3HB       ARG  76   9.286  10.347  -4.858
  594   1HG   ARG  76          2HG       ARG  76  11.277   9.453  -3.394
  595   2HG   ARG  76          3HG       ARG  76  10.888   7.910  -4.180
  596   1HD   ARG  76          2HD       ARG  76  11.538   8.675  -6.315
  597   2HD   ARG  76          3HD       ARG  76  11.333  10.374  -5.866
  598    HE   ARG  76           HE       ARG  76  13.480  10.456  -5.128
  599   1HH1  ARG  76          1HH2      ARG  76  12.649   7.034  -5.003
  600   2HH1  ARG  76          2HH2      ARG  76  14.173   6.593  -4.283
  601   1HH2  ARG  76          1HH1      ARG  76  15.350   9.830  -4.039
  602   2HH2  ARG  76          2HH1      ARG  76  15.440   8.169  -3.493
  603    H    ASP  77           H        ASP  77   7.702  11.444  -4.051
  604    HA   ASP  77           HA       ASP  77   4.916  11.221  -3.322
  605   1HB   ASP  77          2HB       ASP  77   4.834  13.296  -4.741
  606   2HB   ASP  77          3HB       ASP  77   5.857  13.380  -3.315
  607    H    LEU  78           H        LEU  78   3.750   9.805  -4.280
  608    HA   LEU  78           HA       LEU  78   4.013   8.698  -6.945
  609   1HB   LEU  78          2HB       LEU  78   1.606   8.872  -5.075
  610   2HB   LEU  78          3HB       LEU  78   1.707   7.840  -6.492
  611    HG   LEU  78           HG       LEU  78   3.603   7.642  -4.088
  612   1HD1  LEU  78          1HD1      LEU  78   1.035   6.197  -4.527
  613   2HD1  LEU  78          2HD1      LEU  78   2.354   5.592  -3.501
  614   3HD1  LEU  78          3HD1      LEU  78   1.605   7.166  -3.173
  615   1HD2  LEU  78          1HD2      LEU  78   4.732   6.674  -5.926
  616   2HD2  LEU  78          2HD2      LEU  78   3.940   5.289  -5.151
  617   3HD2  LEU  78          3HD2      LEU  78   3.247   5.995  -6.608
  618    H    SER  79           H        SER  79   2.635   9.029  -8.777
  619    HA   SER  79           HA       SER  79   2.165  11.788  -9.430
  620   1HB   SER  79          2HB       SER  79   2.720  10.239 -11.159
  621   2HB   SER  79          3HB       SER  79   1.385   9.168 -10.727
  622    HG   SER  79           HG       SER  79   0.833  10.186 -12.543
  623    H    ALA  80           H        ALA  80   0.336  12.917  -9.854
  624    HA   ALA  80           HA       ALA  80  -2.003  12.701  -8.283
  625   1HB   ALA  80          1HB       ALA  80  -1.555  14.022 -10.991
  626   2HB   ALA  80          2HB       ALA  80  -2.898  14.367  -9.875
  627   3HB   ALA  80          3HB       ALA  80  -1.232  14.759  -9.399
  628    H    LYS  81           H        LYS  81  -1.229  11.269 -11.470
  629    HA   LYS  81           HA       LYS  81  -3.999  10.382 -11.966
  630   1HB   LYS  81          2HB       LYS  81  -1.640   9.030 -13.265
  631   2HB   LYS  81          3HB       LYS  81  -3.250   9.340 -13.875
  632   1HG   LYS  81          2HG       LYS  81  -2.514  11.873 -13.856
  633   2HG   LYS  81          3HG       LYS  81  -0.883  11.208 -13.651
  634   1HD   LYS  81          2HD       LYS  81  -1.115  11.663 -15.925
  635   2HD   LYS  81          3HD       LYS  81  -1.189   9.911 -15.792
  636   1HE   LYS  81          2HE       LYS  81  -3.723  11.607 -15.838
  637   2HE   LYS  81          3HE       LYS  81  -2.856  11.281 -17.340
  638   1HZ   LYS  81          1HZ       LYS  81  -3.917   9.189 -15.544
  639   2HZ   LYS  81          2HZ       LYS  81  -4.584   9.649 -16.974
  640   3HZ   LYS  81          3HZ       LYS  81  -3.109   8.923 -16.945
  641    H    GLU  82           H        GLU  82  -1.226   9.161 -10.215
  642    HA   GLU  82           HA       GLU  82  -1.962   6.392 -10.225
  643   1HB   GLU  82          2HB       GLU  82   0.307   7.639  -9.786
  644   2HB   GLU  82          3HB       GLU  82  -0.232   7.778  -8.138
  645   1HG   GLU  82          2HG       GLU  82  -0.418   5.060  -9.446
  646   2HG   GLU  82          3HG       GLU  82   1.175   5.691  -9.034
  647    H    THR  83           H        THR  83  -2.009   8.901  -7.657
  648    HA   THR  83           HA       THR  83  -3.442   7.458  -5.796
  649    HB   THR  83           HB       THR  83  -2.395   9.425  -5.078
  650    HG1  THR  83           1HG      THR  83  -5.154  10.180  -4.863
  651   1HG2  THR  83          1HG       THR  83  -4.260  11.089  -6.817
  652   2HG2  THR  83          2HG       THR  83  -3.152  11.713  -5.580
  653   3HG2  THR  83          3HG       THR  83  -2.503  10.891  -7.002
  654    H    LYS  84           H        LYS  84  -4.918   9.493  -8.281
  655    HA   LYS  84           HA       LYS  84  -7.650   9.090  -7.716
  656   1HB   LYS  84          2HB       LYS  84  -6.170   9.365 -10.364
  657   2HB   LYS  84          3HB       LYS  84  -7.933   9.356 -10.244
  658   1HG   LYS  84          2HG       LYS  84  -7.968  11.391  -8.959
  659   2HG   LYS  84          3HG       LYS  84  -6.229  11.335  -8.684
  660   1HD   LYS  84          2HD       LYS  84  -6.599  12.993 -10.374
  661   2HD   LYS  84          3HD       LYS  84  -5.827  11.608 -11.130
  662   1HE   LYS  84          2HE       LYS  84  -7.500  12.306 -12.647
  663   2HE   LYS  84          3HE       LYS  84  -8.106  10.823 -11.902
  664   1HZ   LYS  84          1HZ       LYS  84  -8.867  13.582 -11.132
  665   2HZ   LYS  84          2HZ       LYS  84  -9.813  12.531 -11.974
  666   3HZ   LYS  84          3HZ       LYS  84  -9.423  12.221 -10.403
  667    H    MET  85           H        MET  85  -5.623   7.061  -9.899
  668    HA   MET  85           HA       MET  85  -7.728   5.092 -10.298
  669   1HB   MET  85          2HB       MET  85  -4.734   5.070 -10.852
  670   2HB   MET  85          3HB       MET  85  -5.791   3.685 -11.169
  671   1HG   MET  85          2HG       MET  85  -7.234   5.115 -12.602
  672   2HG   MET  85          3HG       MET  85  -6.139   6.471 -12.332
  673   1HE   MET  85          1HE       MET  85  -6.698   2.985 -13.972
  674   2HE   MET  85          2HE       MET  85  -5.188   2.697 -14.864
  675   3HE   MET  85          3HE       MET  85  -5.199   2.598 -13.093
  676    H    LEU  86           H        LEU  86  -4.868   5.168  -8.115
  677    HA   LEU  86           HA       LEU  86  -5.224   2.551  -7.076
  678   1HB   LEU  86          2HB       LEU  86  -3.143   3.675  -6.857
  679   2HB   LEU  86          3HB       LEU  86  -3.868   5.032  -5.998
  680    HG   LEU  86           HG       LEU  86  -4.346   3.565  -4.056
  681   1HD1  LEU  86          1HD1      LEU  86  -2.959   1.413  -5.685
  682   2HD1  LEU  86          2HD1      LEU  86  -3.283   1.315  -3.934
  683   3HD1  LEU  86          3HD1      LEU  86  -4.620   1.379  -5.079
  684   1HD2  LEU  86          1HD2      LEU  86  -2.229   4.827  -4.174
  685   2HD2  LEU  86          2HD2      LEU  86  -2.005   3.287  -3.321
  686   3HD2  LEU  86          3HD2      LEU  86  -1.465   3.502  -5.010
  687    H    MET  87           H        MET  87  -6.508   5.725  -5.726
  688    HA   MET  87           HA       MET  87  -7.820   4.323  -3.586
  689   1HB   MET  87          2HB       MET  87  -9.073   6.227  -3.112
  690   2HB   MET  87          3HB       MET  87  -7.466   6.778  -3.568
  691   1HG   MET  87          2HG       MET  87  -8.286   7.567  -5.712
  692   2HG   MET  87          3HG       MET  87  -9.866   6.820  -5.447
  693   1HE   MET  87          1HE       MET  87 -10.844   9.192  -6.232
  694   2HE   MET  87          2HE       MET  87 -10.504  10.711  -5.363
  695   3HE   MET  87          3HE       MET  87  -9.210   9.906  -6.268
  696    H    ALA  88           H        ALA  88  -8.972   5.119  -6.901
  697    HA   ALA  88           HA       ALA  88 -11.604   4.096  -6.539
  698   1HB   ALA  88          1HB       ALA  88  -9.924   4.365  -9.071
  699   2HB   ALA  88          2HB       ALA  88 -11.691   4.182  -8.998
  700   3HB   ALA  88          3HB       ALA  88 -10.923   5.641  -8.339
  701    H    ALA  89           H        ALA  89  -8.607   2.391  -7.486
  702    HA   ALA  89           HA       ALA  89  -9.995  -0.161  -7.886
  703   1HB   ALA  89          1HB       ALA  89  -7.036   0.516  -7.538
  704   2HB   ALA  89          2HB       ALA  89  -7.695  -1.044  -8.082
  705   3HB   ALA  89          3HB       ALA  89  -7.910   0.408  -9.082
  706    H    GLY  90           H        GLY  90  -8.087   1.332  -5.249
  707   1HA   GLY  90          2HA       GLY  90  -7.908  -1.018  -3.629
  708   2HA   GLY  90          3HA       GLY  90  -7.473   0.625  -3.192
  709    H    ASP  91           H        ASP  91 -10.175   1.735  -3.654
  710    HA   ASP  91           HA       ASP  91 -11.763   0.701  -1.414
  711   1HB   ASP  91          2HB       ASP  91 -11.770   3.079  -1.880
  712   2HB   ASP  91          3HB       ASP  91 -12.282   2.792  -3.547
  713    H    LYS  92           H        LYS  92 -12.174  -1.406  -1.950
  714    HA   LYS  92           HA       LYS  92 -13.619  -2.233  -4.411
  715   1HB   LYS  92          2HB       LYS  92 -12.615  -3.591  -1.872
  716   2HB   LYS  92          3HB       LYS  92 -13.803  -4.374  -2.886
  717   1HG   LYS  92          2HG       LYS  92 -11.612  -3.339  -4.552
  718   2HG   LYS  92          3HG       LYS  92 -10.960  -4.334  -3.247
  719   1HD   LYS  92          2HD       LYS  92 -12.269  -6.230  -3.884
  720   2HD   LYS  92          3HD       LYS  92 -13.342  -5.247  -4.900
  721   1HE   LYS  92          2HE       LYS  92 -11.423  -4.786  -6.434
  722   2HE   LYS  92          3HE       LYS  92 -10.444  -5.933  -5.501
  723   1HZ   LYS  92          1HZ       LYS  92 -13.003  -6.566  -6.871
  724   2HZ   LYS  92          2HZ       LYS  92 -11.530  -7.045  -7.400
  725   3HZ   LYS  92          3HZ       LYS  92 -12.106  -7.636  -6.000
  726    H    ASP  93           H        ASP  93 -14.285  -1.228  -1.112
  727    HA   ASP  93           HA       ASP  93 -17.006  -2.214  -1.017
  728   1HB   ASP  93          2HB       ASP  93 -15.587  -0.033   0.560
  729   2HB   ASP  93          3HB       ASP  93 -17.221  -0.590   0.915
  730    H    GLY  94           H        GLY  94 -15.710   1.019  -1.880
  731   1HA   GLY  94          2HA       GLY  94 -16.937   2.493  -3.396
  732   2HA   GLY  94          3HA       GLY  94 -18.456   1.890  -2.742
  733    H    ASP  95           H        ASP  95 -15.752   2.629  -0.623
  734    HA   ASP  95           HA       ASP  95 -17.278   4.991   0.484
  735   1HB   ASP  95          2HB       ASP  95 -16.250   4.576   2.655
  736   2HB   ASP  95          3HB       ASP  95 -17.207   3.211   2.091
  737    H    GLY  96           H        GLY  96 -14.797   4.477  -1.520
  738   1HA   GLY  96          2HA       GLY  96 -13.237   5.810  -2.404
  739   2HA   GLY  96          3HA       GLY  96 -13.752   7.130  -1.337
  740    H    LYS  97           H        LYS  97 -12.737   4.339   0.428
  741    HA   LYS  97           HA       LYS  97  -9.915   5.367   0.629
  742   1HB   LYS  97          2HB       LYS  97 -11.955   4.664   2.757
  743   2HB   LYS  97          3HB       LYS  97 -10.232   4.484   3.083
  744   1HG   LYS  97          2HG       LYS  97  -9.855   6.657   3.287
  745   2HG   LYS  97          3HG       LYS  97 -10.805   7.105   1.868
  746   1HD   LYS  97          2HD       LYS  97 -12.799   7.315   3.071
  747   2HD   LYS  97          3HD       LYS  97 -12.220   6.325   4.425
  748   1HE   LYS  97          2HE       LYS  97 -10.449   8.093   4.861
  749   2HE   LYS  97          3HE       LYS  97 -11.251   9.116   3.669
  750   1HZ   LYS  97          1HZ       LYS  97 -12.495   8.043   6.132
  751   2HZ   LYS  97          2HZ       LYS  97 -11.958   9.584   5.928
  752   3HZ   LYS  97          3HZ       LYS  97 -13.243   9.031   5.047
  753    H    ILE  98           H        ILE  98  -8.348   3.907   1.308
  754    HA   ILE  98           HA       ILE  98  -8.808   1.055   0.523
  755    HB   ILE  98           HB       ILE  98  -6.294   2.552   1.330
  756   1HG1  ILE  98          2HG       ILE  98  -7.483   1.479  -1.219
  757   2HG1  ILE  98          3HG       ILE  98  -6.924   3.105  -0.865
  758   1HG2  ILE  98          1HG       ILE  98  -6.447  -0.393   0.618
  759   2HG2  ILE  98          2HG       ILE  98  -4.972   0.522   0.961
  760   3HG2  ILE  98          3HG       ILE  98  -6.110   0.224   2.257
  761   1HD1  ILE  98          1HD1      ILE  98  -5.232   0.654  -1.455
  762   2HD1  ILE  98          2HD1      ILE  98  -5.416   2.117  -2.425
  763   3HD1  ILE  98          3HD1      ILE  98  -4.553   2.198  -0.869
  764    H    GLY  99           H        GLY  99  -9.726  -0.212   1.955
  765   1HA   GLY  99          2HA       GLY  99  -9.090   0.056   4.872
  766   2HA   GLY  99          3HA       GLY  99 -10.463  -0.826   4.176
  767    H    VAL 100           H        VAL 100  -8.217  -1.707   5.940
  768    HA   VAL 100           HA       VAL 100  -6.245  -3.167   4.784
  769    HB   VAL 100           HB       VAL 100  -6.406  -2.806   7.143
  770   1HG1  VAL 100          1HG       VAL 100  -8.491  -4.989   7.437
  771   2HG1  VAL 100          2HG       VAL 100  -7.737  -4.010   8.697
  772   3HG1  VAL 100          3HG       VAL 100  -8.839  -3.245   7.548
  773   1HG2  VAL 100          1HG       VAL 100  -5.015  -4.672   6.221
  774   2HG2  VAL 100          2HG       VAL 100  -5.517  -4.898   7.902
  775   3HG2  VAL 100          3HG       VAL 100  -6.327  -5.801   6.623
  776    H    ASP 101           H        ASP 101  -9.421  -4.656   5.492
  777    HA   ASP 101           HA       ASP 101  -8.695  -7.240   4.575
  778   1HB   ASP 101          2HB       ASP 101 -10.643  -6.320   6.112
  779   2HB   ASP 101          3HB       ASP 101 -11.551  -6.230   4.606
  780    H    GLU 102           H        GLU 102 -10.194  -4.506   2.945
  781    HA   GLU 102           HA       GLU 102 -10.621  -5.661   0.345
  782   1HB   GLU 102          2HB       GLU 102  -9.739  -2.783   0.776
  783   2HB   GLU 102          3HB       GLU 102 -10.728  -3.465  -0.492
  784   1HG   GLU 102          2HG       GLU 102 -12.571  -3.788   1.165
  785   2HG   GLU 102          3HG       GLU 102 -11.542  -3.073   2.425
  786    H    PHE 103           H        PHE 103  -7.925  -3.663   1.645
  787    HA   PHE 103           HA       PHE 103  -6.327  -3.779  -0.611
  788   1HB   PHE 103          2HB       PHE 103  -6.207  -2.388   1.603
  789   2HB   PHE 103          3HB       PHE 103  -5.196  -3.672   2.206
  790    HD1  PHE 103           HD1      PHE 103  -4.956  -2.451  -1.374
  791    HD2  PHE 103           HD2      PHE 103  -3.395  -2.133   2.646
  792    HE1  PHE 103           HE1      PHE 103  -3.070  -1.139  -2.212
  793    HE2  PHE 103           HE2      PHE 103  -1.508  -0.786   1.786
  794    HZ   PHE 103           HZ       PHE 103  -1.334  -0.284  -0.649
  795    H    SER 104           H        SER 104  -6.342  -6.025   2.091
  796    HA   SER 104           HA       SER 104  -4.222  -7.785   1.455
  797   1HB   SER 104          2HB       SER 104  -5.620  -7.706   3.522
  798   2HB   SER 104          3HB       SER 104  -6.958  -8.432   2.622
  799    HG   SER 104           HG       SER 104  -5.835 -10.062   3.649
  800    H    THR 105           H        THR 105  -7.457  -7.593  -0.034
  801    HA   THR 105           HA       THR 105  -7.044 -10.207  -1.406
  802    HB   THR 105           HB       THR 105  -9.516 -10.301  -1.348
  803    HG1  THR 105           1HG      THR 105  -9.530  -8.276   0.632
  804   1HG2  THR 105          1HG       THR 105  -8.214  -9.965   1.388
  805   2HG2  THR 105          2HG       THR 105  -9.670 -10.908   1.015
  806   3HG2  THR 105          3HG       THR 105  -8.086 -11.409   0.373
  807    H    LEU 106           H        LEU 106  -8.017  -6.911  -1.886
  808    HA   LEU 106           HA       LEU 106  -8.591  -6.590  -4.588
  809   1HB   LEU 106          2HB       LEU 106  -8.525  -4.868  -2.910
  810   2HB   LEU 106          3HB       LEU 106  -6.820  -5.123  -2.592
  811    HG   LEU 106           HG       LEU 106  -7.537  -3.034  -3.732
  812   1HD1  LEU 106          1HD1      LEU 106  -5.359  -4.611  -5.093
  813   2HD1  LEU 106          2HD1      LEU 106  -5.532  -2.842  -5.041
  814   3HD1  LEU 106          3HD1      LEU 106  -5.213  -3.743  -3.550
  815   1HD2  LEU 106          1HD2      LEU 106  -9.067  -3.912  -5.404
  816   2HD2  LEU 106          2HD2      LEU 106  -7.754  -2.999  -6.157
  817   3HD2  LEU 106          3HD2      LEU 106  -7.735  -4.764  -6.224
  818    H    VAL 107           H        VAL 107  -5.452  -7.365  -3.143
  819    HA   VAL 107           HA       VAL 107  -4.106  -7.449  -5.780
  820    HB   VAL 107           HB       VAL 107  -2.133  -8.002  -4.430
  821   1HG1  VAL 107          1HG       VAL 107  -3.630  -5.559  -3.372
  822   2HG1  VAL 107          2HG       VAL 107  -1.887  -5.753  -3.533
  823   3HG1  VAL 107          3HG       VAL 107  -2.885  -5.648  -4.982
  824   1HG2  VAL 107          1HG       VAL 107  -3.948  -8.778  -2.405
  825   2HG2  VAL 107          2HG       VAL 107  -2.206  -8.659  -2.296
  826   3HG2  VAL 107          3HG       VAL 107  -3.221  -7.293  -1.813
  827    H    ALA 108           H        ALA 108  -5.777  -9.694  -3.848
  828    HA   ALA 108           HA       ALA 108  -4.377 -12.107  -4.804
  829   1HB   ALA 108          1HB       ALA 108  -7.021 -11.834  -3.352
  830   2HB   ALA 108          2HB       ALA 108  -6.057 -13.306  -3.583
  831   3HB   ALA 108          3HB       ALA 108  -5.428 -11.985  -2.569
  832    H    GLU 109           H        GLU 109  -7.188 -10.122  -5.680
  833    HA   GLU 109           HA       GLU 109  -8.035 -11.568  -8.006
  834   1HB   GLU 109          2HB       GLU 109  -7.943  -8.632  -7.256
  835   2HB   GLU 109          3HB       GLU 109  -8.428  -9.128  -8.864
  836   1HG   GLU 109          2HG       GLU 109  -9.917 -10.782  -7.067
  837   2HG   GLU 109          3HG       GLU 109  -9.963  -9.151  -6.400
  838    H    SER 110           H        SER 110  -4.956 -10.081  -7.411
  839    HA   SER 110           HA       SER 110  -3.280  -9.436  -8.880
  840   1HB   SER 110          2HB       SER 110  -2.962 -11.700  -7.897
  841   2HB   SER 110          3HB       SER 110  -3.566 -12.391  -9.423
  842    HG   SER 110           HG       SER 110  -1.943 -11.013 -10.451
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1   3.565  -2.646  10.679
    2   2H    MET   1           H2       MET   1   3.951  -1.052  10.416
    3   3H    MET   1           H3       MET   1   2.458  -1.487  10.941
    4    HA   MET   1           HA       MET   1   3.802  -0.532  12.701
    5   1HB   MET   1          2HB       MET   1   1.990  -2.253  13.010
    6   2HB   MET   1          3HB       MET   1   3.257  -3.464  13.227
    7   1HG   MET   1          2HG       MET   1   3.961  -2.524  15.260
    8   2HG   MET   1          3HG       MET   1   3.217  -0.953  14.904
    9   1HE   MET   1          1HE       MET   1   2.255  -0.923  17.368
   10   2HE   MET   1          2HE       MET   1   1.129  -2.135  18.018
   11   3HE   MET   1          3HE       MET   1   2.832  -2.564  17.750
   12    H    SER   2           H        SER   2   5.575  -2.881  10.801
   13    HA   SER   2           HA       SER   2   8.077  -1.874  11.566
   14   1HB   SER   2          2HB       SER   2   7.324  -4.505  12.881
   15   2HB   SER   2          3HB       SER   2   9.006  -4.090  12.490
   16    HG   SER   2           HG       SER   2   7.304  -2.324  13.915
   17    H    MET   3           H        MET   3   7.621  -1.726   9.220
   18    HA   MET   3           HA       MET   3   7.269  -4.133   7.689
   19   1HB   MET   3          2HB       MET   3   6.724  -1.384   7.274
   20   2HB   MET   3          3HB       MET   3   7.921  -1.791   6.076
   21   1HG   MET   3          2HG       MET   3   6.277  -2.587   4.835
   22   2HG   MET   3          3HG       MET   3   6.246  -3.977   5.887
   23   1HE   MET   3          1HE       MET   3   5.096  -2.441   8.591
   24   2HE   MET   3          2HE       MET   3   3.349  -2.698   8.443
   25   3HE   MET   3          3HE       MET   3   4.464  -4.043   8.145
   26    H    THR   4           H        THR   4   9.052  -5.208   8.418
   27    HA   THR   4           HA       THR   4  11.524  -5.330   6.901
   28    HB   THR   4           HB       THR   4  11.359  -3.639   9.400
   29    HG1  THR   4           1HG      THR   4  11.532  -2.888   7.211
   30   1HG2  THR   4          1HG       THR   4  13.857  -5.180   8.632
   31   2HG2  THR   4          2HG       THR   4  13.815  -3.754   9.684
   32   3HG2  THR   4          3HG       THR   4  12.989  -5.235  10.181
   33    H    ASP   5           H        ASP   5  10.116  -5.688  10.148
   34    HA   ASP   5           HA       ASP   5  11.463  -8.260  10.635
   35   1HB   ASP   5          2HB       ASP   5  11.434  -6.308  12.239
   36   2HB   ASP   5          3HB       ASP   5   9.684  -6.478  12.376
   37    H    LEU   6           H        LEU   6   8.178  -6.889  10.633
   38    HA   LEU   6           HA       LEU   6   6.734  -9.315  11.102
   39   1HB   LEU   6          2HB       LEU   6   6.027  -6.606   9.909
   40   2HB   LEU   6          3HB       LEU   6   4.830  -7.827  10.280
   41    HG   LEU   6           HG       LEU   6   6.656  -6.518  12.322
   42   1HD1  LEU   6          1HD1      LEU   6   3.701  -6.125  11.745
   43   2HD1  LEU   6          2HD1      LEU   6   4.655  -5.302  13.009
   44   3HD1  LEU   6          3HD1      LEU   6   4.991  -4.999  11.285
   45   1HD2  LEU   6          1HD2      LEU   6   5.965  -8.727  13.123
   46   2HD2  LEU   6          2HD2      LEU   6   5.068  -7.480  13.993
   47   3HD2  LEU   6          3HD2      LEU   6   4.278  -8.391  12.683
   48    H    LEU   7           H        LEU   7   8.032  -7.982   8.189
   49    HA   LEU   7           HA       LEU   7   6.551  -9.973   6.502
   50   1HB   LEU   7          2HB       LEU   7   7.600  -7.253   5.678
   51   2HB   LEU   7          3HB       LEU   7   6.892  -8.443   4.598
   52    HG   LEU   7           HG       LEU   7   5.319  -6.744   4.932
   53   1HD1  LEU   7          1HD1      LEU   7   4.467  -9.085   6.667
   54   2HD1  LEU   7          2HD1      LEU   7   3.393  -7.858   6.043
   55   3HD1  LEU   7          3HD1      LEU   7   4.255  -8.912   4.895
   56   1HD2  LEU   7          1HD2      LEU   7   6.326  -5.981   7.193
   57   2HD2  LEU   7          2HD2      LEU   7   4.587  -5.784   6.880
   58   3HD2  LEU   7          3HD2      LEU   7   5.137  -7.106   7.898
   59    H    ASN   8           H        ASN   8   9.332  -8.062   5.651
   60    HA   ASN   8           HA       ASN   8  11.536  -9.709   6.024
   61   1HB   ASN   8          2HB       ASN   8   9.922 -10.370   3.558
   62   2HB   ASN   8          3HB       ASN   8  11.679 -10.294   3.387
   63   1HD2  ASN   8          2HD2      ASN   8  10.246 -12.526   2.783
   64   2HD2  ASN   8          1HD2      ASN   8  10.775 -13.762   3.985
   65    H    ALA   9           H        ALA   9  12.816  -7.844   6.119
   66    HA   ALA   9           HA       ALA   9  12.565  -5.492   4.667
   67   1HB   ALA   9          1HB       ALA   9  15.151  -6.819   5.585
   68   2HB   ALA   9          2HB       ALA   9  14.932  -5.095   5.203
   69   3HB   ALA   9          3HB       ALA   9  14.071  -5.814   6.573
   70    H    GLU  10           H        GLU  10  14.417  -8.364   3.583
   71    HA   GLU  10           HA       GLU  10  15.468  -7.299   1.159
   72   1HB   GLU  10          2HB       GLU  10  14.754 -10.112   2.062
   73   2HB   GLU  10          3HB       GLU  10  15.618  -9.774   0.556
   74   1HG   GLU  10          2HG       GLU  10  17.524  -8.918   1.676
   75   2HG   GLU  10          3HG       GLU  10  16.668  -8.709   3.204
   76    H    ASP  11           H        ASP  11  12.393  -8.891   1.831
   77    HA   ASP  11           HA       ASP  11  11.469  -8.980  -0.942
   78   1HB   ASP  11          2HB       ASP  11   9.931  -9.306   1.665
   79   2HB   ASP  11          3HB       ASP  11   9.286  -9.521   0.059
   80    H    ILE  12           H        ILE  12  10.889  -6.805   1.880
   81    HA   ILE  12           HA       ILE  12   9.343  -4.833   0.495
   82    HB   ILE  12           HB       ILE  12  10.877  -4.930   3.063
   83   1HG1  ILE  12          2HG       ILE  12   8.654  -3.642   3.740
   84   2HG1  ILE  12          3HG       ILE  12   8.077  -4.137   2.156
   85   1HG2  ILE  12          1HG       ILE  12  10.076  -2.237   1.921
   86   2HG2  ILE  12          2HG       ILE  12  10.594  -2.590   3.586
   87   3HG2  ILE  12          3HG       ILE  12  11.741  -2.784   2.274
   88   1HD1  ILE  12          1HD1      ILE  12   9.083  -5.886   4.426
   89   2HD1  ILE  12          2HD1      ILE  12   7.399  -5.721   3.863
   90   3HD1  ILE  12          3HD1      ILE  12   8.608  -6.527   2.835
   91    H    LYS  13           H        LYS  13  12.909  -5.051   0.773
   92    HA   LYS  13           HA       LYS  13  13.548  -2.678  -0.584
   93   1HB   LYS  13          2HB       LYS  13  15.314  -3.782   0.459
   94   2HB   LYS  13          3HB       LYS  13  14.839  -5.359  -0.143
   95   1HG   LYS  13          2HG       LYS  13  16.892  -4.756  -1.161
   96   2HG   LYS  13          3HG       LYS  13  15.630  -4.848  -2.368
   97   1HD   LYS  13          2HD       LYS  13  15.624  -2.117  -1.599
   98   2HD   LYS  13          3HD       LYS  13  17.332  -2.561  -1.554
   99   1HE   LYS  13          2HE       LYS  13  17.160  -3.417  -3.887
  100   2HE   LYS  13          3HE       LYS  13  15.434  -3.017  -3.901
  101   1HZ   LYS  13          1HZ       LYS  13  17.623  -1.050  -3.596
  102   2HZ   LYS  13          2HZ       LYS  13  16.724  -1.282  -4.955
  103   3HZ   LYS  13          3HZ       LYS  13  16.015  -0.699  -3.594
  104    H    LYS  14           H        LYS  14  12.738  -5.844  -2.011
  105    HA   LYS  14           HA       LYS  14  12.935  -4.866  -4.786
  106   1HB   LYS  14          2HB       LYS  14  11.796  -7.395  -3.523
  107   2HB   LYS  14          3HB       LYS  14  11.745  -7.070  -5.267
  108   1HG   LYS  14          2HG       LYS  14  14.171  -6.893  -5.381
  109   2HG   LYS  14          3HG       LYS  14  14.320  -7.068  -3.624
  110   1HD   LYS  14          2HD       LYS  14  13.411  -9.342  -3.731
  111   2HD   LYS  14          3HD       LYS  14  13.208  -9.199  -5.496
  112   1HE   LYS  14          2HE       LYS  14  15.623  -8.864  -5.782
  113   2HE   LYS  14          3HE       LYS  14  15.862  -8.860  -4.028
  114   1HZ   LYS  14          1HZ       LYS  14  14.878 -11.166  -5.597
  115   2HZ   LYS  14          2HZ       LYS  14  16.397 -11.011  -4.982
  116   3HZ   LYS  14          3HZ       LYS  14  15.107 -11.147  -3.970
  117    H    ALA  15           H        ALA  15  10.287  -5.299  -2.490
  118    HA   ALA  15           HA       ALA  15   8.120  -4.645  -4.152
  119   1HB   ALA  15          1HB       ALA  15   8.326  -3.705  -1.266
  120   2HB   ALA  15          2HB       ALA  15   6.964  -4.401  -2.149
  121   3HB   ALA  15          3HB       ALA  15   8.331  -5.424  -1.668
  122    H    VAL  16           H        VAL  16   9.968  -2.330  -2.039
  123    HA   VAL  16           HA       VAL  16   8.563  -0.008  -2.911
  124    HB   VAL  16           HB       VAL  16  11.399  -0.215  -1.857
  125   1HG1  VAL  16          1HG       VAL  16   9.563   2.206  -2.059
  126   2HG1  VAL  16          2HG       VAL  16  11.092   2.147  -1.154
  127   3HG1  VAL  16          3HG       VAL  16  11.108   1.981  -2.912
  128   1HG2  VAL  16          1HG       VAL  16   9.584  -1.082  -0.313
  129   2HG2  VAL  16          2HG       VAL  16  10.462   0.321   0.280
  130   3HG2  VAL  16          3HG       VAL  16   8.826   0.520  -0.392
  131    H    GLY  17           H        GLY  17  11.264  -1.697  -4.437
  132   1HA   GLY  17          2HA       GLY  17  11.902   0.273  -6.443
  133   2HA   GLY  17          3HA       GLY  17  12.246  -1.456  -6.510
  134    H    ALA  18           H        ALA  18   9.108  -1.791  -6.115
  135    HA   ALA  18           HA       ALA  18   8.424  -1.695  -8.980
  136   1HB   ALA  18          1HB       ALA  18   6.848  -2.825  -6.629
  137   2HB   ALA  18          2HB       ALA  18   6.568  -3.110  -8.355
  138   3HB   ALA  18          3HB       ALA  18   8.042  -3.733  -7.573
  139    H    PHE  19           H        PHE  19   6.960  -0.469  -5.868
  140    HA   PHE  19           HA       PHE  19   5.107   1.280  -7.329
  141   1HB   PHE  19          2HB       PHE  19   5.979   1.406  -4.414
  142   2HB   PHE  19          3HB       PHE  19   4.757   2.406  -5.207
  143    HD1  PHE  19           1HD      PHE  19   4.706   0.225  -2.743
  144    HD2  PHE  19           2HD      PHE  19   3.031   0.723  -6.655
  145    HE1  PHE  19           1HE      PHE  19   2.665  -1.029  -2.028
  146    HE2  PHE  19           2HE      PHE  19   1.046  -0.600  -5.950
  147    HZ   PHE  19           HZ       PHE  19   0.885  -1.474  -3.631
  148    H    SER  20           H        SER  20   8.492   1.661  -6.419
  149    HA   SER  20           HA       SER  20   8.670   4.506  -6.412
  150   1HB   SER  20          2HB       SER  20  10.424   3.214  -5.439
  151   2HB   SER  20          3HB       SER  20  10.693   2.318  -6.954
  152    HG   SER  20           HG       SER  20  11.196   4.349  -7.898
  153    H    ALA  21           H        ALA  21   7.036   4.501  -8.328
  154    HA   ALA  21           HA       ALA  21   8.447   5.429 -10.748
  155   1HB   ALA  21          1HB       ALA  21   6.299   3.264 -10.714
  156   2HB   ALA  21          2HB       ALA  21   7.000   3.990 -12.187
  157   3HB   ALA  21          3HB       ALA  21   8.009   3.010 -11.114
  158    H    THR  22           H        THR  22   6.230   5.924 -12.325
  159    HA   THR  22           HA       THR  22   4.344   7.528 -10.680
  160    HB   THR  22           HB       THR  22   4.332   9.105 -12.685
  161    HG1  THR  22           1HG      THR  22   6.288   9.110 -13.862
  162   1HG2  THR  22          1HG       THR  22   6.944   8.886 -11.136
  163   2HG2  THR  22          2HG       THR  22   6.292  10.348 -11.909
  164   3HG2  THR  22          3HG       THR  22   5.458   9.631 -10.516
  165    H    ASP  23           H        ASP  23   2.554   6.409 -10.702
  166    HA   ASP  23           HA       ASP  23   0.570   5.630 -11.422
  167   1HB   ASP  23          2HB       ASP  23   0.933   7.326 -13.365
  168   2HB   ASP  23          3HB       ASP  23   1.240   5.889 -14.340
  169    H    SER  24           H        SER  24   3.439   4.131 -11.837
  170    HA   SER  24           HA       SER  24   2.490   1.738 -13.303
  171   1HB   SER  24          2HB       SER  24   4.829   2.919 -13.484
  172   2HB   SER  24          3HB       SER  24   5.214   1.946 -12.049
  173    HG   SER  24           HG       SER  24   5.708   0.783 -13.889
  174    H    PHE  25           H        PHE  25   1.075   2.181 -11.060
  175    HA   PHE  25           HA       PHE  25   1.996   1.521  -8.584
  176   1HB   PHE  25          2HB       PHE  25  -0.170   2.594  -9.161
  177   2HB   PHE  25          3HB       PHE  25  -0.817   1.057  -9.681
  178    HD1  PHE  25           1HD      PHE  25   0.881   2.571  -6.662
  179    HD2  PHE  25           2HD      PHE  25  -2.261   0.021  -8.155
  180    HE1  PHE  25           1HE      PHE  25   0.142   2.116  -4.335
  181    HE2  PHE  25           2HE      PHE  25  -3.025  -0.386  -5.825
  182    HZ   PHE  25           HZ       PHE  25  -1.783   0.597  -3.917
  183    H    ASP  26           H        ASP  26   0.207  -0.907 -10.602
  184    HA   ASP  26           HA       ASP  26  -0.001  -3.205 -10.270
  185   1HB   ASP  26          2HB       ASP  26   2.875  -2.395 -10.642
  186   2HB   ASP  26          3HB       ASP  26   2.524  -4.090 -10.393
  187    H    HIS  27           H        HIS  27  -0.350  -2.058  -7.650
  188    HA   HIS  27           HA       HIS  27   1.070  -3.203  -5.649
  189   1HB   HIS  27          2HB       HIS  27  -0.818  -3.155  -4.180
  190   2HB   HIS  27          3HB       HIS  27  -0.775  -1.738  -5.194
  191    HD1  HIS  27           HD1      HIS  27  -2.476  -2.708  -7.695
  192    HD2  HIS  27           HD2      HIS  27  -3.322  -3.333  -3.619
  193    HE1  HIS  27           HE1      HIS  27  -5.007  -3.094  -7.510
  194    H    LYS  28           H        LYS  28  -1.309  -4.995  -7.500
  195    HA   LYS  28           HA       LYS  28  -1.342  -7.578  -6.309
  196   1HB   LYS  28          2HB       LYS  28  -1.344  -6.518  -9.163
  197   2HB   LYS  28          3HB       LYS  28  -1.500  -8.225  -8.819
  198   1HG   LYS  28          2HG       LYS  28  -3.545  -7.968  -7.649
  199   2HG   LYS  28          3HG       LYS  28  -3.349  -6.225  -7.456
  200   1HD   LYS  28          2HD       LYS  28  -3.846  -7.632 -10.111
  201   2HD   LYS  28          3HD       LYS  28  -5.084  -6.870  -9.093
  202   1HE   LYS  28          2HE       LYS  28  -3.788  -4.710  -9.232
  203   2HE   LYS  28          3HE       LYS  28  -2.697  -5.477 -10.393
  204   1HZ   LYS  28          1HZ       LYS  28  -5.623  -5.143 -10.747
  205   2HZ   LYS  28          2HZ       LYS  28  -4.465  -4.258 -11.517
  206   3HZ   LYS  28          3HZ       LYS  28  -4.621  -5.865 -11.828
  207    H    LYS  29           H        LYS  29   1.231  -6.057  -8.251
  208    HA   LYS  29           HA       LYS  29   2.911  -8.488  -8.345
  209   1HB   LYS  29          2HB       LYS  29   2.522  -6.689 -10.201
  210   2HB   LYS  29          3HB       LYS  29   3.653  -5.699  -9.272
  211   1HG   LYS  29          2HG       LYS  29   5.435  -7.337  -9.597
  212   2HG   LYS  29          3HG       LYS  29   4.281  -8.506 -10.266
  213   1HD   LYS  29          2HD       LYS  29   5.423  -7.556 -12.144
  214   2HD   LYS  29          3HD       LYS  29   3.782  -6.904 -12.136
  215   1HE   LYS  29          2HE       LYS  29   4.856  -4.894 -10.810
  216   2HE   LYS  29          3HE       LYS  29   6.394  -5.535 -11.410
  217   1HZ   LYS  29          1HZ       LYS  29   4.066  -4.575 -12.987
  218   2HZ   LYS  29          2HZ       LYS  29   5.542  -3.890 -12.931
  219   3HZ   LYS  29          3HZ       LYS  29   5.350  -5.350 -13.687
  220    H    PHE  30           H        PHE  30   2.938  -5.226  -6.895
  221    HA   PHE  30           HA       PHE  30   5.326  -5.378  -5.290
  222   1HB   PHE  30          2HB       PHE  30   3.926  -3.344  -5.535
  223   2HB   PHE  30          3HB       PHE  30   2.661  -4.094  -4.581
  224    HD1  PHE  30           1HD      PHE  30   3.037  -4.590  -2.091
  225    HD2  PHE  30           2HD      PHE  30   5.742  -2.249  -4.473
  226    HE1  PHE  30           1HE      PHE  30   3.976  -3.588  -0.036
  227    HE2  PHE  30           2HE      PHE  30   6.696  -1.263  -2.395
  228    HZ   PHE  30           HZ       PHE  30   5.821  -1.948  -0.178
  229    H    PHE  31           H        PHE  31   1.970  -6.208  -4.248
  230    HA   PHE  31           HA       PHE  31   2.642  -7.277  -1.732
  231   1HB   PHE  31          2HB       PHE  31   0.230  -7.365  -3.452
  232   2HB   PHE  31          3HB       PHE  31   0.326  -8.431  -2.077
  233    HD1  PHE  31           1HD      PHE  31  -0.594  -7.732  -0.094
  234    HD2  PHE  31           2HD      PHE  31   0.859  -4.772  -2.847
  235    HE1  PHE  31           1HE      PHE  31  -1.459  -5.938   1.387
  236    HE2  PHE  31           2HE      PHE  31   0.059  -2.965  -1.331
  237    HZ   PHE  31           HZ       PHE  31  -1.108  -3.556   0.783
  238    H    GLN  32           H        GLN  32   2.961  -8.770  -4.820
  239    HA   GLN  32           HA       GLN  32   3.166 -11.491  -3.673
  240   1HB   GLN  32          2HB       GLN  32   3.249 -10.363  -6.504
  241   2HB   GLN  32          3HB       GLN  32   3.773 -12.024  -6.149
  242   1HG   GLN  32          2HG       GLN  32   1.675 -12.566  -5.116
  243   2HG   GLN  32          3HG       GLN  32   1.070 -10.909  -5.279
  244   1HE2  GLN  32          2HE       GLN  32   1.320 -10.233  -7.834
  245   2HE2  GLN  32          1HE       GLN  32   0.651 -11.452  -8.942
  246    H    MET  33           H        MET  33   5.341  -9.134  -5.387
  247    HA   MET  33           HA       MET  33   7.737 -10.640  -4.918
  248   1HB   MET  33          2HB       MET  33   7.182  -7.710  -5.511
  249   2HB   MET  33          3HB       MET  33   8.826  -8.314  -5.271
  250   1HG   MET  33          2HG       MET  33   6.897  -9.463  -7.321
  251   2HG   MET  33          3HG       MET  33   8.108  -8.227  -7.672
  252   1HE   MET  33          1HE       MET  33   8.859  -9.930  -9.671
  253   2HE   MET  33          2HE       MET  33   9.448 -11.580  -9.364
  254   3HE   MET  33          3HE       MET  33   7.734 -11.189  -9.098
  255    H    VAL  34           H        VAL  34   6.227  -8.081  -2.962
  256    HA   VAL  34           HA       VAL  34   8.169  -8.071  -0.822
  257    HB   VAL  34           HB       VAL  34   6.427  -6.354  -1.516
  258   1HG1  VAL  34          1HG       VAL  34   4.677  -7.703   0.431
  259   2HG1  VAL  34          2HG       VAL  34   4.327  -6.348  -0.665
  260   3HG1  VAL  34          3HG       VAL  34   4.543  -8.005  -1.298
  261   1HG2  VAL  34          1HG       VAL  34   7.889  -6.283   0.569
  262   2HG2  VAL  34          2HG       VAL  34   6.382  -5.346   0.656
  263   3HG2  VAL  34          3HG       VAL  34   6.524  -6.919   1.475
  264    H    GLY  35           H        GLY  35   5.834 -10.422  -1.750
  265   1HA   GLY  35          2HA       GLY  35   4.739 -12.149  -0.793
  266   2HA   GLY  35          3HA       GLY  35   5.966 -12.099   0.493
  267    H    LEU  36           H        LEU  36   3.934  -9.304   0.176
  268    HA   LEU  36           HA       LEU  36   3.081  -9.306   2.818
  269   1HB   LEU  36          2HB       LEU  36   2.214  -7.889   0.329
  270   2HB   LEU  36          3HB       LEU  36   1.021  -7.918   1.612
  271    HG   LEU  36           HG       LEU  36   3.857  -6.980   2.175
  272   1HD1  LEU  36          1HD1      LEU  36   1.454  -5.180   1.688
  273   2HD1  LEU  36          2HD1      LEU  36   3.144  -4.717   1.936
  274   3HD1  LEU  36          3HD1      LEU  36   2.636  -5.503   0.426
  275   1HD2  LEU  36          1HD2      LEU  36   2.435  -7.723   4.055
  276   2HD2  LEU  36          2HD2      LEU  36   2.803  -5.989   4.078
  277   3HD2  LEU  36          3HD2      LEU  36   1.199  -6.597   3.545
  278    H    LYS  37           H        LYS  37   0.981 -10.201   0.109
  279    HA   LYS  37           HA       LYS  37  -1.002 -11.445   1.847
  280   1HB   LYS  37          2HB       LYS  37  -2.210 -12.055  -0.052
  281   2HB   LYS  37          3HB       LYS  37  -1.456 -10.507  -0.451
  282   1HG   LYS  37          2HG       LYS  37   0.267 -11.663  -1.762
  283   2HG   LYS  37          3HG       LYS  37  -0.417 -13.239  -1.305
  284   1HD   LYS  37          2HD       LYS  37  -2.497 -12.744  -2.500
  285   2HD   LYS  37          3HD       LYS  37  -1.847 -11.145  -2.965
  286   1HE   LYS  37          2HE       LYS  37   0.098 -12.250  -3.983
  287   2HE   LYS  37          3HE       LYS  37  -0.568 -13.842  -3.619
  288   1HZ   LYS  37          1HZ       LYS  37  -1.935 -11.842  -5.336
  289   2HZ   LYS  37          2HZ       LYS  37  -0.950 -13.041  -5.929
  290   3HZ   LYS  37          3HZ       LYS  37  -2.344 -13.431  -5.137
  291    H    LYS  38           H        LYS  38   2.035 -12.602   1.112
  292    HA   LYS  38           HA       LYS  38   1.358 -15.471   1.513
  293   1HB   LYS  38          2HB       LYS  38   3.126 -15.900   0.235
  294   2HB   LYS  38          3HB       LYS  38   3.341 -14.189  -0.044
  295   1HG   LYS  38          2HG       LYS  38   4.807 -14.169   2.084
  296   2HG   LYS  38          3HG       LYS  38   4.751 -15.927   2.018
  297   1HD   LYS  38          2HD       LYS  38   5.939 -15.968  -0.085
  298   2HD   LYS  38          3HD       LYS  38   5.704 -14.234  -0.326
  299   1HE   LYS  38          2HE       LYS  38   6.990 -13.914   1.905
  300   2HE   LYS  38          3HE       LYS  38   7.482 -15.603   1.731
  301   1HZ   LYS  38          1HZ       LYS  38   8.027 -13.445  -0.248
  302   2HZ   LYS  38          2HZ       LYS  38   9.097 -13.922   0.835
  303   3HZ   LYS  38          3HZ       LYS  38   8.591 -14.992  -0.334
  304    H    LYS  39           H        LYS  39   2.181 -12.655   3.285
  305    HA   LYS  39           HA       LYS  39   2.868 -14.196   5.740
  306   1HB   LYS  39          2HB       LYS  39   2.535 -11.198   5.304
  307   2HB   LYS  39          3HB       LYS  39   3.091 -11.960   6.780
  308   1HG   LYS  39          2HG       LYS  39   4.604 -11.976   4.123
  309   2HG   LYS  39          3HG       LYS  39   4.876 -10.933   5.493
  310   1HD   LYS  39          2HD       LYS  39   6.544 -12.466   5.716
  311   2HD   LYS  39          3HD       LYS  39   5.332 -12.978   6.897
  312   1HE   LYS  39          2HE       LYS  39   4.555 -14.504   4.788
  313   2HE   LYS  39          3HE       LYS  39   6.224 -14.231   4.295
  314   1HZ   LYS  39          1HZ       LYS  39   5.361 -15.366   6.889
  315   2HZ   LYS  39          2HZ       LYS  39   5.999 -16.229   5.646
  316   3HZ   LYS  39          3HZ       LYS  39   6.921 -15.116   6.449
  317    H    SER  40           H        SER  40   1.613 -13.466   7.708
  318    HA   SER  40           HA       SER  40  -0.908 -14.630   7.390
  319   1HB   SER  40          2HB       SER  40   0.145 -13.035   9.763
  320   2HB   SER  40          3HB       SER  40  -1.108 -14.294   9.798
  321    HG   SER  40           HG       SER  40   0.951 -15.119  10.384
  322    H    ALA  41           H        ALA  41  -3.047 -13.891   7.719
  323    HA   ALA  41           HA       ALA  41  -3.888 -11.316   6.917
  324   1HB   ALA  41          1HB       ALA  41  -5.227 -13.265   8.850
  325   2HB   ALA  41          2HB       ALA  41  -6.025 -11.952   7.973
  326   3HB   ALA  41          3HB       ALA  41  -5.351 -13.330   7.067
  327    H    ASP  42           H        ASP  42  -3.222 -12.574  10.195
  328    HA   ASP  42           HA       ASP  42  -3.856 -10.162  11.566
  329   1HB   ASP  42          2HB       ASP  42  -2.188 -12.605  12.254
  330   2HB   ASP  42          3HB       ASP  42  -2.218 -11.220  13.337
  331    H    ASP  43           H        ASP  43  -1.157 -10.887   9.519
  332    HA   ASP  43           HA       ASP  43   0.548  -8.804  10.703
  333   1HB   ASP  43          2HB       ASP  43   1.393 -11.025   9.581
  334   2HB   ASP  43          3HB       ASP  43   1.196 -10.096   8.078
  335    H    VAL  44           H        VAL  44  -1.326  -9.419   7.672
  336    HA   VAL  44           HA       VAL  44  -0.845  -6.934   6.513
  337    HB   VAL  44           HB       VAL  44  -2.066  -9.153   5.710
  338   1HG1  VAL  44          1HG       VAL  44  -4.428  -7.277   5.704
  339   2HG1  VAL  44          2HG       VAL  44  -4.344  -9.009   5.321
  340   3HG1  VAL  44          3HG       VAL  44  -4.215  -8.475   6.990
  341   1HG2  VAL  44          1HG       VAL  44  -1.066  -7.480   4.281
  342   2HG2  VAL  44          2HG       VAL  44  -2.646  -7.973   3.656
  343   3HG2  VAL  44          3HG       VAL  44  -2.476  -6.406   4.488
  344    H    LYS  45           H        LYS  45  -3.015  -7.628   9.128
  345    HA   LYS  45           HA       LYS  45  -4.312  -5.061   9.405
  346   1HB   LYS  45          2HB       LYS  45  -3.467  -7.191  11.384
  347   2HB   LYS  45          3HB       LYS  45  -4.246  -5.679  11.887
  348   1HG   LYS  45          2HG       LYS  45  -6.132  -6.120  10.351
  349   2HG   LYS  45          3HG       LYS  45  -5.414  -7.669   9.883
  350   1HD   LYS  45          2HD       LYS  45  -5.642  -8.518  12.178
  351   2HD   LYS  45          3HD       LYS  45  -6.164  -6.916  12.739
  352   1HE   LYS  45          2HE       LYS  45  -7.970  -7.336  10.727
  353   2HE   LYS  45          3HE       LYS  45  -7.668  -9.011  11.208
  354   1HZ   LYS  45          1HZ       LYS  45  -8.526  -6.819  13.010
  355   2HZ   LYS  45          2HZ       LYS  45  -9.489  -8.031  12.462
  356   3HZ   LYS  45          3HZ       LYS  45  -8.242  -8.370  13.482
  357    H    LYS  46           H        LYS  46  -1.060  -6.014  10.495
  358    HA   LYS  46           HA       LYS  46  -0.471  -3.388  11.694
  359   1HB   LYS  46          2HB       LYS  46   1.313  -5.764  10.961
  360   2HB   LYS  46          3HB       LYS  46   1.903  -4.268  11.611
  361   1HG   LYS  46          2HG       LYS  46   1.814  -5.559  13.498
  362   2HG   LYS  46          3HG       LYS  46   0.293  -4.662  13.627
  363   1HD   LYS  46          2HD       LYS  46  -0.948  -6.593  12.794
  364   2HD   LYS  46          3HD       LYS  46   0.567  -7.420  12.371
  365   1HE   LYS  46          2HE       LYS  46   1.153  -7.405  14.841
  366   2HE   LYS  46          3HE       LYS  46  -0.498  -6.826  15.147
  367   1HZ   LYS  46          1HZ       LYS  46   0.340  -9.387  13.940
  368   2HZ   LYS  46          2HZ       LYS  46  -0.635  -9.177  15.261
  369   3HZ   LYS  46          3HZ       LYS  46  -1.154  -8.831  13.708
  370    H    VAL  47           H        VAL  47  -0.143  -4.908   8.573
  371    HA   VAL  47           HA       VAL  47   1.643  -3.042   7.310
  372    HB   VAL  47           HB       VAL  47  -0.477  -4.806   6.075
  373   1HG1  VAL  47          1HG       VAL  47   1.914  -3.560   4.699
  374   2HG1  VAL  47          2HG       VAL  47   0.644  -4.572   3.977
  375   3HG1  VAL  47          3HG       VAL  47   0.247  -2.961   4.539
  376   1HG2  VAL  47          1HG       VAL  47   1.441  -5.909   7.466
  377   2HG2  VAL  47          2HG       VAL  47   1.209  -6.452   5.829
  378   3HG2  VAL  47          3HG       VAL  47   2.509  -5.294   6.212
  379    H    PHE  48           H        PHE  48  -1.966  -3.246   6.756
  380    HA   PHE  48           HA       PHE  48  -2.451  -0.793   5.720
  381   1HB   PHE  48          2HB       PHE  48  -4.072  -2.547   6.031
  382   2HB   PHE  48          3HB       PHE  48  -3.942  -2.454   7.786
  383    HD1  PHE  48           1HD      PHE  48  -5.411  -1.030   9.011
  384    HD2  PHE  48           2HD      PHE  48  -4.850  -0.447   4.771
  385    HE1  PHE  48           1HE      PHE  48  -7.229   0.671   8.998
  386    HE2  PHE  48           2HE      PHE  48  -6.587   1.284   4.787
  387    HZ   PHE  48           HZ       PHE  48  -7.817   1.820   6.872
  388    H    HIS  49           H        HIS  49  -2.338  -1.384   9.283
  389    HA   HIS  49           HA       HIS  49  -2.774   1.281  10.105
  390   1HB   HIS  49          2HB       HIS  49  -2.977  -0.332  11.754
  391   2HB   HIS  49          3HB       HIS  49  -1.497  -1.164  11.295
  392    HD1  HIS  49           HD1      HIS  49   0.410  -0.842  12.913
  393    HD2  HIS  49           HD2      HIS  49  -2.319   2.346  12.884
  394    HE1  HIS  49           HE1      HIS  49   1.258   0.854  14.644
  395    H    MET  50           H        MET  50   0.234  -0.058   8.771
  396    HA   MET  50           HA       MET  50   1.964   2.026   9.824
  397   1HB   MET  50          2HB       MET  50   2.490  -0.393   8.883
  398   2HB   MET  50          3HB       MET  50   2.485   0.402   7.315
  399   1HG   MET  50          2HG       MET  50   4.731   0.281   8.137
  400   2HG   MET  50          3HG       MET  50   4.227   1.972   8.137
  401   1HE   MET  50          1HE       MET  50   5.935   3.021   9.668
  402   2HE   MET  50          2HE       MET  50   6.656   2.175  11.055
  403   3HE   MET  50          3HE       MET  50   6.796   1.486   9.418
  404    H    LEU  51           H        LEU  51  -0.335   1.940   7.291
  405    HA   LEU  51           HA       LEU  51   0.866   4.096   5.608
  406   1HB   LEU  51          2HB       LEU  51  -1.714   2.559   5.302
  407   2HB   LEU  51          3HB       LEU  51  -0.856   3.467   4.073
  408    HG   LEU  51           HG       LEU  51   0.039   0.849   5.383
  409   1HD1  LEU  51          1HD1      LEU  51  -1.021   1.448   2.624
  410   2HD1  LEU  51          2HD1      LEU  51  -0.219  -0.076   3.098
  411   3HD1  LEU  51          3HD1      LEU  51  -1.729   0.415   3.873
  412   1HD2  LEU  51          1HD2      LEU  51   2.036   2.134   4.872
  413   2HD2  LEU  51          2HD2      LEU  51   1.873   0.807   3.726
  414   3HD2  LEU  51          3HD2      LEU  51   1.452   2.459   3.234
  415    H    ASP  52           H        ASP  52  -1.903   3.430   7.715
  416    HA   ASP  52           HA       ASP  52  -3.325   5.888   7.553
  417   1HB   ASP  52          2HB       ASP  52  -4.166   3.631   8.261
  418   2HB   ASP  52          3HB       ASP  52  -3.354   3.876   9.805
  419    H    LYS  53           H        LYS  53  -0.883   6.869   7.708
  420    HA   LYS  53           HA       LYS  53   0.253   7.219  10.295
  421   1HB   LYS  53          2HB       LYS  53   1.869   8.545   9.292
  422   2HB   LYS  53          3HB       LYS  53   1.404   7.325   8.100
  423   1HG   LYS  53          2HG       LYS  53  -0.244   9.119   7.191
  424   2HG   LYS  53          3HG       LYS  53   0.621  10.247   8.243
  425   1HD   LYS  53          2HD       LYS  53   1.712  10.518   6.192
  426   2HD   LYS  53          3HD       LYS  53   2.775   9.405   7.077
  427   1HE   LYS  53          2HE       LYS  53   1.645   7.479   5.875
  428   2HE   LYS  53          3HE       LYS  53   0.681   8.657   4.973
  429   1HZ   LYS  53          1HZ       LYS  53   3.634   8.464   4.922
  430   2HZ   LYS  53          2HZ       LYS  53   2.658   8.033   3.677
  431   3HZ   LYS  53          3HZ       LYS  53   2.745   9.596   4.119
  432    H    ASP  54           H        ASP  54  -2.417   8.887   8.967
  433    HA   ASP  54           HA       ASP  54  -2.270  11.219  10.753
  434   1HB   ASP  54          2HB       ASP  54  -4.341  11.842   9.629
  435   2HB   ASP  54          3HB       ASP  54  -3.118  11.402   8.435
  436    H    LYS  55           H        LYS  55  -3.225   7.968  11.103
  437    HA   LYS  55           HA       LYS  55  -4.577   6.783  12.424
  438   1HB   LYS  55          2HB       LYS  55  -3.910   9.095  14.242
  439   2HB   LYS  55          3HB       LYS  55  -4.970   7.811  14.804
  440   1HG   LYS  55          2HG       LYS  55  -2.251   7.180  13.595
  441   2HG   LYS  55          3HG       LYS  55  -2.457   7.594  15.304
  442   1HD   LYS  55          2HD       LYS  55  -3.984   5.717  15.655
  443   2HD   LYS  55          3HD       LYS  55  -3.978   5.330  13.934
  444   1HE   LYS  55          2HE       LYS  55  -2.556   3.767  15.096
  445   2HE   LYS  55          3HE       LYS  55  -1.592   4.770  14.010
  446   1HZ   LYS  55          1HZ       LYS  55  -1.856   5.189  16.930
  447   2HZ   LYS  55          2HZ       LYS  55  -0.560   4.506  16.172
  448   3HZ   LYS  55          3HZ       LYS  55  -0.929   6.091  15.912
  449    H    SER  56           H        SER  56  -6.175   6.910  10.905
  450    HA   SER  56           HA       SER  56  -8.695   7.720  12.259
  451   1HB   SER  56          2HB       SER  56  -9.823   8.630  10.453
  452   2HB   SER  56          3HB       SER  56  -8.246   9.431  10.462
  453    HG   SER  56           HG       SER  56  -9.016   8.713   8.360
  454    H    GLY  57           H        GLY  57  -7.006   5.169  10.715
  455   1HA   GLY  57          2HA       GLY  57  -7.647   2.972  10.591
  456   2HA   GLY  57          3HA       GLY  57  -9.315   3.395  10.978
  457    H    PHE  58           H        PHE  58  -7.777   5.110   8.335
  458    HA   PHE  58           HA       PHE  58  -9.014   3.513   6.158
  459   1HB   PHE  58          2HB       PHE  58 -10.083   6.268   6.922
  460   2HB   PHE  58          3HB       PHE  58 -10.446   5.380   5.466
  461    HD1  PHE  58           1HD      PHE  58 -11.339   5.828   8.934
  462    HD2  PHE  58           2HD      PHE  58 -11.743   3.211   5.532
  463    HE1  PHE  58           1HE      PHE  58 -13.266   4.713  10.022
  464    HE2  PHE  58           2HE      PHE  58 -13.704   2.132   6.597
  465    HZ   PHE  58           HZ       PHE  58 -14.457   2.862   8.852
  466    H    ILE  59           H        ILE  59  -7.647   3.732   4.425
  467    HA   ILE  59           HA       ILE  59  -5.791   6.046   4.457
  468    HB   ILE  59           HB       ILE  59  -5.849   3.681   2.634
  469   1HG1  ILE  59          2HG       ILE  59  -3.789   4.134   4.823
  470   2HG1  ILE  59          3HG       ILE  59  -5.266   3.236   5.136
  471   1HG2  ILE  59          1HG       ILE  59  -3.571   5.651   3.059
  472   2HG2  ILE  59          2HG       ILE  59  -3.672   4.377   1.829
  473   3HG2  ILE  59          3HG       ILE  59  -4.720   5.786   1.728
  474   1HD1  ILE  59          1HD1      ILE  59  -3.167   2.556   3.057
  475   2HD1  ILE  59          2HD1      ILE  59  -3.586   1.651   4.532
  476   3HD1  ILE  59          3HD1      ILE  59  -4.736   1.738   3.191
  477    H    GLU  60           H        GLU  60  -5.998   7.725   3.284
  478    HA   GLU  60           HA       GLU  60  -7.878   7.916   1.004
  479   1HB   GLU  60          2HB       GLU  60  -8.950   9.883   1.919
  480   2HB   GLU  60          3HB       GLU  60  -9.116   8.502   2.982
  481   1HG   GLU  60          2HG       GLU  60  -6.959   9.639   4.155
  482   2HG   GLU  60          3HG       GLU  60  -7.687  11.073   3.455
  483    H    GLU  61           H        GLU  61  -7.698  10.340   0.116
  484    HA   GLU  61           HA       GLU  61  -5.475  10.251  -1.439
  485   1HB   GLU  61          2HB       GLU  61  -6.049  12.345  -2.351
  486   2HB   GLU  61          3HB       GLU  61  -7.463  11.356  -2.061
  487   1HG   GLU  61          2HG       GLU  61  -8.436  13.051  -0.999
  488   2HG   GLU  61          3HG       GLU  61  -7.234  12.958   0.278
  489    H    ASP  62           H        ASP  62  -5.656  12.202   1.481
  490    HA   ASP  62           HA       ASP  62  -3.275  13.651   1.462
  491   1HB   ASP  62          2HB       ASP  62  -5.013  13.916   3.144
  492   2HB   ASP  62          3HB       ASP  62  -4.782  12.264   3.719
  493    H    GLU  63           H        GLU  63  -3.726  10.280   2.640
  494    HA   GLU  63           HA       GLU  63  -0.838   9.914   3.185
  495   1HB   GLU  63          2HB       GLU  63  -3.079   7.904   2.920
  496   2HB   GLU  63          3HB       GLU  63  -1.452   7.544   3.494
  497   1HG   GLU  63          2HG       GLU  63  -1.842   8.367   5.583
  498   2HG   GLU  63          3HG       GLU  63  -2.852   9.704   5.019
  499    H    LEU  64           H        LEU  64  -3.269   9.006   0.752
  500    HA   LEU  64           HA       LEU  64  -2.005   7.081  -0.722
  501   1HB   LEU  64          2HB       LEU  64  -4.306   8.686  -0.878
  502   2HB   LEU  64          3HB       LEU  64  -3.487   8.999  -2.396
  503    HG   LEU  64           HG       LEU  64  -3.395   6.458  -2.627
  504   1HD1  LEU  64          1HD1      LEU  64  -5.417   6.604  -0.381
  505   2HD1  LEU  64          2HD1      LEU  64  -5.110   5.175  -1.395
  506   3HD1  LEU  64          3HD1      LEU  64  -3.826   5.799  -0.348
  507   1HD2  LEU  64          1HD2      LEU  64  -4.965   7.800  -3.920
  508   2HD2  LEU  64          2HD2      LEU  64  -5.827   6.370  -3.337
  509   3HD2  LEU  64          3HD2      LEU  64  -6.062   7.931  -2.529
  510    H    GLY  65           H        GLY  65  -1.555  10.554  -1.132
  511   1HA   GLY  65          2HA       GLY  65   0.197  10.626  -3.354
  512   2HA   GLY  65          3HA       GLY  65   0.297  11.729  -1.980
  513    H    PHE  66           H        PHE  66   1.041   9.635  -0.015
  514    HA   PHE  66           HA       PHE  66   3.675   8.654  -0.912
  515   1HB   PHE  66          2HB       PHE  66   4.891   9.901   0.869
  516   2HB   PHE  66          3HB       PHE  66   4.324  10.849  -0.479
  517    HD1  PHE  66           1HD      PHE  66   2.316  12.358  -0.254
  518    HD2  PHE  66           2HD      PHE  66   4.279  10.534   3.109
  519    HE1  PHE  66           1HE      PHE  66   1.130  13.912   1.266
  520    HE2  PHE  66           2HE      PHE  66   3.106  12.138   4.647
  521    HZ   PHE  66           HZ       PHE  66   1.505  13.792   3.711
  522    H    ILE  67           H        ILE  67   1.394   7.301  -0.163
  523    HA   ILE  67           HA       ILE  67   1.229   5.995   2.321
  524    HB   ILE  67           HB       ILE  67  -0.381   5.871   0.595
  525   1HG1  ILE  67          2HG       ILE  67   0.009   3.877   2.072
  526   2HG1  ILE  67          3HG       ILE  67  -1.056   3.688   0.692
  527   1HG2  ILE  67          1HG       ILE  67   1.614   4.482  -1.220
  528   2HG2  ILE  67          2HG       ILE  67  -0.130   4.634  -1.504
  529   3HG2  ILE  67          3HG       ILE  67   0.885   6.071  -1.475
  530   1HD1  ILE  67          1HD1      ILE  67   1.844   2.783   0.742
  531   2HD1  ILE  67          2HD1      ILE  67   0.458   1.726   1.031
  532   3HD1  ILE  67          3HD1      ILE  67   0.665   2.478  -0.549
  533    H    LEU  68           H        LEU  68   3.490   5.503  -0.337
  534    HA   LEU  68           HA       LEU  68   4.717   3.145   0.485
  535   1HB   LEU  68          2HB       LEU  68   6.097   5.504  -0.838
  536   2HB   LEU  68          3HB       LEU  68   6.601   3.807  -0.888
  537    HG   LEU  68           HG       LEU  68   4.189   5.119  -2.227
  538   1HD1  LEU  68          1HD1      LEU  68   6.825   3.885  -3.161
  539   2HD1  LEU  68          2HD1      LEU  68   5.492   4.208  -4.258
  540   3HD1  LEU  68          3HD1      LEU  68   6.215   5.543  -3.391
  541   1HD2  LEU  68          1HD2      LEU  68   3.506   2.886  -1.447
  542   2HD2  LEU  68          2HD2      LEU  68   3.732   2.896  -3.190
  543   3HD2  LEU  68          3HD2      LEU  68   5.004   2.214  -2.130
  544    H    LYS  69           H        LYS  69   5.164   6.327   1.874
  545    HA   LYS  69           HA       LYS  69   7.663   5.830   3.200
  546   1HB   LYS  69          2HB       LYS  69   5.833   7.997   2.959
  547   2HB   LYS  69          3HB       LYS  69   5.989   7.704   4.685
  548   1HG   LYS  69          2HG       LYS  69   8.336   8.037   2.760
  549   2HG   LYS  69          3HG       LYS  69   7.574   9.373   3.620
  550   1HD   LYS  69          2HD       LYS  69   8.210   8.432   5.788
  551   2HD   LYS  69          3HD       LYS  69   8.848   6.979   5.012
  552   1HE   LYS  69          2HE       LYS  69  10.669   8.468   5.636
  553   2HE   LYS  69          3HE       LYS  69  10.587   8.237   3.886
  554   1HZ   LYS  69          1HZ       LYS  69   9.558  10.604   5.342
  555   2HZ   LYS  69          2HZ       LYS  69  10.943  10.558   4.457
  556   3HZ   LYS  69          3HZ       LYS  69   9.488  10.387   3.715
  557    H    GLY  70           H        GLY  70   4.562   4.495   3.860
  558   1HA   GLY  70          2HA       GLY  70   5.365   3.676   6.599
  559   2HA   GLY  70          3HA       GLY  70   3.880   3.229   5.749
  560    H    PHE  71           H        PHE  71   5.606   2.368   3.300
  561    HA   PHE  71           HA       PHE  71   6.212  -0.335   4.302
  562   1HB   PHE  71          2HB       PHE  71   6.671   0.870   1.554
  563   2HB   PHE  71          3HB       PHE  71   6.883  -0.817   1.997
  564    HD1  PHE  71           1HD      PHE  71   4.534  -1.670   3.430
  565    HD2  PHE  71           2HD      PHE  71   4.851   1.068   0.118
  566    HE1  PHE  71           1HE      PHE  71   2.200  -2.180   2.776
  567    HE2  PHE  71           2HE      PHE  71   2.499   0.610  -0.485
  568    HZ   PHE  71           HZ       PHE  71   1.169  -1.036   0.827
  569    H    SER  72           H        SER  72   8.073   2.632   3.331
  570    HA   SER  72           HA       SER  72  10.262   2.018   5.039
  571   1HB   SER  72          2HB       SER  72  10.328   0.999   2.231
  572   2HB   SER  72          3HB       SER  72  11.838   1.702   2.841
  573    HG   SER  72           HG       SER  72  10.259  -0.259   4.133
  574    HA   PRO  73           HA       PRO  73  11.520   6.105   3.416
  575   1HB   PRO  73          2HB       PRO  73  14.262   6.003   3.433
  576   2HB   PRO  73          3HB       PRO  73  13.279   6.178   4.919
  577   1HG   PRO  73          2HG       PRO  73  14.436   3.628   3.743
  578   2HG   PRO  73          3HG       PRO  73  14.556   4.219   5.434
  579   1HD   PRO  73          2HD       PRO  73  12.692   2.401   4.707
  580   2HD   PRO  73          3HD       PRO  73  12.294   3.688   5.875
  581    H    ASP  74           H        ASP  74  12.655   7.002   1.599
  582    HA   ASP  74           HA       ASP  74  12.798   7.371  -0.520
  583   1HB   ASP  74          2HB       ASP  74  14.912   5.797  -0.018
  584   2HB   ASP  74          3HB       ASP  74  14.146   4.825  -1.274
  585    H    ALA  75           H        ALA  75  10.725   5.200   0.394
  586    HA   ALA  75           HA       ALA  75   8.711   4.741  -1.249
  587   1HB   ALA  75          1HB       ALA  75   9.160   6.820   0.931
  588   2HB   ALA  75          2HB       ALA  75   7.558   6.582   0.244
  589   3HB   ALA  75          3HB       ALA  75   8.400   5.224   1.032
  590    H    ARG  76           H        ARG  76   9.486   8.150  -0.745
  591    HA   ARG  76           HA       ARG  76   9.121  10.072  -1.875
  592   1HB   ARG  76          2HB       ARG  76   8.936   8.987  -4.628
  593   2HB   ARG  76          3HB       ARG  76   9.865  10.337  -3.977
  594   1HG   ARG  76          2HG       ARG  76  11.301   8.361  -2.893
  595   2HG   ARG  76          3HG       ARG  76  10.529   7.418  -4.164
  596   1HD   ARG  76          2HD       ARG  76  12.339   8.007  -5.349
  597   2HD   ARG  76          3HD       ARG  76  11.484   9.542  -5.623
  598    HE   ARG  76           HE       ARG  76  12.787   9.827  -3.165
  599   1HH1  ARG  76          1HH2      ARG  76  14.049   9.193  -6.346
  600   2HH1  ARG  76          2HH2      ARG  76  15.703   9.416  -5.817
  601   1HH2  ARG  76          1HH1      ARG  76  14.907   9.376  -2.639
  602   2HH2  ARG  76          2HH1      ARG  76  16.098  10.048  -3.695
  603    H    ASP  77           H        ASP  77   7.671  11.055  -3.763
  604    HA   ASP  77           HA       ASP  77   4.917  10.525  -2.948
  605   1HB   ASP  77          2HB       ASP  77   6.063  12.653  -4.790
  606   2HB   ASP  77          3HB       ASP  77   4.444  12.619  -4.078
  607    H    LEU  78           H        LEU  78   3.593   9.333  -4.065
  608    HA   LEU  78           HA       LEU  78   4.042   8.118  -6.669
  609   1HB   LEU  78          2HB       LEU  78   1.475   8.513  -5.049
  610   2HB   LEU  78          3HB       LEU  78   1.607   7.538  -6.504
  611    HG   LEU  78           HG       LEU  78   2.873   6.960  -3.808
  612   1HD1  LEU  78          1HD1      LEU  78   0.956   5.367  -5.567
  613   2HD1  LEU  78          2HD1      LEU  78   1.507   4.940  -3.934
  614   3HD1  LEU  78          3HD1      LEU  78   0.466   6.355  -4.176
  615   1HD2  LEU  78          1HD2      LEU  78   4.575   6.247  -5.308
  616   2HD2  LEU  78          2HD2      LEU  78   3.582   4.788  -5.052
  617   3HD2  LEU  78          3HD2      LEU  78   3.413   5.719  -6.531
  618    H    SER  79           H        SER  79   2.575   8.378  -8.532
  619    HA   SER  79           HA       SER  79   2.437  11.197  -9.362
  620   1HB   SER  79          2HB       SER  79   2.978   9.631 -11.036
  621   2HB   SER  79          3HB       SER  79   1.600   8.601 -10.672
  622    HG   SER  79           HG       SER  79   1.341   9.914 -12.541
  623    H    ALA  80           H        ALA  80   0.630  12.422  -9.894
  624    HA   ALA  80           HA       ALA  80  -1.715  12.234  -8.272
  625   1HB   ALA  80          1HB       ALA  80  -1.248  13.702 -10.909
  626   2HB   ALA  80          2HB       ALA  80  -2.587  13.996  -9.777
  627   3HB   ALA  80          3HB       ALA  80  -0.918  14.337  -9.279
  628    H    LYS  81           H        LYS  81  -0.947  10.906 -11.469
  629    HA   LYS  81           HA       LYS  81  -3.642  10.000 -12.166
  630   1HB   LYS  81          2HB       LYS  81  -0.960   8.818 -13.008
  631   2HB   LYS  81          3HB       LYS  81  -2.517   8.553 -13.780
  632   1HG   LYS  81          2HG       LYS  81  -0.853  11.097 -13.775
  633   2HG   LYS  81          3HG       LYS  81  -1.207  10.020 -15.129
  634   1HD   LYS  81          2HD       LYS  81  -3.675  10.629 -14.837
  635   2HD   LYS  81          3HD       LYS  81  -3.136  11.875 -13.681
  636   1HE   LYS  81          2HE       LYS  81  -1.579  12.738 -15.505
  637   2HE   LYS  81          3HE       LYS  81  -2.358  11.606 -16.620
  638   1HZ   LYS  81          1HZ       LYS  81  -3.706  13.803 -15.161
  639   2HZ   LYS  81          2HZ       LYS  81  -3.360  13.785 -16.768
  640   3HZ   LYS  81          3HZ       LYS  81  -4.465  12.732 -16.159
  641    H    GLU  82           H        GLU  82  -0.875   8.613 -10.499
  642    HA   GLU  82           HA       GLU  82  -1.878   6.009 -10.056
  643   1HB   GLU  82          2HB       GLU  82   0.452   7.173  -9.800
  644   2HB   GLU  82          3HB       GLU  82  -0.011   7.405  -8.116
  645   1HG   GLU  82          2HG       GLU  82  -0.171   5.034  -7.762
  646   2HG   GLU  82          3HG       GLU  82  -0.082   4.724  -9.503
  647    H    THR  83           H        THR  83  -1.743   8.818  -7.786
  648    HA   THR  83           HA       THR  83  -3.456   7.912  -5.775
  649    HB   THR  83           HB       THR  83  -3.011  10.678  -6.925
  650    HG1  THR  83           1HG      THR  83  -1.807  10.783  -4.970
  651   1HG2  THR  83          1HG       THR  83  -4.472   9.986  -4.339
  652   2HG2  THR  83          2HG       THR  83  -3.906  11.598  -4.809
  653   3HG2  THR  83          3HG       THR  83  -5.176  10.808  -5.749
  654    H    LYS  84           H        LYS  84  -4.493   9.591  -8.805
  655    HA   LYS  84           HA       LYS  84  -7.279   9.533  -8.359
  656   1HB   LYS  84          2HB       LYS  84  -5.979  10.712 -10.224
  657   2HB   LYS  84          3HB       LYS  84  -5.908   9.160 -11.052
  658   1HG   LYS  84          2HG       LYS  84  -8.537   9.192 -10.804
  659   2HG   LYS  84          3HG       LYS  84  -8.289  10.919 -10.489
  660   1HD   LYS  84          2HD       LYS  84  -6.890  10.920 -12.697
  661   2HD   LYS  84          3HD       LYS  84  -7.532   9.294 -12.956
  662   1HE   LYS  84          2HE       LYS  84  -8.981  10.692 -14.178
  663   2HE   LYS  84          3HE       LYS  84  -9.872  10.289 -12.705
  664   1HZ   LYS  84          1HZ       LYS  84  -8.375  12.802 -13.190
  665   2HZ   LYS  84          2HZ       LYS  84 -10.011  12.650 -13.190
  666   3HZ   LYS  84          3HZ       LYS  84  -9.164  12.437 -11.796
  667    H    MET  85           H        MET  85  -5.354   7.060 -10.158
  668    HA   MET  85           HA       MET  85  -7.654   5.315 -10.431
  669   1HB   MET  85          2HB       MET  85  -4.982   5.381 -11.479
  670   2HB   MET  85          3HB       MET  85  -5.148   3.841 -10.631
  671   1HG   MET  85          2HG       MET  85  -7.303   3.452 -11.855
  672   2HG   MET  85          3HG       MET  85  -7.020   4.949 -12.754
  673   1HE   MET  85          1HE       MET  85  -7.308   3.776 -15.052
  674   2HE   MET  85          2HE       MET  85  -6.477   2.276 -15.520
  675   3HE   MET  85          3HE       MET  85  -7.677   2.251 -14.206
  676    H    LEU  86           H        LEU  86  -4.970   5.386  -8.087
  677    HA   LEU  86           HA       LEU  86  -5.503   2.996  -6.707
  678   1HB   LEU  86          2HB       LEU  86  -3.450   4.282  -6.570
  679   2HB   LEU  86          3HB       LEU  86  -4.289   5.653  -5.840
  680    HG   LEU  86           HG       LEU  86  -4.572   4.507  -3.759
  681   1HD1  LEU  86          1HD1      LEU  86  -3.664   2.085  -5.296
  682   2HD1  LEU  86          2HD1      LEU  86  -3.644   2.144  -3.506
  683   3HD1  LEU  86          3HD1      LEU  86  -5.162   2.271  -4.411
  684   1HD2  LEU  86          1HD2      LEU  86  -2.309   5.468  -4.307
  685   2HD2  LEU  86          2HD2      LEU  86  -2.216   4.105  -3.173
  686   3HD2  LEU  86          3HD2      LEU  86  -1.805   3.886  -4.890
  687    H    MET  87           H        MET  87  -6.710   6.321  -6.010
  688    HA   MET  87           HA       MET  87  -8.252   5.731  -3.729
  689   1HB   MET  87          2HB       MET  87  -7.775   7.995  -4.563
  690   2HB   MET  87          3HB       MET  87  -8.790   7.715  -5.983
  691   1HG   MET  87          2HG       MET  87 -10.771   7.483  -4.548
  692   2HG   MET  87          3HG       MET  87  -9.771   7.669  -3.100
  693   1HE   MET  87          1HE       MET  87 -11.715   9.450  -2.480
  694   2HE   MET  87          2HE       MET  87 -12.015  10.939  -3.411
  695   3HE   MET  87          3HE       MET  87 -12.461   9.358  -4.094
  696    H    ALA  88           H        ALA  88  -9.241   5.521  -7.167
  697    HA   ALA  88           HA       ALA  88 -11.878   4.471  -6.606
  698   1HB   ALA  88          1HB       ALA  88 -10.164   4.507  -9.141
  699   2HB   ALA  88          2HB       ALA  88 -11.892   4.083  -9.068
  700   3HB   ALA  88          3HB       ALA  88 -11.360   5.723  -8.647
  701    H    ALA  89           H        ALA  89  -8.927   2.861  -7.935
  702    HA   ALA  89           HA       ALA  89 -10.213   0.306  -8.087
  703   1HB   ALA  89          1HB       ALA  89  -7.262   1.052  -8.293
  704   2HB   ALA  89          2HB       ALA  89  -8.009  -0.458  -8.857
  705   3HB   ALA  89          3HB       ALA  89  -8.434   1.082  -9.631
  706    H    GLY  90           H        GLY  90  -8.290   1.794  -5.491
  707   1HA   GLY  90          2HA       GLY  90  -7.774  -0.705  -4.085
  708   2HA   GLY  90          3HA       GLY  90  -7.604   0.946  -3.471
  709    H    ASP  91           H        ASP  91 -10.157   1.979  -3.712
  710    HA   ASP  91           HA       ASP  91 -11.658   0.762  -1.554
  711   1HB   ASP  91          2HB       ASP  91 -11.531   3.140  -1.806
  712   2HB   ASP  91          3HB       ASP  91 -12.264   3.051  -3.418
  713    H    LYS  92           H        LYS  92 -11.557  -1.338  -3.250
  714    HA   LYS  92           HA       LYS  92 -13.697  -1.608  -5.174
  715   1HB   LYS  92          2HB       LYS  92 -12.282  -3.571  -3.359
  716   2HB   LYS  92          3HB       LYS  92 -13.549  -4.110  -4.449
  717   1HG   LYS  92          2HG       LYS  92 -11.105  -2.595  -5.447
  718   2HG   LYS  92          3HG       LYS  92 -11.166  -4.355  -5.288
  719   1HD   LYS  92          2HD       LYS  92 -13.145  -4.428  -6.794
  720   2HD   LYS  92          3HD       LYS  92 -12.921  -2.692  -7.121
  721   1HE   LYS  92          2HE       LYS  92 -10.704  -3.083  -8.026
  722   2HE   LYS  92          3HE       LYS  92 -10.698  -4.763  -7.462
  723   1HZ   LYS  92          1HZ       LYS  92 -12.551  -3.729  -9.517
  724   2HZ   LYS  92          2HZ       LYS  92 -11.189  -4.623  -9.811
  725   3HZ   LYS  92          3HZ       LYS  92 -12.426  -5.291  -8.986
  726    H    ASP  93           H        ASP  93 -13.933  -1.218  -1.844
  727    HA   ASP  93           HA       ASP  93 -16.539  -2.536  -1.420
  728   1HB   ASP  93          2HB       ASP  93 -14.737  -2.631   0.238
  729   2HB   ASP  93          3HB       ASP  93 -14.654  -0.871   0.279
  730    H    GLY  94           H        GLY  94 -15.412   0.637  -2.478
  731   1HA   GLY  94          2HA       GLY  94 -16.670   2.417  -3.163
  732   2HA   GLY  94          3HA       GLY  94 -18.135   1.543  -2.731
  733    H    ASP  95           H        ASP  95 -15.647   2.231  -0.334
  734    HA   ASP  95           HA       ASP  95 -17.568   4.196   0.953
  735   1HB   ASP  95          2HB       ASP  95 -17.284   3.447   2.986
  736   2HB   ASP  95          3HB       ASP  95 -16.775   1.963   2.204
  737    H    GLY  96           H        GLY  96 -14.989   4.249  -0.903
  738   1HA   GLY  96          2HA       GLY  96 -13.743   5.811  -1.742
  739   2HA   GLY  96          3HA       GLY  96 -14.371   7.013  -0.581
  740    H    LYS  97           H        LYS  97 -12.908   4.267   0.857
  741    HA   LYS  97           HA       LYS  97 -10.146   5.400   0.861
  742   1HB   LYS  97          2HB       LYS  97 -11.728   4.571   3.338
  743   2HB   LYS  97          3HB       LYS  97  -9.993   4.855   3.284
  744   1HG   LYS  97          2HG       LYS  97 -10.540   6.957   3.935
  745   2HG   LYS  97          3HG       LYS  97 -10.756   7.199   2.212
  746   1HD   LYS  97          2HD       LYS  97 -12.628   8.165   3.296
  747   2HD   LYS  97          3HD       LYS  97 -13.210   6.685   2.527
  748   1HE   LYS  97          2HE       LYS  97 -12.607   5.657   4.951
  749   2HE   LYS  97          3HE       LYS  97 -12.834   7.341   5.442
  750   1HZ   LYS  97          1HZ       LYS  97 -14.760   5.458   4.222
  751   2HZ   LYS  97          2HZ       LYS  97 -14.933   6.292   5.598
  752   3HZ   LYS  97          3HZ       LYS  97 -15.045   7.073   4.128
  753    H    ILE  98           H        ILE  98  -8.568   3.844   1.514
  754    HA   ILE  98           HA       ILE  98  -9.231   1.069   0.598
  755    HB   ILE  98           HB       ILE  98  -6.650   2.518   1.175
  756   1HG1  ILE  98          2HG       ILE  98  -7.718   0.961  -1.194
  757   2HG1  ILE  98          3HG       ILE  98  -7.844   2.708  -0.995
  758   1HG2  ILE  98          1HG       ILE  98  -6.788  -0.483   0.680
  759   2HG2  ILE  98          2HG       ILE  98  -5.313   0.487   0.800
  760   3HG2  ILE  98          3HG       ILE  98  -6.300   0.243   2.229
  761   1HD1  ILE  98          1HD1      ILE  98  -5.354   1.092  -1.506
  762   2HD1  ILE  98          2HD1      ILE  98  -6.064   2.429  -2.428
  763   3HD1  ILE  98          3HD1      ILE  98  -5.284   2.759  -0.869
  764    H    GLY  99           H        GLY  99  -9.814  -0.420   1.911
  765   1HA   GLY  99          2HA       GLY  99  -9.202  -0.208   4.869
  766   2HA   GLY  99          3HA       GLY  99 -10.602  -1.040   4.180
  767    H    VAL 100           H        VAL 100  -8.162  -1.885   5.860
  768    HA   VAL 100           HA       VAL 100  -6.370  -3.443   4.604
  769    HB   VAL 100           HB       VAL 100  -6.381  -3.021   6.983
  770   1HG1  VAL 100          1HG       VAL 100  -8.356  -5.280   7.397
  771   2HG1  VAL 100          2HG       VAL 100  -7.532  -4.307   8.624
  772   3HG1  VAL 100          3HG       VAL 100  -8.735  -3.547   7.576
  773   1HG2  VAL 100          1HG       VAL 100  -4.983  -4.828   5.920
  774   2HG2  VAL 100          2HG       VAL 100  -5.294  -5.029   7.643
  775   3HG2  VAL 100          3HG       VAL 100  -6.194  -6.006   6.482
  776    H    ASP 101           H        ASP 101  -9.599  -4.758   5.416
  777    HA   ASP 101           HA       ASP 101  -9.087  -7.444   4.693
  778   1HB   ASP 101          2HB       ASP 101 -11.004  -6.400   6.020
  779   2HB   ASP 101          3HB       ASP 101 -11.736  -5.954   4.478
  780    H    GLU 102           H        GLU 102 -10.234  -4.717   2.801
  781    HA   GLU 102           HA       GLU 102 -10.499  -5.974   0.215
  782   1HB   GLU 102          2HB       GLU 102  -9.655  -3.103   0.655
  783   2HB   GLU 102          3HB       GLU 102 -10.581  -3.757  -0.665
  784   1HG   GLU 102          2HG       GLU 102 -12.584  -3.679   0.484
  785   2HG   GLU 102          3HG       GLU 102 -11.846  -3.805   2.077
  786    H    PHE 103           H        PHE 103  -7.941  -3.904   1.678
  787    HA   PHE 103           HA       PHE 103  -6.225  -4.094  -0.522
  788   1HB   PHE 103          2HB       PHE 103  -6.344  -2.514   1.608
  789   2HB   PHE 103          3HB       PHE 103  -5.161  -3.619   2.264
  790    HD1  PHE 103           1HD      PHE 103  -5.508  -2.287  -1.297
  791    HD2  PHE 103           2HD      PHE 103  -3.262  -2.216   2.395
  792    HE1  PHE 103           1HE      PHE 103  -3.814  -0.869  -2.358
  793    HE2  PHE 103           2HE      PHE 103  -1.595  -0.746   1.329
  794    HZ   PHE 103           HZ       PHE 103  -1.839  -0.080  -1.058
  795    H    SER 104           H        SER 104  -6.411  -6.247   2.204
  796    HA   SER 104           HA       SER 104  -4.136  -7.922   1.795
  797   1HB   SER 104          2HB       SER 104  -5.665  -7.936   3.752
  798   2HB   SER 104          3HB       SER 104  -6.965  -8.565   2.735
  799    HG   SER 104           HG       SER 104  -6.005 -10.284   3.754
  800    H    THR 105           H        THR 105  -7.235  -7.764   0.039
  801    HA   THR 105           HA       THR 105  -6.663 -10.342  -1.328
  802    HB   THR 105           HB       THR 105  -9.123 -10.547  -1.388
  803    HG1  THR 105           1HG      THR 105  -9.348  -8.571   0.627
  804   1HG2  THR 105          1HG       THR 105  -7.974 -10.174   1.399
  805   2HG2  THR 105          2HG       THR 105  -9.326 -11.230   0.938
  806   3HG2  THR 105          3HG       THR 105  -7.672 -11.584   0.367
  807    H    LEU 106           H        LEU 106  -7.580  -7.058  -1.852
  808    HA   LEU 106           HA       LEU 106  -8.092  -6.829  -4.589
  809   1HB   LEU 106          2HB       LEU 106  -6.796  -5.220  -2.469
  810   2HB   LEU 106          3HB       LEU 106  -5.964  -4.986  -3.964
  811    HG   LEU 106           HG       LEU 106  -7.595  -3.276  -3.667
  812   1HD1  LEU 106          1HD1      LEU 106  -8.486  -5.177  -5.883
  813   2HD1  LEU 106          2HD1      LEU 106  -8.840  -3.457  -5.776
  814   3HD1  LEU 106          3HD1      LEU 106  -7.169  -3.996  -5.977
  815   1HD2  LEU 106          1HD2      LEU 106  -9.133  -4.629  -2.230
  816   2HD2  LEU 106          2HD2      LEU 106  -9.923  -3.620  -3.429
  817   3HD2  LEU 106          3HD2      LEU 106  -9.780  -5.385  -3.697
  818    H    VAL 107           H        VAL 107  -5.158  -7.768  -3.059
  819    HA   VAL 107           HA       VAL 107  -3.561  -7.832  -5.537
  820    HB   VAL 107           HB       VAL 107  -1.720  -8.284  -3.986
  821   1HG1  VAL 107          1HG       VAL 107  -3.466  -5.885  -3.199
  822   2HG1  VAL 107          2HG       VAL 107  -1.722  -5.976  -3.078
  823   3HG1  VAL 107          3HG       VAL 107  -2.476  -5.973  -4.669
  824   1HG2  VAL 107          1HG       VAL 107  -3.188  -9.416  -2.182
  825   2HG2  VAL 107          2HG       VAL 107  -1.989  -8.283  -1.618
  826   3HG2  VAL 107          3HG       VAL 107  -3.671  -7.784  -1.700
  827    H    ALA 108           H        ALA 108  -5.382  -9.974  -3.662
  828    HA   ALA 108           HA       ALA 108  -4.119 -12.450  -4.601
  829   1HB   ALA 108          1HB       ALA 108  -6.807 -12.019  -3.290
  830   2HB   ALA 108          2HB       ALA 108  -5.928 -13.547  -3.499
  831   3HB   ALA 108          3HB       ALA 108  -5.272 -12.287  -2.425
  832    H    GLU 109           H        GLU 109  -6.552 -10.104  -5.722
  833    HA   GLU 109           HA       GLU 109  -7.344 -11.539  -8.084
  834   1HB   GLU 109          2HB       GLU 109  -6.834  -8.546  -7.882
  835   2HB   GLU 109          3HB       GLU 109  -7.748  -9.386  -9.116
  836   1HG   GLU 109          2HG       GLU 109  -9.372 -10.119  -7.297
  837   2HG   GLU 109          3HG       GLU 109  -8.557  -8.977  -6.226
  838    H    SER 110           H        SER 110  -4.201 -10.481  -7.163
  839    HA   SER 110           HA       SER 110  -2.248 -10.113  -8.334
  840   1HB   SER 110          2HB       SER 110  -1.357 -12.207  -8.945
  841   2HB   SER 110          3HB       SER 110  -2.454 -12.436  -7.573
  842    HG   SER 110           HG       SER 110  -2.806 -14.016  -9.197
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1   3.826  -2.073  11.939
    2   2H    MET   1           H2       MET   1   2.658  -2.814  12.820
    3   3H    MET   1           H3       MET   1   3.793  -3.711  12.044
    4    HA   MET   1           HA       MET   1   4.339  -1.881  14.295
    5   1HB   MET   1          2HB       MET   1   4.020  -4.892  14.145
    6   2HB   MET   1          3HB       MET   1   4.995  -4.143  15.404
    7   1HG   MET   1          2HG       MET   1   2.103  -3.401  14.891
    8   2HG   MET   1          3HG       MET   1   2.601  -4.676  16.000
    9   1HE   MET   1          1HE       MET   1   4.988  -3.832  17.671
   10   2HE   MET   1          2HE       MET   1   4.216  -2.923  18.985
   11   3HE   MET   1          3HE       MET   1   3.448  -4.396  18.358
   12    H    SER   2           H        SER   2   5.927  -0.900  12.695
   13    HA   SER   2           HA       SER   2   7.923  -0.612  11.786
   14   1HB   SER   2          2HB       SER   2   8.770  -1.358  14.012
   15   2HB   SER   2          3HB       SER   2   9.027  -2.976  13.313
   16    HG   SER   2           HG       SER   2  10.875  -1.607  13.118
   17    H    MET   3           H        MET   3   7.657  -0.883   9.675
   18    HA   MET   3           HA       MET   3   7.239  -3.476   8.473
   19   1HB   MET   3          2HB       MET   3   6.407  -1.021   7.782
   20   2HB   MET   3          3HB       MET   3   7.835  -1.081   6.779
   21   1HG   MET   3          2HG       MET   3   6.451  -2.153   5.333
   22   2HG   MET   3          3HG       MET   3   6.766  -3.574   6.293
   23   1HE   MET   3          1HE       MET   3   5.096  -3.051   9.000
   24   2HE   MET   3          2HE       MET   3   3.535  -3.770   8.591
   25   3HE   MET   3          3HE       MET   3   5.026  -4.590   8.096
   26    H    THR   4           H        THR   4   9.021  -4.485   9.215
   27    HA   THR   4           HA       THR   4  11.316  -4.774   7.429
   28    HB   THR   4           HB       THR   4  11.527  -3.241  10.033
   29    HG1  THR   4           1HG      THR   4  11.497  -2.400   7.813
   30   1HG2  THR   4          1HG       THR   4  13.813  -4.860   8.841
   31   2HG2  THR   4          2HG       THR   4  13.995  -3.531  10.000
   32   3HG2  THR   4          3HG       THR   4  13.138  -5.001  10.477
   33    H    ASP   5           H        ASP   5  10.114  -5.225  10.763
   34    HA   ASP   5           HA       ASP   5  11.268  -7.900  11.014
   35   1HB   ASP   5          2HB       ASP   5  11.271  -6.100  12.777
   36   2HB   ASP   5          3HB       ASP   5   9.515  -6.226  12.872
   37    H    LEU   6           H        LEU   6   8.025  -6.446  10.892
   38    HA   LEU   6           HA       LEU   6   6.516  -8.856  11.255
   39   1HB   LEU   6          2HB       LEU   6   5.956  -6.025  10.377
   40   2HB   LEU   6          3HB       LEU   6   4.719  -7.230  10.093
   41    HG   LEU   6           HG       LEU   6   4.597  -5.854  12.229
   42   1HD1  LEU   6          1HD1      LEU   6   4.447  -8.875  12.457
   43   2HD1  LEU   6          2HD1      LEU   6   3.687  -7.718  13.571
   44   3HD1  LEU   6          3HD1      LEU   6   3.176  -7.800  11.867
   45   1HD2  LEU   6          1HD2      LEU   6   6.991  -6.215  12.974
   46   2HD2  LEU   6          2HD2      LEU   6   5.782  -6.585  14.208
   47   3HD2  LEU   6          3HD2      LEU   6   6.584  -7.893  13.329
   48    H    LEU   7           H        LEU   7   6.742  -6.968   8.228
   49    HA   LEU   7           HA       LEU   7   6.314  -9.315   6.546
   50   1HB   LEU   7          2HB       LEU   7   7.058  -6.430   6.022
   51   2HB   LEU   7          3HB       LEU   7   7.100  -7.623   4.715
   52    HG   LEU   7           HG       LEU   7   4.588  -7.122   6.324
   53   1HD1  LEU   7          1HD1      LEU   7   5.562  -5.888   3.710
   54   2HD1  LEU   7          2HD1      LEU   7   3.898  -5.810   4.269
   55   3HD1  LEU   7          3HD1      LEU   7   5.179  -5.042   5.217
   56   1HD2  LEU   7          1HD2      LEU   7   4.830  -9.294   4.980
   57   2HD2  LEU   7          2HD2      LEU   7   3.504  -8.250   4.496
   58   3HD2  LEU   7          3HD2      LEU   7   5.000  -8.299   3.528
   59    H    ASN   8           H        ASN   8   8.904  -7.669   5.208
   60    HA   ASN   8           HA       ASN   8  11.155  -8.894   6.549
   61   1HB   ASN   8          2HB       ASN   8  10.000 -10.071   3.983
   62   2HB   ASN   8          3HB       ASN   8  11.739 -10.065   4.228
   63   1HD2  ASN   8          2HD2      ASN   8  12.557 -11.079   6.337
   64   2HD2  ASN   8          1HD2      ASN   8  11.655 -12.518   6.811
   65    H    ALA   9           H        ALA   9  12.575  -7.192   6.375
   66    HA   ALA   9           HA       ALA   9  12.394  -4.994   4.698
   67   1HB   ALA   9          1HB       ALA   9  14.898  -6.242   5.882
   68   2HB   ALA   9          2HB       ALA   9  14.769  -4.587   5.241
   69   3HB   ALA   9          3HB       ALA   9  13.809  -5.059   6.647
   70    H    GLU  10           H        GLU  10  13.970  -8.064   3.889
   71    HA   GLU  10           HA       GLU  10  15.256  -7.329   1.450
   72   1HB   GLU  10          2HB       GLU  10  14.102  -9.970   2.441
   73   2HB   GLU  10          3HB       GLU  10  15.080  -9.797   0.974
   74   1HG   GLU  10          2HG       GLU  10  16.959  -8.903   2.314
   75   2HG   GLU  10          3HG       GLU  10  16.000  -9.056   3.790
   76    H    ASP  11           H        ASP  11  12.098  -9.076   1.824
   77    HA   ASP  11           HA       ASP  11  11.149  -8.799  -0.782
   78   1HB   ASP  11          2HB       ASP  11   9.524  -8.859   1.785
   79   2HB   ASP  11          3HB       ASP  11   9.034  -9.360   0.168
   80    H    ILE  12           H        ILE  12  10.759  -6.569   1.988
   81    HA   ILE  12           HA       ILE  12   9.271  -4.517   0.703
   82    HB   ILE  12           HB       ILE  12  10.961  -4.761   3.107
   83   1HG1  ILE  12          2HG       ILE  12   9.044  -3.072   3.890
   84   2HG1  ILE  12          3HG       ILE  12   8.268  -3.552   2.388
   85   1HG2  ILE  12          1HG       ILE  12  10.552  -1.993   1.963
   86   2HG2  ILE  12          2HG       ILE  12  11.133  -2.405   3.608
   87   3HG2  ILE  12          3HG       ILE  12  12.128  -2.814   2.212
   88   1HD1  ILE  12          1HD1      ILE  12   9.206  -5.356   4.658
   89   2HD1  ILE  12          2HD1      ILE  12   7.539  -4.885   4.297
   90   3HD1  ILE  12          3HD1      ILE  12   8.422  -5.940   3.164
   91    H    LYS  13           H        LYS  13  12.798  -5.118   0.452
   92    HA   LYS  13           HA       LYS  13  13.323  -2.666  -0.927
   93   1HB   LYS  13          2HB       LYS  13  15.423  -3.313  -0.894
   94   2HB   LYS  13          3HB       LYS  13  14.892  -4.699   0.039
   95   1HG   LYS  13          2HG       LYS  13  14.752  -6.021  -2.119
   96   2HG   LYS  13          3HG       LYS  13  15.371  -4.597  -2.973
   97   1HD   LYS  13          2HD       LYS  13  17.418  -4.661  -1.558
   98   2HD   LYS  13          3HD       LYS  13  16.801  -6.130  -0.758
   99   1HE   LYS  13          2HE       LYS  13  16.744  -7.309  -2.907
  100   2HE   LYS  13          3HE       LYS  13  17.238  -5.836  -3.759
  101   1HZ   LYS  13          1HZ       LYS  13  18.882  -7.287  -1.762
  102   2HZ   LYS  13          2HZ       LYS  13  19.127  -7.305  -3.387
  103   3HZ   LYS  13          3HZ       LYS  13  19.332  -5.913  -2.542
  104    H    LYS  14           H        LYS  14  12.321  -5.813  -2.189
  105    HA   LYS  14           HA       LYS  14  12.179  -4.902  -4.991
  106   1HB   LYS  14          2HB       LYS  14  11.188  -7.366  -3.510
  107   2HB   LYS  14          3HB       LYS  14  10.584  -6.960  -5.124
  108   1HG   LYS  14          2HG       LYS  14  12.853  -6.904  -6.033
  109   2HG   LYS  14          3HG       LYS  14  13.517  -7.382  -4.455
  110   1HD   LYS  14          2HD       LYS  14  12.454  -9.542  -4.566
  111   2HD   LYS  14          3HD       LYS  14  11.371  -9.027  -5.861
  112   1HE   LYS  14          2HE       LYS  14  13.036 -10.471  -6.815
  113   2HE   LYS  14          3HE       LYS  14  13.245  -8.829  -7.433
  114   1HZ   LYS  14          1HZ       LYS  14  14.850 -10.071  -5.277
  115   2HZ   LYS  14          2HZ       LYS  14  15.357  -9.814  -6.823
  116   3HZ   LYS  14          3HZ       LYS  14  15.040  -8.534  -5.839
  117    H    ALA  15           H        ALA  15   9.865  -5.073  -2.303
  118    HA   ALA  15           HA       ALA  15   7.557  -4.305  -3.706
  119   1HB   ALA  15          1HB       ALA  15   8.147  -3.294  -0.900
  120   2HB   ALA  15          2HB       ALA  15   6.657  -3.945  -1.585
  121   3HB   ALA  15          3HB       ALA  15   8.016  -5.025  -1.227
  122    H    VAL  16           H        VAL  16   9.777  -2.107  -1.885
  123    HA   VAL  16           HA       VAL  16   8.591   0.325  -2.811
  124    HB   VAL  16           HB       VAL  16  11.442  -0.200  -1.885
  125   1HG1  VAL  16          1HG       VAL  16   9.920   2.429  -2.129
  126   2HG1  VAL  16          2HG       VAL  16  11.493   2.214  -1.332
  127   3HG1  VAL  16          3HG       VAL  16  11.348   1.953  -3.072
  128   1HG2  VAL  16          1HG       VAL  16   9.687  -0.748  -0.179
  129   2HG2  VAL  16          2HG       VAL  16  10.677   0.643   0.260
  130   3HG2  VAL  16          3HG       VAL  16   9.032   0.892  -0.362
  131    H    GLY  17           H        GLY  17  11.106  -1.740  -4.271
  132   1HA   GLY  17          2HA       GLY  17  11.700  -0.076  -6.527
  133   2HA   GLY  17          3HA       GLY  17  11.965  -1.811  -6.390
  134    H    ALA  18           H        ALA  18   8.892  -2.142  -5.911
  135    HA   ALA  18           HA       ALA  18   8.173  -2.553  -8.688
  136   1HB   ALA  18          1HB       ALA  18   6.452  -2.837  -6.190
  137   2HB   ALA  18          2HB       ALA  18   6.242  -3.635  -7.747
  138   3HB   ALA  18          3HB       ALA  18   7.624  -4.054  -6.728
  139    H    PHE  19           H        PHE  19   6.755  -0.537  -6.083
  140    HA   PHE  19           HA       PHE  19   5.209   1.182  -7.913
  141   1HB   PHE  19          2HB       PHE  19   5.949   1.489  -4.982
  142   2HB   PHE  19          3HB       PHE  19   4.826   2.516  -5.867
  143    HD1  PHE  19           1HD      PHE  19   3.638  -0.151  -7.387
  144    HD2  PHE  19           2HD      PHE  19   4.051   1.212  -3.305
  145    HE1  PHE  19           1HE      PHE  19   1.710  -1.424  -6.743
  146    HE2  PHE  19           2HE      PHE  19   2.090  -0.161  -2.651
  147    HZ   PHE  19           HZ       PHE  19   0.926  -1.508  -4.357
  148    H    SER  20           H        SER  20   8.529   1.053  -7.501
  149    HA   SER  20           HA       SER  20   9.234   3.848  -7.277
  150   1HB   SER  20          2HB       SER  20  10.835   2.148  -6.627
  151   2HB   SER  20          3HB       SER  20  10.814   1.454  -8.265
  152    HG   SER  20           HG       SER  20  11.518   3.476  -9.007
  153    H    ALA  21           H        ALA  21   7.325   4.061  -9.030
  154    HA   ALA  21           HA       ALA  21   8.565   4.868 -11.589
  155   1HB   ALA  21          1HB       ALA  21   6.136   3.028 -11.335
  156   2HB   ALA  21          2HB       ALA  21   6.813   3.638 -12.862
  157   3HB   ALA  21          3HB       ALA  21   7.752   2.509 -11.870
  158    H    THR  22           H        THR  22   6.484   5.745 -12.953
  159    HA   THR  22           HA       THR  22   4.912   7.604 -11.215
  160    HB   THR  22           HB       THR  22   4.778   9.023 -13.247
  161    HG1  THR  22           1HG      THR  22   5.172   7.190 -14.648
  162   1HG2  THR  22          1HG       THR  22   7.673   8.386 -12.556
  163   2HG2  THR  22          2HG       THR  22   7.038   9.887 -13.258
  164   3HG2  THR  22          3HG       THR  22   6.597   9.433 -11.599
  165    H    ASP  23           H        ASP  23   2.777   7.185 -11.174
  166    HA   ASP  23           HA       ASP  23   0.660   6.489 -11.727
  167   1HB   ASP  23          2HB       ASP  23   1.527   6.954 -14.540
  168   2HB   ASP  23          3HB       ASP  23  -0.095   7.059 -13.823
  169    H    SER  24           H        SER  24   2.683   4.254 -11.725
  170    HA   SER  24           HA       SER  24   1.649   2.431 -13.887
  171   1HB   SER  24          2HB       SER  24   4.394   2.556 -12.609
  172   2HB   SER  24          3HB       SER  24   3.883   1.402 -13.851
  173    HG   SER  24           HG       SER  24   3.918   4.264 -14.166
  174    H    PHE  25           H        PHE  25   1.185   2.915 -10.799
  175    HA   PHE  25           HA       PHE  25   2.007   1.386  -9.114
  176   1HB   PHE  25          2HB       PHE  25   0.077   3.023  -9.016
  177   2HB   PHE  25          3HB       PHE  25  -1.024   1.705  -9.183
  178    HD1  PHE  25           1HD      PHE  25  -1.620   0.409  -7.228
  179    HD2  PHE  25           2HD      PHE  25   1.674   3.182  -7.067
  180    HE1  PHE  25           1HE      PHE  25  -1.574   0.218  -4.746
  181    HE2  PHE  25           2HE      PHE  25   1.704   2.996  -4.594
  182    HZ   PHE  25           HZ       PHE  25   0.057   1.542  -3.429
  183    H    ASP  26           H        ASP  26   2.662  -0.804  -9.753
  184    HA   ASP  26           HA       ASP  26   0.825  -2.768 -10.697
  185   1HB   ASP  26          2HB       ASP  26   2.743  -4.101 -11.007
  186   2HB   ASP  26          3HB       ASP  26   3.179  -2.455 -11.431
  187    H    HIS  27           H        HIS  27  -0.176  -2.076  -8.289
  188    HA   HIS  27           HA       HIS  27   0.544  -3.061  -5.908
  189   1HB   HIS  27          2HB       HIS  27  -1.886  -3.210  -5.291
  190   2HB   HIS  27          3HB       HIS  27  -1.332  -1.717  -6.012
  191    HD1  HIS  27           HD1      HIS  27  -1.999  -1.428  -8.798
  192    HD2  HIS  27           HD2      HIS  27  -4.088  -4.172  -6.338
  193    HE1  HIS  27           HE1      HIS  27  -4.243  -1.883  -9.915
  194    H    LYS  28           H        LYS  28  -1.175  -5.120  -8.132
  195    HA   LYS  28           HA       LYS  28  -1.366  -7.580  -6.749
  196   1HB   LYS  28          2HB       LYS  28  -0.533  -7.534  -9.666
  197   2HB   LYS  28          3HB       LYS  28  -1.650  -8.583  -8.811
  198   1HG   LYS  28          2HG       LYS  28  -3.102  -7.333 -10.025
  199   2HG   LYS  28          3HG       LYS  28  -3.098  -6.378  -8.550
  200   1HD   LYS  28          2HD       LYS  28  -2.747  -4.634 -10.006
  201   2HD   LYS  28          3HD       LYS  28  -1.063  -5.152  -9.975
  202   1HE   LYS  28          2HE       LYS  28  -1.542  -4.970 -12.250
  203   2HE   LYS  28          3HE       LYS  28  -1.635  -6.705 -11.923
  204   1HZ   LYS  28          1HZ       LYS  28  -3.920  -4.831 -12.180
  205   2HZ   LYS  28          2HZ       LYS  28  -3.543  -6.052 -13.215
  206   3HZ   LYS  28          3HZ       LYS  28  -4.109  -6.378 -11.699
  207    H    LYS  29           H        LYS  29   1.364  -6.358  -8.671
  208    HA   LYS  29           HA       LYS  29   3.178  -8.616  -8.227
  209   1HB   LYS  29          2HB       LYS  29   3.207  -5.988  -9.709
  210   2HB   LYS  29          3HB       LYS  29   4.750  -6.687  -9.273
  211   1HG   LYS  29          2HG       LYS  29   2.627  -8.304 -10.729
  212   2HG   LYS  29          3HG       LYS  29   3.718  -7.215 -11.582
  213   1HD   LYS  29          2HD       LYS  29   5.283  -8.871  -9.756
  214   2HD   LYS  29          3HD       LYS  29   4.235  -9.905 -10.739
  215   1HE   LYS  29          2HE       LYS  29   5.071  -8.882 -12.798
  216   2HE   LYS  29          3HE       LYS  29   6.003  -7.693 -11.876
  217   1HZ   LYS  29          1HZ       LYS  29   6.463 -10.616 -11.796
  218   2HZ   LYS  29          2HZ       LYS  29   7.372  -9.543 -12.651
  219   3HZ   LYS  29          3HZ       LYS  29   7.348  -9.475 -11.007
  220    H    PHE  30           H        PHE  30   2.954  -5.198  -7.108
  221    HA   PHE  30           HA       PHE  30   5.107  -5.191  -5.270
  222   1HB   PHE  30          2HB       PHE  30   3.713  -3.238  -5.733
  223   2HB   PHE  30          3HB       PHE  30   2.346  -3.970  -4.911
  224    HD1  PHE  30           1HD      PHE  30   2.559  -4.501  -2.349
  225    HD2  PHE  30           2HD      PHE  30   5.242  -1.913  -4.509
  226    HE1  PHE  30           1HE      PHE  30   3.390  -3.594  -0.227
  227    HE2  PHE  30           2HE      PHE  30   6.026  -0.956  -2.367
  228    HZ   PHE  30           HZ       PHE  30   5.135  -1.821  -0.219
  229    H    PHE  31           H        PHE  31   1.719  -6.211  -4.502
  230    HA   PHE  31           HA       PHE  31   2.286  -7.112  -1.879
  231   1HB   PHE  31          2HB       PHE  31   0.055  -7.444  -3.818
  232   2HB   PHE  31          3HB       PHE  31   0.174  -8.651  -2.567
  233    HD1  PHE  31           1HD      PHE  31  -0.950  -8.325  -0.581
  234    HD2  PHE  31           2HD      PHE  31   0.248  -4.879  -2.873
  235    HE1  PHE  31           1HE      PHE  31  -2.075  -6.858   1.051
  236    HE2  PHE  31           2HE      PHE  31  -0.923  -3.408  -1.241
  237    HZ   PHE  31           HZ       PHE  31  -2.110  -4.422   0.697
  238    H    GLN  32           H        GLN  32   2.612  -8.852  -4.942
  239    HA   GLN  32           HA       GLN  32   3.150 -11.433  -3.702
  240   1HB   GLN  32          2HB       GLN  32   3.701 -10.263  -6.477
  241   2HB   GLN  32          3HB       GLN  32   4.120 -11.918  -6.044
  242   1HG   GLN  32          2HG       GLN  32   1.879 -12.592  -5.849
  243   2HG   GLN  32          3HG       GLN  32   1.278 -10.950  -5.651
  244   1HE2  GLN  32          2HE       GLN  32   0.106 -10.321  -7.423
  245   2HE2  GLN  32          1HE       GLN  32   0.453 -10.910  -9.068
  246    H    MET  33           H        MET  33   5.234  -8.896  -5.178
  247    HA   MET  33           HA       MET  33   7.763 -10.062  -4.684
  248   1HB   MET  33          2HB       MET  33   6.796  -7.208  -5.108
  249   2HB   MET  33          3HB       MET  33   8.500  -7.596  -4.919
  250   1HG   MET  33          2HG       MET  33   8.537  -8.974  -6.865
  251   2HG   MET  33          3HG       MET  33   6.779  -8.952  -7.015
  252   1HE   MET  33          1HE       MET  33   8.926  -8.314  -9.371
  253   2HE   MET  33          2HE       MET  33   9.271  -6.586  -9.626
  254   3HE   MET  33          3HE       MET  33  10.030  -7.450  -8.271
  255    H    VAL  34           H        VAL  34   5.880  -7.846  -2.629
  256    HA   VAL  34           HA       VAL  34   7.886  -7.711  -0.511
  257    HB   VAL  34           HB       VAL  34   6.092  -6.023  -1.184
  258   1HG1  VAL  34          1HG       VAL  34   4.368  -7.589   0.682
  259   2HG1  VAL  34          2HG       VAL  34   3.982  -6.093  -0.212
  260   3HG1  VAL  34          3HG       VAL  34   4.214  -7.626  -1.076
  261   1HG2  VAL  34          1HG       VAL  34   7.547  -5.841   0.868
  262   2HG2  VAL  34          2HG       VAL  34   5.952  -5.081   1.047
  263   3HG2  VAL  34          3HG       VAL  34   6.287  -6.664   1.781
  264    H    GLY  35           H        GLY  35   5.786 -10.251  -1.435
  265   1HA   GLY  35          2HA       GLY  35   5.090 -12.165  -0.408
  266   2HA   GLY  35          3HA       GLY  35   6.113 -11.747   0.969
  267    H    LEU  36           H        LEU  36   3.523  -9.544   0.034
  268    HA   LEU  36           HA       LEU  36   2.609  -9.398   2.726
  269   1HB   LEU  36          2HB       LEU  36   1.915  -8.140   0.130
  270   2HB   LEU  36          3HB       LEU  36   0.511  -8.346   1.175
  271    HG   LEU  36           HG       LEU  36   3.039  -7.100   2.228
  272   1HD1  LEU  36          1HD1      LEU  36   0.641  -5.441   1.475
  273   2HD1  LEU  36          2HD1      LEU  36   2.331  -4.981   1.695
  274   3HD1  LEU  36          3HD1      LEU  36   1.826  -5.823   0.226
  275   1HD2  LEU  36          1HD2      LEU  36   1.298  -8.081   3.806
  276   2HD2  LEU  36          2HD2      LEU  36   1.693  -6.376   3.930
  277   3HD2  LEU  36          3HD2      LEU  36   0.161  -6.886   3.163
  278    H    LYS  37           H        LYS  37   0.743 -10.334   0.037
  279    HA   LYS  37           HA       LYS  37  -1.361 -11.893   1.178
  280   1HB   LYS  37          2HB       LYS  37   0.095 -12.382  -1.452
  281   2HB   LYS  37          3HB       LYS  37  -1.283 -13.344  -0.924
  282   1HG   LYS  37          2HG       LYS  37  -2.634 -11.181  -0.760
  283   2HG   LYS  37          3HG       LYS  37  -1.304 -10.394  -1.619
  284   1HD   LYS  37          2HD       LYS  37  -2.881 -12.805  -2.614
  285   2HD   LYS  37          3HD       LYS  37  -3.171 -11.130  -3.077
  286   1HE   LYS  37          2HE       LYS  37  -0.839 -10.994  -3.985
  287   2HE   LYS  37          3HE       LYS  37  -0.631 -12.715  -3.607
  288   1HZ   LYS  37          1HZ       LYS  37  -2.568 -11.532  -5.520
  289   2HZ   LYS  37          2HZ       LYS  37  -1.293 -12.505  -5.887
  290   3HZ   LYS  37          3HZ       LYS  37  -2.582 -13.123  -5.075
  291    H    LYS  38           H        LYS  38   1.976 -12.802   1.176
  292    HA   LYS  38           HA       LYS  38   1.468 -15.648   1.859
  293   1HB   LYS  38          2HB       LYS  38   3.329 -15.837   0.653
  294   2HB   LYS  38          3HB       LYS  38   3.642 -14.120   0.658
  295   1HG   LYS  38          2HG       LYS  38   4.772 -14.389   2.923
  296   2HG   LYS  38          3HG       LYS  38   4.577 -16.144   2.717
  297   1HD   LYS  38          2HD       LYS  38   5.775 -15.810   0.436
  298   2HD   LYS  38          3HD       LYS  38   6.180 -14.184   1.024
  299   1HE   LYS  38          2HE       LYS  38   7.288 -15.221   3.017
  300   2HE   LYS  38          3HE       LYS  38   6.901 -16.823   2.365
  301   1HZ   LYS  38          1HZ       LYS  38   8.655 -14.789   1.097
  302   2HZ   LYS  38          2HZ       LYS  38   9.137 -16.215   1.757
  303   3HZ   LYS  38          3HZ       LYS  38   8.226 -16.212   0.389
  304    H    LYS  39           H        LYS  39   2.133 -12.597   3.420
  305    HA   LYS  39           HA       LYS  39   2.741 -13.730   6.032
  306   1HB   LYS  39          2HB       LYS  39   2.899 -11.159   4.713
  307   2HB   LYS  39          3HB       LYS  39   1.781 -10.967   6.046
  308   1HG   LYS  39          2HG       LYS  39   4.002 -10.455   6.804
  309   2HG   LYS  39          3HG       LYS  39   3.503 -11.962   7.577
  310   1HD   LYS  39          2HD       LYS  39   4.877 -13.233   5.878
  311   2HD   LYS  39          3HD       LYS  39   5.375 -11.685   5.165
  312   1HE   LYS  39          2HE       LYS  39   6.862 -11.263   6.817
  313   2HE   LYS  39          3HE       LYS  39   5.658 -11.615   8.049
  314   1HZ   LYS  39          1HZ       LYS  39   7.386 -13.581   6.708
  315   2HZ   LYS  39          2HZ       LYS  39   7.490 -13.051   8.257
  316   3HZ   LYS  39          3HZ       LYS  39   6.188 -13.959   7.803
  317    H    SER  40           H        SER  40   1.393 -13.175   7.906
  318    HA   SER  40           HA       SER  40  -1.186 -14.473   7.500
  319   1HB   SER  40          2HB       SER  40   0.377 -14.986   9.386
  320   2HB   SER  40          3HB       SER  40   0.025 -13.382  10.072
  321    HG   SER  40           HG       SER  40  -1.330 -15.050  10.934
  322    H    ALA  41           H        ALA  41  -3.126 -13.711   8.707
  323    HA   ALA  41           HA       ALA  41  -4.181 -11.211   7.793
  324   1HB   ALA  41          1HB       ALA  41  -5.050 -12.975  10.128
  325   2HB   ALA  41          2HB       ALA  41  -6.028 -11.725   9.345
  326   3HB   ALA  41          3HB       ALA  41  -5.562 -13.180   8.431
  327    H    ASP  42           H        ASP  42  -3.056 -12.170  11.083
  328    HA   ASP  42           HA       ASP  42  -3.257  -9.732  12.362
  329   1HB   ASP  42          2HB       ASP  42  -1.211 -11.987  12.605
  330   2HB   ASP  42          3HB       ASP  42  -1.273 -10.630  13.726
  331    H    ASP  43           H        ASP  43  -0.761 -10.782  10.090
  332    HA   ASP  43           HA       ASP  43   1.050  -8.554  10.639
  333   1HB   ASP  43          2HB       ASP  43   1.616 -10.952   9.705
  334   2HB   ASP  43          3HB       ASP  43   1.164 -10.256   8.145
  335    H    VAL  44           H        VAL  44  -1.163  -9.518   7.963
  336    HA   VAL  44           HA       VAL  44  -1.062  -7.193   6.401
  337    HB   VAL  44           HB       VAL  44  -2.832  -9.523   6.767
  338   1HG1  VAL  44          1HG       VAL  44  -4.033  -7.097   5.414
  339   2HG1  VAL  44          2HG       VAL  44  -4.656  -8.764   5.399
  340   3HG1  VAL  44          3HG       VAL  44  -4.608  -7.892   6.918
  341   1HG2  VAL  44          1HG       VAL  44  -1.030  -9.318   5.061
  342   2HG2  VAL  44          2HG       VAL  44  -2.618  -9.622   4.345
  343   3HG2  VAL  44          3HG       VAL  44  -1.935  -7.986   4.295
  344    H    LYS  45           H        LYS  45  -3.133  -7.728   9.320
  345    HA   LYS  45           HA       LYS  45  -4.377  -5.194   9.508
  346   1HB   LYS  45          2HB       LYS  45  -5.163  -6.772  10.946
  347   2HB   LYS  45          3HB       LYS  45  -3.575  -7.425  11.292
  348   1HG   LYS  45          2HG       LYS  45  -4.254  -6.466  13.270
  349   2HG   LYS  45          3HG       LYS  45  -3.015  -5.431  12.587
  350   1HD   LYS  45          2HD       LYS  45  -4.595  -3.961  13.508
  351   2HD   LYS  45          3HD       LYS  45  -4.874  -3.879  11.763
  352   1HE   LYS  45          2HE       LYS  45  -6.804  -5.404  11.991
  353   2HE   LYS  45          3HE       LYS  45  -6.449  -5.624  13.711
  354   1HZ   LYS  45          1HZ       LYS  45  -7.236  -3.070  12.440
  355   2HZ   LYS  45          2HZ       LYS  45  -8.185  -3.990  13.416
  356   3HZ   LYS  45          3HZ       LYS  45  -6.849  -3.243  14.024
  357    H    LYS  46           H        LYS  46  -1.172  -6.172  10.673
  358    HA   LYS  46           HA       LYS  46  -0.464  -3.544  11.738
  359   1HB   LYS  46          2HB       LYS  46   1.027  -6.169  11.396
  360   2HB   LYS  46          3HB       LYS  46   1.745  -4.757  12.162
  361   1HG   LYS  46          2HG       LYS  46   0.210  -4.783  13.991
  362   2HG   LYS  46          3HG       LYS  46  -0.918  -5.816  13.129
  363   1HD   LYS  46          2HD       LYS  46   0.974  -7.611  13.187
  364   2HD   LYS  46          3HD       LYS  46   1.627  -6.634  14.519
  365   1HE   LYS  46          2HE       LYS  46  -0.444  -6.872  15.780
  366   2HE   LYS  46          3HE       LYS  46  -1.292  -7.494  14.353
  367   1HZ   LYS  46          1HZ       LYS  46   0.848  -8.940  15.784
  368   2HZ   LYS  46          2HZ       LYS  46  -0.767  -9.296  15.810
  369   3HZ   LYS  46          3HZ       LYS  46   0.076  -9.451  14.420
  370    H    VAL  47           H        VAL  47  -0.027  -5.102   8.691
  371    HA   VAL  47           HA       VAL  47   1.849  -3.281   7.462
  372    HB   VAL  47           HB       VAL  47  -0.343  -5.029   6.326
  373   1HG1  VAL  47          1HG       VAL  47   1.786  -3.726   4.654
  374   2HG1  VAL  47          2HG       VAL  47   0.413  -4.726   4.116
  375   3HG1  VAL  47          3HG       VAL  47   0.117  -3.132   4.749
  376   1HG2  VAL  47          1HG       VAL  47   1.819  -6.016   7.473
  377   2HG2  VAL  47          2HG       VAL  47   1.245  -6.674   5.959
  378   3HG2  VAL  47          3HG       VAL  47   2.594  -5.508   5.994
  379    H    PHE  48           H        PHE  48  -1.833  -3.351   7.130
  380    HA   PHE  48           HA       PHE  48  -1.943  -0.823   5.924
  381   1HB   PHE  48          2HB       PHE  48  -3.750  -2.438   5.889
  382   2HB   PHE  48          3HB       PHE  48  -3.872  -2.402   7.647
  383    HD1  PHE  48           1HD      PHE  48  -4.081  -0.121   4.657
  384    HD2  PHE  48           2HD      PHE  48  -5.449  -1.021   8.657
  385    HE1  PHE  48           1HE      PHE  48  -5.808   1.656   4.487
  386    HE2  PHE  48           2HE      PHE  48  -7.200   0.701   8.445
  387    HZ   PHE  48           HZ       PHE  48  -7.371   2.035   6.347
  388    H    HIS  49           H        HIS  49  -2.042  -1.641   9.419
  389    HA   HIS  49           HA       HIS  49  -2.385   1.031  10.359
  390   1HB   HIS  49          2HB       HIS  49  -1.601  -1.593  11.496
  391   2HB   HIS  49          3HB       HIS  49  -0.850  -0.253  12.317
  392    HD1  HIS  49           HD1      HIS  49  -3.687   1.633  11.916
  393    HD2  HIS  49           HD2      HIS  49  -2.980  -2.094  13.750
  394    HE1  HIS  49           HE1      HIS  49  -5.468   1.358  13.710
  395    H    MET  50           H        MET  50   0.390  -0.149   8.692
  396    HA   MET  50           HA       MET  50   2.102   1.948   9.916
  397   1HB   MET  50          2HB       MET  50   2.868  -0.482   9.390
  398   2HB   MET  50          3HB       MET  50   2.868   0.033   7.696
  399   1HG   MET  50          2HG       MET  50   5.062   0.309   8.575
  400   2HG   MET  50          3HG       MET  50   4.392   1.908   8.326
  401   1HE   MET  50          1HE       MET  50   3.950   3.641  10.147
  402   2HE   MET  50          2HE       MET  50   5.195   3.666  11.420
  403   3HE   MET  50          3HE       MET  50   5.663   3.450   9.718
  404    H    LEU  51           H        LEU  51   0.320   1.195   6.948
  405    HA   LEU  51           HA       LEU  51   1.347   3.448   5.376
  406   1HB   LEU  51          2HB       LEU  51  -1.046   1.589   5.103
  407   2HB   LEU  51          3HB       LEU  51  -0.726   2.953   4.028
  408    HG   LEU  51           HG       LEU  51   1.399   1.952   3.299
  409   1HD1  LEU  51          1HD1      LEU  51   0.437  -0.506   4.825
  410   2HD1  LEU  51          2HD1      LEU  51   1.805  -0.444   3.705
  411   3HD1  LEU  51          3HD1      LEU  51   1.903   0.434   5.217
  412   1HD2  LEU  51          1HD2      LEU  51  -0.731   1.680   2.069
  413   2HD2  LEU  51          2HD2      LEU  51   0.236   0.204   1.948
  414   3HD2  LEU  51          3HD2      LEU  51  -1.144   0.288   3.069
  415    H    ASP  52           H        ASP  52  -1.509   2.886   7.481
  416    HA   ASP  52           HA       ASP  52  -2.708   5.440   6.906
  417   1HB   ASP  52          2HB       ASP  52  -3.906   3.450   7.837
  418   2HB   ASP  52          3HB       ASP  52  -3.148   3.766   9.403
  419    H    LYS  53           H        LYS  53  -1.327   7.027   7.026
  420    HA   LYS  53           HA       LYS  53   0.716   7.420   9.130
  421   1HB   LYS  53          2HB       LYS  53   0.038   8.624   6.425
  422   2HB   LYS  53          3HB       LYS  53   1.234   9.388   7.461
  423   1HG   LYS  53          2HG       LYS  53   1.536   6.417   7.036
  424   2HG   LYS  53          3HG       LYS  53   1.854   7.449   5.644
  425   1HD   LYS  53          2HD       LYS  53   3.131   7.906   8.370
  426   2HD   LYS  53          3HD       LYS  53   3.849   6.867   7.119
  427   1HE   LYS  53          2HE       LYS  53   3.849   8.739   5.514
  428   2HE   LYS  53          3HE       LYS  53   3.111   9.801   6.721
  429   1HZ   LYS  53          1HZ       LYS  53   5.756   8.509   7.012
  430   2HZ   LYS  53          2HZ       LYS  53   5.507  10.097   6.618
  431   3HZ   LYS  53          3HZ       LYS  53   5.062   9.533   8.095
  432    H    ASP  54           H        ASP  54  -1.783   7.568  10.009
  433    HA   ASP  54           HA       ASP  54  -2.179  10.187  11.295
  434   1HB   ASP  54          2HB       ASP  54  -3.409  10.999   9.547
  435   2HB   ASP  54          3HB       ASP  54  -3.623   9.399   8.865
  436    H    LYS  55           H        LYS  55  -3.618   7.034  10.469
  437    HA   LYS  55           HA       LYS  55  -3.521   5.196  11.874
  438   1HB   LYS  55          2HB       LYS  55  -2.611   6.833  13.770
  439   2HB   LYS  55          3HB       LYS  55  -4.271   6.774  14.324
  440   1HG   LYS  55          2HG       LYS  55  -3.440   5.128  15.596
  441   2HG   LYS  55          3HG       LYS  55  -3.791   4.099  14.213
  442   1HD   LYS  55          2HD       LYS  55  -1.077   5.462  14.566
  443   2HD   LYS  55          3HD       LYS  55  -1.470   3.962  15.406
  444   1HE   LYS  55          2HE       LYS  55  -1.906   2.815  13.301
  445   2HE   LYS  55          3HE       LYS  55  -1.615   4.305  12.381
  446   1HZ   LYS  55          1HZ       LYS  55   0.397   2.933  14.062
  447   2HZ   LYS  55          2HZ       LYS  55   0.284   2.856  12.413
  448   3HZ   LYS  55          3HZ       LYS  55   0.651   4.287  13.144
  449    H    SER  56           H        SER  56  -5.974   7.327  11.081
  450    HA   SER  56           HA       SER  56  -8.118   6.693  12.679
  451   1HB   SER  56          2HB       SER  56  -9.561   7.579  10.998
  452   2HB   SER  56          3HB       SER  56  -8.059   8.508  10.987
  453    HG   SER  56           HG       SER  56  -8.855   7.898   8.852
  454    H    GLY  57           H        GLY  57  -6.925   4.530  10.194
  455   1HA   GLY  57          2HA       GLY  57  -7.583   2.176  10.244
  456   2HA   GLY  57          3HA       GLY  57  -9.226   2.656  10.676
  457    H    PHE  58           H        PHE  58  -7.664   4.645   8.331
  458    HA   PHE  58           HA       PHE  58  -8.961   3.446   5.945
  459   1HB   PHE  58          2HB       PHE  58  -9.719   6.234   6.871
  460   2HB   PHE  58          3HB       PHE  58 -10.435   5.289   5.590
  461    HD1  PHE  58           1HD      PHE  58 -10.729   6.345   8.975
  462    HD2  PHE  58           2HD      PHE  58 -11.688   3.045   6.376
  463    HE1  PHE  58           1HE      PHE  58 -12.363   5.526  10.633
  464    HE2  PHE  58           2HE      PHE  58 -13.353   2.239   8.033
  465    HZ   PHE  58           HZ       PHE  58 -13.685   3.472  10.169
  466    H    ILE  59           H        ILE  59  -7.571   3.981   4.143
  467    HA   ILE  59           HA       ILE  59  -5.859   6.432   4.503
  468    HB   ILE  59           HB       ILE  59  -5.594   4.207   2.505
  469   1HG1  ILE  59          2HG       ILE  59  -3.617   4.953   4.704
  470   2HG1  ILE  59          3HG       ILE  59  -4.905   3.788   4.996
  471   1HG2  ILE  59          1HG       ILE  59  -3.766   6.599   2.958
  472   2HG2  ILE  59          2HG       ILE  59  -3.517   5.298   1.780
  473   3HG2  ILE  59          3HG       ILE  59  -4.856   6.410   1.576
  474   1HD1  ILE  59          1HD1      ILE  59  -2.697   3.555   2.941
  475   2HD1  ILE  59          2HD1      ILE  59  -3.020   2.523   4.360
  476   3HD1  ILE  59          3HD1      ILE  59  -4.121   2.490   2.973
  477    H    GLU  60           H        GLU  60  -6.427   8.133   3.639
  478    HA   GLU  60           HA       GLU  60  -8.368   8.375   1.411
  479   1HB   GLU  60          2HB       GLU  60  -7.553  10.540   3.402
  480   2HB   GLU  60          3HB       GLU  60  -8.971  10.464   2.378
  481   1HG   GLU  60          2HG       GLU  60  -9.859  10.050   4.464
  482   2HG   GLU  60          3HG       GLU  60  -9.698   8.429   3.810
  483    H    GLU  61           H        GLU  61  -8.004  10.407  -0.003
  484    HA   GLU  61           HA       GLU  61  -5.629  10.005  -1.331
  485   1HB   GLU  61          2HB       GLU  61  -6.155  11.801  -2.821
  486   2HB   GLU  61          3HB       GLU  61  -7.470  10.706  -2.516
  487   1HG   GLU  61          2HG       GLU  61  -8.779  12.472  -2.188
  488   2HG   GLU  61          3HG       GLU  61  -7.963  12.747  -0.655
  489    H    ASP  62           H        ASP  62  -6.066  12.517   1.104
  490    HA   ASP  62           HA       ASP  62  -3.760  14.029   0.963
  491   1HB   ASP  62          2HB       ASP  62  -5.161  12.728   3.337
  492   2HB   ASP  62          3HB       ASP  62  -3.858  13.896   3.524
  493    H    GLU  63           H        GLU  63  -4.010  10.777   2.417
  494    HA   GLU  63           HA       GLU  63  -1.081  10.633   2.996
  495   1HB   GLU  63          2HB       GLU  63  -3.440   8.773   3.477
  496   2HB   GLU  63          3HB       GLU  63  -1.767   8.362   3.886
  497   1HG   GLU  63          2HG       GLU  63  -1.649  10.128   5.528
  498   2HG   GLU  63          3HG       GLU  63  -3.211  10.792   5.013
  499    H    LEU  64           H        LEU  64  -3.562   9.256   0.885
  500    HA   LEU  64           HA       LEU  64  -2.260   7.032  -0.071
  501   1HB   LEU  64          2HB       LEU  64  -4.669   7.837  -0.246
  502   2HB   LEU  64          3HB       LEU  64  -4.138   8.729  -1.673
  503    HG   LEU  64           HG       LEU  64  -3.372   5.868  -1.663
  504   1HD1  LEU  64          1HD1      LEU  64  -6.324   6.611  -1.726
  505   2HD1  LEU  64          2HD1      LEU  64  -5.648   5.041  -2.218
  506   3HD1  LEU  64          3HD1      LEU  64  -5.512   5.567  -0.538
  507   1HD2  LEU  64          1HD2      LEU  64  -3.157   7.330  -3.619
  508   2HD2  LEU  64          2HD2      LEU  64  -4.364   6.078  -3.955
  509   3HD2  LEU  64          3HD2      LEU  64  -4.908   7.697  -3.572
  510    H    GLY  65           H        GLY  65  -1.657  10.340  -0.961
  511   1HA   GLY  65          2HA       GLY  65  -0.124  10.001  -3.349
  512   2HA   GLY  65          3HA       GLY  65   0.048  11.307  -2.178
  513    H    PHE  66           H        PHE  66   0.795   9.017  -0.061
  514    HA   PHE  66           HA       PHE  66   3.360   8.076  -1.171
  515   1HB   PHE  66          2HB       PHE  66   4.757   9.227   0.536
  516   2HB   PHE  66          3HB       PHE  66   4.101  10.234  -0.717
  517    HD1  PHE  66           1HD      PHE  66   2.450  11.982  -0.277
  518    HD2  PHE  66           2HD      PHE  66   3.979   9.503   2.889
  519    HE1  PHE  66           1HE      PHE  66   1.587  13.594   1.398
  520    HE2  PHE  66           2HE      PHE  66   3.143  11.146   4.573
  521    HZ   PHE  66           HZ       PHE  66   1.953  13.188   3.820
  522    H    ILE  67           H        ILE  67   1.277   6.549  -0.342
  523    HA   ILE  67           HA       ILE  67   1.204   5.440   2.238
  524    HB   ILE  67           HB       ILE  67   0.222   3.556   1.349
  525   1HG1  ILE  67          2HG       ILE  67   0.162   3.441  -1.364
  526   2HG1  ILE  67          3HG       ILE  67   1.770   4.144  -1.173
  527   1HG2  ILE  67          1HG       ILE  67  -0.498   5.749  -0.558
  528   2HG2  ILE  67          2HG       ILE  67  -1.536   4.445   0.044
  529   3HG2  ILE  67          3HG       ILE  67  -0.980   5.712   1.162
  530   1HD1  ILE  67          1HD1      ILE  67   0.664   1.523  -0.132
  531   2HD1  ILE  67          2HD1      ILE  67   2.130   1.790  -1.111
  532   3HD1  ILE  67          3HD1      ILE  67   2.086   2.252   0.620
  533    H    LEU  68           H        LEU  68   3.559   4.891  -0.210
  534    HA   LEU  68           HA       LEU  68   5.004   2.737   0.923
  535   1HB   LEU  68          2HB       LEU  68   5.832   5.041  -0.846
  536   2HB   LEU  68          3HB       LEU  68   6.964   3.781  -0.352
  537    HG   LEU  68           HG       LEU  68   4.461   2.654  -1.414
  538   1HD1  LEU  68          1HD1      LEU  68   6.195   4.312  -3.285
  539   2HD1  LEU  68          2HD1      LEU  68   4.809   3.301  -3.727
  540   3HD1  LEU  68          3HD1      LEU  68   4.562   4.741  -2.738
  541   1HD2  LEU  68          1HD2      LEU  68   6.571   1.373  -1.009
  542   2HD2  LEU  68          2HD2      LEU  68   6.137   1.322  -2.725
  543   3HD2  LEU  68          3HD2      LEU  68   7.415   2.405  -2.188
  544    H    LYS  69           H        LYS  69   4.997   6.106   2.057
  545    HA   LYS  69           HA       LYS  69   7.448   5.764   3.637
  546   1HB   LYS  69          2HB       LYS  69   5.248   7.856   3.620
  547   2HB   LYS  69          3HB       LYS  69   6.453   7.798   4.904
  548   1HG   LYS  69          2HG       LYS  69   8.259   7.809   3.142
  549   2HG   LYS  69          3HG       LYS  69   7.004   8.218   1.953
  550   1HD   LYS  69          2HD       LYS  69   6.529  10.300   3.028
  551   2HD   LYS  69          3HD       LYS  69   7.440   9.869   4.482
  552   1HE   LYS  69          2HE       LYS  69   8.698  10.220   1.730
  553   2HE   LYS  69          3HE       LYS  69   8.588  11.506   2.937
  554   1HZ   LYS  69          1HZ       LYS  69   9.990   8.935   3.358
  555   2HZ   LYS  69          2HZ       LYS  69  10.723  10.375   3.041
  556   3HZ   LYS  69          3HZ       LYS  69   9.901  10.162   4.444
  557    H    GLY  70           H        GLY  70   4.431   4.322   3.989
  558   1HA   GLY  70          2HA       GLY  70   5.011   3.652   6.833
  559   2HA   GLY  70          3HA       GLY  70   3.674   3.038   5.833
  560    H    PHE  71           H        PHE  71   5.181   2.216   3.548
  561    HA   PHE  71           HA       PHE  71   6.074  -0.334   4.485
  562   1HB   PHE  71          2HB       PHE  71   6.149   1.006   1.774
  563   2HB   PHE  71          3HB       PHE  71   6.921  -0.542   2.053
  564    HD1  PHE  71           1HD      PHE  71   3.938   0.815   0.853
  565    HD2  PHE  71           2HD      PHE  71   5.430  -2.320   3.408
  566    HE1  PHE  71           1HE      PHE  71   1.879  -0.511   0.455
  567    HE2  PHE  71           2HE      PHE  71   3.364  -3.586   3.076
  568    HZ   PHE  71           HZ       PHE  71   1.550  -2.683   1.600
  569    H    SER  72           H        SER  72   8.017   2.604   3.475
  570    HA   SER  72           HA       SER  72  10.283   1.740   5.020
  571   1HB   SER  72          2HB       SER  72   9.911   0.472   2.505
  572   2HB   SER  72          3HB       SER  72  11.154   1.687   2.228
  573    HG   SER  72           HG       SER  72  11.548  -0.623   3.232
  574    HA   PRO  73           HA       PRO  73  11.556   5.880   3.444
  575   1HB   PRO  73          2HB       PRO  73  14.285   5.777   3.367
  576   2HB   PRO  73          3HB       PRO  73  13.360   5.893   4.896
  577   1HG   PRO  73          2HG       PRO  73  14.478   3.396   3.584
  578   2HG   PRO  73          3HG       PRO  73  14.655   3.923   5.290
  579   1HD   PRO  73          2HD       PRO  73  12.774   2.132   4.515
  580   2HD   PRO  73          3HD       PRO  73  12.434   3.317   5.802
  581    H    ASP  74           H        ASP  74  12.854   6.718   1.674
  582    HA   ASP  74           HA       ASP  74  12.992   7.157  -0.518
  583   1HB   ASP  74          2HB       ASP  74  14.879   5.413  -0.213
  584   2HB   ASP  74          3HB       ASP  74  13.851   4.351  -1.182
  585    H    ALA  75           H        ALA  75  10.600   5.901   0.578
  586    HA   ALA  75           HA       ALA  75   8.829   4.698  -1.115
  587   1HB   ALA  75          1HB       ALA  75   8.700   6.941   0.945
  588   2HB   ALA  75          2HB       ALA  75   7.236   6.234   0.283
  589   3HB   ALA  75          3HB       ALA  75   8.403   5.207   1.175
  590    H    ARG  76           H        ARG  76   9.460   8.145  -0.962
  591    HA   ARG  76           HA       ARG  76   8.976   9.987  -2.181
  592   1HB   ARG  76          2HB       ARG  76   8.567   8.329  -4.676
  593   2HB   ARG  76          3HB       ARG  76   9.214   9.968  -4.499
  594   1HG   ARG  76          2HG       ARG  76  11.063   8.774  -3.054
  595   2HG   ARG  76          3HG       ARG  76  10.501   7.318  -3.903
  596   1HD   ARG  76          2HD       ARG  76  11.184   8.216  -6.030
  597   2HD   ARG  76          3HD       ARG  76  11.495   9.816  -5.305
  598    HE   ARG  76           HE       ARG  76  13.030   7.733  -3.958
  599   1HH1  ARG  76          1HH2      ARG  76  13.264   9.836  -6.744
  600   2HH1  ARG  76          2HH2      ARG  76  15.016   9.782  -6.710
  601   1HH2  ARG  76          1HH1      ARG  76  15.011   7.651  -3.938
  602   2HH2  ARG  76          2HH1      ARG  76  16.074   8.454  -5.106
  603    H    ASP  77           H        ASP  77   7.479  11.109  -3.717
  604    HA   ASP  77           HA       ASP  77   4.695  10.766  -2.978
  605   1HB   ASP  77          2HB       ASP  77   4.514  12.852  -4.370
  606   2HB   ASP  77          3HB       ASP  77   5.514  12.970  -2.931
  607    H    LEU  78           H        LEU  78   3.493   9.412  -4.012
  608    HA   LEU  78           HA       LEU  78   3.850   8.323  -6.676
  609   1HB   LEU  78          2HB       LEU  78   1.271   8.666  -5.075
  610   2HB   LEU  78          3HB       LEU  78   1.483   7.654  -6.486
  611    HG   LEU  78           HG       LEU  78   2.638   7.247  -3.691
  612   1HD1  LEU  78          1HD1      LEU  78   0.963   5.446  -5.477
  613   2HD1  LEU  78          2HD1      LEU  78   1.393   5.180  -3.767
  614   3HD1  LEU  78          3HD1      LEU  78   0.306   6.503  -4.210
  615   1HD2  LEU  78          1HD2      LEU  78   4.502   6.571  -4.953
  616   2HD2  LEU  78          2HD2      LEU  78   3.580   5.067  -4.768
  617   3HD2  LEU  78          3HD2      LEU  78   3.509   5.950  -6.290
  618    H    SER  79           H        SER  79   2.661   8.786  -8.579
  619    HA   SER  79           HA       SER  79   2.358  11.590  -9.177
  620   1HB   SER  79          2HB       SER  79   1.195   9.218 -10.646
  621   2HB   SER  79          3HB       SER  79   1.365  10.858 -11.271
  622    HG   SER  79           HG       SER  79   2.867   9.561 -12.123
  623    H    ALA  80           H        ALA  80   0.510  12.779  -9.685
  624    HA   ALA  80           HA       ALA  80  -1.770  12.640  -8.100
  625   1HB   ALA  80          1HB       ALA  80  -1.431  13.843 -10.882
  626   2HB   ALA  80          2HB       ALA  80  -2.700  14.276  -9.708
  627   3HB   ALA  80          3HB       ALA  80  -0.999  14.625  -9.340
  628    H    LYS  81           H        LYS  81  -1.402  11.228 -11.423
  629    HA   LYS  81           HA       LYS  81  -4.209  10.445 -11.566
  630   1HB   LYS  81          2HB       LYS  81  -2.134   9.043 -13.220
  631   2HB   LYS  81          3HB       LYS  81  -3.769   9.463 -13.612
  632   1HG   LYS  81          2HG       LYS  81  -1.432  11.428 -13.469
  633   2HG   LYS  81          3HG       LYS  81  -2.165  10.760 -14.929
  634   1HD   LYS  81          2HD       LYS  81  -4.354  11.768 -14.260
  635   2HD   LYS  81          3HD       LYS  81  -3.538  12.543 -12.879
  636   1HE   LYS  81          2HE       LYS  81  -2.053  13.774 -14.392
  637   2HE   LYS  81          3HE       LYS  81  -2.727  12.929 -15.794
  638   1HZ   LYS  81          1HZ       LYS  81  -4.241  14.759 -14.024
  639   2HZ   LYS  81          2HZ       LYS  81  -3.706  15.119 -15.536
  640   3HZ   LYS  81          3HZ       LYS  81  -4.858  13.966 -15.329
  641    H    GLU  82           H        GLU  82  -1.217   8.965 -10.408
  642    HA   GLU  82           HA       GLU  82  -2.165   6.299 -10.109
  643   1HB   GLU  82          2HB       GLU  82   0.246   7.497  -9.928
  644   2HB   GLU  82          3HB       GLU  82  -0.148   7.504  -8.212
  645   1HG   GLU  82          2HG       GLU  82  -0.374   5.112  -8.184
  646   2HG   GLU  82          3HG       GLU  82  -0.367   5.040  -9.957
  647    H    THR  83           H        THR  83  -1.842   9.019  -7.746
  648    HA   THR  83           HA       THR  83  -3.343   7.946  -5.663
  649    HB   THR  83           HB       THR  83  -3.105  10.823  -6.602
  650    HG1  THR  83           1HG      THR  83  -1.614  10.778  -4.832
  651   1HG2  THR  83          1HG       THR  83  -4.036   9.826  -3.874
  652   2HG2  THR  83          2HG       THR  83  -3.668  11.502  -4.301
  653   3HG2  THR  83          3HG       THR  83  -5.046  10.692  -5.054
  654    H    LYS  84           H        LYS  84  -4.652   9.857  -8.408
  655    HA   LYS  84           HA       LYS  84  -7.376   9.747  -7.700
  656   1HB   LYS  84          2HB       LYS  84  -5.839  10.515 -10.016
  657   2HB   LYS  84          3HB       LYS  84  -7.151   9.492 -10.582
  658   1HG   LYS  84          2HG       LYS  84  -8.787  10.910  -9.373
  659   2HG   LYS  84          3HG       LYS  84  -7.457  11.936  -8.791
  660   1HD   LYS  84          2HD       LYS  84  -6.885  12.549 -11.119
  661   2HD   LYS  84          3HD       LYS  84  -8.125  11.447 -11.729
  662   1HE   LYS  84          2HE       LYS  84  -8.993  13.697 -11.817
  663   2HE   LYS  84          3HE       LYS  84  -9.889  12.764 -10.615
  664   1HZ   LYS  84          1HZ       LYS  84  -7.709  14.678 -10.004
  665   2HZ   LYS  84          2HZ       LYS  84  -9.313  14.963  -9.787
  666   3HZ   LYS  84          3HZ       LYS  84  -8.552  13.817  -8.890
  667    H    MET  85           H        MET  85  -5.732   7.400  -9.896
  668    HA   MET  85           HA       MET  85  -8.093   5.694  -9.938
  669   1HB   MET  85          2HB       MET  85  -5.310   5.499 -11.053
  670   2HB   MET  85          3HB       MET  85  -6.184   3.986 -10.779
  671   1HG   MET  85          2HG       MET  85  -8.132   4.869 -12.039
  672   2HG   MET  85          3HG       MET  85  -7.221   6.339 -12.388
  673   1HE   MET  85          1HE       MET  85  -8.570   3.382 -13.983
  674   2HE   MET  85          2HE       MET  85  -7.243   2.458 -14.715
  675   3HE   MET  85          3HE       MET  85  -7.474   2.431 -12.952
  676    H    LEU  86           H        LEU  86  -5.054   5.529  -7.979
  677    HA   LEU  86           HA       LEU  86  -5.678   3.004  -6.824
  678   1HB   LEU  86          2HB       LEU  86  -3.441   3.898  -6.842
  679   2HB   LEU  86          3HB       LEU  86  -3.934   5.305  -5.917
  680    HG   LEU  86           HG       LEU  86  -4.385   3.862  -3.931
  681   1HD1  LEU  86          1HD1      LEU  86  -3.405   1.640  -5.746
  682   2HD1  LEU  86          2HD1      LEU  86  -3.505   1.522  -3.966
  683   3HD1  LEU  86          3HD1      LEU  86  -4.967   1.748  -4.927
  684   1HD2  LEU  86          1HD2      LEU  86  -2.216   4.954  -4.214
  685   2HD2  LEU  86          2HD2      LEU  86  -2.004   3.364  -3.473
  686   3HD2  LEU  86          3HD2      LEU  86  -1.642   3.610  -5.203
  687    H    MET  87           H        MET  87  -6.641   6.333  -5.759
  688    HA   MET  87           HA       MET  87  -7.917   5.502  -3.347
  689   1HB   MET  87          2HB       MET  87  -7.596   7.851  -3.889
  690   2HB   MET  87          3HB       MET  87  -8.692   7.736  -5.280
  691   1HG   MET  87          2HG       MET  87 -10.590   7.333  -3.856
  692   2HG   MET  87          3HG       MET  87  -9.542   6.988  -2.488
  693   1HE   MET  87          1HE       MET  87 -11.132   9.849  -4.674
  694   2HE   MET  87          2HE       MET  87 -10.355  11.285  -3.965
  695   3HE   MET  87          3HE       MET  87  -9.387  10.137  -4.916
  696    H    ALA  88           H        ALA  88  -9.412   5.825  -6.616
  697    HA   ALA  88           HA       ALA  88 -11.901   4.646  -5.854
  698   1HB   ALA  88          1HB       ALA  88 -10.561   4.925  -8.584
  699   2HB   ALA  88          2HB       ALA  88 -12.278   4.547  -8.305
  700   3HB   ALA  88          3HB       ALA  88 -11.622   6.116  -7.798
  701    H    ALA  89           H        ALA  89  -9.085   3.154  -7.522
  702    HA   ALA  89           HA       ALA  89 -10.432   0.598  -7.782
  703   1HB   ALA  89          1HB       ALA  89  -7.546   1.393  -8.370
  704   2HB   ALA  89          2HB       ALA  89  -8.376  -0.064  -8.946
  705   3HB   ALA  89          3HB       ALA  89  -8.904   1.536  -9.508
  706    H    GLY  90           H        GLY  90  -7.935   1.893  -5.518
  707   1HA   GLY  90          2HA       GLY  90  -7.188  -0.709  -4.466
  708   2HA   GLY  90          3HA       GLY  90  -6.800   0.883  -3.807
  709    H    ASP  91           H        ASP  91  -9.830   1.510  -3.888
  710    HA   ASP  91           HA       ASP  91 -10.671  -0.080  -1.511
  711   1HB   ASP  91          2HB       ASP  91 -10.543   2.290  -1.075
  712   2HB   ASP  91          3HB       ASP  91 -11.617   2.630  -2.445
  713    H    LYS  92           H        LYS  92 -11.295  -1.869  -2.828
  714    HA   LYS  92           HA       LYS  92 -13.048  -1.712  -5.060
  715   1HB   LYS  92          2HB       LYS  92 -12.176  -3.915  -3.189
  716   2HB   LYS  92          3HB       LYS  92 -13.403  -4.252  -4.405
  717   1HG   LYS  92          2HG       LYS  92 -10.769  -2.916  -5.155
  718   2HG   LYS  92          3HG       LYS  92 -10.910  -4.665  -5.022
  719   1HD   LYS  92          2HD       LYS  92 -11.847  -4.867  -7.035
  720   2HD   LYS  92          3HD       LYS  92 -13.128  -3.741  -6.632
  721   1HE   LYS  92          2HE       LYS  92 -11.960  -3.018  -8.625
  722   2HE   LYS  92          3HE       LYS  92 -11.770  -1.831  -7.325
  723   1HZ   LYS  92          1HZ       LYS  92  -9.708  -3.883  -7.794
  724   2HZ   LYS  92          2HZ       LYS  92  -9.707  -2.451  -8.626
  725   3HZ   LYS  92          3HZ       LYS  92  -9.594  -2.426  -6.997
  726    H    ASP  93           H        ASP  93 -14.007  -1.300  -1.777
  727    HA   ASP  93           HA       ASP  93 -16.839  -1.954  -2.209
  728   1HB   ASP  93          2HB       ASP  93 -15.358  -0.194  -0.231
  729   2HB   ASP  93          3HB       ASP  93 -17.109  -0.243  -0.289
  730    H    GLY  94           H        GLY  94 -14.766   0.750  -3.144
  731   1HA   GLY  94          2HA       GLY  94 -15.338   2.493  -4.577
  732   2HA   GLY  94          3HA       GLY  94 -17.052   2.160  -4.355
  733    H    ASP  95           H        ASP  95 -15.397   2.472  -1.313
  734    HA   ASP  95           HA       ASP  95 -16.721   5.045  -0.788
  735   1HB   ASP  95          2HB       ASP  95 -14.686   4.127   1.170
  736   2HB   ASP  95          3HB       ASP  95 -16.312   4.727   1.411
  737    H    GLY  96           H        GLY  96 -13.699   3.962  -1.810
  738   1HA   GLY  96          2HA       GLY  96 -11.842   5.029  -2.741
  739   2HA   GLY  96          3HA       GLY  96 -12.319   6.582  -2.031
  740    H    LYS  97           H        LYS  97 -12.732   4.531   0.484
  741    HA   LYS  97           HA       LYS  97 -10.048   5.149   1.607
  742   1HB   LYS  97          2HB       LYS  97 -12.710   4.390   2.808
  743   2HB   LYS  97          3HB       LYS  97 -11.227   4.342   3.752
  744   1HG   LYS  97          2HG       LYS  97 -10.966   6.600   3.827
  745   2HG   LYS  97          3HG       LYS  97 -11.559   6.880   2.194
  746   1HD   LYS  97          2HD       LYS  97 -13.383   6.114   4.492
  747   2HD   LYS  97          3HD       LYS  97 -13.000   7.798   4.050
  748   1HE   LYS  97          2HE       LYS  97 -14.041   7.670   1.957
  749   2HE   LYS  97          3HE       LYS  97 -13.946   5.921   1.899
  750   1HZ   LYS  97          1HZ       LYS  97 -15.732   7.424   3.707
  751   2HZ   LYS  97          2HZ       LYS  97 -16.181   6.659   2.315
  752   3HZ   LYS  97          3HZ       LYS  97 -15.635   5.782   3.591
  753    H    ILE  98           H        ILE  98  -8.599   3.735   1.326
  754    HA   ILE  98           HA       ILE  98  -8.923   0.872   0.903
  755    HB   ILE  98           HB       ILE  98  -6.517   2.581   1.607
  756   1HG1  ILE  98          2HG       ILE  98  -7.623   1.292  -0.896
  757   2HG1  ILE  98          3HG       ILE  98  -7.369   3.000  -0.587
  758   1HG2  ILE  98          1HG       ILE  98  -6.446  -0.382   0.959
  759   2HG2  ILE  98          2HG       ILE  98  -5.033   0.658   1.204
  760   3HG2  ILE  98          3HG       ILE  98  -6.073   0.293   2.559
  761   1HD1  ILE  98          1HD1      ILE  98  -5.268   0.900  -1.182
  762   2HD1  ILE  98          2HD1      ILE  98  -5.755   2.268  -2.178
  763   3HD1  ILE  98          3HD1      ILE  98  -4.879   2.566  -0.657
  764    H    GLY  99           H        GLY  99  -9.488  -0.553   2.322
  765   1HA   GLY  99          2HA       GLY  99  -8.921  -0.288   5.252
  766   2HA   GLY  99          3HA       GLY  99 -10.355  -1.052   4.584
  767    H    VAL 100           H        VAL 100  -8.073  -2.072   6.222
  768    HA   VAL 100           HA       VAL 100  -6.115  -3.343   4.764
  769    HB   VAL 100           HB       VAL 100  -6.067  -2.909   7.132
  770   1HG1  VAL 100          1HG       VAL 100  -7.703  -5.378   7.707
  771   2HG1  VAL 100          2HG       VAL 100  -6.944  -4.271   8.854
  772   3HG1  VAL 100          3HG       VAL 100  -8.307  -3.716   7.870
  773   1HG2  VAL 100          1HG       VAL 100  -4.627  -4.659   5.880
  774   2HG2  VAL 100          2HG       VAL 100  -4.635  -4.598   7.632
  775   3HG2  VAL 100          3HG       VAL 100  -5.581  -5.850   6.797
  776    H    ASP 101           H        ASP 101  -9.013  -4.964   5.928
  777    HA   ASP 101           HA       ASP 101  -8.814  -7.504   4.976
  778   1HB   ASP 101          2HB       ASP 101 -11.033  -5.419   5.132
  779   2HB   ASP 101          3HB       ASP 101 -11.391  -7.106   4.825
  780    H    GLU 102           H        GLU 102  -9.973  -4.673   3.212
  781    HA   GLU 102           HA       GLU 102 -10.505  -5.995   0.682
  782   1HB   GLU 102          2HB       GLU 102 -10.116  -3.046   1.324
  783   2HB   GLU 102          3HB       GLU 102 -10.843  -3.701  -0.133
  784   1HG   GLU 102          2HG       GLU 102 -12.836  -4.261   0.925
  785   2HG   GLU 102          3HG       GLU 102 -12.111  -4.473   2.514
  786    H    PHE 103           H        PHE 103  -7.941  -3.789   1.888
  787    HA   PHE 103           HA       PHE 103  -6.325  -3.644  -0.373
  788   1HB   PHE 103          2HB       PHE 103  -6.268  -2.394   1.875
  789   2HB   PHE 103          3HB       PHE 103  -5.340  -3.735   2.499
  790    HD1  PHE 103           1HD      PHE 103  -5.203  -1.749  -0.739
  791    HD2  PHE 103           2HD      PHE 103  -3.163  -2.984   2.861
  792    HE1  PHE 103           1HE      PHE 103  -3.212  -0.466  -1.422
  793    HE2  PHE 103           2HE      PHE 103  -1.141  -1.791   2.115
  794    HZ   PHE 103           HZ       PHE 103  -1.148  -0.518  -0.034
  795    H    SER 104           H        SER 104  -6.246  -6.120   2.160
  796    HA   SER 104           HA       SER 104  -4.038  -7.693   1.213
  797   1HB   SER 104          2HB       SER 104  -5.117  -7.800   3.455
  798   2HB   SER 104          3HB       SER 104  -6.539  -8.558   2.719
  799    HG   SER 104           HG       SER 104  -5.137 -10.151   3.491
  800    H    THR 105           H        THR 105  -7.503  -7.775   0.388
  801    HA   THR 105           HA       THR 105  -7.165 -10.250  -1.198
  802    HB   THR 105           HB       THR 105  -9.685 -10.073  -1.340
  803    HG1  THR 105           1HG      THR 105  -9.507  -8.282   0.860
  804   1HG2  THR 105          1HG       THR 105  -8.413 -10.132   1.430
  805   2HG2  THR 105          2HG       THR 105  -9.978 -10.848   0.976
  806   3HG2  THR 105          3HG       THR 105  -8.467 -11.493   0.293
  807    H    LEU 106           H        LEU 106  -7.691  -6.904  -1.649
  808    HA   LEU 106           HA       LEU 106  -8.423  -6.330  -4.164
  809   1HB   LEU 106          2HB       LEU 106  -6.736  -5.131  -2.160
  810   2HB   LEU 106          3HB       LEU 106  -5.799  -5.046  -3.607
  811    HG   LEU 106           HG       LEU 106  -6.956  -3.021  -3.357
  812   1HD1  LEU 106          1HD1      LEU 106  -8.429  -4.576  -5.515
  813   2HD1  LEU 106          2HD1      LEU 106  -8.076  -2.836  -5.443
  814   3HD1  LEU 106          3HD1      LEU 106  -6.756  -3.983  -5.649
  815   1HD2  LEU 106          1HD2      LEU 106  -8.705  -3.654  -1.853
  816   2HD2  LEU 106          2HD2      LEU 106  -9.441  -2.894  -3.264
  817   3HD2  LEU 106          3HD2      LEU 106  -9.502  -4.667  -3.066
  818    H    VAL 107           H        VAL 107  -5.265  -7.455  -3.319
  819    HA   VAL 107           HA       VAL 107  -4.210  -7.576  -6.066
  820    HB   VAL 107           HB       VAL 107  -2.142  -8.224  -4.785
  821   1HG1  VAL 107          1HG       VAL 107  -3.489  -5.646  -3.838
  822   2HG1  VAL 107          2HG       VAL 107  -1.761  -5.953  -3.997
  823   3HG1  VAL 107          3HG       VAL 107  -2.764  -5.872  -5.443
  824   1HG2  VAL 107          1HG       VAL 107  -3.775  -8.983  -2.736
  825   2HG2  VAL 107          2HG       VAL 107  -2.100  -8.555  -2.567
  826   3HG2  VAL 107          3HG       VAL 107  -3.355  -7.353  -2.199
  827    H    ALA 108           H        ALA 108  -5.867  -9.711  -4.124
  828    HA   ALA 108           HA       ALA 108  -4.774 -12.177  -5.389
  829   1HB   ALA 108          1HB       ALA 108  -7.006 -11.833  -3.357
  830   2HB   ALA 108          2HB       ALA 108  -6.253 -13.351  -3.889
  831   3HB   ALA 108          3HB       ALA 108  -5.310 -12.163  -2.954
  832    H    GLU 109           H        GLU 109  -7.799 -10.191  -5.164
  833    HA   GLU 109           HA       GLU 109  -8.967 -11.261  -7.594
  834   1HB   GLU 109          2HB       GLU 109  -9.151  -8.496  -6.320
  835   2HB   GLU 109          3HB       GLU 109 -10.058  -9.016  -7.747
  836   1HG   GLU 109          2HG       GLU 109 -10.957 -10.950  -6.343
  837   2HG   GLU 109          3HG       GLU 109 -10.275 -10.137  -4.929
  838    H    SER 110           H        SER 110  -6.391  -8.820  -6.981
  839    HA   SER 110           HA       SER 110  -4.871  -7.887  -8.388
  840   1HB   SER 110          2HB       SER 110  -3.755  -9.412  -9.901
  841   2HB   SER 110          3HB       SER 110  -4.289 -10.329  -8.485
  842    HG   SER 110           HG       SER 110  -6.298 -10.620  -9.946
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1   9.934  -0.759  13.963
    2   2H    MET   1           H2       MET   1  10.306  -1.237  15.508
    3   3H    MET   1           H3       MET   1   8.782  -0.728  15.125
    4    HA   MET   1           HA       MET   1  10.119  -3.172  14.219
    5   1HB   MET   1          2HB       MET   1   8.807  -2.879  16.541
    6   2HB   MET   1          3HB       MET   1   7.396  -3.095  15.513
    7   1HG   MET   1          2HG       MET   1   7.900  -5.244  16.252
    8   2HG   MET   1          3HG       MET   1   8.625  -5.251  14.651
    9   1HE   MET   1          1HE       MET   1  11.646  -4.272  14.716
   10   2HE   MET   1          2HE       MET   1  12.342  -5.793  15.295
   11   3HE   MET   1          3HE       MET   1  10.975  -5.830  14.167
   12    H    SER   2           H        SER   2   7.540  -4.372  13.450
   13    HA   SER   2           HA       SER   2   5.956  -4.437  11.906
   14   1HB   SER   2          2HB       SER   2   5.595  -1.967  12.522
   15   2HB   SER   2          3HB       SER   2   6.411  -1.595  10.989
   16    HG   SER   2           HG       SER   2   4.061  -1.866  10.926
   17    H    MET   3           H        MET   3   6.076  -3.079   9.286
   18    HA   MET   3           HA       MET   3   7.291  -5.001   7.678
   19   1HB   MET   3          2HB       MET   3   7.129  -3.342   5.832
   20   2HB   MET   3          3HB       MET   3   5.675  -3.659   6.739
   21   1HG   MET   3          2HG       MET   3   6.546  -1.463   8.068
   22   2HG   MET   3          3HG       MET   3   7.208  -1.165   6.463
   23   1HE   MET   3          1HE       MET   3   4.233  -1.467   8.759
   24   2HE   MET   3          2HE       MET   3   2.811  -1.627   7.722
   25   3HE   MET   3          3HE       MET   3   3.959  -2.975   7.858
   26    H    THR   4           H        THR   4   9.128  -5.667   8.036
   27    HA   THR   4           HA       THR   4  11.749  -4.842   7.534
   28    HB   THR   4           HB       THR   4  10.645  -3.997  10.263
   29    HG1  THR   4           1HG      THR   4  10.805  -2.528   8.464
   30   1HG2  THR   4          1HG       THR   4  13.575  -4.415   9.480
   31   2HG2  THR   4          2HG       THR   4  13.017  -3.561  10.935
   32   3HG2  THR   4          3HG       THR   4  12.701  -5.289  10.757
   33    H    ASP   5           H        ASP   5   9.825  -6.108  10.235
   34    HA   ASP   5           HA       ASP   5  11.474  -8.617  10.289
   35   1HB   ASP   5          2HB       ASP   5  11.747  -6.973  12.146
   36   2HB   ASP   5          3HB       ASP   5  10.020  -7.092  12.488
   37    H    LEU   6           H        LEU   6   8.222  -7.306  10.833
   38    HA   LEU   6           HA       LEU   6   6.739  -9.722  11.177
   39   1HB   LEU   6          2HB       LEU   6   6.136  -6.903  10.186
   40   2HB   LEU   6          3HB       LEU   6   4.897  -8.114  10.143
   41    HG   LEU   6           HG       LEU   6   4.724  -6.660  12.086
   42   1HD1  LEU   6          1HD1      LEU   6   5.344  -9.511  12.937
   43   2HD1  LEU   6          2HD1      LEU   6   4.316  -8.339  13.787
   44   3HD1  LEU   6          3HD1      LEU   6   3.828  -8.967  12.200
   45   1HD2  LEU   6          1HD2      LEU   6   7.192  -6.336  12.501
   46   2HD2  LEU   6          2HD2      LEU   6   6.223  -6.685  13.949
   47   3HD2  LEU   6          3HD2      LEU   6   7.229  -7.950  13.220
   48    H    LEU   7           H        LEU   7   7.314  -7.795   8.277
   49    HA   LEU   7           HA       LEU   7   6.541 -10.039   6.529
   50   1HB   LEU   7          2HB       LEU   7   7.357  -7.202   5.823
   51   2HB   LEU   7          3HB       LEU   7   6.898  -8.453   4.664
   52    HG   LEU   7           HG       LEU   7   4.804  -8.537   6.481
   53   1HD1  LEU   7          1HD1      LEU   7   5.275  -5.621   6.085
   54   2HD1  LEU   7          2HD1      LEU   7   4.123  -6.461   7.168
   55   3HD1  LEU   7          3HD1      LEU   7   5.807  -6.488   7.561
   56   1HD2  LEU   7          1HD2      LEU   7   4.706  -8.522   3.959
   57   2HD2  LEU   7          2HD2      LEU   7   3.439  -7.619   4.775
   58   3HD2  LEU   7          3HD2      LEU   7   4.804  -6.747   4.040
   59    H    ASN   8           H        ASN   8   9.249  -7.882   6.019
   60    HA   ASN   8           HA       ASN   8  11.540  -9.417   6.302
   61   1HB   ASN   8          2HB       ASN   8   9.926 -10.082   3.858
   62   2HB   ASN   8          3HB       ASN   8  11.672  -9.963   3.657
   63   1HD2  ASN   8          2HD2      ASN   8  10.066 -12.225   3.129
   64   2HD2  ASN   8          1HD2      ASN   8  10.896 -13.460   4.144
   65    H    ALA   9           H        ALA   9  12.723  -7.458   6.340
   66    HA   ALA   9           HA       ALA   9  12.500  -5.217   4.765
   67   1HB   ALA   9          1HB       ALA   9  15.078  -6.608   5.593
   68   2HB   ALA   9          2HB       ALA   9  14.904  -4.893   5.155
   69   3HB   ALA   9          3HB       ALA   9  14.099  -5.522   6.605
   70    H    GLU  10           H        GLU  10  13.978  -8.282   3.629
   71    HA   GLU  10           HA       GLU  10  14.967  -7.406   1.101
   72   1HB   GLU  10          2HB       GLU  10  13.882 -10.113   1.995
   73   2HB   GLU  10          3HB       GLU  10  14.810  -9.828   0.517
   74   1HG   GLU  10          2HG       GLU  10  16.750  -9.086   1.852
   75   2HG   GLU  10          3HG       GLU  10  15.839  -9.331   3.347
   76    H    ASP  11           H        ASP  11  11.853  -8.700   2.022
   77    HA   ASP  11           HA       ASP  11  10.637  -8.784  -0.623
   78   1HB   ASP  11          2HB       ASP  11   9.264  -8.778   2.098
   79   2HB   ASP  11          3HB       ASP  11   8.557  -9.183   0.551
   80    H    ILE  12           H        ILE  12  10.422  -6.566   2.171
   81    HA   ILE  12           HA       ILE  12   8.950  -4.400   0.985
   82    HB   ILE  12           HB       ILE  12  10.726  -4.820   3.351
   83   1HG1  ILE  12          2HG       ILE  12   8.783  -3.297   4.300
   84   2HG1  ILE  12          3HG       ILE  12   7.982  -3.651   2.775
   85   1HG2  ILE  12          1HG       ILE  12  10.213  -2.003   2.392
   86   2HG2  ILE  12          2HG       ILE  12  10.835  -2.512   3.984
   87   3HG2  ILE  12          3HG       ILE  12  11.806  -2.803   2.552
   88   1HD1  ILE  12          1HD1      ILE  12   8.966  -5.604   4.883
   89   2HD1  ILE  12          2HD1      ILE  12   7.272  -5.240   4.463
   90   3HD1  ILE  12          3HD1      ILE  12   8.296  -6.124   3.317
   91    H    LYS  13           H        LYS  13  12.499  -4.964   0.876
   92    HA   LYS  13           HA       LYS  13  13.122  -2.634  -0.567
   93   1HB   LYS  13          2HB       LYS  13  14.820  -3.884   0.469
   94   2HB   LYS  13          3HB       LYS  13  14.312  -5.393  -0.248
   95   1HG   LYS  13          2HG       LYS  13  16.369  -4.707  -1.166
   96   2HG   LYS  13          3HG       LYS  13  15.121  -4.755  -2.414
   97   1HD   LYS  13          2HD       LYS  13  14.969  -2.324  -2.472
   98   2HD   LYS  13          3HD       LYS  13  15.886  -2.170  -0.964
   99   1HE   LYS  13          2HE       LYS  13  17.903  -3.038  -2.093
  100   2HE   LYS  13          3HE       LYS  13  16.998  -3.198  -3.609
  101   1HZ   LYS  13          1HZ       LYS  13  17.431  -0.648  -2.158
  102   2HZ   LYS  13          2HZ       LYS  13  18.259  -1.114  -3.499
  103   3HZ   LYS  13          3HZ       LYS  13  16.646  -0.808  -3.589
  104    H    LYS  14           H        LYS  14  12.146  -5.842  -1.909
  105    HA   LYS  14           HA       LYS  14  12.032  -4.766  -4.647
  106   1HB   LYS  14          2HB       LYS  14  10.880  -7.323  -3.458
  107   2HB   LYS  14          3HB       LYS  14  10.775  -6.862  -5.169
  108   1HG   LYS  14          2HG       LYS  14  13.325  -6.647  -5.167
  109   2HG   LYS  14          3HG       LYS  14  13.305  -7.382  -3.564
  110   1HD   LYS  14          2HD       LYS  14  13.507  -9.338  -4.662
  111   2HD   LYS  14          3HD       LYS  14  11.770  -9.196  -4.972
  112   1HE   LYS  14          2HE       LYS  14  12.276  -8.051  -7.140
  113   2HE   LYS  14          3HE       LYS  14  14.005  -8.175  -6.790
  114   1HZ   LYS  14          1HZ       LYS  14  12.169 -10.463  -7.171
  115   2HZ   LYS  14          2HZ       LYS  14  13.326  -9.965  -8.232
  116   3HZ   LYS  14          3HZ       LYS  14  13.757 -10.593  -6.775
  117    H    ALA  15           H        ALA  15   9.633  -5.023  -2.054
  118    HA   ALA  15           HA       ALA  15   7.356  -4.286  -3.518
  119   1HB   ALA  15          1HB       ALA  15   7.904  -3.222  -0.716
  120   2HB   ALA  15          2HB       ALA  15   6.391  -3.766  -1.430
  121   3HB   ALA  15          3HB       ALA  15   7.671  -4.943  -1.028
  122    H    VAL  16           H        VAL  16   9.514  -2.026  -1.690
  123    HA   VAL  16           HA       VAL  16   8.294   0.350  -2.675
  124    HB   VAL  16           HB       VAL  16  11.193  -0.036  -1.832
  125   1HG1  VAL  16          1HG       VAL  16   9.471   2.478  -1.944
  126   2HG1  VAL  16          2HG       VAL  16  11.121   2.370  -1.297
  127   3HG1  VAL  16          3HG       VAL  16  10.839   2.120  -3.023
  128   1HG2  VAL  16          1HG       VAL  16   9.640  -0.668  -0.003
  129   2HG2  VAL  16          2HG       VAL  16  10.423   0.881   0.325
  130   3HG2  VAL  16          3HG       VAL  16   8.737   0.845  -0.231
  131    H    GLY  17           H        GLY  17  10.860  -1.648  -4.094
  132   1HA   GLY  17          2HA       GLY  17  11.523   0.004  -6.326
  133   2HA   GLY  17          3HA       GLY  17  11.748  -1.740  -6.205
  134    H    ALA  18           H        ALA  18   8.569  -1.788  -5.778
  135    HA   ALA  18           HA       ALA  18   7.946  -2.202  -8.600
  136   1HB   ALA  18          1HB       ALA  18   6.061  -2.435  -6.240
  137   2HB   ALA  18          2HB       ALA  18   6.036  -3.315  -7.771
  138   3HB   ALA  18          3HB       ALA  18   7.298  -3.658  -6.570
  139    H    PHE  19           H        PHE  19   6.352  -0.251  -6.008
  140    HA   PHE  19           HA       PHE  19   4.916   1.480  -7.877
  141   1HB   PHE  19          2HB       PHE  19   5.520   1.826  -4.931
  142   2HB   PHE  19          3HB       PHE  19   4.386   2.790  -5.872
  143    HD1  PHE  19           1HD      PHE  19   3.526   1.552  -3.338
  144    HD2  PHE  19           2HD      PHE  19   3.443  -0.023  -7.358
  145    HE1  PHE  19           1HE      PHE  19   1.671   0.090  -2.715
  146    HE2  PHE  19           2HE      PHE  19   1.583  -1.451  -6.728
  147    HZ   PHE  19           HZ       PHE  19   0.663  -1.424  -4.402
  148    H    SER  20           H        SER  20   8.254   1.540  -6.915
  149    HA   SER  20           HA       SER  20   8.808   4.336  -7.049
  150   1HB   SER  20          2HB       SER  20  10.446   1.839  -7.378
  151   2HB   SER  20          3HB       SER  20  11.151   3.405  -7.824
  152    HG   SER  20           HG       SER  20  11.415   2.771  -5.573
  153    H    ALA  21           H        ALA  21   7.152   4.638  -8.769
  154    HA   ALA  21           HA       ALA  21   8.480   5.380 -11.284
  155   1HB   ALA  21          1HB       ALA  21   5.962   3.655 -11.126
  156   2HB   ALA  21          2HB       ALA  21   6.652   4.335 -12.625
  157   3HB   ALA  21          3HB       ALA  21   7.550   3.114 -11.706
  158    H    THR  22           H        THR  22   6.439   6.582 -12.633
  159    HA   THR  22           HA       THR  22   5.527   8.684 -10.808
  160    HB   THR  22           HB       THR  22   4.600   9.763 -12.798
  161    HG1  THR  22           1HG      THR  22   4.018   8.457 -14.339
  162   1HG2  THR  22          1HG       THR  22   7.426   8.747 -13.309
  163   2HG2  THR  22          2HG       THR  22   6.687  10.224 -13.952
  164   3HG2  THR  22          3HG       THR  22   7.001  10.080 -12.210
  165    H    ASP  23           H        ASP  23   3.637   7.010 -13.238
  166    HA   ASP  23           HA       ASP  23   1.320   6.690 -11.430
  167   1HB   ASP  23          2HB       ASP  23   0.057   6.812 -13.666
  168   2HB   ASP  23          3HB       ASP  23   0.680   8.247 -12.884
  169    H    SER  24           H        SER  24   3.606   4.723 -12.460
  170    HA   SER  24           HA       SER  24   2.086   2.533 -13.660
  171   1HB   SER  24          2HB       SER  24   4.528   3.261 -14.136
  172   2HB   SER  24          3HB       SER  24   4.936   2.325 -12.686
  173    HG   SER  24           HG       SER  24   5.015   0.846 -14.238
  174    H    PHE  25           H        PHE  25   0.772   2.846 -11.429
  175    HA   PHE  25           HA       PHE  25   1.694   1.466  -9.083
  176   1HB   PHE  25          2HB       PHE  25  -0.198   3.119  -9.182
  177   2HB   PHE  25          3HB       PHE  25  -1.146   2.010 -10.125
  178    HD1  PHE  25           1HD      PHE  25  -2.685   0.631  -9.005
  179    HD2  PHE  25           2HD      PHE  25   0.687   2.216  -6.831
  180    HE1  PHE  25           1HE      PHE  25  -3.555  -0.358  -6.894
  181    HE2  PHE  25           2HE      PHE  25  -0.196   1.271  -4.750
  182    HZ   PHE  25           HZ       PHE  25  -2.261  -0.098  -4.777
  183    H    ASP  26           H        ASP  26   2.155  -0.746  -8.978
  184    HA   ASP  26           HA       ASP  26   0.414  -2.640 -10.450
  185   1HB   ASP  26          2HB       ASP  26   2.351  -3.932 -10.845
  186   2HB   ASP  26          3HB       ASP  26   2.668  -2.278 -11.340
  187    H    HIS  27           H        HIS  27  -0.600  -2.046  -8.027
  188    HA   HIS  27           HA       HIS  27  -0.012  -3.073  -5.682
  189   1HB   HIS  27          2HB       HIS  27  -2.375  -3.670  -5.238
  190   2HB   HIS  27          3HB       HIS  27  -2.140  -2.118  -5.938
  191    HD1  HIS  27           HD1      HIS  27  -4.350  -4.968  -6.336
  192    HD2  HIS  27           HD2      HIS  27  -2.624  -2.057  -8.832
  193    HE1  HIS  27           HE1      HIS  27  -5.736  -4.940  -8.473
  194    H    LYS  28           H        LYS  28  -1.373  -5.214  -8.051
  195    HA   LYS  28           HA       LYS  28  -1.389  -7.779  -6.917
  196   1HB   LYS  28          2HB       LYS  28  -0.528  -6.812  -9.698
  197   2HB   LYS  28          3HB       LYS  28  -0.946  -8.485  -9.311
  198   1HG   LYS  28          2HG       LYS  28  -3.158  -8.013  -8.961
  199   2HG   LYS  28          3HG       LYS  28  -2.960  -6.324  -8.630
  200   1HD   LYS  28          2HD       LYS  28  -2.580  -7.507 -11.401
  201   2HD   LYS  28          3HD       LYS  28  -4.047  -6.733 -10.805
  202   1HE   LYS  28          2HE       LYS  28  -1.937  -4.919 -10.215
  203   2HE   LYS  28          3HE       LYS  28  -1.622  -5.507 -11.852
  204   1HZ   LYS  28          1HZ       LYS  28  -4.029  -4.143 -10.818
  205   2HZ   LYS  28          2HZ       LYS  28  -3.040  -3.626 -12.013
  206   3HZ   LYS  28          3HZ       LYS  28  -4.040  -4.916 -12.281
  207    H    LYS  29           H        LYS  29   1.316  -6.276  -8.689
  208    HA   LYS  29           HA       LYS  29   3.190  -8.392  -8.202
  209   1HB   LYS  29          2HB       LYS  29   3.049  -5.916  -9.761
  210   2HB   LYS  29          3HB       LYS  29   4.540  -5.918  -8.830
  211   1HG   LYS  29          2HG       LYS  29   5.156  -8.114  -9.778
  212   2HG   LYS  29          3HG       LYS  29   3.660  -8.109 -10.743
  213   1HD   LYS  29          2HD       LYS  29   4.363  -5.987 -11.826
  214   2HD   LYS  29          3HD       LYS  29   5.849  -5.972 -10.859
  215   1HE   LYS  29          2HE       LYS  29   6.578  -8.082 -11.887
  216   2HE   LYS  29          3HE       LYS  29   5.068  -8.179 -12.808
  217   1HZ   LYS  29          1HZ       LYS  29   7.069  -6.008 -13.058
  218   2HZ   LYS  29          2HZ       LYS  29   6.872  -7.238 -14.138
  219   3HZ   LYS  29          3HZ       LYS  29   5.681  -6.123 -13.921
  220    H    PHE  30           H        PHE  30   2.739  -5.065  -6.919
  221    HA   PHE  30           HA       PHE  30   4.829  -4.946  -5.043
  222   1HB   PHE  30          2HB       PHE  30   3.412  -3.082  -5.649
  223   2HB   PHE  30          3HB       PHE  30   2.010  -3.826  -4.902
  224    HD1  PHE  30           1HD      PHE  30   1.580  -3.569  -2.524
  225    HD2  PHE  30           2HD      PHE  30   5.259  -2.243  -4.247
  226    HE1  PHE  30           1HE      PHE  30   2.089  -2.355  -0.449
  227    HE2  PHE  30           2HE      PHE  30   5.830  -1.051  -2.139
  228    HZ   PHE  30           HZ       PHE  30   4.240  -1.099  -0.240
  229    H    PHE  31           H        PHE  31   1.475  -6.127  -4.348
  230    HA   PHE  31           HA       PHE  31   2.042  -6.987  -1.688
  231   1HB   PHE  31          2HB       PHE  31  -0.130  -7.587  -3.671
  232   2HB   PHE  31          3HB       PHE  31   0.040  -8.595  -2.251
  233    HD1  PHE  31           1HD      PHE  31  -1.485  -8.118  -0.557
  234    HD2  PHE  31           2HD      PHE  31   0.027  -4.893  -2.955
  235    HE1  PHE  31           1HE      PHE  31  -2.642  -6.491   0.902
  236    HE2  PHE  31           2HE      PHE  31  -1.147  -3.251  -1.487
  237    HZ   PHE  31           HZ       PHE  31  -2.456  -4.087   0.460
  238    H    GLN  32           H        GLN  32   2.358  -8.699  -4.804
  239    HA   GLN  32           HA       GLN  32   3.025 -11.273  -3.659
  240   1HB   GLN  32          2HB       GLN  32   3.424 -10.009  -6.393
  241   2HB   GLN  32          3HB       GLN  32   3.926 -11.661  -6.025
  242   1HG   GLN  32          2HG       GLN  32   1.717 -12.408  -5.659
  243   2HG   GLN  32          3HG       GLN  32   1.080 -10.785  -5.430
  244   1HE2  GLN  32          2HE       GLN  32  -0.490 -10.586  -7.092
  245   2HE2  GLN  32          1HE       GLN  32  -0.059 -10.988  -8.763
  246    H    MET  33           H        MET  33   5.085  -8.628  -4.954
  247    HA   MET  33           HA       MET  33   7.626  -9.750  -4.353
  248   1HB   MET  33          2HB       MET  33   6.644  -6.888  -4.700
  249   2HB   MET  33          3HB       MET  33   8.342  -7.285  -4.427
  250   1HG   MET  33          2HG       MET  33   8.457  -8.608  -6.439
  251   2HG   MET  33          3HG       MET  33   6.719  -8.443  -6.720
  252   1HE   MET  33          1HE       MET  33   7.424  -7.817  -9.200
  253   2HE   MET  33          2HE       MET  33   8.324  -6.345  -9.641
  254   3HE   MET  33          3HE       MET  33   9.171  -7.708  -8.873
  255    H    VAL  34           H        VAL  34   5.615  -7.490  -2.365
  256    HA   VAL  34           HA       VAL  34   7.487  -7.520  -0.163
  257    HB   VAL  34           HB       VAL  34   5.709  -5.777  -0.827
  258   1HG1  VAL  34          1HG       VAL  34   3.968  -7.195   1.141
  259   2HG1  VAL  34          2HG       VAL  34   3.631  -5.778   0.109
  260   3HG1  VAL  34          3HG       VAL  34   3.822  -7.377  -0.626
  261   1HG2  VAL  34          1HG       VAL  34   7.255  -5.675   1.159
  262   2HG2  VAL  34          2HG       VAL  34   5.713  -4.837   1.386
  263   3HG2  VAL  34          3HG       VAL  34   5.995  -6.429   2.128
  264    H    GLY  35           H        GLY  35   5.523  -9.997  -1.271
  265   1HA   GLY  35          2HA       GLY  35   4.757 -11.952  -0.385
  266   2HA   GLY  35          3HA       GLY  35   5.760 -11.634   1.036
  267    H    LEU  36           H        LEU  36   3.286  -9.298   0.222
  268    HA   LEU  36           HA       LEU  36   2.185  -9.218   2.823
  269   1HB   LEU  36          2HB       LEU  36   1.816  -7.896   0.303
  270   2HB   LEU  36          3HB       LEU  36   0.242  -8.399   0.810
  271    HG   LEU  36           HG       LEU  36   2.072  -6.917   2.711
  272   1HD1  LEU  36          1HD1      LEU  36   0.861  -5.818   0.300
  273   2HD1  LEU  36          2HD1      LEU  36   0.212  -5.039   1.746
  274   3HD1  LEU  36          3HD1      LEU  36   1.954  -5.084   1.457
  275   1HD2  LEU  36          1HD2      LEU  36   0.228  -7.972   3.771
  276   2HD2  LEU  36          2HD2      LEU  36  -0.231  -6.275   3.647
  277   3HD2  LEU  36          3HD2      LEU  36  -0.928  -7.436   2.522
  278    H    LYS  37           H        LYS  37   0.657 -10.494  -0.041
  279    HA   LYS  37           HA       LYS  37  -1.470 -12.052   1.086
  280   1HB   LYS  37          2HB       LYS  37   0.157 -12.428  -1.463
  281   2HB   LYS  37          3HB       LYS  37  -1.086 -13.571  -0.976
  282   1HG   LYS  37          2HG       LYS  37  -2.684 -11.509  -0.853
  283   2HG   LYS  37          3HG       LYS  37  -1.471 -10.708  -1.862
  284   1HD   LYS  37          2HD       LYS  37  -2.813 -13.387  -2.475
  285   2HD   LYS  37          3HD       LYS  37  -3.304 -11.835  -3.142
  286   1HE   LYS  37          2HE       LYS  37  -1.188 -11.545  -4.289
  287   2HE   LYS  37          3HE       LYS  37  -0.543 -13.021  -3.549
  288   1HZ   LYS  37          1HZ       LYS  37  -2.823 -12.896  -5.440
  289   2HZ   LYS  37          2HZ       LYS  37  -1.328 -13.482  -5.775
  290   3HZ   LYS  37          3HZ       LYS  37  -2.292 -14.265  -4.702
  291    H    LYS  38           H        LYS  38   1.955 -12.849   1.165
  292    HA   LYS  38           HA       LYS  38   1.403 -15.694   1.838
  293   1HB   LYS  38          2HB       LYS  38   3.386 -16.183   0.980
  294   2HB   LYS  38          3HB       LYS  38   3.443 -14.552   0.338
  295   1HG   LYS  38          2HG       LYS  38   4.706 -13.840   2.400
  296   2HG   LYS  38          3HG       LYS  38   4.690 -15.498   2.965
  297   1HD   LYS  38          2HD       LYS  38   5.751 -15.322   0.221
  298   2HD   LYS  38          3HD       LYS  38   6.588 -14.224   1.311
  299   1HE   LYS  38          2HE       LYS  38   7.775 -16.308   1.331
  300   2HE   LYS  38          3HE       LYS  38   7.005 -16.077   2.905
  301   1HZ   LYS  38          1HZ       LYS  38   5.988 -17.808   0.729
  302   2HZ   LYS  38          2HZ       LYS  38   6.691 -18.325   2.122
  303   3HZ   LYS  38          3HZ       LYS  38   5.231 -17.570   2.172
  304    H    LYS  39           H        LYS  39   2.070 -12.680   3.349
  305    HA   LYS  39           HA       LYS  39   2.839 -13.791   5.956
  306   1HB   LYS  39          2HB       LYS  39   2.535 -11.070   4.721
  307   2HB   LYS  39          3HB       LYS  39   2.045 -11.170   6.397
  308   1HG   LYS  39          2HG       LYS  39   4.300 -10.636   6.543
  309   2HG   LYS  39          3HG       LYS  39   4.251 -12.342   6.901
  310   1HD   LYS  39          2HD       LYS  39   4.682 -12.360   4.147
  311   2HD   LYS  39          3HD       LYS  39   5.502 -10.874   4.623
  312   1HE   LYS  39          2HE       LYS  39   6.573 -12.383   6.497
  313   2HE   LYS  39          3HE       LYS  39   5.977 -13.735   5.529
  314   1HZ   LYS  39          1HZ       LYS  39   8.116 -11.845   5.006
  315   2HZ   LYS  39          2HZ       LYS  39   8.098 -13.407   4.671
  316   3HZ   LYS  39          3HZ       LYS  39   7.327 -12.345   3.652
  317    H    SER  40           H        SER  40   1.526 -13.125   7.889
  318    HA   SER  40           HA       SER  40  -0.961 -14.586   7.668
  319   1HB   SER  40          2HB       SER  40   0.635 -14.683   9.607
  320   2HB   SER  40          3HB       SER  40   0.103 -13.052  10.069
  321    HG   SER  40           HG       SER  40  -1.576 -13.900  10.984
  322    H    ALA  41           H        ALA  41  -3.034 -13.837   8.559
  323    HA   ALA  41           HA       ALA  41  -4.060 -11.506   7.242
  324   1HB   ALA  41          1HB       ALA  41  -5.167 -13.075   9.607
  325   2HB   ALA  41          2HB       ALA  41  -6.095 -11.993   8.551
  326   3HB   ALA  41          3HB       ALA  41  -5.409 -13.500   7.886
  327    H    ASP  42           H        ASP  42  -3.084 -12.077  10.643
  328    HA   ASP  42           HA       ASP  42  -3.821  -9.509  11.652
  329   1HB   ASP  42          2HB       ASP  42  -2.301 -10.203  13.535
  330   2HB   ASP  42          3HB       ASP  42  -3.556 -11.381  13.143
  331    H    ASP  43           H        ASP  43  -0.915 -10.852  10.144
  332    HA   ASP  43           HA       ASP  43   0.885  -8.664  10.626
  333   1HB   ASP  43          2HB       ASP  43   1.380 -11.096   9.931
  334   2HB   ASP  43          3HB       ASP  43   1.013 -10.586   8.285
  335    H    VAL  44           H        VAL  44  -1.078  -9.573   7.748
  336    HA   VAL  44           HA       VAL  44  -0.762  -7.365   6.080
  337    HB   VAL  44           HB       VAL  44  -2.984  -9.330   6.690
  338   1HG1  VAL  44          1HG       VAL  44  -2.913  -7.282   4.476
  339   2HG1  VAL  44          2HG       VAL  44  -3.896  -8.768   4.458
  340   3HG1  VAL  44          3HG       VAL  44  -4.164  -7.576   5.722
  341   1HG2  VAL  44          1HG       VAL  44  -0.705 -10.045   5.553
  342   2HG2  VAL  44          2HG       VAL  44  -2.253 -10.628   4.934
  343   3HG2  VAL  44          3HG       VAL  44  -1.436  -9.309   4.114
  344    H    LYS  45           H        LYS  45  -2.853  -7.704   8.996
  345    HA   LYS  45           HA       LYS  45  -4.053  -5.121   8.804
  346   1HB   LYS  45          2HB       LYS  45  -4.274  -7.390  10.469
  347   2HB   LYS  45          3HB       LYS  45  -3.666  -6.125  11.549
  348   1HG   LYS  45          2HG       LYS  45  -5.448  -4.630  10.753
  349   2HG   LYS  45          3HG       LYS  45  -6.059  -5.894   9.686
  350   1HD   LYS  45          2HD       LYS  45  -5.939  -6.262  12.697
  351   2HD   LYS  45          3HD       LYS  45  -7.322  -5.552  11.856
  352   1HE   LYS  45          2HE       LYS  45  -6.684  -7.907  10.392
  353   2HE   LYS  45          3HE       LYS  45  -6.526  -8.370  12.087
  354   1HZ   LYS  45          1HZ       LYS  45  -8.911  -7.104  10.858
  355   2HZ   LYS  45          2HZ       LYS  45  -8.786  -8.682  11.284
  356   3HZ   LYS  45          3HZ       LYS  45  -8.782  -7.517  12.447
  357    H    LYS  46           H        LYS  46  -0.983  -6.087  10.368
  358    HA   LYS  46           HA       LYS  46  -0.400  -3.360  11.313
  359   1HB   LYS  46          2HB       LYS  46   1.464  -5.730  10.809
  360   2HB   LYS  46          3HB       LYS  46   1.998  -4.139  11.297
  361   1HG   LYS  46          2HG       LYS  46   1.996  -5.242  13.273
  362   2HG   LYS  46          3HG       LYS  46   0.494  -4.336  13.362
  363   1HD   LYS  46          2HD       LYS  46   0.360  -7.139  12.272
  364   2HD   LYS  46          3HD       LYS  46   0.794  -7.005  13.960
  365   1HE   LYS  46          2HE       LYS  46  -1.666  -5.636  12.811
  366   2HE   LYS  46          3HE       LYS  46  -1.685  -7.300  13.399
  367   1HZ   LYS  46          1HZ       LYS  46  -0.931  -4.954  15.033
  368   2HZ   LYS  46          2HZ       LYS  46  -2.353  -5.780  15.136
  369   3HZ   LYS  46          3HZ       LYS  46  -0.944  -6.516  15.548
  370    H    VAL  47           H        VAL  47   0.293  -5.165   8.333
  371    HA   VAL  47           HA       VAL  47   1.920  -3.319   6.993
  372    HB   VAL  47           HB       VAL  47  -0.186  -5.068   5.717
  373   1HG1  VAL  47          1HG       VAL  47   2.072  -3.383   4.606
  374   2HG1  VAL  47          2HG       VAL  47   1.504  -4.825   3.770
  375   3HG1  VAL  47          3HG       VAL  47   0.380  -3.486   4.044
  376   1HG2  VAL  47          1HG       VAL  47   1.770  -6.156   7.077
  377   2HG2  VAL  47          2HG       VAL  47   1.513  -6.661   5.413
  378   3HG2  VAL  47          3HG       VAL  47   2.787  -5.484   5.791
  379    H    PHE  48           H        PHE  48  -1.652  -3.480   6.419
  380    HA   PHE  48           HA       PHE  48  -2.073  -0.977   5.354
  381   1HB   PHE  48          2HB       PHE  48  -3.816  -2.502   5.276
  382   2HB   PHE  48          3HB       PHE  48  -3.603  -3.012   6.946
  383    HD1  PHE  48           1HD      PHE  48  -4.653  -1.922   8.788
  384    HD2  PHE  48           2HD      PHE  48  -4.985  -0.321   4.794
  385    HE1  PHE  48           1HE      PHE  48  -6.304  -0.251   9.597
  386    HE2  PHE  48           2HE      PHE  48  -6.599   1.381   5.630
  387    HZ   PHE  48           HZ       PHE  48  -7.236   1.403   8.007
  388    H    HIS  49           H        HIS  49  -1.992  -1.783   8.904
  389    HA   HIS  49           HA       HIS  49  -2.937   0.697   9.760
  390   1HB   HIS  49          2HB       HIS  49  -2.662  -1.377  11.125
  391   2HB   HIS  49          3HB       HIS  49  -0.929  -1.050  11.233
  392    HD1  HIS  49           HD1      HIS  49  -2.162   2.250  11.619
  393    HD2  HIS  49           HD2      HIS  49  -2.338  -1.258  13.935
  394    HE1  HIS  49           HE1      HIS  49  -2.824   2.959  14.020
  395    H    MET  50           H        MET  50   0.404  -0.111   8.876
  396    HA   MET  50           HA       MET  50   1.640   2.242  10.014
  397   1HB   MET  50          2HB       MET  50   2.621   0.001   9.216
  398   2HB   MET  50          3HB       MET  50   2.622   0.718   7.593
  399   1HG   MET  50          2HG       MET  50   4.775   1.133   8.339
  400   2HG   MET  50          3HG       MET  50   3.982   2.647   8.752
  401   1HE   MET  50          1HE       MET  50   4.101   3.658  11.116
  402   2HE   MET  50          2HE       MET  50   5.440   3.053  12.122
  403   3HE   MET  50          3HE       MET  50   5.715   3.419  10.402
  404    H    LEU  51           H        LEU  51  -0.275   1.845   7.174
  405    HA   LEU  51           HA       LEU  51   0.803   4.105   5.613
  406   1HB   LEU  51          2HB       LEU  51  -1.772   2.580   5.234
  407   2HB   LEU  51          3HB       LEU  51  -0.842   3.441   4.021
  408    HG   LEU  51           HG       LEU  51  -0.131   0.820   5.408
  409   1HD1  LEU  51          1HD1      LEU  51  -0.960   1.451   2.576
  410   2HD1  LEU  51          2HD1      LEU  51  -0.287  -0.119   3.109
  411   3HD1  LEU  51          3HD1      LEU  51  -1.811   0.476   3.765
  412   1HD2  LEU  51          1HD2      LEU  51   1.944   2.131   4.995
  413   2HD2  LEU  51          2HD2      LEU  51   1.841   0.631   4.098
  414   3HD2  LEU  51          3HD2      LEU  51   1.530   2.184   3.274
  415    H    ASP  52           H        ASP  52  -1.710   3.498   7.968
  416    HA   ASP  52           HA       ASP  52  -3.370   5.804   7.425
  417   1HB   ASP  52          2HB       ASP  52  -4.163   3.620   8.304
  418   2HB   ASP  52          3HB       ASP  52  -3.301   3.937   9.809
  419    H    LYS  53           H        LYS  53  -1.350   7.097   7.402
  420    HA   LYS  53           HA       LYS  53   0.153   7.725   9.746
  421   1HB   LYS  53          2HB       LYS  53  -0.020   9.191   7.084
  422   2HB   LYS  53          3HB       LYS  53   1.202   9.451   8.327
  423   1HG   LYS  53          2HG       LYS  53   1.255   6.659   7.978
  424   2HG   LYS  53          3HG       LYS  53   0.993   7.266   6.341
  425   1HD   LYS  53          2HD       LYS  53   3.166   8.162   8.254
  426   2HD   LYS  53          3HD       LYS  53   3.401   6.971   6.969
  427   1HE   LYS  53          2HE       LYS  53   2.485   9.853   6.551
  428   2HE   LYS  53          3HE       LYS  53   4.162   9.321   6.381
  429   1HZ   LYS  53          1HZ       LYS  53   1.902   8.324   4.734
  430   2HZ   LYS  53          2HZ       LYS  53   3.000   9.436   4.239
  431   3HZ   LYS  53          3HZ       LYS  53   3.470   7.898   4.518
  432    H    ASP  54           H        ASP  54  -2.698   8.288   9.936
  433    HA   ASP  54           HA       ASP  54  -2.667  10.960  11.245
  434   1HB   ASP  54          2HB       ASP  54  -4.971  11.278  10.359
  435   2HB   ASP  54          3HB       ASP  54  -3.776  11.143   9.068
  436    H    LYS  55           H        LYS  55  -3.204   7.596  11.625
  437    HA   LYS  55           HA       LYS  55  -4.321   6.274  12.972
  438   1HB   LYS  55          2HB       LYS  55  -2.874   7.953  14.497
  439   2HB   LYS  55          3HB       LYS  55  -4.436   8.384  15.138
  440   1HG   LYS  55          2HG       LYS  55  -4.501   6.503  16.374
  441   2HG   LYS  55          3HG       LYS  55  -4.331   5.495  14.933
  442   1HD   LYS  55          2HD       LYS  55  -2.025   6.730  16.489
  443   2HD   LYS  55          3HD       LYS  55  -2.566   5.040  16.584
  444   1HE   LYS  55          2HE       LYS  55  -2.145   4.854  14.089
  445   2HE   LYS  55          3HE       LYS  55  -1.440   6.467  14.133
  446   1HZ   LYS  55          1HZ       LYS  55  -0.450   4.133  15.663
  447   2HZ   LYS  55          2HZ       LYS  55   0.256   4.769  14.320
  448   3HZ   LYS  55          3HZ       LYS  55   0.201   5.643  15.712
  449    H    SER  56           H        SER  56  -6.063   6.653  11.401
  450    HA   SER  56           HA       SER  56  -8.616   7.025  12.921
  451   1HB   SER  56          2HB       SER  56  -9.747   8.053  11.056
  452   2HB   SER  56          3HB       SER  56  -8.355   9.036  11.547
  453    HG   SER  56           HG       SER  56  -7.415   8.698   9.667
  454    H    GLY  57           H        GLY  57  -6.835   4.969  10.772
  455   1HA   GLY  57          2HA       GLY  57  -7.312   2.731  10.436
  456   2HA   GLY  57          3HA       GLY  57  -8.970   2.965  10.977
  457    H    PHE  58           H        PHE  58  -7.582   4.938   8.345
  458    HA   PHE  58           HA       PHE  58  -8.867   3.374   6.191
  459   1HB   PHE  58          2HB       PHE  58  -9.983   6.138   6.856
  460   2HB   PHE  58          3HB       PHE  58 -10.483   5.054   5.576
  461    HD1  PHE  58           1HD      PHE  58 -10.909   5.966   9.059
  462    HD2  PHE  58           2HD      PHE  58 -11.740   2.925   6.116
  463    HE1  PHE  58           1HE      PHE  58 -12.654   5.022  10.532
  464    HE2  PHE  58           2HE      PHE  58 -13.507   1.989   7.592
  465    HZ   PHE  58           HZ       PHE  58 -13.966   3.034   9.800
  466    H    ILE  59           H        ILE  59  -7.524   3.692   4.390
  467    HA   ILE  59           HA       ILE  59  -5.771   6.090   4.464
  468    HB   ILE  59           HB       ILE  59  -5.651   3.811   2.537
  469   1HG1  ILE  59          2HG       ILE  59  -3.673   4.042   4.807
  470   2HG1  ILE  59          3HG       ILE  59  -5.222   3.299   5.155
  471   1HG2  ILE  59          1HG       ILE  59  -3.502   5.812   3.288
  472   2HG2  ILE  59          2HG       ILE  59  -3.361   4.521   2.087
  473   3HG2  ILE  59          3HG       ILE  59  -4.458   5.868   1.800
  474   1HD1  ILE  59          1HD1      ILE  59  -3.345   2.379   2.949
  475   2HD1  ILE  59          2HD1      ILE  59  -3.648   1.585   4.514
  476   3HD1  ILE  59          3HD1      ILE  59  -4.943   1.692   3.316
  477    H    GLU  60           H        GLU  60  -5.749   7.666   3.080
  478    HA   GLU  60           HA       GLU  60  -7.847   8.112   1.036
  479   1HB   GLU  60          2HB       GLU  60  -7.033   9.754   3.490
  480   2HB   GLU  60          3HB       GLU  60  -8.027  10.418   2.189
  481   1HG   GLU  60          2HG       GLU  60  -9.852   9.059   2.638
  482   2HG   GLU  60          3HG       GLU  60  -8.864   7.836   3.429
  483    H    GLU  61           H        GLU  61  -7.335  10.130  -0.257
  484    HA   GLU  61           HA       GLU  61  -5.028   9.983  -1.663
  485   1HB   GLU  61          2HB       GLU  61  -5.552  12.103  -2.659
  486   2HB   GLU  61          3HB       GLU  61  -6.940  11.036  -2.505
  487   1HG   GLU  61          2HG       GLU  61  -7.673  12.349  -0.478
  488   2HG   GLU  61          3HG       GLU  61  -6.331  13.463  -0.767
  489    H    ASP  62           H        ASP  62  -5.375  12.012   1.184
  490    HA   ASP  62           HA       ASP  62  -3.028  13.580   1.123
  491   1HB   ASP  62          2HB       ASP  62  -4.888  13.855   2.716
  492   2HB   ASP  62          3HB       ASP  62  -4.527  12.294   3.450
  493    H    GLU  63           H        GLU  63  -3.501  10.312   2.484
  494    HA   GLU  63           HA       GLU  63  -0.672   9.979   3.239
  495   1HB   GLU  63          2HB       GLU  63  -3.037   8.076   3.042
  496   2HB   GLU  63          3HB       GLU  63  -1.449   7.597   3.642
  497   1HG   GLU  63          2HG       GLU  63  -1.744   8.598   5.668
  498   2HG   GLU  63          3HG       GLU  63  -2.620   9.979   5.014
  499    H    LEU  64           H        LEU  64  -2.899   8.946   0.708
  500    HA   LEU  64           HA       LEU  64  -1.540   6.972  -0.602
  501   1HB   LEU  64          2HB       LEU  64  -3.867   8.478  -0.885
  502   2HB   LEU  64          3HB       LEU  64  -2.999   8.837  -2.367
  503    HG   LEU  64           HG       LEU  64  -2.780   6.316  -2.618
  504   1HD1  LEU  64          1HD1      LEU  64  -4.908   6.331  -0.446
  505   2HD1  LEU  64          2HD1      LEU  64  -4.456   4.927  -1.436
  506   3HD1  LEU  64          3HD1      LEU  64  -3.282   5.624  -0.309
  507   1HD2  LEU  64          1HD2      LEU  64  -4.417   7.712  -3.852
  508   2HD2  LEU  64          2HD2      LEU  64  -5.193   6.182  -3.416
  509   3HD2  LEU  64          3HD2      LEU  64  -5.539   7.642  -2.484
  510    H    GLY  65           H        GLY  65  -1.074  10.444  -1.157
  511   1HA   GLY  65          2HA       GLY  65   0.736  10.361  -3.351
  512   2HA   GLY  65          3HA       GLY  65   0.827  11.544  -2.048
  513    H    PHE  66           H        PHE  66   1.372   9.432   0.016
  514    HA   PHE  66           HA       PHE  66   4.077   8.495  -0.680
  515   1HB   PHE  66          2HB       PHE  66   5.234   9.731   0.907
  516   2HB   PHE  66          3HB       PHE  66   4.304  10.874  -0.026
  517    HD1  PHE  66           1HD      PHE  66   5.548  10.461   3.066
  518    HD2  PHE  66           2HD      PHE  66   1.708  11.215   1.230
  519    HE1  PHE  66           1HE      PHE  66   4.759  11.580   5.135
  520    HE2  PHE  66           2HE      PHE  66   0.925  12.269   3.298
  521    HZ   PHE  66           HZ       PHE  66   2.431  12.469   5.261
  522    H    ILE  67           H        ILE  67   1.784   7.042  -0.206
  523    HA   ILE  67           HA       ILE  67   1.380   5.815   2.307
  524    HB   ILE  67           HB       ILE  67  -0.141   5.679   0.539
  525   1HG1  ILE  67          2HG       ILE  67   0.185   3.701   2.067
  526   2HG1  ILE  67          3HG       ILE  67  -0.870   3.520   0.676
  527   1HG2  ILE  67          1HG       ILE  67   1.882   4.207  -1.183
  528   2HG2  ILE  67          2HG       ILE  67   0.156   4.416  -1.532
  529   3HG2  ILE  67          3HG       ILE  67   1.220   5.816  -1.481
  530   1HD1  ILE  67          1HD1      ILE  67   2.004   2.536   0.803
  531   2HD1  ILE  67          2HD1      ILE  67   0.572   1.527   1.043
  532   3HD1  ILE  67          3HD1      ILE  67   0.857   2.259  -0.527
  533    H    LEU  68           H        LEU  68   3.712   5.034  -0.238
  534    HA   LEU  68           HA       LEU  68   4.899   2.761   0.951
  535   1HB   LEU  68          2HB       LEU  68   6.000   4.915  -0.871
  536   2HB   LEU  68          3HB       LEU  68   6.921   3.488  -0.427
  537    HG   LEU  68           HG       LEU  68   4.253   2.710  -1.354
  538   1HD1  LEU  68          1HD1      LEU  68   5.962   4.274  -3.333
  539   2HD1  LEU  68          2HD1      LEU  68   4.394   3.507  -3.642
  540   3HD1  LEU  68          3HD1      LEU  68   4.480   4.894  -2.574
  541   1HD2  LEU  68          1HD2      LEU  68   6.312   1.281  -1.167
  542   2HD2  LEU  68          2HD2      LEU  68   5.609   1.236  -2.783
  543   3HD2  LEU  68          3HD2      LEU  68   7.043   2.227  -2.490
  544    H    LYS  69           H        LYS  69   5.208   6.115   1.997
  545    HA   LYS  69           HA       LYS  69   7.797   5.787   3.224
  546   1HB   LYS  69          2HB       LYS  69   6.115   7.942   2.698
  547   2HB   LYS  69          3HB       LYS  69   6.051   7.837   4.453
  548   1HG   LYS  69          2HG       LYS  69   8.511   8.146   2.669
  549   2HG   LYS  69          3HG       LYS  69   7.756   9.397   3.631
  550   1HD   LYS  69          2HD       LYS  69   8.364   8.201   5.715
  551   2HD   LYS  69          3HD       LYS  69   9.139   6.918   4.756
  552   1HE   LYS  69          2HE       LYS  69  10.730   8.487   3.807
  553   2HE   LYS  69          3HE       LYS  69   9.939   9.849   4.614
  554   1HZ   LYS  69          1HZ       LYS  69  11.232   7.585   6.020
  555   2HZ   LYS  69          2HZ       LYS  69  11.903   9.077   5.824
  556   3HZ   LYS  69          3HZ       LYS  69  10.546   8.893   6.735
  557    H    GLY  70           H        GLY  70   4.783   4.485   4.081
  558   1HA   GLY  70          2HA       GLY  70   5.643   3.875   6.862
  559   2HA   GLY  70          3HA       GLY  70   4.180   3.280   6.048
  560    H    PHE  71           H        PHE  71   5.390   2.209   3.697
  561    HA   PHE  71           HA       PHE  71   6.396  -0.328   4.579
  562   1HB   PHE  71          2HB       PHE  71   6.264   1.005   1.878
  563   2HB   PHE  71          3HB       PHE  71   7.110  -0.508   2.122
  564    HD1  PHE  71           1HD      PHE  71   3.769   1.070   2.017
  565    HD2  PHE  71           2HD      PHE  71   5.952  -2.570   2.789
  566    HE1  PHE  71           1HE      PHE  71   1.685  -0.254   1.768
  567    HE2  PHE  71           2HE      PHE  71   3.854  -3.872   2.572
  568    HZ   PHE  71           HZ       PHE  71   1.718  -2.705   2.045
  569    H    SER  72           H        SER  72   8.190   2.595   3.295
  570    HA   SER  72           HA       SER  72  10.452   2.146   4.940
  571   1HB   SER  72          2HB       SER  72  10.269   0.648   2.389
  572   2HB   SER  72          3HB       SER  72  11.827   1.465   2.640
  573    HG   SER  72           HG       SER  72  10.405  -0.204   4.429
  574    HA   PRO  73           HA       PRO  73  11.631   6.004   2.929
  575   1HB   PRO  73          2HB       PRO  73  14.358   5.971   2.787
  576   2HB   PRO  73          3HB       PRO  73  13.478   6.109   4.340
  577   1HG   PRO  73          2HG       PRO  73  14.610   3.597   3.068
  578   2HG   PRO  73          3HG       PRO  73  14.850   4.186   4.746
  579   1HD   PRO  73          2HD       PRO  73  12.982   2.331   4.133
  580   2HD   PRO  73          3HD       PRO  73  12.655   3.568   5.370
  581    H    ASP  74           H        ASP  74  12.720   6.828   1.032
  582    HA   ASP  74           HA       ASP  74  13.126   7.048  -1.164
  583   1HB   ASP  74          2HB       ASP  74  14.574   4.909  -0.852
  584   2HB   ASP  74          3HB       ASP  74  13.251   4.084  -1.682
  585    H    ALA  75           H        ALA  75  10.546   5.839   0.216
  586    HA   ALA  75           HA       ALA  75   8.527   5.649  -1.782
  587   1HB   ALA  75          1HB       ALA  75   8.670   6.713   1.063
  588   2HB   ALA  75          2HB       ALA  75   7.162   6.458   0.176
  589   3HB   ALA  75          3HB       ALA  75   8.248   5.077   0.563
  590    H    ARG  76           H        ARG  76   9.387   7.193  -3.353
  591    HA   ARG  76           HA       ARG  76   9.266  10.046  -2.876
  592   1HB   ARG  76          2HB       ARG  76   8.962   8.729  -5.605
  593   2HB   ARG  76          3HB       ARG  76   9.628  10.322  -5.214
  594   1HG   ARG  76          2HG       ARG  76  11.433   8.975  -3.855
  595   2HG   ARG  76          3HG       ARG  76  10.829   7.582  -4.756
  596   1HD   ARG  76          2HD       ARG  76  12.675   8.280  -5.990
  597   2HD   ARG  76          3HD       ARG  76  11.287   8.923  -6.888
  598    HE   ARG  76           HE       ARG  76  12.570  10.670  -4.869
  599   1HH1  ARG  76          1HH2      ARG  76  12.421   9.929  -8.272
  600   2HH1  ARG  76          2HH2      ARG  76  13.160  11.431  -8.765
  601   1HH2  ARG  76          1HH1      ARG  76  13.511  12.593  -5.509
  602   2HH2  ARG  76          2HH1      ARG  76  13.772  12.912  -7.197
  603    H    ASP  77           H        ASP  77   7.793  11.534  -4.069
  604    HA   ASP  77           HA       ASP  77   5.075  11.054  -3.302
  605   1HB   ASP  77          2HB       ASP  77   6.217  13.266  -3.277
  606   2HB   ASP  77          3HB       ASP  77   6.256  13.260  -5.041
  607    H    LEU  78           H        LEU  78   3.851   9.651  -4.359
  608    HA   LEU  78           HA       LEU  78   4.201   8.737  -7.063
  609   1HB   LEU  78          2HB       LEU  78   1.666   8.618  -5.375
  610   2HB   LEU  78          3HB       LEU  78   2.058   7.597  -6.758
  611    HG   LEU  78           HG       LEU  78   3.480   7.589  -4.068
  612   1HD1  LEU  78          1HD1      LEU  78   1.842   5.373  -5.295
  613   2HD1  LEU  78          2HD1      LEU  78   2.475   5.499  -3.653
  614   3HD1  LEU  78          3HD1      LEU  78   1.169   6.570  -4.191
  615   1HD2  LEU  78          1HD2      LEU  78   5.099   7.045  -5.843
  616   2HD2  LEU  78          2HD2      LEU  78   4.656   5.568  -4.997
  617   3HD2  LEU  78          3HD2      LEU  78   3.946   5.902  -6.578
  618    H    SER  79           H        SER  79   2.932   9.061  -8.985
  619    HA   SER  79           HA       SER  79   2.287  11.787  -9.545
  620   1HB   SER  79          2HB       SER  79   2.908  10.260 -11.317
  621   2HB   SER  79          3HB       SER  79   1.507   9.230 -10.986
  622    HG   SER  79           HG       SER  79   1.342  10.709 -12.783
  623    H    ALA  80           H        ALA  80   0.390  12.889  -9.755
  624    HA   ALA  80           HA       ALA  80  -1.852  12.318  -8.133
  625   1HB   ALA  80          1HB       ALA  80  -1.678  14.042 -10.640
  626   2HB   ALA  80          2HB       ALA  80  -2.935  14.136  -9.386
  627   3HB   ALA  80          3HB       ALA  80  -1.258  14.562  -8.985
  628    H    LYS  81           H        LYS  81  -1.048  10.936 -11.226
  629    HA   LYS  81           HA       LYS  81  -3.852  10.076 -11.726
  630   1HB   LYS  81          2HB       LYS  81  -1.448   9.107 -13.290
  631   2HB   LYS  81          3HB       LYS  81  -3.136   9.157 -13.769
  632   1HG   LYS  81          2HG       LYS  81  -1.143  11.429 -13.606
  633   2HG   LYS  81          3HG       LYS  81  -2.026  10.835 -15.006
  634   1HD   LYS  81          2HD       LYS  81  -4.182  11.638 -13.859
  635   2HD   LYS  81          3HD       LYS  81  -3.147  12.405 -12.649
  636   1HE   LYS  81          2HE       LYS  81  -1.981  13.397 -14.881
  637   2HE   LYS  81          3HE       LYS  81  -3.616  13.148 -15.509
  638   1HZ   LYS  81          1HZ       LYS  81  -2.869  14.754 -13.132
  639   2HZ   LYS  81          2HZ       LYS  81  -3.414  15.343 -14.564
  640   3HZ   LYS  81          3HZ       LYS  81  -4.422  14.474 -13.595
  641    H    GLU  82           H        GLU  82  -0.859   8.842 -10.453
  642    HA   GLU  82           HA       GLU  82  -1.414   6.042 -10.213
  643   1HB   GLU  82          2HB       GLU  82   0.726   7.703  -9.735
  644   2HB   GLU  82          3HB       GLU  82   0.201   7.484  -8.105
  645   1HG   GLU  82          2HG       GLU  82   0.553   5.064  -9.888
  646   2HG   GLU  82          3HG       GLU  82   1.966   5.886  -9.268
  647    H    THR  83           H        THR  83  -1.585   8.714  -7.841
  648    HA   THR  83           HA       THR  83  -2.971   7.329  -5.828
  649    HB   THR  83           HB       THR  83  -3.545   9.532  -4.900
  650    HG1  THR  83           1HG      THR  83  -2.760  11.344  -6.083
  651   1HG2  THR  83          1HG       THR  83  -0.720   9.559  -6.046
  652   2HG2  THR  83          2HG       THR  83  -1.304  10.373  -4.584
  653   3HG2  THR  83          3HG       THR  83  -1.222   8.602  -4.640
  654    H    LYS  84           H        LYS  84  -4.360   9.319  -8.456
  655    HA   LYS  84           HA       LYS  84  -7.073   9.073  -7.722
  656   1HB   LYS  84          2HB       LYS  84  -6.044  10.559  -9.506
  657   2HB   LYS  84          3HB       LYS  84  -6.103   9.173 -10.609
  658   1HG   LYS  84          2HG       LYS  84  -8.594   9.077 -10.244
  659   2HG   LYS  84          3HG       LYS  84  -8.451  10.449  -9.127
  660   1HD   LYS  84          2HD       LYS  84  -7.426  11.773 -11.063
  661   2HD   LYS  84          3HD       LYS  84  -7.908  10.428 -12.122
  662   1HE   LYS  84          2HE       LYS  84 -10.273  10.711 -11.321
  663   2HE   LYS  84          3HE       LYS  84  -9.749  12.073 -10.321
  664   1HZ   LYS  84          1HZ       LYS  84  -9.600  11.954 -13.275
  665   2HZ   LYS  84          2HZ       LYS  84 -10.664  12.850 -12.400
  666   3HZ   LYS  84          3HZ       LYS  84  -9.063  13.209 -12.355
  667    H    MET  85           H        MET  85  -5.290   6.875  -9.996
  668    HA   MET  85           HA       MET  85  -7.545   5.031 -10.115
  669   1HB   MET  85          2HB       MET  85  -4.641   4.862 -10.983
  670   2HB   MET  85          3HB       MET  85  -5.608   3.396 -10.843
  671   1HG   MET  85          2HG       MET  85  -5.940   3.930 -13.046
  672   2HG   MET  85          3HG       MET  85  -7.388   4.541 -12.271
  673   1HE   MET  85          1HE       MET  85  -4.367   5.151 -14.447
  674   2HE   MET  85          2HE       MET  85  -4.030   6.891 -14.352
  675   3HE   MET  85          3HE       MET  85  -3.670   5.840 -12.963
  676    H    LEU  86           H        LEU  86  -4.564   5.072  -8.105
  677    HA   LEU  86           HA       LEU  86  -4.901   2.631  -6.786
  678   1HB   LEU  86          2HB       LEU  86  -2.876   3.827  -6.601
  679   2HB   LEU  86          3HB       LEU  86  -3.672   5.281  -6.022
  680    HG   LEU  86           HG       LEU  86  -3.984   4.448  -3.850
  681   1HD1  LEU  86          1HD1      LEU  86  -3.731   1.790  -5.026
  682   2HD1  LEU  86          2HD1      LEU  86  -2.888   1.987  -3.460
  683   3HD1  LEU  86          3HD1      LEU  86  -4.613   2.320  -3.638
  684   1HD2  LEU  86          1HD2      LEU  86  -1.723   5.246  -4.431
  685   2HD2  LEU  86          2HD2      LEU  86  -1.675   4.012  -3.155
  686   3HD2  LEU  86          3HD2      LEU  86  -1.237   3.607  -4.834
  687    H    MET  87           H        MET  87  -6.252   5.832  -5.778
  688    HA   MET  87           HA       MET  87  -7.573   4.911  -3.469
  689   1HB   MET  87          2HB       MET  87  -7.241   7.306  -4.233
  690   2HB   MET  87          3HB       MET  87  -8.597   7.103  -5.332
  691   1HG   MET  87          2HG       MET  87 -10.099   7.339  -3.653
  692   2HG   MET  87          3HG       MET  87  -9.261   6.192  -2.619
  693   1HE   MET  87          1HE       MET  87 -10.798   9.276  -2.108
  694   2HE   MET  87          2HE       MET  87  -9.599  10.565  -1.866
  695   3HE   MET  87          3HE       MET  87  -9.874   9.915  -3.493
  696    H    ALA  88           H        ALA  88  -8.953   5.212  -6.779
  697    HA   ALA  88           HA       ALA  88 -11.482   4.042  -6.152
  698   1HB   ALA  88          1HB       ALA  88  -9.992   4.278  -8.807
  699   2HB   ALA  88          2HB       ALA  88 -11.730   3.961  -8.610
  700   3HB   ALA  88          3HB       ALA  88 -11.048   5.514  -8.088
  701    H    ALA  89           H        ALA  89  -8.468   2.516  -7.416
  702    HA   ALA  89           HA       ALA  89  -9.768  -0.047  -7.827
  703   1HB   ALA  89          1HB       ALA  89  -6.816   0.719  -7.791
  704   2HB   ALA  89          2HB       ALA  89  -7.499  -0.800  -8.415
  705   3HB   ALA  89          3HB       ALA  89  -7.884   0.740  -9.210
  706    H    GLY  90           H        GLY  90  -7.621   1.266  -5.254
  707   1HA   GLY  90          2HA       GLY  90  -7.225  -1.195  -3.844
  708   2HA   GLY  90          3HA       GLY  90  -6.997   0.438  -3.219
  709    H    ASP  91           H        ASP  91  -9.619   1.452  -3.476
  710    HA   ASP  91           HA       ASP  91 -11.091   0.318  -1.258
  711   1HB   ASP  91          2HB       ASP  91 -11.093   2.644  -1.598
  712   2HB   ASP  91          3HB       ASP  91 -11.660   2.460  -3.267
  713    H    LYS  92           H        LYS  92 -11.028  -1.948  -2.418
  714    HA   LYS  92           HA       LYS  92 -12.903  -2.466  -4.531
  715   1HB   LYS  92          2HB       LYS  92 -11.752  -4.205  -2.342
  716   2HB   LYS  92          3HB       LYS  92 -12.949  -4.850  -3.445
  717   1HG   LYS  92          2HG       LYS  92 -10.324  -3.581  -4.352
  718   2HG   LYS  92          3HG       LYS  92 -10.600  -5.309  -4.112
  719   1HD   LYS  92          2HD       LYS  92 -11.216  -5.441  -6.251
  720   2HD   LYS  92          3HD       LYS  92 -12.723  -4.660  -5.774
  721   1HE   LYS  92          2HE       LYS  92 -11.580  -2.415  -6.217
  722   2HE   LYS  92          3HE       LYS  92 -10.201  -3.313  -6.840
  723   1HZ   LYS  92          1HZ       LYS  92 -12.956  -3.417  -7.917
  724   2HZ   LYS  92          2HZ       LYS  92 -11.665  -2.692  -8.632
  725   3HZ   LYS  92          3HZ       LYS  92 -11.709  -4.331  -8.475
  726    H    ASP  93           H        ASP  93 -13.666  -1.641  -1.318
  727    HA   ASP  93           HA       ASP  93 -16.385  -2.776  -1.327
  728   1HB   ASP  93          2HB       ASP  93 -14.906  -0.792   0.423
  729   2HB   ASP  93          3HB       ASP  93 -16.626  -1.091   0.636
  730    H    GLY  94           H        GLY  94 -14.948   0.325  -2.418
  731   1HA   GLY  94          2HA       GLY  94 -16.049   1.961  -3.669
  732   2HA   GLY  94          3HA       GLY  94 -17.611   1.255  -3.292
  733    H    ASP  95           H        ASP  95 -15.328   2.023  -0.705
  734    HA   ASP  95           HA       ASP  95 -17.240   4.052   0.446
  735   1HB   ASP  95          2HB       ASP  95 -14.553   3.181   1.563
  736   2HB   ASP  95          3HB       ASP  95 -15.807   4.089   2.399
  737    H    GLY  96           H        GLY  96 -14.501   3.989  -1.550
  738   1HA   GLY  96          2HA       GLY  96 -12.932   5.337  -2.300
  739   2HA   GLY  96          3HA       GLY  96 -13.736   6.758  -1.571
  740    H    LYS  97           H        LYS  97 -12.916   4.277   0.662
  741    HA   LYS  97           HA       LYS  97 -10.100   5.254   1.086
  742   1HB   LYS  97          2HB       LYS  97 -12.214   4.542   3.173
  743   2HB   LYS  97          3HB       LYS  97 -10.477   4.452   3.483
  744   1HG   LYS  97          2HG       LYS  97 -10.418   6.578   3.937
  745   2HG   LYS  97          3HG       LYS  97 -10.796   6.959   2.256
  746   1HD   LYS  97          2HD       LYS  97 -12.308   8.171   3.462
  747   2HD   LYS  97          3HD       LYS  97 -13.273   6.760   2.976
  748   1HE   LYS  97          2HE       LYS  97 -12.814   5.715   5.208
  749   2HE   LYS  97          3HE       LYS  97 -11.790   7.102   5.635
  750   1HZ   LYS  97          1HZ       LYS  97 -14.681   7.280   5.079
  751   2HZ   LYS  97          2HZ       LYS  97 -13.990   7.301   6.580
  752   3HZ   LYS  97          3HZ       LYS  97 -13.677   8.519   5.517
  753    H    ILE  98           H        ILE  98  -8.620   3.772   1.567
  754    HA   ILE  98           HA       ILE  98  -9.205   0.919   0.912
  755    HB   ILE  98           HB       ILE  98  -6.623   2.383   1.501
  756   1HG1  ILE  98          2HG       ILE  98  -7.745   1.247  -1.075
  757   2HG1  ILE  98          3HG       ILE  98  -7.720   2.952  -0.642
  758   1HG2  ILE  98          1HG       ILE  98  -6.949  -0.523   0.685
  759   2HG2  ILE  98          2HG       ILE  98  -5.409   0.343   0.890
  760   3HG2  ILE  98          3HG       ILE  98  -6.398   0.023   2.287
  761   1HD1  ILE  98          1HD1      ILE  98  -5.386   1.215  -1.375
  762   2HD1  ILE  98          2HD1      ILE  98  -5.954   2.754  -2.062
  763   3HD1  ILE  98          3HD1      ILE  98  -5.168   2.742  -0.472
  764    H    GLY  99           H        GLY  99  -9.783  -0.438   2.464
  765   1HA   GLY  99          2HA       GLY  99  -8.524  -0.186   5.161
  766   2HA   GLY  99          3HA       GLY  99 -10.061  -1.001   4.852
  767    H    VAL 100           H        VAL 100  -7.769  -2.125   6.026
  768    HA   VAL 100           HA       VAL 100  -6.023  -3.650   4.605
  769    HB   VAL 100           HB       VAL 100  -5.938  -3.548   6.974
  770   1HG1  VAL 100          1HG       VAL 100  -8.350  -5.349   7.310
  771   2HG1  VAL 100          2HG       VAL 100  -7.387  -4.535   8.549
  772   3HG1  VAL 100          3HG       VAL 100  -8.410  -3.580   7.497
  773   1HG2  VAL 100          1HG       VAL 100  -4.880  -5.459   5.931
  774   2HG2  VAL 100          2HG       VAL 100  -5.488  -5.903   7.534
  775   3HG2  VAL 100          3HG       VAL 100  -6.361  -6.436   6.119
  776    H    ASP 101           H        ASP 101  -9.317  -4.797   5.385
  777    HA   ASP 101           HA       ASP 101  -8.875  -7.444   4.494
  778   1HB   ASP 101          2HB       ASP 101 -10.719  -6.249   6.025
  779   2HB   ASP 101          3HB       ASP 101 -11.640  -6.228   4.524
  780    H    GLU 102           H        GLU 102 -10.283  -4.623   2.869
  781    HA   GLU 102           HA       GLU 102 -10.709  -5.809   0.276
  782   1HB   GLU 102          2HB       GLU 102  -9.847  -2.938   0.817
  783   2HB   GLU 102          3HB       GLU 102 -10.691  -3.555  -0.574
  784   1HG   GLU 102          2HG       GLU 102 -12.616  -2.985   0.395
  785   2HG   GLU 102          3HG       GLU 102 -12.366  -4.214   1.638
  786    H    PHE 103           H        PHE 103  -7.975  -3.809   1.543
  787    HA   PHE 103           HA       PHE 103  -6.510  -3.894  -0.812
  788   1HB   PHE 103          2HB       PHE 103  -6.311  -2.558   1.491
  789   2HB   PHE 103          3HB       PHE 103  -5.117  -3.767   1.871
  790    HD1  PHE 103           1HD      PHE 103  -3.343  -2.175   2.113
  791    HD2  PHE 103           2HD      PHE 103  -5.644  -2.166  -1.539
  792    HE1  PHE 103           1HE      PHE 103  -1.686  -0.686   1.060
  793    HE2  PHE 103           2HE      PHE 103  -3.965  -0.721  -2.596
  794    HZ   PHE 103           HZ       PHE 103  -1.968   0.029  -1.318
  795    H    SER 104           H        SER 104  -6.348  -6.161   1.861
  796    HA   SER 104           HA       SER 104  -4.272  -7.933   1.069
  797   1HB   SER 104          2HB       SER 104  -5.500  -7.872   3.245
  798   2HB   SER 104          3HB       SER 104  -6.931  -8.526   2.437
  799    HG   SER 104           HG       SER 104  -5.725 -10.194   3.377
  800    H    THR 105           H        THR 105  -7.671  -7.799  -0.021
  801    HA   THR 105           HA       THR 105  -7.356 -10.402  -1.425
  802    HB   THR 105           HB       THR 105  -9.837 -10.318  -1.469
  803    HG1  THR 105           1HG      THR 105  -9.755  -8.348   0.572
  804   1HG2  THR 105          1HG       THR 105  -8.546 -10.141   1.292
  805   2HG2  THR 105          2HG       THR 105 -10.083 -10.946   0.900
  806   3HG2  THR 105          3HG       THR 105  -8.552 -11.575   0.248
  807    H    LEU 106           H        LEU 106  -8.190  -7.079  -1.983
  808    HA   LEU 106           HA       LEU 106  -8.854  -6.796  -4.645
  809   1HB   LEU 106          2HB       LEU 106  -8.603  -5.023  -3.033
  810   2HB   LEU 106          3HB       LEU 106  -6.922  -5.357  -2.792
  811    HG   LEU 106           HG       LEU 106  -7.924  -3.295  -4.180
  812   1HD1  LEU 106          1HD1      LEU 106  -5.266  -4.664  -4.614
  813   2HD1  LEU 106          2HD1      LEU 106  -5.632  -2.974  -5.065
  814   3HD1  LEU 106          3HD1      LEU 106  -5.659  -3.488  -3.370
  815   1HD2  LEU 106          1HD2      LEU 106  -8.703  -4.796  -6.077
  816   2HD2  LEU 106          2HD2      LEU 106  -7.655  -3.434  -6.518
  817   3HD2  LEU 106          3HD2      LEU 106  -6.992  -5.066  -6.449
  818    H    VAL 107           H        VAL 107  -5.558  -7.374  -3.407
  819    HA   VAL 107           HA       VAL 107  -4.381  -7.544  -6.094
  820    HB   VAL 107           HB       VAL 107  -2.349  -8.180  -4.942
  821   1HG1  VAL 107          1HG       VAL 107  -3.574  -5.977  -3.258
  822   2HG1  VAL 107          2HG       VAL 107  -1.948  -6.115  -3.947
  823   3HG1  VAL 107          3HG       VAL 107  -3.283  -5.769  -5.003
  824   1HG2  VAL 107          1HG       VAL 107  -3.395  -9.634  -3.167
  825   2HG2  VAL 107          2HG       VAL 107  -2.191  -8.548  -2.604
  826   3HG2  VAL 107          3HG       VAL 107  -3.893  -8.158  -2.321
  827    H    ALA 108           H        ALA 108  -5.962  -9.801  -4.097
  828    HA   ALA 108           HA       ALA 108  -4.647 -12.206  -5.173
  829   1HB   ALA 108          1HB       ALA 108  -7.099 -12.049  -3.386
  830   2HB   ALA 108          2HB       ALA 108  -5.937 -13.380  -3.563
  831   3HB   ALA 108          3HB       ALA 108  -5.458 -11.868  -2.748
  832    H    GLU 109           H        GLU 109  -7.821 -10.596  -5.260
  833    HA   GLU 109           HA       GLU 109  -8.906 -11.894  -7.594
  834   1HB   GLU 109          2HB       GLU 109  -9.411  -9.519  -5.939
  835   2HB   GLU 109          3HB       GLU 109  -9.502  -9.085  -7.632
  836   1HG   GLU 109          2HG       GLU 109 -10.982 -11.476  -6.463
  837   2HG   GLU 109          3HG       GLU 109 -11.661  -9.849  -6.514
  838    H    SER 110           H        SER 110  -6.495  -9.217  -7.168
  839    HA   SER 110           HA       SER 110  -5.243  -8.106  -8.662
  840   1HB   SER 110          2HB       SER 110  -3.999  -9.392 -10.327
  841   2HB   SER 110          3HB       SER 110  -4.202 -10.394  -8.897
  842    HG   SER 110           HG       SER 110  -6.283 -11.033 -10.174
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1   3.946  -2.968  10.620
    2   2H    MET   1           H2       MET   1   2.451  -2.497  11.109
    3   3H    MET   1           H3       MET   1   3.255  -3.683  11.925
    4    HA   MET   1           HA       MET   1   4.091  -0.879  11.752
    5   1HB   MET   1          2HB       MET   1   2.078  -1.119  13.059
    6   2HB   MET   1          3HB       MET   1   2.807  -2.381  14.058
    7   1HG   MET   1          2HG       MET   1   4.144  -0.893  15.209
    8   2HG   MET   1          3HG       MET   1   4.265   0.234  13.862
    9   1HE   MET   1          1HE       MET   1   4.157   2.112  15.728
   10   2HE   MET   1          2HE       MET   1   2.768   2.372  16.810
   11   3HE   MET   1          3HE       MET   1   3.811   0.951  17.033
   12    H    SER   2           H        SER   2   6.000  -1.855  10.882
   13    HA   SER   2           HA       SER   2   8.349  -2.014  11.733
   14   1HB   SER   2          2HB       SER   2   9.047  -4.105  12.777
   15   2HB   SER   2          3HB       SER   2   8.012  -3.138  13.824
   16    HG   SER   2           HG       SER   2   7.482  -5.401  13.772
   17    H    MET   3           H        MET   3   7.726  -1.806   9.362
   18    HA   MET   3           HA       MET   3   7.302  -4.232   7.854
   19   1HB   MET   3          2HB       MET   3   6.748  -1.512   7.443
   20   2HB   MET   3          3HB       MET   3   8.002  -1.851   6.276
   21   1HG   MET   3          2HG       MET   3   6.327  -2.597   4.987
   22   2HG   MET   3          3HG       MET   3   6.418  -4.068   5.927
   23   1HE   MET   3          1HE       MET   3   5.221  -3.230   8.736
   24   2HE   MET   3          2HE       MET   3   3.476  -3.459   8.560
   25   3HE   MET   3          3HE       MET   3   4.589  -4.687   7.928
   26    H    THR   4           H        THR   4   9.101  -5.240   8.725
   27    HA   THR   4           HA       THR   4  11.416  -5.663   7.046
   28    HB   THR   4           HB       THR   4  11.662  -3.837   9.453
   29    HG1  THR   4           1HG      THR   4  11.611  -3.198   7.198
   30   1HG2  THR   4          1HG       THR   4  13.834  -5.708   8.447
   31   2HG2  THR   4          2HG       THR   4  14.159  -4.202   9.336
   32   3HG2  THR   4          3HG       THR   4  13.248  -5.507  10.107
   33    H    ASP   5           H        ASP   5  10.210  -5.655  10.399
   34    HA   ASP   5           HA       ASP   5  11.423  -8.142  11.196
   35   1HB   ASP   5          2HB       ASP   5  10.836  -6.025  12.573
   36   2HB   ASP   5          3HB       ASP   5   9.166  -6.553  12.515
   37    H    LEU   6           H        LEU   6   8.057  -7.078  10.687
   38    HA   LEU   6           HA       LEU   6   6.811  -9.640  10.916
   39   1HB   LEU   6          2HB       LEU   6   5.972  -7.015   9.601
   40   2HB   LEU   6          3HB       LEU   6   4.887  -8.371   9.810
   41    HG   LEU   6           HG       LEU   6   6.279  -6.973  12.107
   42   1HD1  LEU   6          1HD1      LEU   6   3.431  -6.651  11.094
   43   2HD1  LEU   6          2HD1      LEU   6   4.146  -5.872  12.538
   44   3HD1  LEU   6          3HD1      LEU   6   4.748  -5.459  10.917
   45   1HD2  LEU   6          1HD2      LEU   6   5.608  -9.228  12.735
   46   2HD2  LEU   6          2HD2      LEU   6   4.532  -8.061  13.505
   47   3HD2  LEU   6          3HD2      LEU   6   3.981  -8.966  12.070
   48    H    LEU   7           H        LEU   7   7.875  -7.842   8.070
   49    HA   LEU   7           HA       LEU   7   6.885  -9.980   6.277
   50   1HB   LEU   7          2HB       LEU   7   7.626  -7.081   5.911
   51   2HB   LEU   7          3HB       LEU   7   7.679  -8.152   4.513
   52    HG   LEU   7           HG       LEU   7   5.588  -6.898   4.669
   53   1HD1  LEU   7          1HD1      LEU   7   5.751  -9.860   4.475
   54   2HD1  LEU   7          2HD1      LEU   7   4.138  -9.222   4.772
   55   3HD1  LEU   7          3HD1      LEU   7   5.088  -8.665   3.374
   56   1HD2  LEU   7          1HD2      LEU   7   5.351  -6.797   7.119
   57   2HD2  LEU   7          2HD2      LEU   7   3.889  -7.385   6.318
   58   3HD2  LEU   7          3HD2      LEU   7   4.936  -8.526   7.146
   59    H    ASN   8           H        ASN   8   9.669  -7.990   5.962
   60    HA   ASN   8           HA       ASN   8  11.911  -9.320   6.287
   61   1HB   ASN   8          2HB       ASN   8  10.579 -10.614   3.944
   62   2HB   ASN   8          3HB       ASN   8  12.193 -10.035   3.608
   63   1HD2  ASN   8          2HD2      ASN   8  10.398 -12.107   5.813
   64   2HD2  ASN   8          1HD2      ASN   8  11.821 -13.130   6.201
   65    H    ALA   9           H        ALA   9  13.239  -7.541   6.135
   66    HA   ALA   9           HA       ALA   9  12.775  -5.236   4.557
   67   1HB   ALA   9          1HB       ALA   9  15.392  -6.414   5.589
   68   2HB   ALA   9          2HB       ALA   9  15.207  -4.784   4.903
   69   3HB   ALA   9          3HB       ALA   9  14.353  -5.205   6.386
   70    H    GLU  10           H        GLU  10  14.528  -8.235   3.696
   71    HA   GLU  10           HA       GLU  10  15.532  -7.342   1.200
   72   1HB   GLU  10          2HB       GLU  10  15.615  -9.743   2.724
   73   2HB   GLU  10          3HB       GLU  10  14.805 -10.188   1.227
   74   1HG   GLU  10          2HG       GLU  10  16.803  -8.757   0.135
   75   2HG   GLU  10          3HG       GLU  10  17.602  -9.155   1.651
   76    H    ASP  11           H        ASP  11  12.360  -8.460   2.069
   77    HA   ASP  11           HA       ASP  11  11.375  -8.911  -0.690
   78   1HB   ASP  11          2HB       ASP  11   9.944  -8.927   2.003
   79   2HB   ASP  11          3HB       ASP  11   9.237  -9.256   0.434
   80    H    ILE  12           H        ILE  12  10.792  -6.639   2.008
   81    HA   ILE  12           HA       ILE  12   9.292  -4.646   0.682
   82    HB   ILE  12           HB       ILE  12  11.029  -4.786   3.095
   83   1HG1  ILE  12          2HG       ILE  12   8.948  -3.308   3.890
   84   2HG1  ILE  12          3HG       ILE  12   8.220  -3.860   2.388
   85   1HG2  ILE  12          1HG       ILE  12  10.343  -2.065   1.973
   86   2HG2  ILE  12          2HG       ILE  12  10.993  -2.459   3.589
   87   3HG2  ILE  12          3HG       ILE  12  11.988  -2.738   2.176
   88   1HD1  ILE  12          1HD1      ILE  12   9.308  -5.537   4.685
   89   2HD1  ILE  12          2HD1      ILE  12   7.604  -5.334   4.212
   90   3HD1  ILE  12          3HD1      ILE  12   8.720  -6.235   3.158
   91    H    LYS  13           H        LYS  13  12.875  -4.980   0.730
   92    HA   LYS  13           HA       LYS  13  13.481  -2.671  -0.689
   93   1HB   LYS  13          2HB       LYS  13  15.161  -3.894   0.469
   94   2HB   LYS  13          3HB       LYS  13  14.766  -5.398  -0.361
   95   1HG   LYS  13          2HG       LYS  13  16.856  -4.563  -1.130
   96   2HG   LYS  13          3HG       LYS  13  15.672  -4.609  -2.425
   97   1HD   LYS  13          2HD       LYS  13  15.486  -1.970  -1.325
   98   2HD   LYS  13          3HD       LYS  13  17.203  -2.309  -1.355
   99   1HE   LYS  13          2HE       LYS  13  15.365  -2.712  -3.761
  100   2HE   LYS  13          3HE       LYS  13  16.124  -1.163  -3.402
  101   1HZ   LYS  13          1HZ       LYS  13  17.618  -3.674  -3.863
  102   2HZ   LYS  13          2HZ       LYS  13  17.423  -2.470  -4.970
  103   3HZ   LYS  13          3HZ       LYS  13  18.276  -2.189  -3.594
  104    H    LYS  14           H        LYS  14  12.696  -5.881  -2.106
  105    HA   LYS  14           HA       LYS  14  12.970  -4.839  -4.873
  106   1HB   LYS  14          2HB       LYS  14  11.954  -7.480  -3.712
  107   2HB   LYS  14          3HB       LYS  14  11.662  -7.025  -5.387
  108   1HG   LYS  14          2HG       LYS  14  13.586  -8.256  -5.639
  109   2HG   LYS  14          3HG       LYS  14  14.196  -6.613  -5.591
  110   1HD   LYS  14          2HD       LYS  14  15.696  -7.532  -4.144
  111   2HD   LYS  14          3HD       LYS  14  14.440  -7.185  -2.965
  112   1HE   LYS  14          2HE       LYS  14  13.574  -9.594  -3.439
  113   2HE   LYS  14          3HE       LYS  14  15.109  -9.845  -4.296
  114   1HZ   LYS  14          1HZ       LYS  14  14.756  -9.077  -1.458
  115   2HZ   LYS  14          2HZ       LYS  14  15.409 -10.511  -1.947
  116   3HZ   LYS  14          3HZ       LYS  14  16.230  -9.188  -2.180
  117    H    ALA  15           H        ALA  15  10.339  -5.261  -2.552
  118    HA   ALA  15           HA       ALA  15   8.217  -4.737  -4.331
  119   1HB   ALA  15          1HB       ALA  15   8.257  -4.002  -1.395
  120   2HB   ALA  15          2HB       ALA  15   6.920  -4.587  -2.410
  121   3HB   ALA  15          3HB       ALA  15   8.228  -5.688  -1.972
  122    H    VAL  16           H        VAL  16   9.880  -2.352  -2.133
  123    HA   VAL  16           HA       VAL  16   8.344  -0.118  -2.976
  124    HB   VAL  16           HB       VAL  16  11.199  -0.191  -1.928
  125   1HG1  VAL  16          1HG       VAL  16   9.346   2.207  -2.239
  126   2HG1  VAL  16          2HG       VAL  16  10.838   2.185  -1.278
  127   3HG1  VAL  16          3HG       VAL  16  10.926   1.976  -3.023
  128   1HG2  VAL  16          1HG       VAL  16   9.418  -1.059  -0.384
  129   2HG2  VAL  16          2HG       VAL  16  10.178   0.430   0.177
  130   3HG2  VAL  16          3HG       VAL  16   8.560   0.489  -0.555
  131    H    GLY  17           H        GLY  17  11.097  -1.663  -4.566
  132   1HA   GLY  17          2HA       GLY  17  11.658   0.302  -6.557
  133   2HA   GLY  17          3HA       GLY  17  11.999  -1.424  -6.662
  134    H    ALA  18           H        ALA  18   8.895  -1.846  -6.273
  135    HA   ALA  18           HA       ALA  18   8.280  -1.829  -9.139
  136   1HB   ALA  18          1HB       ALA  18   6.635  -2.829  -6.782
  137   2HB   ALA  18          2HB       ALA  18   6.428  -3.239  -8.500
  138   3HB   ALA  18          3HB       ALA  18   7.886  -3.764  -7.623
  139    H    PHE  19           H        PHE  19   6.827  -0.246  -6.237
  140    HA   PHE  19           HA       PHE  19   4.887   1.376  -7.773
  141   1HB   PHE  19          2HB       PHE  19   5.984   1.413  -4.963
  142   2HB   PHE  19          3HB       PHE  19   5.145   2.809  -5.583
  143    HD1  PHE  19           1HD      PHE  19   2.755   2.963  -5.665
  144    HD2  PHE  19           2HD      PHE  19   4.713  -0.768  -4.786
  145    HE1  PHE  19           1HE      PHE  19   0.646   2.083  -4.629
  146    HE2  PHE  19           2HE      PHE  19   2.555  -1.623  -3.825
  147    HZ   PHE  19           HZ       PHE  19   0.553  -0.304  -3.923
  148    H    SER  20           H        SER  20   8.331   1.597  -7.051
  149    HA   SER  20           HA       SER  20   8.693   4.410  -7.082
  150   1HB   SER  20          2HB       SER  20  10.651   2.160  -7.648
  151   2HB   SER  20          3HB       SER  20  11.106   3.867  -7.569
  152    HG   SER  20           HG       SER  20  10.022   2.252  -5.484
  153    H    ALA  21           H        ALA  21   7.208   4.782  -8.852
  154    HA   ALA  21           HA       ALA  21   8.541   5.602 -11.338
  155   1HB   ALA  21          1HB       ALA  21   6.117   3.756 -11.162
  156   2HB   ALA  21          2HB       ALA  21   6.763   4.439 -12.676
  157   3HB   ALA  21          3HB       ALA  21   7.723   3.272 -11.745
  158    H    THR  22           H        THR  22   6.508   6.700 -12.683
  159    HA   THR  22           HA       THR  22   5.308   8.697 -10.907
  160    HB   THR  22           HB       THR  22   4.302   9.548 -13.043
  161    HG1  THR  22           1HG      THR  22   4.173   8.106 -14.550
  162   1HG2  THR  22          1HG       THR  22   7.315   9.089 -13.117
  163   2HG2  THR  22          2HG       THR  22   6.415  10.350 -13.983
  164   3HG2  THR  22          3HG       THR  22   6.483  10.370 -12.208
  165    H    ASP  23           H        ASP  23   3.839   6.602 -13.329
  166    HA   ASP  23           HA       ASP  23   1.326   6.479 -11.768
  167   1HB   ASP  23          2HB       ASP  23   1.388   6.087 -14.725
  168   2HB   ASP  23          3HB       ASP  23   0.178   6.858 -13.687
  169    H    SER  24           H        SER  24   3.695   4.364 -12.194
  170    HA   SER  24           HA       SER  24   2.645   2.085 -13.521
  171   1HB   SER  24          2HB       SER  24   5.045   2.432 -12.916
  172   2HB   SER  24          3HB       SER  24   4.634   2.087 -11.218
  173    HG   SER  24           HG       SER  24   5.136   0.128 -11.907
  174    H    PHE  25           H        PHE  25   2.442   2.934 -10.075
  175    HA   PHE  25           HA       PHE  25   1.578   2.022  -8.266
  176   1HB   PHE  25          2HB       PHE  25  -0.514   2.634  -9.504
  177   2HB   PHE  25          3HB       PHE  25  -0.560   1.045 -10.229
  178    HD1  PHE  25           1HD      PHE  25  -0.150   2.355  -6.733
  179    HD2  PHE  25           2HD      PHE  25  -2.349  -0.215  -9.388
  180    HE1  PHE  25           1HE      PHE  25  -1.524   1.557  -4.825
  181    HE2  PHE  25           2HE      PHE  25  -3.785  -0.944  -7.492
  182    HZ   PHE  25           HZ       PHE  25  -3.327  -0.061  -5.184
  183    H    ASP  26           H        ASP  26   1.061  -0.600 -10.564
  184    HA   ASP  26           HA       ASP  26   1.217  -2.882 -10.231
  185   1HB   ASP  26          2HB       ASP  26   3.658  -1.446 -10.438
  186   2HB   ASP  26          3HB       ASP  26   3.993  -2.697  -9.270
  187    H    HIS  27           H        HIS  27   0.182  -1.662  -7.705
  188    HA   HIS  27           HA       HIS  27   1.249  -2.664  -5.404
  189   1HB   HIS  27          2HB       HIS  27  -0.676  -1.177  -5.557
  190   2HB   HIS  27          3HB       HIS  27  -1.710  -2.510  -6.056
  191    HD1  HIS  27           HD1      HIS  27  -3.279  -2.704  -3.985
  192    HD2  HIS  27           HD2      HIS  27   0.809  -2.533  -3.022
  193    HE1  HIS  27           HE1      HIS  27  -3.077  -3.202  -1.485
  194    H    LYS  28           H        LYS  28  -0.788  -4.412  -7.577
  195    HA   LYS  28           HA       LYS  28  -1.186  -6.915  -6.202
  196   1HB   LYS  28          2HB       LYS  28  -0.869  -6.634  -9.202
  197   2HB   LYS  28          3HB       LYS  28  -1.785  -7.792  -8.270
  198   1HG   LYS  28          2HG       LYS  28  -3.567  -6.493  -8.905
  199   2HG   LYS  28          3HG       LYS  28  -3.118  -5.557  -7.497
  200   1HD   LYS  28          2HD       LYS  28  -3.473  -4.017  -9.313
  201   2HD   LYS  28          3HD       LYS  28  -1.749  -4.046  -9.015
  202   1HE   LYS  28          2HE       LYS  28  -1.826  -4.094 -11.314
  203   2HE   LYS  28          3HE       LYS  28  -1.598  -5.800 -10.923
  204   1HZ   LYS  28          1HZ       LYS  28  -4.250  -4.595 -11.455
  205   2HZ   LYS  28          2HZ       LYS  28  -3.341  -5.369 -12.594
  206   3HZ   LYS  28          3HZ       LYS  28  -3.888  -6.208 -11.304
  207    H    LYS  29           H        LYS  29   1.596  -5.556  -7.925
  208    HA   LYS  29           HA       LYS  29   3.020  -8.146  -8.050
  209   1HB   LYS  29          2HB       LYS  29   3.032  -5.839  -9.632
  210   2HB   LYS  29          3HB       LYS  29   4.482  -5.627  -8.647
  211   1HG   LYS  29          2HG       LYS  29   5.127  -8.023  -9.324
  212   2HG   LYS  29          3HG       LYS  29   3.731  -7.974 -10.429
  213   1HD   LYS  29          2HD       LYS  29   4.737  -5.765 -11.299
  214   2HD   LYS  29          3HD       LYS  29   6.232  -6.231 -10.459
  215   1HE   LYS  29          2HE       LYS  29   6.127  -8.386 -11.765
  216   2HE   LYS  29          3HE       LYS  29   4.662  -7.754 -12.556
  217   1HZ   LYS  29          1HZ       LYS  29   7.354  -6.509 -12.677
  218   2HZ   LYS  29          2HZ       LYS  29   6.616  -7.292 -13.927
  219   3HZ   LYS  29          3HZ       LYS  29   5.999  -5.872 -13.340
  220    H    PHE  30           H        PHE  30   3.277  -4.909  -6.590
  221    HA   PHE  30           HA       PHE  30   5.358  -5.231  -4.782
  222   1HB   PHE  30          2HB       PHE  30   4.174  -3.135  -5.093
  223   2HB   PHE  30          3HB       PHE  30   2.718  -3.808  -4.380
  224    HD1  PHE  30           1HD      PHE  30   5.898  -2.225  -3.663
  225    HD2  PHE  30           2HD      PHE  30   2.589  -4.351  -1.929
  226    HE1  PHE  30           1HE      PHE  30   6.716  -1.634  -1.392
  227    HE2  PHE  30           2HE      PHE  30   3.422  -3.783   0.327
  228    HZ   PHE  30           HZ       PHE  30   5.526  -2.520   0.601
  229    H    PHE  31           H        PHE  31   1.898  -6.042  -3.976
  230    HA   PHE  31           HA       PHE  31   2.405  -7.124  -1.437
  231   1HB   PHE  31          2HB       PHE  31   0.209  -7.036  -3.280
  232   2HB   PHE  31          3HB       PHE  31   0.295  -8.634  -2.606
  233    HD1  PHE  31           1HD      PHE  31  -0.776  -9.116  -0.613
  234    HD2  PHE  31           2HD      PHE  31   0.291  -5.064  -1.516
  235    HE1  PHE  31           1HE      PHE  31  -2.006  -8.365   1.398
  236    HE2  PHE  31           2HE      PHE  31  -0.991  -4.279   0.474
  237    HZ   PHE  31           HZ       PHE  31  -2.144  -5.929   1.933
  238    H    GLN  32           H        GLN  32   2.697  -8.723  -4.562
  239    HA   GLN  32           HA       GLN  32   3.092 -11.409  -3.492
  240   1HB   GLN  32          2HB       GLN  32   3.162 -10.077  -6.214
  241   2HB   GLN  32          3HB       GLN  32   3.981 -11.612  -5.992
  242   1HG   GLN  32          2HG       GLN  32   1.824 -12.049  -6.874
  243   2HG   GLN  32          3HG       GLN  32   1.897 -12.672  -5.233
  244   1HE2  GLN  32          2HE       GLN  32  -0.248 -11.315  -7.306
  245   2HE2  GLN  32          1HE       GLN  32  -1.194 -10.398  -6.136
  246    H    MET  33           H        MET  33   5.176  -8.914  -4.932
  247    HA   MET  33           HA       MET  33   7.707 -10.222  -4.614
  248   1HB   MET  33          2HB       MET  33   6.965  -7.278  -4.874
  249   2HB   MET  33          3HB       MET  33   8.622  -7.883  -4.950
  250   1HG   MET  33          2HG       MET  33   8.179  -9.139  -6.956
  251   2HG   MET  33          3HG       MET  33   6.446  -8.896  -6.807
  252   1HE   MET  33          1HE       MET  33   9.634  -7.719  -8.479
  253   2HE   MET  33          2HE       MET  33   9.471  -5.955  -8.614
  254   3HE   MET  33          3HE       MET  33   9.784  -6.694  -7.027
  255    H    VAL  34           H        VAL  34   6.030  -7.913  -2.478
  256    HA   VAL  34           HA       VAL  34   8.083  -7.865  -0.440
  257    HB   VAL  34           HB       VAL  34   6.299  -6.094  -0.967
  258   1HG1  VAL  34          1HG       VAL  34   4.621  -7.757   0.845
  259   2HG1  VAL  34          2HG       VAL  34   4.195  -6.208   0.065
  260   3HG1  VAL  34          3HG       VAL  34   4.402  -7.698  -0.879
  261   1HG2  VAL  34          1HG       VAL  34   7.788  -6.065   1.048
  262   2HG2  VAL  34          2HG       VAL  34   6.245  -5.209   1.233
  263   3HG2  VAL  34          3HG       VAL  34   6.477  -6.807   1.971
  264    H    GLY  35           H        GLY  35   5.708 -10.212  -1.271
  265   1HA   GLY  35          2HA       GLY  35   4.968 -12.117  -0.242
  266   2HA   GLY  35          3HA       GLY  35   6.114 -11.799   1.070
  267    H    LEU  36           H        LEU  36   3.462  -9.517   0.297
  268    HA   LEU  36           HA       LEU  36   2.720  -9.515   3.126
  269   1HB   LEU  36          2HB       LEU  36   1.883  -8.031   0.642
  270   2HB   LEU  36          3HB       LEU  36   0.725  -8.105   1.971
  271    HG   LEU  36           HG       LEU  36   3.533  -7.087   2.387
  272   1HD1  LEU  36          1HD1      LEU  36   1.011  -5.435   2.104
  273   2HD1  LEU  36          2HD1      LEU  36   2.690  -4.876   2.268
  274   3HD1  LEU  36          3HD1      LEU  36   2.147  -5.667   0.773
  275   1HD2  LEU  36          1HD2      LEU  36   2.396  -7.906   4.407
  276   2HD2  LEU  36          2HD2      LEU  36   2.602  -6.160   4.367
  277   3HD2  LEU  36          3HD2      LEU  36   1.005  -6.906   4.005
  278    H    LYS  37           H        LYS  37   0.976 -10.244   0.271
  279    HA   LYS  37           HA       LYS  37  -1.151 -11.869   1.314
  280   1HB   LYS  37          2HB       LYS  37  -0.015 -11.387  -1.337
  281   2HB   LYS  37          3HB       LYS  37  -0.315 -13.104  -1.130
  282   1HG   LYS  37          2HG       LYS  37  -2.671 -12.273  -0.171
  283   2HG   LYS  37          3HG       LYS  37  -2.290 -10.828  -1.116
  284   1HD   LYS  37          2HD       LYS  37  -2.386 -13.707  -2.135
  285   2HD   LYS  37          3HD       LYS  37  -3.632 -12.481  -2.387
  286   1HE   LYS  37          2HE       LYS  37  -2.095 -11.081  -3.679
  287   2HE   LYS  37          3HE       LYS  37  -0.747 -12.138  -3.296
  288   1HZ   LYS  37          1HZ       LYS  37  -3.075 -12.958  -4.915
  289   2HZ   LYS  37          2HZ       LYS  37  -1.596 -12.503  -5.493
  290   3HZ   LYS  37          3HZ       LYS  37  -1.751 -13.880  -4.586
  291    H    LYS  38           H        LYS  38   2.206 -12.682   1.269
  292    HA   LYS  38           HA       LYS  38   1.741 -15.569   1.791
  293   1HB   LYS  38          2HB       LYS  38   3.717 -15.829   0.824
  294   2HB   LYS  38          3HB       LYS  38   3.855 -14.106   0.581
  295   1HG   LYS  38          2HG       LYS  38   4.919 -13.996   2.931
  296   2HG   LYS  38          3HG       LYS  38   4.999 -15.756   2.861
  297   1HD   LYS  38          2HD       LYS  38   6.471 -15.688   0.935
  298   2HD   LYS  38          3HD       LYS  38   6.218 -13.953   0.726
  299   1HE   LYS  38          2HE       LYS  38   7.177 -13.642   3.086
  300   2HE   LYS  38          3HE       LYS  38   7.640 -15.350   3.015
  301   1HZ   LYS  38          1HZ       LYS  38   8.711 -13.085   1.399
  302   2HZ   LYS  38          2HZ       LYS  38   9.514 -14.121   2.309
  303   3HZ   LYS  38          3HZ       LYS  38   8.877 -14.648   0.886
  304    H    LYS  39           H        LYS  39   1.604 -12.719   3.520
  305    HA   LYS  39           HA       LYS  39   2.501 -13.875   6.084
  306   1HB   LYS  39          2HB       LYS  39   2.909 -11.362   4.845
  307   2HB   LYS  39          3HB       LYS  39   1.608 -11.040   5.982
  308   1HG   LYS  39          2HG       LYS  39   3.722 -10.612   7.048
  309   2HG   LYS  39          3HG       LYS  39   3.013 -12.060   7.783
  310   1HD   LYS  39          2HD       LYS  39   4.598 -13.108   5.706
  311   2HD   LYS  39          3HD       LYS  39   5.520 -11.699   6.236
  312   1HE   LYS  39          2HE       LYS  39   5.351 -12.482   8.592
  313   2HE   LYS  39          3HE       LYS  39   4.437 -13.899   8.050
  314   1HZ   LYS  39          1HZ       LYS  39   7.210 -13.221   7.296
  315   2HZ   LYS  39          2HZ       LYS  39   6.763 -14.421   8.329
  316   3HZ   LYS  39          3HZ       LYS  39   6.376 -14.537   6.730
  317    H    SER  40           H        SER  40   1.156 -13.265   7.991
  318    HA   SER  40           HA       SER  40  -1.382 -14.512   7.681
  319   1HB   SER  40          2HB       SER  40  -0.274 -12.999  10.085
  320   2HB   SER  40          3HB       SER  40  -1.554 -14.230  10.099
  321    HG   SER  40           HG       SER  40   0.462 -15.132  10.651
  322    H    ALA  41           H        ALA  41  -3.493 -13.703   8.409
  323    HA   ALA  41           HA       ALA  41  -4.357 -11.242   7.338
  324   1HB   ALA  41          1HB       ALA  41  -5.550 -12.890   9.616
  325   2HB   ALA  41          2HB       ALA  41  -6.399 -11.662   8.662
  326   3HB   ALA  41          3HB       ALA  41  -5.837 -13.156   7.874
  327    H    ASP  42           H        ASP  42  -3.718 -12.034  10.812
  328    HA   ASP  42           HA       ASP  42  -4.036  -9.492  11.845
  329   1HB   ASP  42          2HB       ASP  42  -2.181 -11.711  12.787
  330   2HB   ASP  42          3HB       ASP  42  -2.807 -10.384  13.781
  331    H    ASP  43           H        ASP  43  -1.330 -10.762  10.070
  332    HA   ASP  43           HA       ASP  43   0.594  -8.674  10.759
  333   1HB   ASP  43          2HB       ASP  43   1.034 -11.089   9.798
  334   2HB   ASP  43          3HB       ASP  43   0.724 -10.334   8.233
  335    H    VAL  44           H        VAL  44  -1.412  -9.435   7.838
  336    HA   VAL  44           HA       VAL  44  -1.187  -7.005   6.503
  337    HB   VAL  44           HB       VAL  44  -2.908  -9.336   6.427
  338   1HG1  VAL  44          1HG       VAL  44  -4.223  -6.844   5.327
  339   2HG1  VAL  44          2HG       VAL  44  -4.774  -8.529   5.242
  340   3HG1  VAL  44          3HG       VAL  44  -4.763  -7.725   6.797
  341   1HG2  VAL  44          1HG       VAL  44  -1.130  -8.805   4.811
  342   2HG2  VAL  44          2HG       VAL  44  -2.700  -8.971   4.005
  343   3HG2  VAL  44          3HG       VAL  44  -2.026  -7.358   4.277
  344    H    LYS  45           H        LYS  45  -3.381  -7.667   9.220
  345    HA   LYS  45           HA       LYS  45  -4.570  -5.070   9.535
  346   1HB   LYS  45          2HB       LYS  45  -4.076  -7.400  11.273
  347   2HB   LYS  45          3HB       LYS  45  -4.166  -5.852  12.115
  348   1HG   LYS  45          2HG       LYS  45  -6.329  -5.372  10.996
  349   2HG   LYS  45          3HG       LYS  45  -6.261  -6.955  10.193
  350   1HD   LYS  45          2HD       LYS  45  -6.286  -8.085  12.396
  351   2HD   LYS  45          3HD       LYS  45  -6.270  -6.506  13.217
  352   1HE   LYS  45          2HE       LYS  45  -8.429  -5.930  12.092
  353   2HE   LYS  45          3HE       LYS  45  -8.455  -7.539  11.355
  354   1HZ   LYS  45          1HZ       LYS  45  -8.496  -6.983  14.265
  355   2HZ   LYS  45          2HZ       LYS  45  -9.777  -7.490  13.366
  356   3HZ   LYS  45          3HZ       LYS  45  -8.483  -8.483  13.593
  357    H    LYS  46           H        LYS  46  -1.531  -6.160  11.033
  358    HA   LYS  46           HA       LYS  46  -0.795  -3.493  11.926
  359   1HB   LYS  46          2HB       LYS  46   0.522  -6.202  11.821
  360   2HB   LYS  46          3HB       LYS  46   1.578  -4.798  11.915
  361   1HG   LYS  46          2HG       LYS  46   0.318  -3.941  13.865
  362   2HG   LYS  46          3HG       LYS  46  -0.691  -5.404  13.843
  363   1HD   LYS  46          2HD       LYS  46   1.273  -6.797  14.335
  364   2HD   LYS  46          3HD       LYS  46   2.345  -5.402  14.147
  365   1HE   LYS  46          2HE       LYS  46   2.072  -5.777  16.498
  366   2HE   LYS  46          3HE       LYS  46   1.255  -4.272  16.065
  367   1HZ   LYS  46          1HZ       LYS  46  -0.070  -6.889  16.483
  368   2HZ   LYS  46          2HZ       LYS  46  -0.109  -5.620  17.528
  369   3HZ   LYS  46          3HZ       LYS  46  -0.844  -5.504  16.061
  370    H    VAL  47           H        VAL  47  -0.333  -5.131   8.867
  371    HA   VAL  47           HA       VAL  47   1.584  -3.300   7.748
  372    HB   VAL  47           HB       VAL  47  -0.481  -5.038   6.398
  373   1HG1  VAL  47          1HG       VAL  47   1.871  -3.659   5.088
  374   2HG1  VAL  47          2HG       VAL  47   0.691  -4.752   4.323
  375   3HG1  VAL  47          3HG       VAL  47   0.168  -3.184   4.881
  376   1HG2  VAL  47          1HG       VAL  47   1.545  -6.031   7.813
  377   2HG2  VAL  47          2HG       VAL  47   1.175  -6.681   6.237
  378   3HG2  VAL  47          3HG       VAL  47   2.504  -5.502   6.451
  379    H    PHE  48           H        PHE  48  -2.023  -3.365   7.012
  380    HA   PHE  48           HA       PHE  48  -2.202  -0.878   5.870
  381   1HB   PHE  48          2HB       PHE  48  -3.976  -2.469   5.913
  382   2HB   PHE  48          3HB       PHE  48  -4.061  -2.426   7.675
  383    HD1  PHE  48           1HD      PHE  48  -4.490  -0.277   4.621
  384    HD2  PHE  48           2HD      PHE  48  -5.481  -0.898   8.781
  385    HE1  PHE  48           1HE      PHE  48  -6.140   1.585   4.537
  386    HE2  PHE  48           2HE      PHE  48  -7.146   0.927   8.658
  387    HZ   PHE  48           HZ       PHE  48  -7.473   2.146   6.518
  388    H    HIS  49           H        HIS  49  -2.264  -1.504   9.405
  389    HA   HIS  49           HA       HIS  49  -2.630   1.169  10.296
  390   1HB   HIS  49          2HB       HIS  49  -1.380  -1.328  11.423
  391   2HB   HIS  49          3HB       HIS  49  -1.056   0.185  12.242
  392    HD1  HIS  49           HD1      HIS  49  -2.636   0.422  14.235
  393    HD2  HIS  49           HD2      HIS  49  -4.417  -1.313  10.840
  394    HE1  HIS  49           HE1      HIS  49  -5.092   0.036  14.816
  395    H    MET  50           H        MET  50   0.217  -0.116   8.702
  396    HA   MET  50           HA       MET  50   1.980   2.016   9.720
  397   1HB   MET  50          2HB       MET  50   2.570  -0.490   9.096
  398   2HB   MET  50          3HB       MET  50   2.606   0.123   7.438
  399   1HG   MET  50          2HG       MET  50   4.820   0.205   8.281
  400   2HG   MET  50          3HG       MET  50   4.240   1.874   8.218
  401   1HE   MET  50          1HE       MET  50   5.966   2.968   9.730
  402   2HE   MET  50          2HE       MET  50   6.641   2.184  11.177
  403   3HE   MET  50          3HE       MET  50   6.823   1.419   9.579
  404    H    LEU  51           H        LEU  51   0.046   1.292   6.821
  405    HA   LEU  51           HA       LEU  51   0.995   3.562   5.194
  406   1HB   LEU  51          2HB       LEU  51  -1.411   1.702   5.048
  407   2HB   LEU  51          3HB       LEU  51  -0.968   2.898   3.851
  408    HG   LEU  51           HG       LEU  51   0.031   1.314   2.763
  409   1HD1  LEU  51          1HD1      LEU  51   2.092   0.899   4.945
  410   2HD1  LEU  51          2HD1      LEU  51   2.252   0.620   3.204
  411   3HD1  LEU  51          3HD1      LEU  51   2.115   2.261   3.802
  412   1HD2  LEU  51          1HD2      LEU  51  -1.256  -0.361   3.924
  413   2HD2  LEU  51          2HD2      LEU  51   0.347  -0.971   3.489
  414   3HD2  LEU  51          3HD2      LEU  51   0.023  -0.479   5.151
  415    H    ASP  52           H        ASP  52  -1.950   2.827   7.164
  416    HA   ASP  52           HA       ASP  52  -2.979   5.557   6.962
  417   1HB   ASP  52          2HB       ASP  52  -4.550   3.801   7.353
  418   2HB   ASP  52          3HB       ASP  52  -3.646   3.211   8.746
  419    H    LYS  53           H        LYS  53  -0.795   6.386   7.315
  420    HA   LYS  53           HA       LYS  53   0.531   6.577   9.775
  421   1HB   LYS  53          2HB       LYS  53   1.300   8.826   9.049
  422   2HB   LYS  53          3HB       LYS  53   1.646   7.475   7.960
  423   1HG   LYS  53          2HG       LYS  53   0.379   8.268   6.315
  424   2HG   LYS  53          3HG       LYS  53  -0.938   8.744   7.387
  425   1HD   LYS  53          2HD       LYS  53  -0.066  10.691   6.223
  426   2HD   LYS  53          3HD       LYS  53   0.111  10.800   7.985
  427   1HE   LYS  53          2HE       LYS  53   2.517  10.021   7.683
  428   2HE   LYS  53          3HE       LYS  53   2.274  10.174   5.933
  429   1HZ   LYS  53          1HZ       LYS  53   1.947  12.345   7.924
  430   2HZ   LYS  53          2HZ       LYS  53   3.228  12.200   6.901
  431   3HZ   LYS  53          3HZ       LYS  53   1.716  12.513   6.312
  432    H    ASP  54           H        ASP  54  -2.500   8.038   8.950
  433    HA   ASP  54           HA       ASP  54  -2.535   9.978  11.137
  434   1HB   ASP  54          2HB       ASP  54  -4.940   8.815   9.730
  435   2HB   ASP  54          3HB       ASP  54  -4.805  10.379  10.528
  436    H    LYS  55           H        LYS  55  -3.042   6.567  10.919
  437    HA   LYS  55           HA       LYS  55  -4.107   4.978  12.100
  438   1HB   LYS  55          2HB       LYS  55  -3.368   6.822  14.406
  439   2HB   LYS  55          3HB       LYS  55  -3.944   5.173  14.621
  440   1HG   LYS  55          2HG       LYS  55  -1.432   5.879  13.030
  441   2HG   LYS  55          3HG       LYS  55  -1.458   5.452  14.742
  442   1HD   LYS  55          2HD       LYS  55  -2.501   3.247  14.175
  443   2HD   LYS  55          3HD       LYS  55  -2.430   3.672  12.460
  444   1HE   LYS  55          2HE       LYS  55  -0.613   2.220  12.970
  445   2HE   LYS  55          3HE       LYS  55  -0.011   3.803  12.512
  446   1HZ   LYS  55          1HZ       LYS  55  -0.284   2.878  15.319
  447   2HZ   LYS  55          2HZ       LYS  55   1.124   2.844  14.470
  448   3HZ   LYS  55          3HZ       LYS  55   0.402   4.287  14.822
  449    H    SER  56           H        SER  56  -5.829   6.593  10.791
  450    HA   SER  56           HA       SER  56  -8.128   7.082  12.642
  451   1HB   SER  56          2HB       SER  56  -9.188   8.308  10.969
  452   2HB   SER  56          3HB       SER  56  -7.501   8.832  10.955
  453    HG   SER  56           HG       SER  56  -8.864   8.121   8.929
  454    H    GLY  57           H        GLY  57  -6.952   4.544  10.725
  455   1HA   GLY  57          2HA       GLY  57  -7.865   2.421  10.569
  456   2HA   GLY  57          3HA       GLY  57  -9.490   3.034  10.898
  457    H    PHE  58           H        PHE  58  -7.936   4.945   8.573
  458    HA   PHE  58           HA       PHE  58  -8.992   3.532   6.149
  459   1HB   PHE  58          2HB       PHE  58  -9.762   6.362   6.945
  460   2HB   PHE  58          3HB       PHE  58 -10.290   5.448   5.543
  461    HD1  PHE  58           1HD      PHE  58 -11.747   3.359   5.875
  462    HD2  PHE  58           2HD      PHE  58 -10.930   6.177   9.034
  463    HE1  PHE  58           1HE      PHE  58 -13.639   2.435   7.200
  464    HE2  PHE  58           2HE      PHE  58 -12.788   5.237  10.360
  465    HZ   PHE  58           HZ       PHE  58 -14.153   3.364   9.447
  466    H    ILE  59           H        ILE  59  -7.966   4.250   4.225
  467    HA   ILE  59           HA       ILE  59  -5.809   6.323   4.509
  468    HB   ILE  59           HB       ILE  59  -6.131   3.927   2.728
  469   1HG1  ILE  59          2HG       ILE  59  -3.727   4.795   4.384
  470   2HG1  ILE  59          3HG       ILE  59  -4.999   3.733   4.992
  471   1HG2  ILE  59          1HG       ILE  59  -4.342   6.274   2.199
  472   2HG2  ILE  59          2HG       ILE  59  -4.080   4.666   1.484
  473   3HG2  ILE  59          3HG       ILE  59  -5.578   5.527   1.173
  474   1HD1  ILE  59          1HD1      ILE  59  -3.023   3.147   2.773
  475   2HD1  ILE  59          2HD1      ILE  59  -3.370   2.236   4.261
  476   3HD1  ILE  59          3HD1      ILE  59  -4.532   2.230   2.938
  477    H    GLU  60           H        GLU  60  -5.881   8.090   3.291
  478    HA   GLU  60           HA       GLU  60  -8.071   8.579   1.386
  479   1HB   GLU  60          2HB       GLU  60  -7.057  10.513   3.548
  480   2HB   GLU  60          3HB       GLU  60  -8.324  10.817   2.371
  481   1HG   GLU  60          2HG       GLU  60  -9.685  10.391   4.097
  482   2HG   GLU  60          3HG       GLU  60  -9.479   8.744   3.553
  483    H    GLU  61           H        GLU  61  -7.512  10.977   0.395
  484    HA   GLU  61           HA       GLU  61  -5.339  10.698  -1.343
  485   1HB   GLU  61          2HB       GLU  61  -5.662  12.957  -1.990
  486   2HB   GLU  61          3HB       GLU  61  -7.159  12.039  -1.898
  487   1HG   GLU  61          2HG       GLU  61  -7.665  13.136   0.302
  488   2HG   GLU  61          3HG       GLU  61  -6.201  14.117   0.111
  489    H    ASP  62           H        ASP  62  -5.403  12.300   1.818
  490    HA   ASP  62           HA       ASP  62  -2.972  13.540   2.012
  491   1HB   ASP  62          2HB       ASP  62  -4.355  11.863   4.148
  492   2HB   ASP  62          3HB       ASP  62  -3.245  13.210   4.416
  493    H    GLU  63           H        GLU  63  -3.522  10.021   2.842
  494    HA   GLU  63           HA       GLU  63  -0.592   9.616   2.991
  495   1HB   GLU  63          2HB       GLU  63  -2.810   7.558   2.870
  496   2HB   GLU  63          3HB       GLU  63  -1.123   7.277   3.309
  497   1HG   GLU  63          2HG       GLU  63  -1.735   7.554   5.439
  498   2HG   GLU  63          3HG       GLU  63  -1.896   9.278   5.113
  499    H    LEU  64           H        LEU  64  -3.241   9.043   0.692
  500    HA   LEU  64           HA       LEU  64  -2.191   7.138  -0.979
  501   1HB   LEU  64          2HB       LEU  64  -4.269   9.072  -1.066
  502   2HB   LEU  64          3HB       LEU  64  -3.424   9.250  -2.583
  503    HG   LEU  64           HG       LEU  64  -3.651   6.686  -2.737
  504   1HD1  LEU  64          1HD1      LEU  64  -5.685   7.246  -0.565
  505   2HD1  LEU  64          2HD1      LEU  64  -5.645   5.767  -1.545
  506   3HD1  LEU  64          3HD1      LEU  64  -4.262   6.174  -0.513
  507   1HD2  LEU  64          1HD2      LEU  64  -4.985   8.285  -4.112
  508   2HD2  LEU  64          2HD2      LEU  64  -6.035   6.964  -3.596
  509   3HD2  LEU  64          3HD2      LEU  64  -6.115   8.526  -2.766
  510    H    GLY  65           H        GLY  65  -1.416  10.580  -1.120
  511   1HA   GLY  65          2HA       GLY  65   0.228  10.678  -3.407
  512   2HA   GLY  65          3HA       GLY  65   0.494  11.640  -1.949
  513    H    PHE  66           H        PHE  66   1.143   9.346  -0.179
  514    HA   PHE  66           HA       PHE  66   3.700   8.361  -1.288
  515   1HB   PHE  66          2HB       PHE  66   5.052   9.545   0.388
  516   2HB   PHE  66          3HB       PHE  66   4.289  10.608  -0.768
  517    HD1  PHE  66           1HD      PHE  66   2.339  12.054  -0.100
  518    HD2  PHE  66           2HD      PHE  66   4.595   9.753   2.753
  519    HE1  PHE  66           1HE      PHE  66   1.428  13.443   1.735
  520    HE2  PHE  66           2HE      PHE  66   3.758  11.192   4.582
  521    HZ   PHE  66           HZ       PHE  66   2.143  13.053   4.064
  522    H    ILE  67           H        ILE  67   1.393   7.051  -0.290
  523    HA   ILE  67           HA       ILE  67   1.182   5.868   2.176
  524    HB   ILE  67           HB       ILE  67  -0.414   5.641   0.533
  525   1HG1  ILE  67          2HG       ILE  67  -0.148   3.623   1.892
  526   2HG1  ILE  67          3HG       ILE  67  -1.013   3.408   0.387
  527   1HG2  ILE  67          1HG       ILE  67   1.614   4.486  -1.386
  528   2HG2  ILE  67          2HG       ILE  67  -0.145   4.383  -1.605
  529   3HG2  ILE  67          3HG       ILE  67   0.634   5.957  -1.563
  530   1HD1  ILE  67          1HD1      ILE  67   1.769   2.427   1.069
  531   2HD1  ILE  67          2HD1      ILE  67   0.345   1.481   0.612
  532   3HD1  ILE  67          3HD1      ILE  67   1.165   2.450  -0.601
  533    H    LEU  68           H        LEU  68   3.531   5.007  -0.313
  534    HA   LEU  68           HA       LEU  68   4.579   2.729   1.006
  535   1HB   LEU  68          2HB       LEU  68   5.852   4.658  -0.961
  536   2HB   LEU  68          3HB       LEU  68   6.610   3.160  -0.435
  537    HG   LEU  68           HG       LEU  68   3.868   2.595  -1.220
  538   1HD1  LEU  68          1HD1      LEU  68   5.436   4.050  -3.362
  539   2HD1  LEU  68          2HD1      LEU  68   3.821   3.302  -3.475
  540   3HD1  LEU  68          3HD1      LEU  68   4.053   4.725  -2.473
  541   1HD2  LEU  68          1HD2      LEU  68   5.926   1.056  -1.255
  542   2HD2  LEU  68          2HD2      LEU  68   4.922   1.023  -2.705
  543   3HD2  LEU  68          3HD2      LEU  68   6.457   1.930  -2.697
  544    H    LYS  69           H        LYS  69   4.985   6.054   1.981
  545    HA   LYS  69           HA       LYS  69   7.431   5.677   3.471
  546   1HB   LYS  69          2HB       LYS  69   5.117   7.627   3.667
  547   2HB   LYS  69          3HB       LYS  69   6.221   7.495   4.996
  548   1HG   LYS  69          2HG       LYS  69   8.042   7.671   2.926
  549   2HG   LYS  69          3HG       LYS  69   6.685   8.577   2.260
  550   1HD   LYS  69          2HD       LYS  69   7.893  10.231   3.325
  551   2HD   LYS  69          3HD       LYS  69   6.733   9.838   4.591
  552   1HE   LYS  69          2HE       LYS  69   9.608   8.818   4.321
  553   2HE   LYS  69          3HE       LYS  69   9.074  10.088   5.423
  554   1HZ   LYS  69          1HZ       LYS  69   8.217   7.245   5.565
  555   2HZ   LYS  69          2HZ       LYS  69   9.313   7.963   6.554
  556   3HZ   LYS  69          3HZ       LYS  69   7.741   8.433   6.589
  557    H    GLY  70           H        GLY  70   4.322   4.323   3.995
  558   1HA   GLY  70          2HA       GLY  70   5.017   3.454   6.744
  559   2HA   GLY  70          3HA       GLY  70   3.631   2.922   5.767
  560    H    PHE  71           H        PHE  71   5.118   2.079   3.432
  561    HA   PHE  71           HA       PHE  71   6.000  -0.531   4.336
  562   1HB   PHE  71          2HB       PHE  71   6.193   0.813   1.618
  563   2HB   PHE  71          3HB       PHE  71   6.619  -0.853   1.947
  564    HD1  PHE  71           1HD      PHE  71   4.409  -1.930   3.586
  565    HD2  PHE  71           2HD      PHE  71   4.306   0.737   0.201
  566    HE1  PHE  71           1HE      PHE  71   2.158  -2.747   2.977
  567    HE2  PHE  71           2HE      PHE  71   2.084  -0.118  -0.418
  568    HZ   PHE  71           HZ       PHE  71   0.996  -1.872   0.963
  569    H    SER  72           H        SER  72   7.808   2.494   3.331
  570    HA   SER  72           HA       SER  72  10.034   1.849   4.977
  571   1HB   SER  72          2HB       SER  72   9.928   0.714   2.249
  572   2HB   SER  72          3HB       SER  72  11.435   1.595   2.580
  573    HG   SER  72           HG       SER  72  10.192  -0.384   4.165
  574    HA   PRO  73           HA       PRO  73  11.247   5.946   3.383
  575   1HB   PRO  73          2HB       PRO  73  13.977   5.898   3.362
  576   2HB   PRO  73          3HB       PRO  73  13.023   5.970   4.875
  577   1HG   PRO  73          2HG       PRO  73  14.238   3.521   3.559
  578   2HG   PRO  73          3HG       PRO  73  14.345   4.026   5.277
  579   1HD   PRO  73          2HD       PRO  73  12.528   2.198   4.398
  580   2HD   PRO  73          3HD       PRO  73  12.143   3.333   5.718
  581    H    ASP  74           H        ASP  74  12.457   6.851   1.592
  582    HA   ASP  74           HA       ASP  74  12.724   7.218  -0.621
  583   1HB   ASP  74          2HB       ASP  74  14.625   5.574  -0.236
  584   2HB   ASP  74          3HB       ASP  74  13.612   4.359  -1.023
  585    H    ALA  75           H        ALA  75  10.281   6.067   0.472
  586    HA   ALA  75           HA       ALA  75   8.591   4.701  -1.226
  587   1HB   ALA  75          1HB       ALA  75   8.286   7.015   0.734
  588   2HB   ALA  75          2HB       ALA  75   6.899   6.171   0.075
  589   3HB   ALA  75          3HB       ALA  75   8.116   5.271   1.036
  590    H    ARG  76           H        ARG  76   9.185   8.157  -1.193
  591    HA   ARG  76           HA       ARG  76   8.737   9.945  -2.499
  592   1HB   ARG  76          2HB       ARG  76   8.496   8.106  -4.900
  593   2HB   ARG  76          3HB       ARG  76   9.036   9.793  -4.834
  594   1HG   ARG  76          2HG       ARG  76  10.879   8.891  -3.225
  595   2HG   ARG  76          3HG       ARG  76  10.449   7.305  -3.899
  596   1HD   ARG  76          2HD       ARG  76  11.154   7.949  -6.093
  597   2HD   ARG  76          3HD       ARG  76  11.279   9.656  -5.608
  598    HE   ARG  76           HE       ARG  76  12.955   7.692  -4.094
  599   1HH1  ARG  76          1HH2      ARG  76  13.042  10.289  -6.441
  600   2HH1  ARG  76          2HH2      ARG  76  14.725  10.630  -6.093
  601   1HH2  ARG  76          1HH1      ARG  76  14.839   8.087  -3.702
  602   2HH2  ARG  76          2HH1      ARG  76  15.839   9.310  -4.521
  603    H    ASP  77           H        ASP  77   7.321  10.920  -4.300
  604    HA   ASP  77           HA       ASP  77   4.563  10.659  -3.465
  605   1HB   ASP  77          2HB       ASP  77   4.357  12.803  -4.709
  606   2HB   ASP  77          3HB       ASP  77   5.428  12.816  -3.318
  607    H    LEU  78           H        LEU  78   3.402   9.243  -4.479
  608    HA   LEU  78           HA       LEU  78   3.636   8.265  -7.195
  609   1HB   LEU  78          2HB       LEU  78   1.123   8.374  -5.466
  610   2HB   LEU  78          3HB       LEU  78   1.446   7.299  -6.820
  611    HG   LEU  78           HG       LEU  78   2.771   7.232  -4.082
  612   1HD1  LEU  78          1HD1      LEU  78   0.945   5.242  -5.432
  613   2HD1  LEU  78          2HD1      LEU  78   1.753   5.034  -3.874
  614   3HD1  LEU  78          3HD1      LEU  78   0.537   6.307  -4.094
  615   1HD2  LEU  78          1HD2      LEU  78   4.476   6.618  -5.740
  616   2HD2  LEU  78          2HD2      LEU  78   3.892   5.136  -4.992
  617   3HD2  LEU  78          3HD2      LEU  78   3.318   5.579  -6.599
  618    H    SER  79           H        SER  79   2.482   8.875  -9.133
  619    HA   SER  79           HA       SER  79   1.989  11.692  -9.295
  620   1HB   SER  79          2HB       SER  79   1.789  11.443 -11.546
  621   2HB   SER  79          3HB       SER  79   2.657   9.959 -11.190
  622    HG   SER  79           HG       SER  79   0.924   9.503 -12.587
  623    H    ALA  80           H        ALA  80   0.075  12.716 -10.181
  624    HA   ALA  80           HA       ALA  80  -2.344  12.357  -8.773
  625   1HB   ALA  80          1HB       ALA  80  -1.796  13.634 -11.484
  626   2HB   ALA  80          2HB       ALA  80  -3.222  13.935 -10.461
  627   3HB   ALA  80          3HB       ALA  80  -1.612  14.434  -9.900
  628    H    LYS  81           H        LYS  81  -1.194  10.664 -11.639
  629    HA   LYS  81           HA       LYS  81  -3.906   9.735 -12.442
  630   1HB   LYS  81          2HB       LYS  81  -1.249   8.720 -13.502
  631   2HB   LYS  81          3HB       LYS  81  -2.832   8.602 -14.246
  632   1HG   LYS  81          2HG       LYS  81  -1.094  11.086 -13.953
  633   2HG   LYS  81          3HG       LYS  81  -1.501  10.224 -15.432
  634   1HD   LYS  81          2HD       LYS  81  -3.924  10.836 -15.099
  635   2HD   LYS  81          3HD       LYS  81  -3.459  11.776 -13.665
  636   1HE   LYS  81          2HE       LYS  81  -1.911  13.128 -15.117
  637   2HE   LYS  81          3HE       LYS  81  -2.551  12.270 -16.527
  638   1HZ   LYS  81          1HZ       LYS  81  -4.136  13.930 -14.653
  639   2HZ   LYS  81          2HZ       LYS  81  -3.710  14.357 -16.181
  640   3HZ   LYS  81          3HZ       LYS  81  -4.756  13.113 -15.938
  641    H    GLU  82           H        GLU  82  -0.918   8.565 -10.929
  642    HA   GLU  82           HA       GLU  82  -1.646   5.890 -10.397
  643   1HB   GLU  82          2HB       GLU  82   0.541   7.530 -10.059
  644   2HB   GLU  82          3HB       GLU  82   0.010   7.382  -8.408
  645   1HG   GLU  82          2HG       GLU  82   0.320   4.919 -10.172
  646   2HG   GLU  82          3HG       GLU  82   1.730   5.689  -9.462
  647    H    THR  83           H        THR  83  -1.814   8.757  -8.171
  648    HA   THR  83           HA       THR  83  -3.289   7.490  -6.141
  649    HB   THR  83           HB       THR  83  -3.963   9.740  -5.386
  650    HG1  THR  83           1HG      THR  83  -2.965  11.464  -6.602
  651   1HG2  THR  83          1HG       THR  83  -1.042   9.657  -6.232
  652   2HG2  THR  83          2HG       THR  83  -1.755  10.594  -4.906
  653   3HG2  THR  83          3HG       THR  83  -1.719   8.823  -4.826
  654    H    LYS  84           H        LYS  84  -4.627   9.300  -8.942
  655    HA   LYS  84           HA       LYS  84  -7.380   8.996  -8.314
  656   1HB   LYS  84          2HB       LYS  84  -6.474  10.424 -10.130
  657   2HB   LYS  84          3HB       LYS  84  -6.055   8.980 -11.063
  658   1HG   LYS  84          2HG       LYS  84  -8.518   8.371 -11.078
  659   2HG   LYS  84          3HG       LYS  84  -8.844   9.905 -10.247
  660   1HD   LYS  84          2HD       LYS  84  -7.793  11.120 -12.194
  661   2HD   LYS  84          3HD       LYS  84  -7.525   9.557 -12.979
  662   1HE   LYS  84          2HE       LYS  84  -9.498  10.459 -13.958
  663   2HE   LYS  84          3HE       LYS  84 -10.003   9.134 -12.903
  664   1HZ   LYS  84          1HZ       LYS  84 -10.117  12.018 -12.224
  665   2HZ   LYS  84          2HZ       LYS  84 -11.408  11.076 -12.610
  666   3HZ   LYS  84          3HZ       LYS  84 -10.572  10.798 -11.222
  667    H    MET  85           H        MET  85  -5.346   6.761 -10.287
  668    HA   MET  85           HA       MET  85  -7.464   4.803 -10.593
  669   1HB   MET  85          2HB       MET  85  -4.440   4.668 -10.956
  670   2HB   MET  85          3HB       MET  85  -5.517   3.291 -11.243
  671   1HG   MET  85          2HG       MET  85  -6.812   4.618 -12.871
  672   2HG   MET  85          3HG       MET  85  -5.708   5.980 -12.647
  673   1HE   MET  85          1HE       MET  85  -5.633   5.935 -15.343
  674   2HE   MET  85          2HE       MET  85  -5.025   4.554 -16.285
  675   3HE   MET  85          3HE       MET  85  -6.577   4.426 -15.427
  676    H    LEU  86           H        LEU  86  -4.704   5.028  -8.335
  677    HA   LEU  86           HA       LEU  86  -5.053   2.681  -6.850
  678   1HB   LEU  86          2HB       LEU  86  -3.150   4.230  -6.794
  679   2HB   LEU  86          3HB       LEU  86  -4.122   5.448  -5.982
  680    HG   LEU  86           HG       LEU  86  -3.436   2.730  -4.806
  681   1HD1  LEU  86          1HD1      LEU  86  -2.213   5.478  -4.269
  682   2HD1  LEU  86          2HD1      LEU  86  -1.788   3.965  -3.434
  683   3HD1  LEU  86          3HD1      LEU  86  -1.424   4.165  -5.153
  684   1HD2  LEU  86          1HD2      LEU  86  -5.299   3.407  -3.626
  685   2HD2  LEU  86          2HD2      LEU  86  -3.972   4.014  -2.633
  686   3HD2  LEU  86          3HD2      LEU  86  -4.869   5.108  -3.718
  687    H    MET  87           H        MET  87  -6.532   5.936  -6.200
  688    HA   MET  87           HA       MET  87  -8.140   5.203  -4.016
  689   1HB   MET  87          2HB       MET  87  -7.778   7.544  -4.941
  690   2HB   MET  87          3HB       MET  87  -8.917   7.161  -6.226
  691   1HG   MET  87          2HG       MET  87 -10.625   6.633  -4.415
  692   2HG   MET  87          3HG       MET  87  -9.451   7.230  -3.235
  693   1HE   MET  87          1HE       MET  87 -10.967   9.123  -2.201
  694   2HE   MET  87          2HE       MET  87 -12.073  10.092  -3.199
  695   3HE   MET  87          3HE       MET  87 -12.245   8.322  -3.146
  696    H    ALA  88           H        ALA  88  -9.153   5.292  -7.470
  697    HA   ALA  88           HA       ALA  88 -11.737   4.195  -7.025
  698   1HB   ALA  88          1HB       ALA  88 -10.022   4.251  -9.549
  699   2HB   ALA  88          2HB       ALA  88 -11.781   3.997  -9.484
  700   3HB   ALA  88          3HB       ALA  88 -11.092   5.554  -8.980
  701    H    ALA  89           H        ALA  89  -8.660   2.515  -7.788
  702    HA   ALA  89           HA       ALA  89  -9.965  -0.074  -8.103
  703   1HB   ALA  89          1HB       ALA  89  -7.029   0.683  -7.736
  704   2HB   ALA  89          2HB       ALA  89  -7.647  -0.905  -8.245
  705   3HB   ALA  89          3HB       ALA  89  -7.881   0.514  -9.286
  706    H    GLY  90           H        GLY  90  -8.020   1.475  -5.495
  707   1HA   GLY  90          2HA       GLY  90  -7.797  -0.881  -3.889
  708   2HA   GLY  90          3HA       GLY  90  -7.384   0.771  -3.434
  709    H    ASP  91           H        ASP  91 -10.060   1.889  -3.772
  710    HA   ASP  91           HA       ASP  91 -11.478   0.887  -1.389
  711   1HB   ASP  91          2HB       ASP  91 -11.354   3.237  -1.746
  712   2HB   ASP  91          3HB       ASP  91 -12.061   3.080  -3.363
  713    H    LYS  92           H        LYS  92 -11.627  -1.301  -2.368
  714    HA   LYS  92           HA       LYS  92 -13.373  -1.920  -4.620
  715   1HB   LYS  92          2HB       LYS  92 -12.211  -3.508  -2.290
  716   2HB   LYS  92          3HB       LYS  92 -13.372  -4.248  -3.392
  717   1HG   LYS  92          2HG       LYS  92 -10.846  -2.890  -4.388
  718   2HG   LYS  92          3HG       LYS  92 -10.876  -4.592  -3.931
  719   1HD   LYS  92          2HD       LYS  92 -12.307  -5.218  -5.654
  720   2HD   LYS  92          3HD       LYS  92 -12.946  -3.589  -5.912
  721   1HE   LYS  92          2HE       LYS  92 -10.891  -2.825  -6.911
  722   2HE   LYS  92          3HE       LYS  92 -10.058  -4.326  -6.451
  723   1HZ   LYS  92          1HZ       LYS  92 -12.359  -4.288  -8.300
  724   2HZ   LYS  92          2HZ       LYS  92 -10.772  -4.363  -8.776
  725   3HZ   LYS  92          3HZ       LYS  92 -11.415  -5.581  -7.887
  726    H    ASP  93           H        ASP  93 -13.941  -1.251  -1.247
  727    HA   ASP  93           HA       ASP  93 -16.700  -2.263  -1.263
  728   1HB   ASP  93          2HB       ASP  93 -15.247  -0.401   0.635
  729   2HB   ASP  93          3HB       ASP  93 -16.857  -1.051   0.928
  730    H    GLY  94           H        GLY  94 -15.301   0.849  -2.215
  731   1HA   GLY  94          2HA       GLY  94 -16.447   2.617  -3.229
  732   2HA   GLY  94          3HA       GLY  94 -17.989   1.931  -2.751
  733    H    ASP  95           H        ASP  95 -15.451   2.522  -0.359
  734    HA   ASP  95           HA       ASP  95 -17.250   4.484   1.058
  735   1HB   ASP  95          2HB       ASP  95 -14.558   3.458   2.008
  736   2HB   ASP  95          3HB       ASP  95 -15.778   4.302   2.957
  737    H    GLY  96           H        GLY  96 -14.805   4.586  -1.199
  738   1HA   GLY  96          2HA       GLY  96 -13.335   5.965  -2.044
  739   2HA   GLY  96          3HA       GLY  96 -13.949   7.316  -1.055
  740    H    LYS  97           H        LYS  97 -12.793   4.465   0.590
  741    HA   LYS  97           HA       LYS  97 -10.018   5.528   0.967
  742   1HB   LYS  97          2HB       LYS  97 -11.937   4.705   3.196
  743   2HB   LYS  97          3HB       LYS  97 -10.200   4.882   3.363
  744   1HG   LYS  97          2HG       LYS  97 -10.737   6.957   4.059
  745   2HG   LYS  97          3HG       LYS  97 -10.600   7.287   2.340
  746   1HD   LYS  97          2HD       LYS  97 -12.505   8.417   3.268
  747   2HD   LYS  97          3HD       LYS  97 -13.048   7.184   2.135
  748   1HE   LYS  97          2HE       LYS  97 -13.357   5.649   4.199
  749   2HE   LYS  97          3HE       LYS  97 -13.129   7.100   5.182
  750   1HZ   LYS  97          1HZ       LYS  97 -15.160   6.780   3.038
  751   2HZ   LYS  97          2HZ       LYS  97 -15.486   6.594   4.651
  752   3HZ   LYS  97          3HZ       LYS  97 -15.039   8.068   4.052
  753    H    ILE  98           H        ILE  98  -8.549   3.922   1.499
  754    HA   ILE  98           HA       ILE  98  -9.232   1.113   0.765
  755    HB   ILE  98           HB       ILE  98  -6.687   2.625   1.270
  756   1HG1  ILE  98          2HG       ILE  98  -7.215   0.608  -0.897
  757   2HG1  ILE  98          3HG       ILE  98  -7.940   2.212  -1.005
  758   1HG2  ILE  98          1HG       ILE  98  -6.717  -0.418   1.167
  759   2HG2  ILE  98          2HG       ILE  98  -5.285   0.627   1.218
  760   3HG2  ILE  98          3HG       ILE  98  -6.322   0.506   2.620
  761   1HD1  ILE  98          1HD1      ILE  98  -4.955   1.913  -0.541
  762   2HD1  ILE  98          2HD1      ILE  98  -5.687   1.876  -2.148
  763   3HD1  ILE  98          3HD1      ILE  98  -5.869   3.315  -1.107
  764    H    GLY  99           H        GLY  99 -10.014  -0.220   2.209
  765   1HA   GLY  99          2HA       GLY  99  -9.204  -0.069   5.091
  766   2HA   GLY  99          3HA       GLY  99 -10.542  -0.999   4.418
  767    H    VAL 100           H        VAL 100  -8.092  -1.732   5.991
  768    HA   VAL 100           HA       VAL 100  -6.183  -3.144   4.757
  769    HB   VAL 100           HB       VAL 100  -6.347  -2.864   7.137
  770   1HG1  VAL 100          1HG       VAL 100  -8.325  -5.145   7.375
  771   2HG1  VAL 100          2HG       VAL 100  -7.576  -4.197   8.661
  772   3HG1  VAL 100          3HG       VAL 100  -8.734  -3.422   7.575
  773   1HG2  VAL 100          1HG       VAL 100  -4.949  -4.674   5.980
  774   2HG2  VAL 100          2HG       VAL 100  -5.212  -4.801   7.706
  775   3HG2  VAL 100          3HG       VAL 100  -6.148  -5.830   6.616
  776    H    ASP 101           H        ASP 101  -9.315  -4.702   5.485
  777    HA   ASP 101           HA       ASP 101  -8.758  -7.244   4.423
  778   1HB   ASP 101          2HB       ASP 101 -11.099  -5.634   5.301
  779   2HB   ASP 101          3HB       ASP 101 -11.494  -6.846   4.108
  780    H    GLU 102           H        GLU 102  -9.924  -4.328   2.807
  781    HA   GLU 102           HA       GLU 102 -10.278  -5.494   0.168
  782   1HB   GLU 102          2HB       GLU 102  -9.499  -2.604   0.703
  783   2HB   GLU 102          3HB       GLU 102 -10.365  -3.284  -0.661
  784   1HG   GLU 102          2HG       GLU 102 -12.318  -3.720   0.791
  785   2HG   GLU 102          3HG       GLU 102 -11.429  -3.094   2.197
  786    H    PHE 103           H        PHE 103  -7.681  -3.527   1.705
  787    HA   PHE 103           HA       PHE 103  -5.916  -3.579  -0.459
  788   1HB   PHE 103          2HB       PHE 103  -5.951  -2.426   2.021
  789   2HB   PHE 103          3HB       PHE 103  -4.733  -3.641   2.299
  790    HD1  PHE 103           1HD      PHE 103  -2.753  -2.359   2.483
  791    HD2  PHE 103           2HD      PHE 103  -5.451  -1.531  -0.791
  792    HE1  PHE 103           1HE      PHE 103  -1.182  -0.681   1.580
  793    HE2  PHE 103           2HE      PHE 103  -3.854   0.105  -1.689
  794    HZ   PHE 103           HZ       PHE 103  -1.706   0.542  -0.518
  795    H    SER 104           H        SER 104  -6.216  -5.966   2.076
  796    HA   SER 104           HA       SER 104  -4.106  -7.754   1.446
  797   1HB   SER 104          2HB       SER 104  -5.621  -7.699   3.455
  798   2HB   SER 104          3HB       SER 104  -6.891  -8.418   2.463
  799    HG   SER 104           HG       SER 104  -5.764 -10.047   3.531
  800    H    THR 105           H        THR 105  -7.241  -7.335  -0.168
  801    HA   THR 105           HA       THR 105  -6.933  -9.916  -1.621
  802    HB   THR 105           HB       THR 105  -9.415  -9.850  -1.671
  803    HG1  THR 105           1HG      THR 105  -9.389  -7.953   0.424
  804   1HG2  THR 105          1HG       THR 105  -8.198  -9.727   1.121
  805   2HG2  THR 105          2HG       THR 105  -9.702 -10.549   0.659
  806   3HG2  THR 105          3HG       THR 105  -8.134 -11.132   0.050
  807    H    LEU 106           H        LEU 106  -7.639  -6.552  -2.002
  808    HA   LEU 106           HA       LEU 106  -8.127  -6.009  -4.649
  809   1HB   LEU 106          2HB       LEU 106  -7.719  -4.428  -2.820
  810   2HB   LEU 106          3HB       LEU 106  -6.033  -4.904  -2.708
  811    HG   LEU 106           HG       LEU 106  -6.421  -2.698  -3.640
  812   1HD1  LEU 106          1HD1      LEU 106  -5.193  -4.340  -5.844
  813   2HD1  LEU 106          2HD1      LEU 106  -4.776  -2.719  -5.278
  814   3HD1  LEU 106          3HD1      LEU 106  -4.439  -4.150  -4.252
  815   1HD2  LEU 106          1HD2      LEU 106  -8.514  -3.131  -4.804
  816   2HD2  LEU 106          2HD2      LEU 106  -7.322  -2.387  -5.888
  817   3HD2  LEU 106          3HD2      LEU 106  -7.675  -4.130  -6.010
  818    H    VAL 107           H        VAL 107  -5.070  -7.082  -3.281
  819    HA   VAL 107           HA       VAL 107  -3.623  -7.190  -5.830
  820    HB   VAL 107           HB       VAL 107  -1.791  -7.938  -4.402
  821   1HG1  VAL 107          1HG       VAL 107  -3.253  -5.608  -3.084
  822   2HG1  VAL 107          2HG       VAL 107  -1.523  -5.813  -3.213
  823   3HG1  VAL 107          3HG       VAL 107  -2.448  -5.484  -4.671
  824   1HG2  VAL 107          1HG       VAL 107  -3.847  -8.795  -2.586
  825   2HG2  VAL 107          2HG       VAL 107  -2.108  -8.956  -2.460
  826   3HG2  VAL 107          3HG       VAL 107  -2.938  -7.533  -1.777
  827    H    ALA 108           H        ALA 108  -5.624  -9.308  -4.229
  828    HA   ALA 108           HA       ALA 108  -4.461 -11.825  -5.240
  829   1HB   ALA 108          1HB       ALA 108  -7.074 -11.490  -3.746
  830   2HB   ALA 108          2HB       ALA 108  -6.018 -12.911  -3.839
  831   3HB   ALA 108          3HB       ALA 108  -5.517 -11.474  -2.904
  832    H    GLU 109           H        GLU 109  -7.241  -9.641  -5.791
  833    HA   GLU 109           HA       GLU 109  -8.258 -10.873  -8.175
  834   1HB   GLU 109          2HB       GLU 109  -7.848  -7.924  -7.559
  835   2HB   GLU 109          3HB       GLU 109  -8.823  -8.565  -8.871
  836   1HG   GLU 109          2HG       GLU 109 -10.388  -9.586  -7.299
  837   2HG   GLU 109          3HG       GLU 109  -9.403  -9.066  -5.922
  838    H    SER 110           H        SER 110  -5.137  -9.520  -7.512
  839    HA   SER 110           HA       SER 110  -3.431  -8.802  -8.852
  840   1HB   SER 110          2HB       SER 110  -2.273 -10.693  -9.675
  841   2HB   SER 110          3HB       SER 110  -3.220 -11.220  -8.269
  842    HG   SER 110           HG       SER 110  -4.728 -12.100  -9.691
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1   3.564  -2.190  11.013
    2   2H    MET   1           H2       MET   1   2.415  -1.372  11.847
    3   3H    MET   1           H3       MET   1   3.033  -2.779  12.443
    4    HA   MET   1           HA       MET   1   4.541  -0.267  12.149
    5   1HB   MET   1          2HB       MET   1   2.803  -0.518  14.063
    6   2HB   MET   1          3HB       MET   1   3.860  -1.768  14.708
    7   1HG   MET   1          2HG       MET   1   4.545   0.119  15.861
    8   2HG   MET   1          3HG       MET   1   5.733   0.068  14.557
    9   1HE   MET   1          1HE       MET   1   6.401   2.611  14.981
   10   2HE   MET   1          2HE       MET   1   5.214   3.923  15.152
   11   3HE   MET   1          3HE       MET   1   5.274   2.619  16.359
   12    H    SER   2           H        SER   2   6.738  -0.640  11.879
   13    HA   SER   2           HA       SER   2   8.738  -1.650  11.738
   14   1HB   SER   2          2HB       SER   2   7.742  -3.904  13.503
   15   2HB   SER   2          3HB       SER   2   9.410  -3.542  13.055
   16    HG   SER   2           HG       SER   2   8.819  -2.665  15.093
   17    H    MET   3           H        MET   3   7.688  -1.751   9.505
   18    HA   MET   3           HA       MET   3   6.620  -4.103   8.428
   19   1HB   MET   3          2HB       MET   3   7.088  -1.511   7.509
   20   2HB   MET   3          3HB       MET   3   8.231  -2.448   6.551
   21   1HG   MET   3          2HG       MET   3   6.395  -2.599   5.218
   22   2HG   MET   3          3HG       MET   3   6.141  -4.045   6.189
   23   1HE   MET   3          1HE       MET   3   5.119  -2.490   9.007
   24   2HE   MET   3          2HE       MET   3   3.381  -2.595   8.772
   25   3HE   MET   3          3HE       MET   3   4.388  -4.003   8.390
   26    H    THR   4           H        THR   4   9.973  -3.109   8.467
   27    HA   THR   4           HA       THR   4  11.416  -5.078   7.199
   28    HB   THR   4           HB       THR   4  11.819  -3.639   9.851
   29    HG1  THR   4           1HG      THR   4  13.230  -2.439   8.386
   30   1HG2  THR   4          1HG       THR   4  13.855  -5.186   8.227
   31   2HG2  THR   4          2HG       THR   4  14.280  -3.967   9.456
   32   3HG2  THR   4          3HG       THR   4  13.413  -5.435   9.925
   33    H    ASP   5           H        ASP   5   9.688  -5.440  10.300
   34    HA   ASP   5           HA       ASP   5  10.992  -8.059  10.818
   35   1HB   ASP   5          2HB       ASP   5  10.864  -6.107  12.492
   36   2HB   ASP   5          3HB       ASP   5   9.134  -6.428  12.597
   37    H    LEU   6           H        LEU   6   7.805  -6.537  10.380
   38    HA   LEU   6           HA       LEU   6   6.226  -8.935  10.714
   39   1HB   LEU   6          2HB       LEU   6   5.676  -6.285   9.320
   40   2HB   LEU   6          3HB       LEU   6   4.447  -7.521   9.597
   41    HG   LEU   6           HG       LEU   6   6.019  -6.248  11.888
   42   1HD1  LEU   6          1HD1      LEU   6   3.431  -5.433  10.534
   43   2HD1  LEU   6          2HD1      LEU   6   3.935  -4.899  12.166
   44   3HD1  LEU   6          3HD1      LEU   6   4.923  -4.475  10.753
   45   1HD2  LEU   6          1HD2      LEU   6   4.870  -8.384  12.438
   46   2HD2  LEU   6          2HD2      LEU   6   4.116  -7.009  13.248
   47   3HD2  LEU   6          3HD2      LEU   6   3.349  -7.732  11.810
   48    H    LEU   7           H        LEU   7   7.343  -7.212   7.759
   49    HA   LEU   7           HA       LEU   7   6.663  -9.611   6.076
   50   1HB   LEU   7          2HB       LEU   7   7.352  -6.765   5.304
   51   2HB   LEU   7          3HB       LEU   7   6.938  -8.084   4.193
   52    HG   LEU   7           HG       LEU   7   5.077  -6.806   6.241
   53   1HD1  LEU   7          1HD1      LEU   7   4.960  -6.772   3.224
   54   2HD1  LEU   7          2HD1      LEU   7   3.939  -5.860   4.324
   55   3HD1  LEU   7          3HD1      LEU   7   5.652  -5.447   4.190
   56   1HD2  LEU   7          1HD2      LEU   7   4.433  -9.138   5.973
   57   2HD2  LEU   7          2HD2      LEU   7   3.318  -8.186   4.996
   58   3HD2  LEU   7          3HD2      LEU   7   4.645  -9.053   4.205
   59    H    ASN   8           H        ASN   8   9.203  -7.845   4.708
   60    HA   ASN   8           HA       ASN   8  11.251  -8.590   6.645
   61   1HB   ASN   8          2HB       ASN   8  10.466 -10.447   4.546
   62   2HB   ASN   8          3HB       ASN   8  12.019  -9.794   4.139
   63   1HD2  ASN   8          2HD2      ASN   8  12.156 -12.470   4.479
   64   2HD2  ASN   8          1HD2      ASN   8  12.419 -12.830   6.201
   65    H    ALA   9           H        ALA   9  13.169  -7.366   6.260
   66    HA   ALA   9           HA       ALA   9  13.214  -5.157   4.546
   67   1HB   ALA   9          1HB       ALA   9  15.577  -6.855   5.454
   68   2HB   ALA   9          2HB       ALA   9  15.684  -5.216   4.772
   69   3HB   ALA   9          3HB       ALA   9  14.860  -5.473   6.311
   70    H    GLU  10           H        GLU  10  14.243  -8.470   3.685
   71    HA   GLU  10           HA       GLU  10  15.222  -7.938   1.064
   72   1HB   GLU  10          2HB       GLU  10  14.818 -10.377   0.665
   73   2HB   GLU  10          3HB       GLU  10  15.774 -10.029   2.112
   74   1HG   GLU  10          2HG       GLU  10  13.970 -10.471   3.575
   75   2HG   GLU  10          3HG       GLU  10  12.779 -10.440   2.255
   76    H    ASP  11           H        ASP  11  11.864  -8.296   2.155
   77    HA   ASP  11           HA       ASP  11  10.937  -8.539  -0.666
   78   1HB   ASP  11          2HB       ASP  11   8.857  -9.315   0.150
   79   2HB   ASP  11          3HB       ASP  11  10.172 -10.273   0.764
   80    H    ILE  12           H        ILE  12  10.577  -6.421   2.172
   81    HA   ILE  12           HA       ILE  12   9.256  -4.291   0.911
   82    HB   ILE  12           HB       ILE  12  11.207  -4.538   3.169
   83   1HG1  ILE  12          2HG       ILE  12   9.455  -2.811   4.136
   84   2HG1  ILE  12          3HG       ILE  12   8.496  -3.217   2.715
   85   1HG2  ILE  12          1HG       ILE  12  10.772  -1.832   1.917
   86   2HG2  ILE  12          2HG       ILE  12  11.476  -2.160   3.529
   87   3HG2  ILE  12          3HG       ILE  12  12.330  -2.697   2.092
   88   1HD1  ILE  12          1HD1      ILE  12   9.578  -5.137   4.815
   89   2HD1  ILE  12          2HD1      ILE  12   7.906  -4.560   4.690
   90   3HD1  ILE  12          3HD1      ILE  12   8.568  -5.604   3.418
   91    H    LYS  13           H        LYS  13  12.749  -5.076   0.623
   92    HA   LYS  13           HA       LYS  13  13.434  -2.872  -0.994
   93   1HB   LYS  13          2HB       LYS  13  15.439  -3.748  -0.847
   94   2HB   LYS  13          3HB       LYS  13  14.770  -5.147  -0.039
   95   1HG   LYS  13          2HG       LYS  13  14.572  -6.328  -2.215
   96   2HG   LYS  13          3HG       LYS  13  15.255  -4.903  -3.032
   97   1HD   LYS  13          2HD       LYS  13  17.319  -5.132  -1.660
   98   2HD   LYS  13          3HD       LYS  13  16.636  -6.594  -0.904
   99   1HE   LYS  13          2HE       LYS  13  16.482  -7.680  -3.112
  100   2HE   LYS  13          3HE       LYS  13  17.094  -6.215  -3.898
  101   1HZ   LYS  13          1HZ       LYS  13  18.601  -7.866  -1.951
  102   2HZ   LYS  13          2HZ       LYS  13  18.863  -7.828  -3.575
  103   3HZ   LYS  13          3HZ       LYS  13  19.162  -6.497  -2.663
  104    H    LYS  14           H        LYS  14  12.131  -5.984  -2.107
  105    HA   LYS  14           HA       LYS  14  12.083  -5.213  -4.941
  106   1HB   LYS  14          2HB       LYS  14  10.782  -7.459  -3.334
  107   2HB   LYS  14          3HB       LYS  14  10.388  -7.148  -5.025
  108   1HG   LYS  14          2HG       LYS  14  12.783  -7.363  -5.643
  109   2HG   LYS  14          3HG       LYS  14  13.141  -7.866  -3.976
  110   1HD   LYS  14          2HD       LYS  14  11.691  -9.826  -4.207
  111   2HD   LYS  14          3HD       LYS  14  11.056  -9.234  -5.746
  112   1HE   LYS  14          2HE       LYS  14  12.603 -10.974  -6.257
  113   2HE   LYS  14          3HE       LYS  14  13.293  -9.434  -6.784
  114   1HZ   LYS  14          1HZ       LYS  14  13.984 -10.870  -4.286
  115   2HZ   LYS  14          2HZ       LYS  14  14.925 -10.784  -5.634
  116   3HZ   LYS  14          3HZ       LYS  14  14.616  -9.426  -4.751
  117    H    ALA  15           H        ALA  15   9.754  -5.064  -2.279
  118    HA   ALA  15           HA       ALA  15   7.480  -4.344  -3.781
  119   1HB   ALA  15          1HB       ALA  15   8.087  -3.433  -0.943
  120   2HB   ALA  15          2HB       ALA  15   6.555  -3.935  -1.679
  121   3HB   ALA  15          3HB       ALA  15   7.802  -5.136  -1.368
  122    H    VAL  16           H        VAL  16   9.726  -2.119  -1.957
  123    HA   VAL  16           HA       VAL  16   8.430   0.270  -2.856
  124    HB   VAL  16           HB       VAL  16  11.348  -0.103  -2.075
  125   1HG1  VAL  16          1HG       VAL  16   9.681   2.440  -2.298
  126   2HG1  VAL  16          2HG       VAL  16  11.300   2.330  -1.580
  127   3HG1  VAL  16          3HG       VAL  16  11.085   2.014  -3.302
  128   1HG2  VAL  16          1HG       VAL  16   9.770  -0.699  -0.252
  129   2HG2  VAL  16          2HG       VAL  16  10.643   0.804   0.082
  130   3HG2  VAL  16          3HG       VAL  16   8.952   0.865  -0.454
  131    H    GLY  17           H        GLY  17  10.968  -1.713  -4.356
  132   1HA   GLY  17          2HA       GLY  17  11.414  -0.094  -6.691
  133   2HA   GLY  17          3HA       GLY  17  11.784  -1.807  -6.498
  134    H    ALA  18           H        ALA  18   8.613  -1.969  -5.844
  135    HA   ALA  18           HA       ALA  18   7.838  -2.525  -8.627
  136   1HB   ALA  18          1HB       ALA  18   6.230  -2.951  -6.080
  137   2HB   ALA  18          2HB       ALA  18   6.020  -3.735  -7.653
  138   3HB   ALA  18          3HB       ALA  18   7.454  -4.092  -6.659
  139    H    PHE  19           H        PHE  19   6.893  -0.297  -5.981
  140    HA   PHE  19           HA       PHE  19   4.944   1.087  -7.807
  141   1HB   PHE  19          2HB       PHE  19   5.615   1.561  -4.892
  142   2HB   PHE  19          3HB       PHE  19   4.441   2.465  -5.845
  143    HD1  PHE  19           1HD      PHE  19   3.247  -0.078  -7.277
  144    HD2  PHE  19           2HD      PHE  19   3.840   1.074  -3.159
  145    HE1  PHE  19           1HE      PHE  19   1.241  -1.261  -6.591
  146    HE2  PHE  19           2HE      PHE  19   1.845  -0.211  -2.500
  147    HZ   PHE  19           HZ       PHE  19   0.560  -1.412  -4.194
  148    H    SER  20           H        SER  20   8.288   1.534  -6.736
  149    HA   SER  20           HA       SER  20   8.352   4.379  -7.189
  150   1HB   SER  20          2HB       SER  20   9.994   3.064  -5.845
  151   2HB   SER  20          3HB       SER  20  10.694   2.461  -7.362
  152    HG   SER  20           HG       SER  20  11.681   4.377  -6.434
  153    H    ALA  21           H        ALA  21   6.939   4.057  -9.113
  154    HA   ALA  21           HA       ALA  21   8.421   4.121 -11.699
  155   1HB   ALA  21          1HB       ALA  21   6.017   2.351 -11.057
  156   2HB   ALA  21          2HB       ALA  21   6.907   2.439 -12.599
  157   3HB   ALA  21          3HB       ALA  21   7.702   1.789 -11.160
  158    H    THR  22           H        THR  22   7.275   6.224 -10.197
  159    HA   THR  22           HA       THR  22   6.028   8.072 -10.190
  160    HB   THR  22           HB       THR  22   5.522   9.196 -12.314
  161    HG1  THR  22           1HG      THR  22   5.112   7.824 -13.938
  162   1HG2  THR  22          1HG       THR  22   8.280   7.909 -12.260
  163   2HG2  THR  22          2HG       THR  22   7.826   9.427 -13.053
  164   3HG2  THR  22          3HG       THR  22   7.781   9.314 -11.281
  165    H    ASP  23           H        ASP  23   4.242   6.558 -12.774
  166    HA   ASP  23           HA       ASP  23   1.685   6.741 -11.309
  167   1HB   ASP  23          2HB       ASP  23   1.401   6.831 -14.190
  168   2HB   ASP  23          3HB       ASP  23   0.895   7.971 -12.955
  169    H    SER  24           H        SER  24   3.843   4.479 -12.466
  170    HA   SER  24           HA       SER  24   1.869   2.683 -13.748
  171   1HB   SER  24          2HB       SER  24   4.182   3.164 -14.668
  172   2HB   SER  24          3HB       SER  24   4.822   2.184 -13.336
  173    HG   SER  24           HG       SER  24   4.483   0.844 -15.074
  174    H    PHE  25           H        PHE  25   0.844   2.793 -11.526
  175    HA   PHE  25           HA       PHE  25   1.937   1.311  -9.329
  176   1HB   PHE  25          2HB       PHE  25   0.116   3.117  -9.408
  177   2HB   PHE  25          3HB       PHE  25  -1.014   1.889  -9.883
  178    HD1  PHE  25           1HD      PHE  25   1.546   2.691  -7.235
  179    HD2  PHE  25           2HD      PHE  25  -2.228   0.860  -8.169
  180    HE1  PHE  25           1HE      PHE  25   1.173   2.279  -4.838
  181    HE2  PHE  25           2HE      PHE  25  -2.565   0.350  -5.714
  182    HZ   PHE  25           HZ       PHE  25  -0.843   1.031  -4.079
  183    H    ASP  26           H        ASP  26   2.023  -0.871  -8.995
  184    HA   ASP  26           HA       ASP  26  -0.225  -2.562  -9.988
  185   1HB   ASP  26          2HB       ASP  26   1.754  -2.759 -11.495
  186   2HB   ASP  26          3HB       ASP  26   2.676  -3.423 -10.144
  187    H    HIS  27           H        HIS  27  -1.089  -2.278  -7.874
  188    HA   HIS  27           HA       HIS  27   0.217  -3.030  -5.473
  189   1HB   HIS  27          2HB       HIS  27  -2.234  -3.367  -4.672
  190   2HB   HIS  27          3HB       HIS  27  -1.704  -1.774  -5.162
  191    HD1  HIS  27           HD1      HIS  27  -2.726  -0.785  -7.451
  192    HD2  HIS  27           HD2      HIS  27  -4.140  -4.558  -6.256
  193    HE1  HIS  27           HE1      HIS  27  -4.710  -1.337  -8.966
  194    H    LYS  28           H        LYS  28  -1.456  -4.926  -7.793
  195    HA   LYS  28           HA       LYS  28  -1.743  -7.452  -6.479
  196   1HB   LYS  28          2HB       LYS  28  -1.116  -7.127  -9.437
  197   2HB   LYS  28          3HB       LYS  28  -2.065  -8.331  -8.628
  198   1HG   LYS  28          2HG       LYS  28  -3.837  -7.088  -9.400
  199   2HG   LYS  28          3HG       LYS  28  -3.570  -6.159  -7.968
  200   1HD   LYS  28          2HD       LYS  28  -3.876  -4.671  -9.855
  201   2HD   LYS  28          3HD       LYS  28  -2.212  -4.518  -9.339
  202   1HE   LYS  28          2HE       LYS  28  -2.188  -4.529 -11.696
  203   2HE   LYS  28          3HE       LYS  28  -1.520  -6.073 -11.186
  204   1HZ   LYS  28          1HZ       LYS  28  -4.326  -5.643 -12.053
  205   2HZ   LYS  28          2HZ       LYS  28  -3.142  -6.308 -12.986
  206   3HZ   LYS  28          3HZ       LYS  28  -3.677  -7.100 -11.648
  207    H    LYS  29           H        LYS  29   0.871  -6.200  -8.604
  208    HA   LYS  29           HA       LYS  29   2.704  -8.357  -8.075
  209   1HB   LYS  29          2HB       LYS  29   2.453  -6.722 -10.035
  210   2HB   LYS  29          3HB       LYS  29   3.415  -5.581  -9.072
  211   1HG   LYS  29          2HG       LYS  29   5.228  -7.383  -9.061
  212   2HG   LYS  29          3HG       LYS  29   4.162  -8.350 -10.099
  213   1HD   LYS  29          2HD       LYS  29   4.066  -6.085 -11.539
  214   2HD   LYS  29          3HD       LYS  29   5.606  -5.760 -10.724
  215   1HE   LYS  29          2HE       LYS  29   6.506  -7.889 -11.591
  216   2HE   LYS  29          3HE       LYS  29   4.912  -8.299 -12.256
  217   1HZ   LYS  29          1HZ       LYS  29   6.565  -5.996 -13.107
  218   2HZ   LYS  29          2HZ       LYS  29   6.334  -7.379 -13.975
  219   3HZ   LYS  29          3HZ       LYS  29   5.072  -6.359 -13.689
  220    H    PHE  30           H        PHE  30   2.538  -5.000  -6.729
  221    HA   PHE  30           HA       PHE  30   4.774  -5.093  -4.996
  222   1HB   PHE  30          2HB       PHE  30   3.368  -3.111  -5.371
  223   2HB   PHE  30          3HB       PHE  30   2.046  -3.851  -4.475
  224    HD1  PHE  30           1HD      PHE  30   5.061  -1.893  -4.239
  225    HD2  PHE  30           2HD      PHE  30   2.384  -4.377  -1.947
  226    HE1  PHE  30           1HE      PHE  30   6.050  -1.039  -2.132
  227    HE2  PHE  30           2HE      PHE  30   3.403  -3.544   0.141
  228    HZ   PHE  30           HZ       PHE  30   5.294  -1.956   0.049
  229    H    PHE  31           H        PHE  31   1.391  -6.177  -4.201
  230    HA   PHE  31           HA       PHE  31   2.079  -7.080  -1.593
  231   1HB   PHE  31          2HB       PHE  31  -0.228  -7.576  -3.440
  232   2HB   PHE  31          3HB       PHE  31  -0.030  -8.587  -2.024
  233    HD1  PHE  31           1HD      PHE  31  -1.537  -8.027  -0.358
  234    HD2  PHE  31           2HD      PHE  31   0.287  -4.859  -2.634
  235    HE1  PHE  31           1HE      PHE  31  -2.622  -6.352   1.102
  236    HE2  PHE  31           2HE      PHE  31  -0.758  -3.186  -1.136
  237    HZ   PHE  31           HZ       PHE  31  -2.198  -3.936   0.744
  238    H    GLN  32           H        GLN  32   2.435  -8.702  -4.686
  239    HA   GLN  32           HA       GLN  32   3.112 -11.316  -3.531
  240   1HB   GLN  32          2HB       GLN  32   3.436 -10.091  -6.305
  241   2HB   GLN  32          3HB       GLN  32   3.988 -11.717  -5.897
  242   1HG   GLN  32          2HG       GLN  32   1.776 -12.479  -5.429
  243   2HG   GLN  32          3HG       GLN  32   1.117 -10.845  -5.401
  244   1HE2  GLN  32          2HE       GLN  32   0.338  -9.967  -7.296
  245   2HE2  GLN  32          1HE       GLN  32   0.427 -10.868  -8.838
  246    H    MET  33           H        MET  33   4.980  -8.588  -4.952
  247    HA   MET  33           HA       MET  33   7.565  -9.674  -4.500
  248   1HB   MET  33          2HB       MET  33   6.522  -6.859  -4.979
  249   2HB   MET  33          3HB       MET  33   8.239  -7.204  -4.801
  250   1HG   MET  33          2HG       MET  33   8.159  -8.811  -6.667
  251   2HG   MET  33          3HG       MET  33   6.425  -8.571  -6.818
  252   1HE   MET  33          1HE       MET  33   9.659  -7.850  -8.400
  253   2HE   MET  33          2HE       MET  33   9.693  -6.118  -8.795
  254   3HE   MET  33          3HE       MET  33   9.936  -6.641  -7.118
  255    H    VAL  34           H        VAL  34   5.680  -7.464  -2.402
  256    HA   VAL  34           HA       VAL  34   7.668  -7.462  -0.237
  257    HB   VAL  34           HB       VAL  34   5.749  -5.751  -0.859
  258   1HG1  VAL  34          1HG       VAL  34   4.236  -7.303   1.207
  259   2HG1  VAL  34          2HG       VAL  34   3.777  -5.824   0.357
  260   3HG1  VAL  34          3HG       VAL  34   3.913  -7.345  -0.542
  261   1HG2  VAL  34          1HG       VAL  34   7.400  -5.323   0.842
  262   2HG2  VAL  34          2HG       VAL  34   5.814  -4.953   1.529
  263   3HG2  VAL  34          3HG       VAL  34   6.674  -6.466   1.941
  264    H    GLY  35           H        GLY  35   5.570  -9.891  -1.410
  265   1HA   GLY  35          2HA       GLY  35   4.659 -11.796  -0.547
  266   2HA   GLY  35          3HA       GLY  35   5.832 -11.616   0.762
  267    H    LEU  36           H        LEU  36   3.296  -9.254   0.243
  268    HA   LEU  36           HA       LEU  36   2.402  -9.199   2.947
  269   1HB   LEU  36          2HB       LEU  36   1.844  -7.879   0.440
  270   2HB   LEU  36          3HB       LEU  36   0.309  -8.356   1.098
  271    HG   LEU  36           HG       LEU  36   2.357  -6.919   2.810
  272   1HD1  LEU  36          1HD1      LEU  36   0.225  -5.183   1.810
  273   2HD1  LEU  36          2HD1      LEU  36   1.966  -4.906   1.913
  274   3HD1  LEU  36          3HD1      LEU  36   1.299  -5.729   0.512
  275   1HD2  LEU  36          1HD2      LEU  36   0.591  -7.946   4.051
  276   2HD2  LEU  36          2HD2      LEU  36   0.138  -6.242   3.954
  277   3HD2  LEU  36          3HD2      LEU  36  -0.649  -7.388   2.891
  278    H    LYS  37           H        LYS  37   0.746 -10.380   0.200
  279    HA   LYS  37           HA       LYS  37  -1.277 -12.107   1.299
  280   1HB   LYS  37          2HB       LYS  37   0.247 -12.342  -1.328
  281   2HB   LYS  37          3HB       LYS  37  -1.022 -13.472  -0.856
  282   1HG   LYS  37          2HG       LYS  37  -2.590 -11.485  -0.581
  283   2HG   LYS  37          3HG       LYS  37  -1.351 -10.514  -1.385
  284   1HD   LYS  37          2HD       LYS  37  -2.681 -13.014  -2.534
  285   2HD   LYS  37          3HD       LYS  37  -3.152 -11.360  -2.905
  286   1HE   LYS  37          2HE       LYS  37  -0.848 -10.925  -3.801
  287   2HE   LYS  37          3HE       LYS  37  -0.454 -12.630  -3.513
  288   1HZ   LYS  37          1HZ       LYS  37  -2.512 -11.569  -5.370
  289   2HZ   LYS  37          2HZ       LYS  37  -1.133 -12.350  -5.788
  290   3HZ   LYS  37          3HZ       LYS  37  -2.333 -13.176  -5.025
  291    H    LYS  38           H        LYS  38   2.165 -12.740   1.396
  292    HA   LYS  38           HA       LYS  38   1.778 -15.656   1.833
  293   1HB   LYS  38          2HB       LYS  38   3.878 -15.920   1.118
  294   2HB   LYS  38          3HB       LYS  38   3.805 -14.256   0.580
  295   1HG   LYS  38          2HG       LYS  38   4.691 -13.713   3.015
  296   2HG   LYS  38          3HG       LYS  38   5.125 -15.406   3.065
  297   1HD   LYS  38          2HD       LYS  38   6.843 -15.147   1.507
  298   2HD   LYS  38          3HD       LYS  38   6.042 -13.802   0.683
  299   1HE   LYS  38          2HE       LYS  38   6.378 -12.405   2.770
  300   2HE   LYS  38          3HE       LYS  38   7.383 -13.702   3.427
  301   1HZ   LYS  38          1HZ       LYS  38   7.966 -12.328   0.867
  302   2HZ   LYS  38          2HZ       LYS  38   8.538 -11.796   2.291
  303   3HZ   LYS  38          3HZ       LYS  38   8.995 -13.290   1.736
  304    H    LYS  39           H        LYS  39   1.978 -12.728   3.633
  305    HA   LYS  39           HA       LYS  39   2.815 -14.020   6.134
  306   1HB   LYS  39          2HB       LYS  39   3.151 -11.433   4.960
  307   2HB   LYS  39          3HB       LYS  39   2.000 -11.193   6.263
  308   1HG   LYS  39          2HG       LYS  39   4.033 -10.954   7.366
  309   2HG   LYS  39          3HG       LYS  39   3.658 -12.644   7.683
  310   1HD   LYS  39          2HD       LYS  39   5.137 -13.199   5.620
  311   2HD   LYS  39          3HD       LYS  39   5.677 -11.509   5.729
  312   1HE   LYS  39          2HE       LYS  39   5.852 -12.210   8.342
  313   2HE   LYS  39          3HE       LYS  39   6.042 -13.816   7.638
  314   1HZ   LYS  39          1HZ       LYS  39   7.778 -11.426   7.180
  315   2HZ   LYS  39          2HZ       LYS  39   8.180 -12.757   7.992
  316   3HZ   LYS  39          3HZ       LYS  39   7.959 -12.842   6.361
  317    H    SER  40           H        SER  40   1.460 -13.001   8.185
  318    HA   SER  40           HA       SER  40  -1.000 -14.449   7.928
  319   1HB   SER  40          2HB       SER  40   0.464 -14.422   9.955
  320   2HB   SER  40          3HB       SER  40  -0.076 -12.759  10.268
  321    HG   SER  40           HG       SER  40  -1.257 -14.525  11.331
  322    H    ALA  41           H        ALA  41  -3.075 -13.635   8.828
  323    HA   ALA  41           HA       ALA  41  -4.151 -11.294   7.510
  324   1HB   ALA  41          1HB       ALA  41  -5.089 -12.835   9.972
  325   2HB   ALA  41          2HB       ALA  41  -6.059 -11.671   9.049
  326   3HB   ALA  41          3HB       ALA  41  -5.544 -13.192   8.284
  327    H    ASP  42           H        ASP  42  -2.989 -11.929  10.824
  328    HA   ASP  42           HA       ASP  42  -3.456  -9.317  11.859
  329   1HB   ASP  42          2HB       ASP  42  -2.622 -11.811  12.857
  330   2HB   ASP  42          3HB       ASP  42  -1.208 -10.791  13.092
  331    H    ASP  43           H        ASP  43  -0.743 -10.762  10.183
  332    HA   ASP  43           HA       ASP  43   1.185  -8.606  10.467
  333   1HB   ASP  43          2HB       ASP  43   0.844 -10.791   8.398
  334   2HB   ASP  43          3HB       ASP  43   2.151  -9.675   8.356
  335    H    VAL  44           H        VAL  44  -1.059  -9.513   7.709
  336    HA   VAL  44           HA       VAL  44  -0.660  -7.264   6.141
  337    HB   VAL  44           HB       VAL  44  -3.022  -9.134   6.518
  338   1HG1  VAL  44          1HG       VAL  44  -2.424  -7.063   4.401
  339   2HG1  VAL  44          2HG       VAL  44  -3.476  -8.469   4.103
  340   3HG1  VAL  44          3HG       VAL  44  -3.899  -7.307   5.366
  341   1HG2  VAL  44          1HG       VAL  44  -0.624 -10.005   5.644
  342   2HG2  VAL  44          2HG       VAL  44  -2.144 -10.539   4.920
  343   3HG2  VAL  44          3HG       VAL  44  -1.188  -9.295   4.132
  344    H    LYS  45           H        LYS  45  -2.926  -7.683   8.913
  345    HA   LYS  45           HA       LYS  45  -4.096  -5.061   8.850
  346   1HB   LYS  45          2HB       LYS  45  -5.236  -6.416  10.299
  347   2HB   LYS  45          3HB       LYS  45  -3.816  -7.339  10.724
  348   1HG   LYS  45          2HG       LYS  45  -4.440  -6.370  12.706
  349   2HG   LYS  45          3HG       LYS  45  -3.040  -5.487  12.172
  350   1HD   LYS  45          2HD       LYS  45  -4.386  -3.813  12.987
  351   2HD   LYS  45          3HD       LYS  45  -4.731  -3.709  11.251
  352   1HE   LYS  45          2HE       LYS  45  -6.807  -4.996  11.571
  353   2HE   LYS  45          3HE       LYS  45  -6.385  -5.313  13.259
  354   1HZ   LYS  45          1HZ       LYS  45  -6.974  -2.639  12.134
  355   2HZ   LYS  45          2HZ       LYS  45  -7.970  -3.515  13.103
  356   3HZ   LYS  45          3HZ       LYS  45  -6.553  -2.939  13.695
  357    H    LYS  46           H        LYS  46  -1.169  -6.145  10.679
  358    HA   LYS  46           HA       LYS  46  -0.579  -3.421  11.479
  359   1HB   LYS  46          2HB       LYS  46   0.978  -6.015  11.575
  360   2HB   LYS  46          3HB       LYS  46   1.801  -4.473  11.756
  361   1HG   LYS  46          2HG       LYS  46   1.442  -4.980  13.931
  362   2HG   LYS  46          3HG       LYS  46   0.187  -3.821  13.563
  363   1HD   LYS  46          2HD       LYS  46  -1.214  -5.257  14.562
  364   2HD   LYS  46          3HD       LYS  46  -1.119  -6.232  13.092
  365   1HE   LYS  46          2HE       LYS  46   0.583  -7.645  14.010
  366   2HE   LYS  46          3HE       LYS  46   0.867  -6.540  15.368
  367   1HZ   LYS  46          1HZ       LYS  46  -1.646  -8.063  14.922
  368   2HZ   LYS  46          2HZ       LYS  46  -0.496  -8.459  16.011
  369   3HZ   LYS  46          3HZ       LYS  46  -1.359  -7.065  16.183
  370    H    VAL  47           H        VAL  47   0.181  -5.143   8.554
  371    HA   VAL  47           HA       VAL  47   1.963  -3.202   7.403
  372    HB   VAL  47           HB       VAL  47   0.121  -5.180   6.055
  373   1HG1  VAL  47          1HG       VAL  47   2.241  -3.326   4.949
  374   2HG1  VAL  47          2HG       VAL  47   1.747  -4.796   4.111
  375   3HG1  VAL  47          3HG       VAL  47   0.551  -3.534   4.389
  376   1HG2  VAL  47          1HG       VAL  47   2.050  -6.174   7.393
  377   2HG2  VAL  47          2HG       VAL  47   2.070  -6.503   5.661
  378   3HG2  VAL  47          3HG       VAL  47   3.141  -5.255   6.366
  379    H    PHE  48           H        PHE  48  -1.653  -3.565   6.718
  380    HA   PHE  48           HA       PHE  48  -1.959  -1.150   5.360
  381   1HB   PHE  48          2HB       PHE  48  -3.708  -2.758   5.399
  382   2HB   PHE  48          3HB       PHE  48  -3.725  -2.830   7.154
  383    HD1  PHE  48           1HD      PHE  48  -4.268  -0.355   4.360
  384    HD2  PHE  48           2HD      PHE  48  -5.307  -1.596   8.360
  385    HE1  PHE  48           1HE      PHE  48  -6.008   1.420   4.479
  386    HE2  PHE  48           2HE      PHE  48  -7.068   0.156   8.441
  387    HZ   PHE  48           HZ       PHE  48  -7.408   1.652   6.486
  388    H    HIS  49           H        HIS  49  -2.008  -1.758   8.835
  389    HA   HIS  49           HA       HIS  49  -2.759   0.855   9.711
  390   1HB   HIS  49          2HB       HIS  49  -2.905  -1.478  10.811
  391   2HB   HIS  49          3HB       HIS  49  -1.229  -1.228  11.305
  392    HD1  HIS  49           HD1      HIS  49  -1.779   1.879  12.106
  393    HD2  HIS  49           HD2      HIS  49  -3.988  -1.526  13.142
  394    HE1  HIS  49           HE1      HIS  49  -3.115   2.445  14.311
  395    H    MET  50           H        MET  50   0.187  -0.087   8.322
  396    HA   MET  50           HA       MET  50   1.836   1.885   9.782
  397   1HB   MET  50          2HB       MET  50   2.421  -0.580   8.718
  398   2HB   MET  50          3HB       MET  50   2.892   0.448   7.392
  399   1HG   MET  50          2HG       MET  50   3.900   0.323  10.240
  400   2HG   MET  50          3HG       MET  50   4.824   0.109   8.764
  401   1HE   MET  50          1HE       MET  50   5.517   1.858  11.504
  402   2HE   MET  50          2HE       MET  50   5.121   3.586  11.386
  403   3HE   MET  50          3HE       MET  50   3.817   2.395  11.604
  404    H    LEU  51           H        LEU  51   0.295   1.438   6.540
  405    HA   LEU  51           HA       LEU  51   1.486   3.841   5.359
  406   1HB   LEU  51          2HB       LEU  51  -1.122   2.464   4.734
  407   2HB   LEU  51          3HB       LEU  51  -0.311   3.651   3.738
  408    HG   LEU  51           HG       LEU  51   0.517   1.994   2.570
  409   1HD1  LEU  51          1HD1      LEU  51   2.106   0.787   4.840
  410   2HD1  LEU  51          2HD1      LEU  51   2.495   0.973   3.117
  411   3HD1  LEU  51          3HD1      LEU  51   2.545   2.364   4.160
  412   1HD2  LEU  51          1HD2      LEU  51  -1.261   0.543   3.438
  413   2HD2  LEU  51          2HD2      LEU  51   0.219  -0.370   3.111
  414   3HD2  LEU  51          3HD2      LEU  51  -0.199   0.060   4.778
  415    H    ASP  52           H        ASP  52  -1.360   3.152   7.295
  416    HA   ASP  52           HA       ASP  52  -2.647   5.657   7.325
  417   1HB   ASP  52          2HB       ASP  52  -3.463   3.532   8.335
  418   2HB   ASP  52          3HB       ASP  52  -2.253   3.681   9.613
  419    H    LYS  53           H        LYS  53  -1.756   7.589   7.627
  420    HA   LYS  53           HA       LYS  53   0.564   7.880   9.506
  421   1HB   LYS  53          2HB       LYS  53   0.271   8.573   6.757
  422   2HB   LYS  53          3HB       LYS  53   0.282  10.080   7.663
  423   1HG   LYS  53          2HG       LYS  53   2.515   9.641   7.102
  424   2HG   LYS  53          3HG       LYS  53   2.407   9.266   8.812
  425   1HD   LYS  53          2HD       LYS  53   1.927   6.895   7.048
  426   2HD   LYS  53          3HD       LYS  53   3.466   7.683   6.754
  427   1HE   LYS  53          2HE       LYS  53   4.234   6.362   8.383
  428   2HE   LYS  53          3HE       LYS  53   3.613   7.633   9.440
  429   1HZ   LYS  53          1HZ       LYS  53   2.348   5.048   8.736
  430   2HZ   LYS  53          2HZ       LYS  53   2.810   5.540  10.225
  431   3HZ   LYS  53          3HZ       LYS  53   1.476   6.177   9.478
  432    H    ASP  54           H        ASP  54  -2.526   8.195   9.856
  433    HA   ASP  54           HA       ASP  54  -2.151  10.501  11.736
  434   1HB   ASP  54          2HB       ASP  54  -4.168  11.473  11.350
  435   2HB   ASP  54          3HB       ASP  54  -3.659  11.066   9.726
  436    H    LYS  55           H        LYS  55  -3.738   7.411  11.108
  437    HA   LYS  55           HA       LYS  55  -3.606   5.631  12.449
  438   1HB   LYS  55          2HB       LYS  55  -2.487   7.087  14.309
  439   2HB   LYS  55          3HB       LYS  55  -4.115   7.186  14.987
  440   1HG   LYS  55          2HG       LYS  55  -3.754   5.188  15.943
  441   2HG   LYS  55          3HG       LYS  55  -3.738   4.464  14.333
  442   1HD   LYS  55          2HD       LYS  55  -1.277   5.567  15.761
  443   2HD   LYS  55          3HD       LYS  55  -1.761   3.865  15.729
  444   1HE   LYS  55          2HE       LYS  55  -1.674   3.947  13.200
  445   2HE   LYS  55          3HE       LYS  55  -1.016   5.580  13.315
  446   1HZ   LYS  55          1HZ       LYS  55   0.236   3.169  14.504
  447   2HZ   LYS  55          2HZ       LYS  55   0.712   3.883  13.100
  448   3HZ   LYS  55          3HZ       LYS  55   0.861   4.687  14.532
  449    H    SER  56           H        SER  56  -5.837   7.330  11.227
  450    HA   SER  56           HA       SER  56  -8.212   6.854  12.741
  451   1HB   SER  56          2HB       SER  56  -9.411   7.576  10.812
  452   2HB   SER  56          3HB       SER  56  -7.958   8.561  10.945
  453    HG   SER  56           HG       SER  56  -8.255   7.889   8.808
  454    H    GLY  57           H        GLY  57  -6.442   4.489  10.857
  455   1HA   GLY  57          2HA       GLY  57  -7.042   2.258  10.490
  456   2HA   GLY  57          3HA       GLY  57  -8.684   2.567  11.058
  457    H    PHE  58           H        PHE  58  -7.731   4.887   8.776
  458    HA   PHE  58           HA       PHE  58  -8.743   3.408   6.351
  459   1HB   PHE  58          2HB       PHE  58  -9.411   6.282   7.050
  460   2HB   PHE  58          3HB       PHE  58 -10.077   5.298   5.760
  461    HD1  PHE  58           1HD      PHE  58 -10.661   6.572   9.010
  462    HD2  PHE  58           2HD      PHE  58 -11.334   3.050   6.616
  463    HE1  PHE  58           1HE      PHE  58 -12.467   5.877  10.548
  464    HE2  PHE  58           2HE      PHE  58 -13.160   2.365   8.156
  465    HZ   PHE  58           HZ       PHE  58 -13.722   3.774  10.126
  466    H    ILE  59           H        ILE  59  -7.909   4.134   4.387
  467    HA   ILE  59           HA       ILE  59  -5.841   6.310   4.515
  468    HB   ILE  59           HB       ILE  59  -5.890   3.887   2.753
  469   1HG1  ILE  59          2HG       ILE  59  -3.708   4.773   4.682
  470   2HG1  ILE  59          3HG       ILE  59  -4.980   3.631   5.118
  471   1HG2  ILE  59          1HG       ILE  59  -3.990   6.269   2.642
  472   2HG2  ILE  59          2HG       ILE  59  -3.824   4.771   1.694
  473   3HG2  ILE  59          3HG       ILE  59  -5.196   5.829   1.420
  474   1HD1  ILE  59          1HD1      ILE  59  -2.798   3.242   3.075
  475   2HD1  ILE  59          2HD1      ILE  59  -3.241   2.241   4.486
  476   3HD1  ILE  59          3HD1      ILE  59  -4.274   2.255   3.054
  477    H    GLU  60           H        GLU  60  -6.287   7.980   3.520
  478    HA   GLU  60           HA       GLU  60  -8.530   8.370   1.646
  479   1HB   GLU  60          2HB       GLU  60  -7.660  10.559   3.478
  480   2HB   GLU  60          3HB       GLU  60  -9.262  10.048   3.009
  481   1HG   GLU  60          2HG       GLU  60  -9.135   9.819   5.352
  482   2HG   GLU  60          3HG       GLU  60  -9.086   8.177   4.726
  483    H    GLU  61           H        GLU  61  -8.253  10.439   0.332
  484    HA   GLU  61           HA       GLU  61  -5.968  10.070  -1.146
  485   1HB   GLU  61          2HB       GLU  61  -6.654  11.723  -2.629
  486   2HB   GLU  61          3HB       GLU  61  -8.036  10.810  -2.071
  487   1HG   GLU  61          2HG       GLU  61  -9.100  12.687  -1.530
  488   2HG   GLU  61          3HG       GLU  61  -7.865  13.090  -0.344
  489    H    ASP  62           H        ASP  62  -6.204  12.446   1.447
  490    HA   ASP  62           HA       ASP  62  -3.891  13.976   0.990
  491   1HB   ASP  62          2HB       ASP  62  -5.071  12.882   3.582
  492   2HB   ASP  62          3HB       ASP  62  -3.830  14.131   3.500
  493    H    GLU  63           H        GLU  63  -4.089  10.914   2.880
  494    HA   GLU  63           HA       GLU  63  -1.167  10.695   3.203
  495   1HB   GLU  63          2HB       GLU  63  -3.586   9.043   3.965
  496   2HB   GLU  63          3HB       GLU  63  -1.965   8.331   4.048
  497   1HG   GLU  63          2HG       GLU  63  -1.189   9.865   5.633
  498   2HG   GLU  63          3HG       GLU  63  -2.418  11.055   5.263
  499    H    LEU  64           H        LEU  64  -3.610   9.590   0.981
  500    HA   LEU  64           HA       LEU  64  -2.354   7.430  -0.181
  501   1HB   LEU  64          2HB       LEU  64  -4.704   8.399  -0.384
  502   2HB   LEU  64          3HB       LEU  64  -4.066   9.325  -1.747
  503    HG   LEU  64           HG       LEU  64  -3.359   6.450  -1.830
  504   1HD1  LEU  64          1HD1      LEU  64  -6.307   7.288  -1.831
  505   2HD1  LEU  64          2HD1      LEU  64  -5.721   5.716  -2.404
  506   3HD1  LEU  64          3HD1      LEU  64  -5.531   6.159  -0.711
  507   1HD2  LEU  64          1HD2      LEU  64  -3.147   8.008  -3.708
  508   2HD2  LEU  64          2HD2      LEU  64  -4.247   6.671  -4.097
  509   3HD2  LEU  64          3HD2      LEU  64  -4.918   8.256  -3.715
  510    H    GLY  65           H        GLY  65  -1.464  10.770  -0.605
  511   1HA   GLY  65          2HA       GLY  65  -0.109  10.552  -3.138
  512   2HA   GLY  65          3HA       GLY  65   0.142  11.803  -1.921
  513    H    PHE  66           H        PHE  66   0.879   9.291  -0.043
  514    HA   PHE  66           HA       PHE  66   3.449   8.439  -1.185
  515   1HB   PHE  66          2HB       PHE  66   4.855   9.470   0.551
  516   2HB   PHE  66          3HB       PHE  66   4.137  10.610  -0.546
  517    HD1  PHE  66           1HD      PHE  66   2.347  12.174   0.179
  518    HD2  PHE  66           2HD      PHE  66   4.324   9.543   2.955
  519    HE1  PHE  66           1HE      PHE  66   1.512  13.539   2.070
  520    HE2  PHE  66           2HE      PHE  66   3.531  10.938   4.846
  521    HZ   PHE  66           HZ       PHE  66   2.119  12.938   4.406
  522    H    ILE  67           H        ILE  67   1.377   6.787  -0.470
  523    HA   ILE  67           HA       ILE  67   1.168   5.834   2.201
  524    HB   ILE  67           HB       ILE  67   0.006   4.012   1.366
  525   1HG1  ILE  67          2HG       ILE  67  -0.108   3.843  -1.325
  526   2HG1  ILE  67          3HG       ILE  67   1.558   4.421  -1.184
  527   1HG2  ILE  67          1HG       ILE  67  -0.536   6.241  -0.559
  528   2HG2  ILE  67          2HG       ILE  67  -1.673   5.023   0.047
  529   3HG2  ILE  67          3HG       ILE  67  -1.018   6.242   1.161
  530   1HD1  ILE  67          1HD1      ILE  67   0.288   1.952   0.048
  531   2HD1  ILE  67          2HD1      ILE  67   1.630   2.035  -1.128
  532   3HD1  ILE  67          3HD1      ILE  67   1.858   2.565   0.571
  533    H    LEU  68           H        LEU  68   3.409   5.000  -0.284
  534    HA   LEU  68           HA       LEU  68   4.683   2.794   0.897
  535   1HB   LEU  68          2HB       LEU  68   5.629   4.972  -0.981
  536   2HB   LEU  68          3HB       LEU  68   6.724   3.705  -0.435
  537    HG   LEU  68           HG       LEU  68   4.235   2.506  -1.319
  538   1HD1  LEU  68          1HD1      LEU  68   5.563   4.346  -3.332
  539   2HD1  LEU  68          2HD1      LEU  68   4.304   3.151  -3.687
  540   3HD1  LEU  68          3HD1      LEU  68   3.921   4.483  -2.630
  541   1HD2  LEU  68          1HD2      LEU  68   6.551   1.457  -1.127
  542   2HD2  LEU  68          2HD2      LEU  68   5.885   1.229  -2.739
  543   3HD2  LEU  68          3HD2      LEU  68   7.090   2.486  -2.470
  544    H    LYS  69           H        LYS  69   4.994   6.138   1.927
  545    HA   LYS  69           HA       LYS  69   7.528   5.752   3.279
  546   1HB   LYS  69          2HB       LYS  69   5.838   7.912   2.689
  547   2HB   LYS  69          3HB       LYS  69   5.773   7.824   4.444
  548   1HG   LYS  69          2HG       LYS  69   8.284   8.005   2.707
  549   2HG   LYS  69          3HG       LYS  69   7.487   9.356   3.509
  550   1HD   LYS  69          2HD       LYS  69   7.984   8.309   5.732
  551   2HD   LYS  69          3HD       LYS  69   8.807   6.983   4.899
  552   1HE   LYS  69          2HE       LYS  69  10.477   8.547   5.657
  553   2HE   LYS  69          3HE       LYS  69  10.410   8.569   3.891
  554   1HZ   LYS  69          1HZ       LYS  69   9.152  10.568   5.680
  555   2HZ   LYS  69          2HZ       LYS  69  10.516  10.806   4.793
  556   3HZ   LYS  69          3HZ       LYS  69   9.072  10.589   4.040
  557    H    GLY  70           H        GLY  70   4.411   4.547   3.972
  558   1HA   GLY  70          2HA       GLY  70   5.128   3.872   6.783
  559   2HA   GLY  70          3HA       GLY  70   3.632   3.471   5.938
  560    H    PHE  71           H        PHE  71   5.502   2.437   3.577
  561    HA   PHE  71           HA       PHE  71   5.940  -0.264   4.708
  562   1HB   PHE  71          2HB       PHE  71   6.513   0.832   1.932
  563   2HB   PHE  71          3HB       PHE  71   6.760  -0.824   2.450
  564    HD1  PHE  71           1HD      PHE  71   4.331  -1.664   3.824
  565    HD2  PHE  71           2HD      PHE  71   4.819   0.816   0.336
  566    HE1  PHE  71           1HE      PHE  71   2.072  -2.308   3.002
  567    HE2  PHE  71           2HE      PHE  71   2.579   0.164  -0.442
  568    HZ   PHE  71           HZ       PHE  71   1.186  -1.393   0.897
  569    H    SER  72           H        SER  72   7.967   2.428   3.233
  570    HA   SER  72           HA       SER  72  10.249   1.882   4.912
  571   1HB   SER  72          2HB       SER  72  10.313  -0.160   3.616
  572   2HB   SER  72          3HB       SER  72  10.024   0.722   2.120
  573    HG   SER  72           HG       SER  72  12.179   0.295   2.172
  574    HA   PRO  73           HA       PRO  73  11.323   5.813   2.973
  575   1HB   PRO  73          2HB       PRO  73  14.100   5.802   3.022
  576   2HB   PRO  73          3HB       PRO  73  13.044   6.136   4.427
  577   1HG   PRO  73          2HG       PRO  73  14.311   3.494   3.635
  578   2HG   PRO  73          3HG       PRO  73  14.321   4.291   5.245
  579   1HD   PRO  73          2HD       PRO  73  12.548   2.353   4.713
  580   2HD   PRO  73          3HD       PRO  73  12.016   3.810   5.587
  581    H    ASP  74           H        ASP  74  12.514   6.763   1.256
  582    HA   ASP  74           HA       ASP  74  12.526   7.245  -0.868
  583   1HB   ASP  74          2HB       ASP  74  14.674   5.853  -0.800
  584   2HB   ASP  74          3HB       ASP  74  13.763   4.648  -1.718
  585    H    ALA  75           H        ALA  75  10.349   5.781   0.304
  586    HA   ALA  75           HA       ALA  75   8.466   4.721  -1.392
  587   1HB   ALA  75          1HB       ALA  75   8.474   6.962   0.689
  588   2HB   ALA  75          2HB       ALA  75   6.985   6.291   0.048
  589   3HB   ALA  75          3HB       ALA  75   8.134   5.238   0.933
  590    H    ARG  76           H        ARG  76   9.433   8.074  -1.155
  591    HA   ARG  76           HA       ARG  76   9.138   9.989  -2.298
  592   1HB   ARG  76          2HB       ARG  76   8.459   8.695  -4.903
  593   2HB   ARG  76          3HB       ARG  76   9.569  10.015  -4.531
  594   1HG   ARG  76          2HG       ARG  76  11.016   8.108  -3.398
  595   2HG   ARG  76          3HG       ARG  76   9.978   7.030  -4.333
  596   1HD   ARG  76          2HD       ARG  76  11.657   7.221  -5.808
  597   2HD   ARG  76          3HD       ARG  76  10.751   8.652  -6.343
  598    HE   ARG  76           HE       ARG  76  12.328   9.709  -4.409
  599   1HH1  ARG  76          1HH2      ARG  76  13.349   7.549  -6.926
  600   2HH1  ARG  76          2HH2      ARG  76  15.040   7.821  -6.611
  601   1HH2  ARG  76          1HH1      ARG  76  14.447   9.432  -3.817
  602   2HH2  ARG  76          2HH1      ARG  76  15.624   9.323  -5.071
  603    H    ASP  77           H        ASP  77   7.683  11.296  -3.791
  604    HA   ASP  77           HA       ASP  77   4.891  11.034  -2.940
  605   1HB   ASP  77          2HB       ASP  77   6.331  13.110  -4.641
  606   2HB   ASP  77          3HB       ASP  77   4.658  13.209  -4.077
  607    H    LEU  78           H        LEU  78   3.465   9.961  -4.066
  608    HA   LEU  78           HA       LEU  78   4.032   8.699  -6.627
  609   1HB   LEU  78          2HB       LEU  78   1.324   8.914  -5.260
  610   2HB   LEU  78          3HB       LEU  78   1.896   7.661  -6.349
  611    HG   LEU  78           HG       LEU  78   2.766   8.157  -3.480
  612   1HD1  LEU  78          1HD1      LEU  78   1.494   5.652  -4.512
  613   2HD1  LEU  78          2HD1      LEU  78   1.768   6.180  -2.839
  614   3HD1  LEU  78          3HD1      LEU  78   0.579   7.018  -3.852
  615   1HD2  LEU  78          1HD2      LEU  78   4.711   7.365  -4.945
  616   2HD2  LEU  78          2HD2      LEU  78   4.310   6.397  -3.558
  617   3HD2  LEU  78          3HD2      LEU  78   3.785   5.873  -5.189
  618    H    SER  79           H        SER  79   3.017   9.089  -8.717
  619    HA   SER  79           HA       SER  79   2.483  11.823  -9.361
  620   1HB   SER  79          2HB       SER  79   1.869   9.198 -10.745
  621   2HB   SER  79          3HB       SER  79   1.205  10.701 -11.361
  622    HG   SER  79           HG       SER  79   3.035  10.218 -12.411
  623    H    ALA  80           H        ALA  80   0.583  12.963  -9.755
  624    HA   ALA  80           HA       ALA  80  -1.748  12.484  -8.267
  625   1HB   ALA  80          1HB       ALA  80  -1.437  13.998 -10.902
  626   2HB   ALA  80          2HB       ALA  80  -2.786  14.168  -9.754
  627   3HB   ALA  80          3HB       ALA  80  -1.150  14.654  -9.272
  628    H    LYS  81           H        LYS  81  -0.913  11.328 -11.516
  629    HA   LYS  81           HA       LYS  81  -3.491  10.129 -12.120
  630   1HB   LYS  81          2HB       LYS  81  -0.955   8.997 -13.270
  631   2HB   LYS  81          3HB       LYS  81  -2.527   9.179 -14.004
  632   1HG   LYS  81          2HG       LYS  81  -0.377  11.282 -13.595
  633   2HG   LYS  81          3HG       LYS  81  -0.957  10.595 -15.102
  634   1HD   LYS  81          2HD       LYS  81  -3.274  11.606 -14.566
  635   2HD   LYS  81          3HD       LYS  81  -2.485  12.481 -13.243
  636   1HE   LYS  81          2HE       LYS  81  -0.827  13.332 -15.049
  637   2HE   LYS  81          3HE       LYS  81  -2.008  12.739 -16.225
  638   1HZ   LYS  81          1HZ       LYS  81  -2.513  14.756 -14.114
  639   2HZ   LYS  81          2HZ       LYS  81  -2.408  15.054 -15.724
  640   3HZ   LYS  81          3HZ       LYS  81  -3.665  14.175 -15.133
  641    H    GLU  82           H        GLU  82  -0.551   9.012 -10.460
  642    HA   GLU  82           HA       GLU  82  -1.346   6.274 -10.193
  643   1HB   GLU  82          2HB       GLU  82   1.006   7.560  -9.572
  644   2HB   GLU  82          3HB       GLU  82   0.274   7.496  -7.975
  645   1HG   GLU  82          2HG       GLU  82  -0.271   5.076  -8.367
  646   2HG   GLU  82          3HG       GLU  82   0.602   5.175  -9.901
  647    H    THR  83           H        THR  83  -1.412   9.003  -7.859
  648    HA   THR  83           HA       THR  83  -2.968   8.006  -5.853
  649    HB   THR  83           HB       THR  83  -2.799  10.744  -7.109
  650    HG1  THR  83           1HG      THR  83  -1.671  11.027  -5.092
  651   1HG2  THR  83          1HG       THR  83  -4.191  10.210  -4.461
  652   2HG2  THR  83          2HG       THR  83  -3.787  11.783  -5.155
  653   3HG2  THR  83          3HG       THR  83  -4.994  10.770  -5.950
  654    H    LYS  84           H        LYS  84  -4.298   9.448  -8.842
  655    HA   LYS  84           HA       LYS  84  -7.034   9.003  -8.218
  656   1HB   LYS  84          2HB       LYS  84  -5.876  10.461 -10.024
  657   2HB   LYS  84          3HB       LYS  84  -5.932   9.031 -11.056
  658   1HG   LYS  84          2HG       LYS  84  -8.359   9.007 -10.988
  659   2HG   LYS  84          3HG       LYS  84  -8.382  10.141  -9.622
  660   1HD   LYS  84          2HD       LYS  84  -7.303  11.873 -11.100
  661   2HD   LYS  84          3HD       LYS  84  -7.545  10.781 -12.481
  662   1HE   LYS  84          2HE       LYS  84  -9.949  10.855 -12.201
  663   2HE   LYS  84          3HE       LYS  84  -9.798  11.628 -10.615
  664   1HZ   LYS  84          1HZ       LYS  84  -9.031  12.889 -13.179
  665   2HZ   LYS  84          2HZ       LYS  84 -10.381  13.238 -12.305
  666   3HZ   LYS  84          3HZ       LYS  84  -8.900  13.582 -11.691
  667    H    MET  85           H        MET  85  -4.838   6.883 -10.151
  668    HA   MET  85           HA       MET  85  -6.929   4.895 -10.532
  669   1HB   MET  85          2HB       MET  85  -4.579   5.415 -11.821
  670   2HB   MET  85          3HB       MET  85  -4.064   4.061 -10.806
  671   1HG   MET  85          2HG       MET  85  -5.997   2.731 -11.686
  672   2HG   MET  85          3HG       MET  85  -6.478   4.124 -12.665
  673   1HE   MET  85          1HE       MET  85  -6.537   3.061 -14.969
  674   2HE   MET  85          2HE       MET  85  -5.337   1.887 -15.554
  675   3HE   MET  85          3HE       MET  85  -6.341   1.499 -14.136
  676    H    LEU  86           H        LEU  86  -4.289   5.278  -8.245
  677    HA   LEU  86           HA       LEU  86  -4.310   2.831  -6.858
  678   1HB   LEU  86          2HB       LEU  86  -2.595   4.637  -6.848
  679   2HB   LEU  86          3HB       LEU  86  -3.647   5.641  -5.876
  680    HG   LEU  86           HG       LEU  86  -2.297   3.054  -5.190
  681   1HD1  LEU  86          1HD1      LEU  86  -1.877   5.814  -4.025
  682   2HD1  LEU  86          2HD1      LEU  86  -0.968   4.344  -3.618
  683   3HD1  LEU  86          3HD1      LEU  86  -0.849   5.024  -5.241
  684   1HD2  LEU  86          1HD2      LEU  86  -4.218   2.804  -3.889
  685   2HD2  LEU  86          2HD2      LEU  86  -2.961   3.374  -2.800
  686   3HD2  LEU  86          3HD2      LEU  86  -4.189   4.511  -3.385
  687    H    MET  87           H        MET  87  -6.003   5.949  -5.925
  688    HA   MET  87           HA       MET  87  -7.405   4.678  -3.790
  689   1HB   MET  87          2HB       MET  87  -8.630   6.642  -3.518
  690   2HB   MET  87          3HB       MET  87  -7.054   7.140  -4.107
  691   1HG   MET  87          2HG       MET  87  -8.464   8.522  -5.269
  692   2HG   MET  87          3HG       MET  87  -8.151   7.251  -6.441
  693   1HE   MET  87          1HE       MET  87 -10.141   7.765  -7.979
  694   2HE   MET  87          2HE       MET  87 -11.790   8.124  -7.416
  695   3HE   MET  87          3HE       MET  87 -10.452   9.222  -7.002
  696    H    ALA  88           H        ALA  88  -8.374   5.127  -7.201
  697    HA   ALA  88           HA       ALA  88 -10.998   4.097  -6.964
  698   1HB   ALA  88          1HB       ALA  88  -9.109   4.178  -9.362
  699   2HB   ALA  88          2HB       ALA  88 -10.871   3.960  -9.431
  700   3HB   ALA  88          3HB       ALA  88 -10.191   5.485  -8.835
  701    H    ALA  89           H        ALA  89  -7.951   2.355  -7.858
  702    HA   ALA  89           HA       ALA  89  -9.349  -0.208  -8.055
  703   1HB   ALA  89          1HB       ALA  89  -6.378   0.450  -7.856
  704   2HB   ALA  89          2HB       ALA  89  -7.088  -1.117  -8.316
  705   3HB   ALA  89          3HB       ALA  89  -7.313   0.301  -9.362
  706    H    GLY  90           H        GLY  90  -7.471   1.494  -5.559
  707   1HA   GLY  90          2HA       GLY  90  -6.945  -0.502  -3.694
  708   2HA   GLY  90          3HA       GLY  90  -7.138   1.218  -3.376
  709    H    ASP  91           H        ASP  91  -9.605   1.932  -3.478
  710    HA   ASP  91           HA       ASP  91 -11.035   0.354  -1.450
  711   1HB   ASP  91          2HB       ASP  91 -11.219   2.715  -1.294
  712   2HB   ASP  91          3HB       ASP  91 -11.763   2.859  -2.972
  713    H    LYS  92           H        LYS  92 -11.039  -1.627  -2.759
  714    HA   LYS  92           HA       LYS  92 -12.824  -1.987  -5.016
  715   1HB   LYS  92          2HB       LYS  92 -11.783  -3.771  -2.798
  716   2HB   LYS  92          3HB       LYS  92 -12.997  -4.396  -3.907
  717   1HG   LYS  92          2HG       LYS  92 -10.376  -3.178  -4.836
  718   2HG   LYS  92          3HG       LYS  92 -10.594  -4.900  -4.529
  719   1HD   LYS  92          2HD       LYS  92 -11.307  -5.164  -6.631
  720   2HD   LYS  92          3HD       LYS  92 -12.742  -4.208  -6.247
  721   1HE   LYS  92          2HE       LYS  92 -11.461  -2.122  -6.819
  722   2HE   LYS  92          3HE       LYS  92 -10.069  -3.118  -7.243
  723   1HZ   LYS  92          1HZ       LYS  92 -12.728  -3.246  -8.546
  724   2HZ   LYS  92          2HZ       LYS  92 -11.381  -2.565  -9.198
  725   3HZ   LYS  92          3HZ       LYS  92 -11.443  -4.192  -8.940
  726    H    ASP  93           H        ASP  93 -13.589  -1.049  -1.885
  727    HA   ASP  93           HA       ASP  93 -16.045  -2.587  -1.593
  728   1HB   ASP  93          2HB       ASP  93 -14.075  -1.521   0.088
  729   2HB   ASP  93          3HB       ASP  93 -15.399  -0.411   0.335
  730    H    GLY  94           H        GLY  94 -15.249   0.829  -2.389
  731   1HA   GLY  94          2HA       GLY  94 -16.784   2.197  -3.557
  732   2HA   GLY  94          3HA       GLY  94 -18.146   1.391  -2.788
  733    H    ASP  95           H        ASP  95 -15.542   2.209  -0.667
  734    HA   ASP  95           HA       ASP  95 -17.199   4.386   0.619
  735   1HB   ASP  95          2HB       ASP  95 -14.536   3.245   1.541
  736   2HB   ASP  95          3HB       ASP  95 -15.572   4.351   2.438
  737    H    GLY  96           H        GLY  96 -14.558   4.031  -1.553
  738   1HA   GLY  96          2HA       GLY  96 -12.905   5.328  -2.361
  739   2HA   GLY  96          3HA       GLY  96 -13.633   6.769  -1.617
  740    H    LYS  97           H        LYS  97 -12.953   4.251   0.631
  741    HA   LYS  97           HA       LYS  97 -10.162   5.199   1.149
  742   1HB   LYS  97          2HB       LYS  97 -12.294   4.590   3.227
  743   2HB   LYS  97          3HB       LYS  97 -10.573   4.715   3.581
  744   1HG   LYS  97          2HG       LYS  97 -10.690   6.923   3.771
  745   2HG   LYS  97          3HG       LYS  97 -11.235   7.080   2.110
  746   1HD   LYS  97          2HD       LYS  97 -12.848   8.147   3.484
  747   2HD   LYS  97          3HD       LYS  97 -13.593   6.651   2.898
  748   1HE   LYS  97          2HE       LYS  97 -12.981   5.537   5.070
  749   2HE   LYS  97          3HE       LYS  97 -12.277   7.056   5.636
  750   1HZ   LYS  97          1HZ       LYS  97 -15.118   6.661   4.901
  751   2HZ   LYS  97          2HZ       LYS  97 -14.539   6.743   6.439
  752   3HZ   LYS  97          3HZ       LYS  97 -14.468   8.064   5.460
  753    H    ILE  98           H        ILE  98  -8.710   3.733   1.653
  754    HA   ILE  98           HA       ILE  98  -9.236   0.898   0.949
  755    HB   ILE  98           HB       ILE  98  -6.727   2.454   1.592
  756   1HG1  ILE  98          2HG       ILE  98  -7.548   0.884  -0.861
  757   2HG1  ILE  98          3HG       ILE  98  -7.728   2.630  -0.682
  758   1HG2  ILE  98          1HG       ILE  98  -6.713  -0.535   1.025
  759   2HG2  ILE  98          2HG       ILE  98  -5.314   0.503   1.346
  760   3HG2  ILE  98          3HG       ILE  98  -6.430   0.143   2.634
  761   1HD1  ILE  98          1HD1      ILE  98  -5.131   1.065  -0.870
  762   2HD1  ILE  98          2HD1      ILE  98  -5.766   2.283  -1.981
  763   3HD1  ILE  98          3HD1      ILE  98  -5.207   2.779  -0.375
  764    H    GLY  99           H        GLY  99  -9.741  -0.487   2.328
  765   1HA   GLY  99          2HA       GLY  99  -8.791  -0.338   5.199
  766   2HA   GLY  99          3HA       GLY  99 -10.262  -1.186   4.702
  767    H    VAL 100           H        VAL 100  -7.959  -2.240   6.121
  768    HA   VAL 100           HA       VAL 100  -6.136  -3.741   4.713
  769    HB   VAL 100           HB       VAL 100  -6.018  -3.574   7.073
  770   1HG1  VAL 100          1HG       VAL 100  -8.406  -5.416   7.433
  771   2HG1  VAL 100          2HG       VAL 100  -7.402  -4.682   8.685
  772   3HG1  VAL 100          3HG       VAL 100  -8.438  -3.655   7.695
  773   1HG2  VAL 100          1HG       VAL 100  -4.864  -5.466   6.185
  774   2HG2  VAL 100          2HG       VAL 100  -5.599  -5.956   7.727
  775   3HG2  VAL 100          3HG       VAL 100  -6.324  -6.487   6.236
  776    H    ASP 101           H        ASP 101  -9.402  -4.937   5.518
  777    HA   ASP 101           HA       ASP 101  -9.045  -7.579   4.612
  778   1HB   ASP 101          2HB       ASP 101 -10.942  -6.099   5.962
  779   2HB   ASP 101          3HB       ASP 101 -11.783  -6.381   4.446
  780    H    GLU 102           H        GLU 102 -10.289  -4.744   2.947
  781    HA   GLU 102           HA       GLU 102 -10.785  -5.845   0.332
  782   1HB   GLU 102          2HB       GLU 102  -9.724  -3.073   0.948
  783   2HB   GLU 102          3HB       GLU 102 -10.644  -3.558  -0.457
  784   1HG   GLU 102          2HG       GLU 102 -12.663  -3.394   0.649
  785   2HG   GLU 102          3HG       GLU 102 -11.995  -3.802   2.228
  786    H    PHE 103           H        PHE 103  -7.990  -3.950   1.624
  787    HA   PHE 103           HA       PHE 103  -6.523  -4.110  -0.714
  788   1HB   PHE 103          2HB       PHE 103  -6.256  -2.744   1.547
  789   2HB   PHE 103          3HB       PHE 103  -5.101  -3.988   1.956
  790    HD1  PHE 103           1HD      PHE 103  -4.742  -3.509  -1.598
  791    HD2  PHE 103           2HD      PHE 103  -3.961  -1.613   2.204
  792    HE1  PHE 103           1HE      PHE 103  -3.150  -1.997  -2.679
  793    HE2  PHE 103           2HE      PHE 103  -2.309  -0.131   1.115
  794    HZ   PHE 103           HZ       PHE 103  -1.917  -0.295  -1.346
  795    H    SER 104           H        SER 104  -6.552  -6.335   1.956
  796    HA   SER 104           HA       SER 104  -4.475  -8.169   1.423
  797   1HB   SER 104          2HB       SER 104  -7.292  -8.797   2.407
  798   2HB   SER 104          3HB       SER 104  -5.847  -9.786   2.649
  799    HG   SER 104           HG       SER 104  -6.385  -7.179   3.710
  800    H    THR 105           H        THR 105  -7.621  -7.834  -0.194
  801    HA   THR 105           HA       THR 105  -7.266 -10.422  -1.613
  802    HB   THR 105           HB       THR 105  -9.745 -10.470  -1.560
  803    HG1  THR 105           1HG      THR 105  -9.717  -8.552   0.522
  804   1HG2  THR 105          1HG       THR 105  -8.439 -10.278   1.182
  805   2HG2  THR 105          2HG       THR 105  -9.891 -11.205   0.758
  806   3HG2  THR 105          3HG       THR 105  -8.302 -11.670   0.100
  807    H    LEU 106           H        LEU 106  -8.131  -7.085  -1.987
  808    HA   LEU 106           HA       LEU 106  -8.694  -6.643  -4.668
  809   1HB   LEU 106          2HB       LEU 106  -8.184  -5.040  -2.738
  810   2HB   LEU 106          3HB       LEU 106  -6.490  -5.351  -2.997
  811    HG   LEU 106           HG       LEU 106  -8.343  -3.482  -4.234
  812   1HD1  LEU 106          1HD1      LEU 106  -5.323  -3.677  -4.127
  813   2HD1  LEU 106          2HD1      LEU 106  -6.229  -2.291  -4.766
  814   3HD1  LEU 106          3HD1      LEU 106  -6.414  -2.751  -3.063
  815   1HD2  LEU 106          1HD2      LEU 106  -8.247  -4.948  -6.229
  816   2HD2  LEU 106          2HD2      LEU 106  -7.479  -3.377  -6.483
  817   3HD2  LEU 106          3HD2      LEU 106  -6.473  -4.799  -6.218
  818    H    VAL 107           H        VAL 107  -5.567  -7.537  -3.261
  819    HA   VAL 107           HA       VAL 107  -4.207  -7.710  -5.864
  820    HB   VAL 107           HB       VAL 107  -2.277  -8.279  -4.482
  821   1HG1  VAL 107          1HG       VAL 107  -3.807  -5.864  -3.375
  822   2HG1  VAL 107          2HG       VAL 107  -2.063  -6.053  -3.498
  823   3HG1  VAL 107          3HG       VAL 107  -3.016  -5.912  -4.963
  824   1HG2  VAL 107          1HG       VAL 107  -3.962  -9.276  -2.557
  825   2HG2  VAL 107          2HG       VAL 107  -2.296  -8.787  -2.299
  826   3HG2  VAL 107          3HG       VAL 107  -3.608  -7.690  -1.895
  827    H    ALA 108           H        ALA 108  -6.004  -9.869  -4.037
  828    HA   ALA 108           HA       ALA 108  -4.705 -12.341  -5.052
  829   1HB   ALA 108          1HB       ALA 108  -7.172 -12.005  -3.318
  830   2HB   ALA 108          2HB       ALA 108  -6.270 -13.501  -3.637
  831   3HB   ALA 108          3HB       ALA 108  -5.512 -12.189  -2.699
  832    H    GLU 109           H        GLU 109  -7.661 -10.373  -5.512
  833    HA   GLU 109           HA       GLU 109  -8.662 -11.622  -7.883
  834   1HB   GLU 109          2HB       GLU 109  -8.455  -8.822  -6.800
  835   2HB   GLU 109          3HB       GLU 109  -8.815  -8.984  -8.510
  836   1HG   GLU 109          2HG       GLU 109 -10.428 -10.440  -6.386
  837   2HG   GLU 109          3HG       GLU 109 -10.756  -8.764  -6.833
  838    H    SER 110           H        SER 110  -5.698  -9.636  -7.357
  839    HA   SER 110           HA       SER 110  -3.946  -9.196  -8.743
  840   1HB   SER 110          2HB       SER 110  -2.879 -11.133  -9.652
  841   2HB   SER 110          3HB       SER 110  -3.725 -11.627  -8.172
  842    HG   SER 110           HG       SER 110  -5.549 -12.036  -9.832
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1   3.793  -2.741  11.462
    2   2H    MET   1           H2       MET   1   3.578  -1.317  10.683
    3   3H    MET   1           H3       MET   1   2.484  -1.797  11.802
    4    HA   MET   1           HA       MET   1   3.834  -0.089  12.718
    5   1HB   MET   1          2HB       MET   1   4.703  -2.716  13.986
    6   2HB   MET   1          3HB       MET   1   4.624  -1.112  14.727
    7   1HG   MET   1          2HG       MET   1   2.396  -3.001  14.017
    8   2HG   MET   1          3HG       MET   1   2.749  -2.206  15.544
    9   1HE   MET   1          1HE       MET   1   0.567  -1.178  16.271
   10   2HE   MET   1          2HE       MET   1  -0.678  -0.629  15.132
   11   3HE   MET   1          3HE       MET   1  -0.105  -2.316  15.082
   12    H    SER   2           H        SER   2   6.613  -1.824  13.670
   13    HA   SER   2           HA       SER   2   8.416  -0.448  12.021
   14   1HB   SER   2          2HB       SER   2   8.808  -3.110  13.450
   15   2HB   SER   2          3HB       SER   2  10.070  -1.970  12.935
   16    HG   SER   2           HG       SER   2   9.577  -1.655  15.107
   17    H    MET   3           H        MET   3   7.774  -0.639   9.827
   18    HA   MET   3           HA       MET   3   7.246  -3.101   8.544
   19   1HB   MET   3          2HB       MET   3   6.544  -0.731   7.833
   20   2HB   MET   3          3HB       MET   3   8.122  -0.615   7.054
   21   1HG   MET   3          2HG       MET   3   6.753  -1.489   5.350
   22   2HG   MET   3          3HG       MET   3   7.535  -2.919   5.977
   23   1HE   MET   3          1HE       MET   3   4.391  -0.926   5.321
   24   2HE   MET   3          2HE       MET   3   3.124  -1.633   6.321
   25   3HE   MET   3          3HE       MET   3   4.426  -0.693   7.072
   26    H    THR   4           H        THR   4   9.010  -4.256   9.375
   27    HA   THR   4           HA       THR   4  11.227  -4.776   7.497
   28    HB   THR   4           HB       THR   4  11.553  -3.441  10.202
   29    HG1  THR   4           1HG      THR   4  11.569  -2.496   7.961
   30   1HG2  THR   4          1HG       THR   4  13.650  -5.159   8.816
   31   2HG2  THR   4          2HG       THR   4  14.008  -3.916  10.033
   32   3HG2  THR   4          3HG       THR   4  13.040  -5.324  10.478
   33    H    ASP   5           H        ASP   5  10.217  -5.307  10.918
   34    HA   ASP   5           HA       ASP   5  11.025  -8.034  10.958
   35   1HB   ASP   5          2HB       ASP   5   9.165  -6.596  12.892
   36   2HB   ASP   5          3HB       ASP   5  10.280  -7.919  13.238
   37    H    LEU   6           H        LEU   6   7.874  -6.467  10.670
   38    HA   LEU   6           HA       LEU   6   6.183  -8.769  10.948
   39   1HB   LEU   6          2HB       LEU   6   5.803  -6.040   9.631
   40   2HB   LEU   6          3HB       LEU   6   4.538  -7.234   9.686
   41    HG   LEU   6           HG       LEU   6   4.139  -5.629  11.362
   42   1HD1  LEU   6          1HD1      LEU   6   5.110  -8.128  12.788
   43   2HD1  LEU   6          2HD1      LEU   6   3.985  -6.923  13.435
   44   3HD1  LEU   6          3HD1      LEU   6   3.522  -7.900  12.032
   45   1HD2  LEU   6          1HD2      LEU   6   6.399  -4.774  11.721
   46   2HD2  LEU   6          2HD2      LEU   6   5.538  -5.084  13.233
   47   3HD2  LEU   6          3HD2      LEU   6   6.788  -6.212  12.696
   48    H    LEU   7           H        LEU   7   7.109  -7.043   7.968
   49    HA   LEU   7           HA       LEU   7   6.255  -9.360   6.358
   50   1HB   LEU   7          2HB       LEU   7   7.088  -6.531   5.709
   51   2HB   LEU   7          3HB       LEU   7   6.979  -7.744   4.428
   52    HG   LEU   7           HG       LEU   7   4.673  -6.991   6.263
   53   1HD1  LEU   7          1HD1      LEU   7   5.305  -6.194   3.391
   54   2HD1  LEU   7          2HD1      LEU   7   3.806  -5.818   4.216
   55   3HD1  LEU   7          3HD1      LEU   7   5.316  -5.117   4.797
   56   1HD2  LEU   7          1HD2      LEU   7   4.467  -9.284   5.298
   57   2HD2  LEU   7          2HD2      LEU   7   3.294  -8.189   4.628
   58   3HD2  LEU   7          3HD2      LEU   7   4.743  -8.620   3.672
   59    H    ASN   8           H        ASN   8   9.233  -7.519   6.542
   60    HA   ASN   8           HA       ASN   8  11.333  -8.900   6.631
   61   1HB   ASN   8          2HB       ASN   8  10.133  -9.853   4.031
   62   2HB   ASN   8          3HB       ASN   8  11.876  -9.801   4.226
   63   1HD2  ASN   8          2HD2      ASN   8  10.338 -12.068   3.635
   64   2HD2  ASN   8          1HD2      ASN   8  10.836 -13.209   4.931
   65    H    ALA   9           H        ALA   9  12.636  -7.070   6.510
   66    HA   ALA   9           HA       ALA   9  12.456  -4.897   4.737
   67   1HB   ALA   9          1HB       ALA   9  14.920  -6.154   6.003
   68   2HB   ALA   9          2HB       ALA   9  14.878  -4.562   5.212
   69   3HB   ALA   9          3HB       ALA   9  13.901  -4.843   6.654
   70    H    GLU  10           H        GLU  10  14.139  -7.999   4.174
   71    HA   GLU  10           HA       GLU  10  15.311  -7.478   1.647
   72   1HB   GLU  10          2HB       GLU  10  14.197 -10.046   2.851
   73   2HB   GLU  10          3HB       GLU  10  15.162  -9.974   1.372
   74   1HG   GLU  10          2HG       GLU  10  17.052  -8.986   2.628
   75   2HG   GLU  10          3HG       GLU  10  16.107  -9.067   4.123
   76    H    ASP  11           H        ASP  11  11.951  -8.246   2.430
   77    HA   ASP  11           HA       ASP  11  11.223  -8.701  -0.424
   78   1HB   ASP  11          2HB       ASP  11   9.550  -8.904   2.082
   79   2HB   ASP  11          3HB       ASP  11   9.078  -9.310   0.432
   80    H    ILE  12           H        ILE  12  10.663  -6.400   2.216
   81    HA   ILE  12           HA       ILE  12   9.217  -4.425   0.807
   82    HB   ILE  12           HB       ILE  12  10.949  -4.534   3.209
   83   1HG1  ILE  12          2HG       ILE  12   9.021  -2.834   3.914
   84   2HG1  ILE  12          3HG       ILE  12   8.232  -3.416   2.452
   85   1HG2  ILE  12          1HG       ILE  12  10.527  -1.842   1.919
   86   2HG2  ILE  12          2HG       ILE  12  11.141  -2.178   3.565
   87   3HG2  ILE  12          3HG       ILE  12  12.099  -2.660   2.179
   88   1HD1  ILE  12          1HD1      ILE  12   9.216  -5.050   4.830
   89   2HD1  ILE  12          2HD1      ILE  12   7.532  -4.694   4.394
   90   3HD1  ILE  12          3HD1      ILE  12   8.507  -5.766   3.363
   91    H    LYS  13           H        LYS  13  12.715  -4.997   0.745
   92    HA   LYS  13           HA       LYS  13  13.496  -2.794  -0.735
   93   1HB   LYS  13          2HB       LYS  13  14.633  -5.361  -0.031
   94   2HB   LYS  13          3HB       LYS  13  15.033  -5.052  -1.712
   95   1HG   LYS  13          2HG       LYS  13  15.485  -3.060   0.549
   96   2HG   LYS  13          3HG       LYS  13  16.701  -4.206  -0.038
   97   1HD   LYS  13          2HD       LYS  13  16.612  -3.176  -2.290
   98   2HD   LYS  13          3HD       LYS  13  15.406  -2.005  -1.712
   99   1HE   LYS  13          2HE       LYS  13  17.021  -1.218   0.016
  100   2HE   LYS  13          3HE       LYS  13  18.226  -2.356  -0.602
  101   1HZ   LYS  13          1HZ       LYS  13  17.027  -0.120  -2.136
  102   2HZ   LYS  13          2HZ       LYS  13  18.550  -0.149  -1.523
  103   3HZ   LYS  13          3HZ       LYS  13  18.131  -1.184  -2.730
  104    H    LYS  14           H        LYS  14  12.589  -5.904  -2.288
  105    HA   LYS  14           HA       LYS  14  12.593  -4.608  -4.926
  106   1HB   LYS  14          2HB       LYS  14  11.809  -6.663  -5.851
  107   2HB   LYS  14          3HB       LYS  14  13.230  -6.912  -4.862
  108   1HG   LYS  14          2HG       LYS  14  10.554  -7.436  -3.562
  109   2HG   LYS  14          3HG       LYS  14  11.060  -8.511  -4.867
  110   1HD   LYS  14          2HD       LYS  14  13.267  -8.820  -3.619
  111   2HD   LYS  14          3HD       LYS  14  12.466  -8.014  -2.254
  112   1HE   LYS  14          2HE       LYS  14  10.671  -9.753  -2.324
  113   2HE   LYS  14          3HE       LYS  14  11.468 -10.502  -3.712
  114   1HZ   LYS  14          1HZ       LYS  14  12.116 -10.680  -0.906
  115   2HZ   LYS  14          2HZ       LYS  14  12.413 -11.732  -2.080
  116   3HZ   LYS  14          3HZ       LYS  14  13.441 -10.442  -1.862
  117    H    ALA  15           H        ALA  15  10.121  -5.185  -2.504
  118    HA   ALA  15           HA       ALA  15   7.861  -4.723  -4.179
  119   1HB   ALA  15          1HB       ALA  15   8.117  -4.018  -1.239
  120   2HB   ALA  15          2HB       ALA  15   6.676  -4.497  -2.158
  121   3HB   ALA  15          3HB       ALA  15   7.943  -5.687  -1.849
  122    H    VAL  16           H        VAL  16   9.618  -2.389  -2.016
  123    HA   VAL  16           HA       VAL  16   8.135  -0.103  -2.879
  124    HB   VAL  16           HB       VAL  16  10.951  -0.335  -1.745
  125   1HG1  VAL  16          1HG       VAL  16   9.281   2.187  -2.173
  126   2HG1  VAL  16          2HG       VAL  16  10.758   2.092  -1.187
  127   3HG1  VAL  16          3HG       VAL  16  10.846   1.819  -2.925
  128   1HG2  VAL  16          1HG       VAL  16   9.127  -1.034  -0.220
  129   2HG2  VAL  16          2HG       VAL  16   9.842   0.497   0.298
  130   3HG2  VAL  16          3HG       VAL  16   8.274   0.498  -0.526
  131    H    GLY  17           H        GLY  17  11.000  -1.690  -4.219
  132   1HA   GLY  17          2HA       GLY  17  11.659   0.187  -6.268
  133   2HA   GLY  17          3HA       GLY  17  12.066  -1.531  -6.234
  134    H    ALA  18           H        ALA  18   8.861  -1.852  -6.028
  135    HA   ALA  18           HA       ALA  18   8.393  -1.922  -8.943
  136   1HB   ALA  18          1HB       ALA  18   6.665  -2.953  -6.659
  137   2HB   ALA  18          2HB       ALA  18   6.559  -3.375  -8.378
  138   3HB   ALA  18          3HB       ALA  18   7.971  -3.883  -7.415
  139    H    PHE  19           H        PHE  19   6.922  -0.437  -5.992
  140    HA   PHE  19           HA       PHE  19   4.965   1.109  -7.619
  141   1HB   PHE  19          2HB       PHE  19   5.676   1.152  -4.663
  142   2HB   PHE  19          3HB       PHE  19   4.500   2.208  -5.442
  143    HD1  PHE  19           1HD      PHE  19   4.170   0.171  -3.077
  144    HD2  PHE  19           2HD      PHE  19   3.080   0.190  -7.253
  145    HE1  PHE  19           1HE      PHE  19   2.072  -1.018  -2.537
  146    HE2  PHE  19           2HE      PHE  19   1.013  -1.048  -6.687
  147    HZ   PHE  19           HZ       PHE  19   0.497  -1.607  -4.341
  148    H    SER  20           H        SER  20   8.228   1.817  -6.201
  149    HA   SER  20           HA       SER  20   7.947   4.660  -6.225
  150   1HB   SER  20          2HB       SER  20  10.387   2.867  -6.213
  151   2HB   SER  20          3HB       SER  20  10.499   4.634  -6.247
  152    HG   SER  20           HG       SER  20  10.384   4.388  -4.144
  153    H    ALA  21           H        ALA  21   6.794   4.678  -8.290
  154    HA   ALA  21           HA       ALA  21   8.443   5.697 -10.514
  155   1HB   ALA  21          1HB       ALA  21   6.513   3.340 -10.672
  156   2HB   ALA  21          2HB       ALA  21   7.198   4.164 -12.104
  157   3HB   ALA  21          3HB       ALA  21   8.255   3.307 -10.978
  158    H    THR  22           H        THR  22   6.040   5.728 -12.269
  159    HA   THR  22           HA       THR  22   4.271   7.673 -10.851
  160    HB   THR  22           HB       THR  22   4.364   9.146 -12.823
  161    HG1  THR  22           1HG      THR  22   5.058   7.384 -14.170
  162   1HG2  THR  22          1HG       THR  22   7.163   8.671 -11.727
  163   2HG2  THR  22          2HG       THR  22   6.549  10.148 -12.489
  164   3HG2  THR  22          3HG       THR  22   5.897   9.625 -10.920
  165    H    ASP  23           H        ASP  23   2.415   6.502 -10.835
  166    HA   ASP  23           HA       ASP  23   0.442   5.759 -11.506
  167   1HB   ASP  23          2HB       ASP  23   0.860   7.513 -13.404
  168   2HB   ASP  23          3HB       ASP  23   1.014   6.058 -14.414
  169    H    SER  24           H        SER  24   3.259   4.252 -11.983
  170    HA   SER  24           HA       SER  24   2.431   1.833 -13.433
  171   1HB   SER  24          2HB       SER  24   4.945   2.631 -11.940
  172   2HB   SER  24          3HB       SER  24   4.731   1.044 -12.699
  173    HG   SER  24           HG       SER  24   5.679   2.257 -14.222
  174    H    PHE  25           H        PHE  25   0.747   2.399 -11.211
  175    HA   PHE  25           HA       PHE  25   1.745   1.152  -8.845
  176   1HB   PHE  25          2HB       PHE  25   0.155   2.947  -8.737
  177   2HB   PHE  25          3HB       PHE  25  -1.083   2.026  -9.575
  178    HD1  PHE  25           1HD      PHE  25  -2.438   0.398  -8.352
  179    HD2  PHE  25           2HD      PHE  25   0.844   2.424  -6.424
  180    HE1  PHE  25           1HE      PHE  25  -3.212  -0.443  -6.156
  181    HE2  PHE  25           2HE      PHE  25   0.091   1.547  -4.228
  182    HZ   PHE  25           HZ       PHE  25  -1.930   0.107  -4.085
  183    H    ASP  26           H        ASP  26   2.176  -1.089  -9.116
  184    HA   ASP  26           HA       ASP  26  -0.091  -2.857  -9.920
  185   1HB   ASP  26          2HB       ASP  26   1.997  -2.786 -11.288
  186   2HB   ASP  26          3HB       ASP  26   2.850  -3.530  -9.940
  187    H    HIS  27           H        HIS  27  -1.122  -2.706  -7.903
  188    HA   HIS  27           HA       HIS  27  -0.105  -3.266  -5.417
  189   1HB   HIS  27          2HB       HIS  27  -2.620  -2.753  -6.452
  190   2HB   HIS  27          3HB       HIS  27  -2.840  -4.379  -5.847
  191    HD1  HIS  27           HD1      HIS  27  -0.685  -3.397  -3.262
  192    HD2  HIS  27           HD2      HIS  27  -4.420  -1.964  -4.564
  193    HE1  HIS  27           HE1      HIS  27  -1.652  -1.979  -1.356
  194    H    LYS  28           H        LYS  28  -1.467  -5.629  -7.563
  195    HA   LYS  28           HA       LYS  28  -0.927  -8.104  -6.299
  196   1HB   LYS  28          2HB       LYS  28  -0.490  -8.830  -8.819
  197   2HB   LYS  28          3HB       LYS  28  -2.062  -8.632  -8.102
  198   1HG   LYS  28          2HG       LYS  28  -2.673  -6.992  -9.504
  199   2HG   LYS  28          3HG       LYS  28  -1.177  -6.127  -9.387
  200   1HD   LYS  28          2HD       LYS  28  -0.079  -7.759 -10.908
  201   2HD   LYS  28          3HD       LYS  28  -1.649  -8.523 -11.188
  202   1HE   LYS  28          2HE       LYS  28  -1.602  -5.551 -11.443
  203   2HE   LYS  28          3HE       LYS  28  -0.542  -6.363 -12.579
  204   1HZ   LYS  28          1HZ       LYS  28  -3.434  -6.952 -12.222
  205   2HZ   LYS  28          2HZ       LYS  28  -2.784  -6.088 -13.474
  206   3HZ   LYS  28          3HZ       LYS  28  -2.443  -7.692 -13.314
  207    H    LYS  29           H        LYS  29   1.400  -6.473  -8.590
  208    HA   LYS  29           HA       LYS  29   3.537  -8.283  -7.943
  209   1HB   LYS  29          2HB       LYS  29   3.381  -5.572  -9.221
  210   2HB   LYS  29          3HB       LYS  29   4.900  -5.978  -8.502
  211   1HG   LYS  29          2HG       LYS  29   4.784  -6.391 -10.920
  212   2HG   LYS  29          3HG       LYS  29   5.362  -7.738  -9.959
  213   1HD   LYS  29          2HD       LYS  29   2.445  -7.672 -10.749
  214   2HD   LYS  29          3HD       LYS  29   3.661  -8.071 -11.971
  215   1HE   LYS  29          2HE       LYS  29   4.564  -9.888 -10.594
  216   2HE   LYS  29          3HE       LYS  29   3.468  -9.480  -9.281
  217   1HZ   LYS  29          1HZ       LYS  29   2.791 -10.759 -11.803
  218   2HZ   LYS  29          2HZ       LYS  29   2.411 -11.156 -10.223
  219   3HZ   LYS  29          3HZ       LYS  29   1.652  -9.899 -10.968
  220    H    PHE  30           H        PHE  30   2.773  -5.082  -6.486
  221    HA   PHE  30           HA       PHE  30   4.930  -5.132  -4.655
  222   1HB   PHE  30          2HB       PHE  30   3.446  -3.195  -4.979
  223   2HB   PHE  30          3HB       PHE  30   2.147  -4.028  -4.124
  224    HD1  PHE  30           1HD      PHE  30   5.330  -2.257  -3.812
  225    HD2  PHE  30           2HD      PHE  30   2.371  -4.514  -1.645
  226    HE1  PHE  30           1HE      PHE  30   6.372  -1.562  -1.659
  227    HE2  PHE  30           2HE      PHE  30   3.443  -3.853   0.490
  228    HZ   PHE  30           HZ       PHE  30   5.477  -2.447   0.479
  229    H    PHE  31           H        PHE  31   1.596  -6.398  -4.030
  230    HA   PHE  31           HA       PHE  31   2.206  -7.448  -1.468
  231   1HB   PHE  31          2HB       PHE  31   0.035  -7.847  -3.481
  232   2HB   PHE  31          3HB       PHE  31   0.242  -9.096  -2.280
  233    HD1  PHE  31           1HD      PHE  31   0.116  -5.316  -2.294
  234    HD2  PHE  31           2HD      PHE  31  -1.172  -8.992  -0.468
  235    HE1  PHE  31           1HE      PHE  31  -1.259  -4.047  -0.625
  236    HE2  PHE  31           2HE      PHE  31  -2.441  -7.737   1.215
  237    HZ   PHE  31           HZ       PHE  31  -2.563  -5.250   1.086
  238    H    GLN  32           H        GLN  32   2.516  -8.988  -4.672
  239    HA   GLN  32           HA       GLN  32   3.265 -11.589  -3.665
  240   1HB   GLN  32          2HB       GLN  32   3.593 -10.170  -6.348
  241   2HB   GLN  32          3HB       GLN  32   4.146 -11.826  -6.087
  242   1HG   GLN  32          2HG       GLN  32   1.974 -12.664  -5.741
  243   2HG   GLN  32          3HG       GLN  32   1.297 -11.083  -5.380
  244   1HE2  GLN  32          2HE       GLN  32  -0.384 -11.026  -6.892
  245   2HE2  GLN  32          1HE       GLN  32  -0.090 -11.240  -8.611
  246    H    MET  33           H        MET  33   5.203  -8.836  -4.866
  247    HA   MET  33           HA       MET  33   7.819  -9.905  -4.493
  248   1HB   MET  33          2HB       MET  33   6.728  -7.059  -4.528
  249   2HB   MET  33          3HB       MET  33   8.440  -7.410  -4.407
  250   1HG   MET  33          2HG       MET  33   6.738  -8.392  -6.722
  251   2HG   MET  33          3HG       MET  33   7.597  -6.854  -6.692
  252   1HE   MET  33          1HE       MET  33   9.648  -6.606  -7.984
  253   2HE   MET  33          2HE       MET  33  10.369  -7.987  -8.840
  254   3HE   MET  33          3HE       MET  33   8.637  -7.629  -9.033
  255    H    VAL  34           H        VAL  34   5.876  -7.797  -2.323
  256    HA   VAL  34           HA       VAL  34   7.877  -7.722  -0.239
  257    HB   VAL  34           HB       VAL  34   5.906  -6.090  -0.863
  258   1HG1  VAL  34          1HG       VAL  34   4.537  -7.564   1.372
  259   2HG1  VAL  34          2HG       VAL  34   3.992  -6.144   0.470
  260   3HG1  VAL  34          3HG       VAL  34   4.113  -7.700  -0.364
  261   1HG2  VAL  34          1HG       VAL  34   7.626  -5.627   0.707
  262   2HG2  VAL  34          2HG       VAL  34   6.080  -5.112   1.387
  263   3HG2  VAL  34          3HG       VAL  34   6.871  -6.619   1.947
  264    H    GLY  35           H        GLY  35   5.669 -10.203  -1.119
  265   1HA   GLY  35          2HA       GLY  35   5.244 -12.240  -0.133
  266   2HA   GLY  35          3HA       GLY  35   6.178 -11.753   1.283
  267    H    LEU  36           H        LEU  36   3.779  -9.478   0.612
  268    HA   LEU  36           HA       LEU  36   2.467  -9.560   3.058
  269   1HB   LEU  36          2HB       LEU  36   2.168  -8.233   0.487
  270   2HB   LEU  36          3HB       LEU  36   0.603  -8.637   1.088
  271    HG   LEU  36           HG       LEU  36   2.578  -7.137   2.792
  272   1HD1  LEU  36          1HD1      LEU  36   0.341  -5.606   1.637
  273   2HD1  LEU  36          2HD1      LEU  36   2.037  -5.164   1.847
  274   3HD1  LEU  36          3HD1      LEU  36   1.554  -6.098   0.444
  275   1HD2  LEU  36          1HD2      LEU  36   0.789  -8.242   4.038
  276   2HD2  LEU  36          2HD2      LEU  36   0.321  -6.541   3.923
  277   3HD2  LEU  36          3HD2      LEU  36  -0.414  -7.706   2.846
  278    H    LYS  37           H        LYS  37   0.991 -10.549   0.124
  279    HA   LYS  37           HA       LYS  37  -1.265 -12.081   1.007
  280   1HB   LYS  37          2HB       LYS  37   0.449 -12.302  -1.487
  281   2HB   LYS  37          3HB       LYS  37  -0.688 -13.581  -1.121
  282   1HG   LYS  37          2HG       LYS  37  -2.373 -11.457  -0.822
  283   2HG   LYS  37          3HG       LYS  37  -1.248 -10.805  -2.015
  284   1HD   LYS  37          2HD       LYS  37  -2.742 -13.448  -2.244
  285   2HD   LYS  37          3HD       LYS  37  -3.228 -11.935  -3.009
  286   1HE   LYS  37          2HE       LYS  37  -1.138 -11.869  -4.315
  287   2HE   LYS  37          3HE       LYS  37  -0.565 -13.334  -3.514
  288   1HZ   LYS  37          1HZ       LYS  37  -2.979 -13.163  -5.229
  289   2HZ   LYS  37          2HZ       LYS  37  -1.560 -13.878  -5.650
  290   3HZ   LYS  37          3HZ       LYS  37  -2.480 -14.514  -4.448
  291    H    LYS  38           H        LYS  38   2.097 -13.115   1.302
  292    HA   LYS  38           HA       LYS  38   1.269 -15.894   2.003
  293   1HB   LYS  38          2HB       LYS  38   4.088 -14.793   1.628
  294   2HB   LYS  38          3HB       LYS  38   3.589 -16.482   1.802
  295   1HG   LYS  38          2HG       LYS  38   2.149 -16.091  -0.306
  296   2HG   LYS  38          3HG       LYS  38   3.080 -14.600  -0.532
  297   1HD   LYS  38          2HD       LYS  38   4.287 -17.391  -0.313
  298   2HD   LYS  38          3HD       LYS  38   3.874 -16.596  -1.840
  299   1HE   LYS  38          2HE       LYS  38   5.442 -14.757  -1.348
  300   2HE   LYS  38          3HE       LYS  38   5.864 -15.512   0.198
  301   1HZ   LYS  38          1HZ       LYS  38   6.295 -16.742  -2.463
  302   2HZ   LYS  38          2HZ       LYS  38   7.468 -16.044  -1.545
  303   3HZ   LYS  38          3HZ       LYS  38   6.718 -17.411  -1.023
  304    H    LYS  39           H        LYS  39   2.049 -12.923   3.452
  305    HA   LYS  39           HA       LYS  39   2.668 -14.053   6.105
  306   1HB   LYS  39          2HB       LYS  39   2.922 -11.435   4.777
  307   2HB   LYS  39          3HB       LYS  39   1.967 -11.278   6.233
  308   1HG   LYS  39          2HG       LYS  39   4.171 -10.953   6.957
  309   2HG   LYS  39          3HG       LYS  39   3.794 -12.608   7.438
  310   1HD   LYS  39          2HD       LYS  39   5.005 -13.340   5.273
  311   2HD   LYS  39          3HD       LYS  39   5.535 -11.647   5.132
  312   1HE   LYS  39          2HE       LYS  39   6.408 -11.840   7.526
  313   2HE   LYS  39          3HE       LYS  39   6.053 -13.571   7.447
  314   1HZ   LYS  39          1HZ       LYS  39   7.976 -12.034   5.810
  315   2HZ   LYS  39          2HZ       LYS  39   8.342 -13.192   6.892
  316   3HZ   LYS  39          3HZ       LYS  39   7.594 -13.607   5.470
  317    H    SER  40           H        SER  40   1.191 -13.102   7.893
  318    HA   SER  40           HA       SER  40  -1.352 -14.451   7.475
  319   1HB   SER  40          2HB       SER  40  -0.092 -14.663   9.561
  320   2HB   SER  40          3HB       SER  40  -0.272 -12.926   9.881
  321    HG   SER  40           HG       SER  40  -1.837 -14.459  10.894
  322    H    ALA  41           H        ALA  41  -3.446 -13.606   8.001
  323    HA   ALA  41           HA       ALA  41  -4.319 -11.097   6.941
  324   1HB   ALA  41          1HB       ALA  41  -5.513 -12.860   9.130
  325   2HB   ALA  41          2HB       ALA  41  -6.364 -11.586   8.244
  326   3HB   ALA  41          3HB       ALA  41  -5.809 -13.039   7.378
  327    H    ASP  42           H        ASP  42  -3.331 -12.128  10.214
  328    HA   ASP  42           HA       ASP  42  -3.828  -9.474  11.320
  329   1HB   ASP  42          2HB       ASP  42  -2.651 -12.012  12.488
  330   2HB   ASP  42          3HB       ASP  42  -2.752 -10.497  13.394
  331    H    ASP  43           H        ASP  43  -1.326 -10.629   9.391
  332    HA   ASP  43           HA       ASP  43   0.630  -8.658  10.450
  333   1HB   ASP  43          2HB       ASP  43   1.337 -10.973   9.562
  334   2HB   ASP  43          3HB       ASP  43   0.943 -10.340   7.958
  335    H    VAL  44           H        VAL  44  -1.377  -9.398   7.557
  336    HA   VAL  44           HA       VAL  44  -1.135  -7.107   6.012
  337    HB   VAL  44           HB       VAL  44  -3.128  -9.233   6.487
  338   1HG1  VAL  44          1HG       VAL  44  -4.096  -6.674   5.186
  339   2HG1  VAL  44          2HG       VAL  44  -4.893  -8.255   5.084
  340   3HG1  VAL  44          3HG       VAL  44  -4.729  -7.480   6.654
  341   1HG2  VAL  44          1HG       VAL  44  -1.387  -9.216   4.680
  342   2HG2  VAL  44          2HG       VAL  44  -3.039  -9.518   4.137
  343   3HG2  VAL  44          3HG       VAL  44  -2.335  -7.912   3.893
  344    H    LYS  45           H        LYS  45  -3.028  -7.440   8.994
  345    HA   LYS  45           HA       LYS  45  -3.950  -4.744   9.289
  346   1HB   LYS  45          2HB       LYS  45  -3.123  -6.888  11.263
  347   2HB   LYS  45          3HB       LYS  45  -3.441  -5.242  11.819
  348   1HG   LYS  45          2HG       LYS  45  -5.678  -5.309  10.752
  349   2HG   LYS  45          3HG       LYS  45  -5.397  -7.015  10.329
  350   1HD   LYS  45          2HD       LYS  45  -4.952  -7.366  12.881
  351   2HD   LYS  45          3HD       LYS  45  -5.562  -5.720  13.092
  352   1HE   LYS  45          2HE       LYS  45  -7.416  -7.081  13.531
  353   2HE   LYS  45          3HE       LYS  45  -7.692  -6.483  11.889
  354   1HZ   LYS  45          1HZ       LYS  45  -6.515  -9.158  12.559
  355   2HZ   LYS  45          2HZ       LYS  45  -8.078  -8.904  12.116
  356   3HZ   LYS  45          3HZ       LYS  45  -6.843  -8.614  11.062
  357    H    LYS  46           H        LYS  46  -0.832  -5.970  10.614
  358    HA   LYS  46           HA       LYS  46  -0.013  -3.328  11.484
  359   1HB   LYS  46          2HB       LYS  46   1.679  -5.809  10.956
  360   2HB   LYS  46          3HB       LYS  46   2.284  -4.294  11.596
  361   1HG   LYS  46          2HG       LYS  46   2.049  -5.473  13.525
  362   2HG   LYS  46          3HG       LYS  46   0.529  -4.567  13.506
  363   1HD   LYS  46          2HD       LYS  46  -0.655  -6.513  12.658
  364   2HD   LYS  46          3HD       LYS  46   0.874  -7.391  12.414
  365   1HE   LYS  46          2HE       LYS  46   1.212  -7.250  14.941
  366   2HE   LYS  46          3HE       LYS  46  -0.453  -6.639  15.037
  367   1HZ   LYS  46          1HZ       LYS  46   0.469  -9.279  14.102
  368   2HZ   LYS  46          2HZ       LYS  46  -0.685  -8.958  15.243
  369   3HZ   LYS  46          3HZ       LYS  46  -0.965  -8.704  13.617
  370    H    VAL  47           H        VAL  47   0.353  -5.056   8.444
  371    HA   VAL  47           HA       VAL  47   2.108  -3.190   7.170
  372    HB   VAL  47           HB       VAL  47   0.043  -5.037   5.921
  373   1HG1  VAL  47          1HG       VAL  47   2.348  -3.456   4.699
  374   2HG1  VAL  47          2HG       VAL  47   1.559  -4.816   3.909
  375   3HG1  VAL  47          3HG       VAL  47   0.618  -3.370   4.256
  376   1HG2  VAL  47          1HG       VAL  47   1.816  -6.240   7.214
  377   2HG2  VAL  47          2HG       VAL  47   2.007  -6.484   5.493
  378   3HG2  VAL  47          3HG       VAL  47   3.043  -5.317   6.360
  379    H    PHE  48           H        PHE  48  -1.548  -3.424   6.505
  380    HA   PHE  48           HA       PHE  48  -1.984  -0.971   5.465
  381   1HB   PHE  48          2HB       PHE  48  -3.526  -2.869   5.699
  382   2HB   PHE  48          3HB       PHE  48  -3.559  -2.671   7.436
  383    HD1  PHE  48           1HD      PHE  48  -4.334  -0.849   4.238
  384    HD2  PHE  48           2HD      PHE  48  -5.212  -1.369   8.429
  385    HE1  PHE  48           1HE      PHE  48  -6.239   0.736   4.060
  386    HE2  PHE  48           2HE      PHE  48  -7.109   0.216   8.234
  387    HZ   PHE  48           HZ       PHE  48  -7.604   1.264   6.048
  388    H    HIS  49           H        HIS  49  -1.629  -1.692   8.946
  389    HA   HIS  49           HA       HIS  49  -2.603   0.771   9.936
  390   1HB   HIS  49          2HB       HIS  49  -0.609  -1.212  11.101
  391   2HB   HIS  49          3HB       HIS  49  -1.187   0.176  11.996
  392    HD1  HIS  49           HD1      HIS  49  -1.865  -2.210  13.525
  393    HD2  HIS  49           HD2      HIS  49  -4.218  -0.951  10.274
  394    HE1  HIS  49           HE1      HIS  49  -4.175  -3.270  13.831
  395    H    MET  50           H        MET  50   0.563   0.048   8.587
  396    HA   MET  50           HA       MET  50   1.874   2.381   9.807
  397   1HB   MET  50          2HB       MET  50   2.742  -0.032   8.823
  398   2HB   MET  50          3HB       MET  50   3.014   0.984   7.422
  399   1HG   MET  50          2HG       MET  50   4.041   1.335  10.265
  400   2HG   MET  50          3HG       MET  50   4.998   0.821   8.877
  401   1HE   MET  50          1HE       MET  50   6.749   2.499  10.051
  402   2HE   MET  50          2HE       MET  50   6.457   4.247  10.228
  403   3HE   MET  50          3HE       MET  50   5.531   3.086  11.207
  404    H    LEU  51           H        LEU  51   0.278   1.553   6.802
  405    HA   LEU  51           HA       LEU  51   0.961   3.890   5.207
  406   1HB   LEU  51          2HB       LEU  51  -1.566   2.215   5.060
  407   2HB   LEU  51          3HB       LEU  51  -0.778   3.147   3.796
  408    HG   LEU  51           HG       LEU  51   0.255   0.571   5.060
  409   1HD1  LEU  51          1HD1      LEU  51  -0.940   1.172   2.347
  410   2HD1  LEU  51          2HD1      LEU  51  -0.095  -0.340   2.773
  411   3HD1  LEU  51          3HD1      LEU  51  -1.587   0.129   3.606
  412   1HD2  LEU  51          1HD2      LEU  51   2.177   1.954   4.491
  413   2HD2  LEU  51          2HD2      LEU  51   2.022   0.658   3.318
  414   3HD2  LEU  51          3HD2      LEU  51   1.505   2.295   2.889
  415    H    ASP  52           H        ASP  52  -1.655   3.023   7.421
  416    HA   ASP  52           HA       ASP  52  -2.987   5.554   7.505
  417   1HB   ASP  52          2HB       ASP  52  -3.385   2.951   8.536
  418   2HB   ASP  52          3HB       ASP  52  -3.274   3.961   9.952
  419    H    LYS  53           H        LYS  53  -0.976   6.737   7.459
  420    HA   LYS  53           HA       LYS  53   0.819   7.222   9.627
  421   1HB   LYS  53          2HB       LYS  53  -0.055   8.870   7.225
  422   2HB   LYS  53          3HB       LYS  53   1.315   9.299   8.229
  423   1HG   LYS  53          2HG       LYS  53   1.321   6.495   7.150
  424   2HG   LYS  53          3HG       LYS  53   1.495   7.771   5.967
  425   1HD   LYS  53          2HD       LYS  53   3.201   7.453   8.475
  426   2HD   LYS  53          3HD       LYS  53   3.649   6.825   6.886
  427   1HE   LYS  53          2HE       LYS  53   3.204   9.760   7.601
  428   2HE   LYS  53          3HE       LYS  53   4.771   8.981   7.352
  429   1HZ   LYS  53          1HZ       LYS  53   2.653   9.242   5.303
  430   2HZ   LYS  53          2HZ       LYS  53   4.016  10.161   5.357
  431   3HZ   LYS  53          3HZ       LYS  53   4.105   8.537   5.055
  432    H    ASP  54           H        ASP  54  -1.648   7.274  10.674
  433    HA   ASP  54           HA       ASP  54  -2.197   9.767  12.102
  434   1HB   ASP  54          2HB       ASP  54  -4.332  10.302  11.005
  435   2HB   ASP  54          3HB       ASP  54  -3.012  10.412   9.840
  436    H    LYS  55           H        LYS  55  -3.470   6.676  10.882
  437    HA   LYS  55           HA       LYS  55  -4.063   4.837  11.950
  438   1HB   LYS  55          2HB       LYS  55  -2.836   5.945  14.021
  439   2HB   LYS  55          3HB       LYS  55  -4.471   6.161  14.619
  440   1HG   LYS  55          2HG       LYS  55  -3.940   4.191  15.621
  441   2HG   LYS  55          3HG       LYS  55  -4.666   3.532  14.169
  442   1HD   LYS  55          2HD       LYS  55  -1.693   3.889  14.752
  443   2HD   LYS  55          3HD       LYS  55  -2.582   2.369  14.763
  444   1HE   LYS  55          2HE       LYS  55  -2.087   4.135  12.323
  445   2HE   LYS  55          3HE       LYS  55  -1.211   2.663  12.713
  446   1HZ   LYS  55          1HZ       LYS  55  -4.126   2.753  12.232
  447   2HZ   LYS  55          2HZ       LYS  55  -2.977   2.346  11.114
  448   3HZ   LYS  55          3HZ       LYS  55  -3.219   1.402  12.452
  449    H    SER  56           H        SER  56  -6.056   7.103  10.996
  450    HA   SER  56           HA       SER  56  -8.500   6.626  12.372
  451   1HB   SER  56          2HB       SER  56  -9.643   7.614  10.614
  452   2HB   SER  56          3HB       SER  56  -8.058   8.401  10.572
  453    HG   SER  56           HG       SER  56  -8.919   7.661   8.480
  454    H    GLY  57           H        GLY  57  -6.882   4.555  10.031
  455   1HA   GLY  57          2HA       GLY  57  -7.286   2.199   9.940
  456   2HA   GLY  57          3HA       GLY  57  -8.932   2.435  10.533
  457    H    PHE  58           H        PHE  58  -8.033   4.651   8.115
  458    HA   PHE  58           HA       PHE  58  -8.695   2.993   5.810
  459   1HB   PHE  58          2HB       PHE  58 -10.011   5.619   5.654
  460   2HB   PHE  58          3HB       PHE  58 -10.522   4.042   5.071
  461    HD1  PHE  58           1HD      PHE  58 -11.665   2.425   6.635
  462    HD2  PHE  58           2HD      PHE  58 -10.831   6.506   7.726
  463    HE1  PHE  58           1HE      PHE  58 -13.259   2.241   8.529
  464    HE2  PHE  58           2HE      PHE  58 -12.402   6.312   9.648
  465    HZ   PHE  58           HZ       PHE  58 -13.615   4.179  10.048
  466    H    ILE  59           H        ILE  59  -7.574   3.750   3.933
  467    HA   ILE  59           HA       ILE  59  -5.699   6.040   4.416
  468    HB   ILE  59           HB       ILE  59  -5.568   4.259   2.001
  469   1HG1  ILE  59          2HG       ILE  59  -4.090   3.802   4.650
  470   2HG1  ILE  59          3HG       ILE  59  -5.426   2.812   4.073
  471   1HG2  ILE  59          1HG       ILE  59  -3.364   5.768   3.433
  472   2HG2  ILE  59          2HG       ILE  59  -3.300   5.025   1.850
  473   3HG2  ILE  59          3HG       ILE  59  -4.301   6.462   2.102
  474   1HD1  ILE  59          1HD1      ILE  59  -2.707   3.057   2.771
  475   2HD1  ILE  59          2HD1      ILE  59  -3.447   1.630   3.528
  476   3HD1  ILE  59          3HD1      ILE  59  -4.085   2.282   2.005
  477    H    GLU  60           H        GLU  60  -5.885   7.862   3.411
  478    HA   GLU  60           HA       GLU  60  -8.165   8.516   1.615
  479   1HB   GLU  60          2HB       GLU  60  -6.841  10.085   3.915
  480   2HB   GLU  60          3HB       GLU  60  -7.894  10.810   2.726
  481   1HG   GLU  60          2HG       GLU  60  -9.285  10.609   4.486
  482   2HG   GLU  60          3HG       GLU  60  -9.746   9.274   3.467
  483    H    GLU  61           H        GLU  61  -7.621  10.663   0.327
  484    HA   GLU  61           HA       GLU  61  -5.397  10.221  -1.302
  485   1HB   GLU  61          2HB       GLU  61  -5.784  12.223  -2.404
  486   2HB   GLU  61          3HB       GLU  61  -7.309  11.417  -2.080
  487   1HG   GLU  61          2HG       GLU  61  -7.900  13.032  -0.384
  488   2HG   GLU  61          3HG       GLU  61  -6.282  13.749  -0.408
  489    H    ASP  62           H        ASP  62  -5.581  12.362   1.518
  490    HA   ASP  62           HA       ASP  62  -3.243  13.817   1.357
  491   1HB   ASP  62          2HB       ASP  62  -4.367  12.573   3.903
  492   2HB   ASP  62          3HB       ASP  62  -3.508  14.102   3.739
  493    H    GLU  63           H        GLU  63  -3.670  10.498   2.454
  494    HA   GLU  63           HA       GLU  63  -0.806  10.099   3.195
  495   1HB   GLU  63          2HB       GLU  63  -3.257   8.311   3.086
  496   2HB   GLU  63          3HB       GLU  63  -1.638   7.700   3.448
  497   1HG   GLU  63          2HG       GLU  63  -1.527   8.803   5.507
  498   2HG   GLU  63          3HG       GLU  63  -2.775   9.982   5.084
  499    H    LEU  64           H        LEU  64  -3.215   9.098   0.765
  500    HA   LEU  64           HA       LEU  64  -1.885   7.172  -0.616
  501   1HB   LEU  64          2HB       LEU  64  -4.256   8.649  -0.795
  502   2HB   LEU  64          3HB       LEU  64  -3.492   8.908  -2.343
  503    HG   LEU  64           HG       LEU  64  -3.313   6.380  -2.489
  504   1HD1  LEU  64          1HD1      LEU  64  -5.104   6.554  -0.054
  505   2HD1  LEU  64          2HD1      LEU  64  -4.912   5.101  -1.055
  506   3HD1  LEU  64          3HD1      LEU  64  -3.514   5.752  -0.193
  507   1HD2  LEU  64          1HD2      LEU  64  -5.088   7.738  -3.587
  508   2HD2  LEU  64          2HD2      LEU  64  -5.685   6.142  -3.088
  509   3HD2  LEU  64          3HD2      LEU  64  -6.091   7.590  -2.132
  510    H    GLY  65           H        GLY  65  -1.508  10.604  -1.242
  511   1HA   GLY  65          2HA       GLY  65   0.158  10.608  -3.532
  512   2HA   GLY  65          3HA       GLY  65   0.315  11.763  -2.224
  513    H    PHE  66           H        PHE  66   1.042   9.651  -0.228
  514    HA   PHE  66           HA       PHE  66   3.696   8.709  -1.140
  515   1HB   PHE  66          2HB       PHE  66   4.783   9.883   0.809
  516   2HB   PHE  66          3HB       PHE  66   4.288  10.867  -0.543
  517    HD1  PHE  66           1HD      PHE  66   2.924  12.764  -0.260
  518    HD2  PHE  66           2HD      PHE  66   3.121   9.807   2.859
  519    HE1  PHE  66           1HE      PHE  66   1.632  14.259   1.234
  520    HE2  PHE  66           2HE      PHE  66   1.805  11.334   4.369
  521    HZ   PHE  66           HZ       PHE  66   1.083  13.545   3.544
  522    H    ILE  67           H        ILE  67   1.225   7.362  -0.351
  523    HA   ILE  67           HA       ILE  67   1.175   5.981   2.075
  524    HB   ILE  67           HB       ILE  67  -0.506   5.858   0.434
  525   1HG1  ILE  67          2HG       ILE  67   0.014   3.846   1.875
  526   2HG1  ILE  67          3HG       ILE  67  -1.165   3.676   0.584
  527   1HG2  ILE  67          1HG       ILE  67   1.398   4.459  -1.481
  528   2HG2  ILE  67          2HG       ILE  67  -0.351   4.671  -1.694
  529   3HG2  ILE  67          3HG       ILE  67   0.722   6.067  -1.679
  530   1HD1  ILE  67          1HD1      ILE  67   1.735   2.816   0.340
  531   2HD1  ILE  67          2HD1      ILE  67   0.423   1.723   0.785
  532   3HD1  ILE  67          3HD1      ILE  67   0.423   2.479  -0.806
  533    H    LEU  68           H        LEU  68   3.289   5.503  -0.656
  534    HA   LEU  68           HA       LEU  68   4.614   3.156   0.084
  535   1HB   LEU  68          2HB       LEU  68   5.761   5.569  -1.369
  536   2HB   LEU  68          3HB       LEU  68   6.375   3.910  -1.451
  537    HG   LEU  68           HG       LEU  68   3.748   5.020  -2.529
  538   1HD1  LEU  68          1HD1      LEU  68   6.180   3.836  -3.938
  539   2HD1  LEU  68          2HD1      LEU  68   4.705   4.450  -4.720
  540   3HD1  LEU  68          3HD1      LEU  68   5.767   5.558  -3.848
  541   1HD2  LEU  68          1HD2      LEU  68   3.317   2.747  -1.735
  542   2HD2  LEU  68          2HD2      LEU  68   3.373   2.779  -3.493
  543   3HD2  LEU  68          3HD2      LEU  68   4.785   2.179  -2.572
  544    H    LYS  69           H        LYS  69   5.025   6.374   1.437
  545    HA   LYS  69           HA       LYS  69   7.592   5.935   2.684
  546   1HB   LYS  69          2HB       LYS  69   6.085   8.104   2.075
  547   2HB   LYS  69          3HB       LYS  69   5.656   7.955   3.770
  548   1HG   LYS  69          2HG       LYS  69   8.456   8.263   2.578
  549   2HG   LYS  69          3HG       LYS  69   7.466   9.551   3.258
  550   1HD   LYS  69          2HD       LYS  69   7.533   8.283   5.480
  551   2HD   LYS  69          3HD       LYS  69   8.794   7.263   4.738
  552   1HE   LYS  69          2HE       LYS  69  10.116   9.314   4.222
  553   2HE   LYS  69          3HE       LYS  69   8.874  10.304   4.995
  554   1HZ   LYS  69          1HZ       LYS  69  10.495   8.229   6.349
  555   2HZ   LYS  69          2HZ       LYS  69  10.695   9.854   6.508
  556   3HZ   LYS  69          3HZ       LYS  69   9.330   9.132   7.072
  557    H    GLY  70           H        GLY  70   4.519   4.642   3.428
  558   1HA   GLY  70          2HA       GLY  70   5.352   3.977   6.214
  559   2HA   GLY  70          3HA       GLY  70   3.770   3.665   5.494
  560    H    PHE  71           H        PHE  71   5.610   2.635   3.014
  561    HA   PHE  71           HA       PHE  71   6.006  -0.098   4.060
  562   1HB   PHE  71          2HB       PHE  71   6.505   1.044   1.299
  563   2HB   PHE  71          3HB       PHE  71   6.778  -0.619   1.779
  564    HD1  PHE  71           1HD      PHE  71   4.697   1.096  -0.185
  565    HD2  PHE  71           2HD      PHE  71   4.465  -1.549   3.205
  566    HE1  PHE  71           1HE      PHE  71   2.386   0.491  -0.817
  567    HE2  PHE  71           2HE      PHE  71   2.170  -2.193   2.537
  568    HZ   PHE  71           HZ       PHE  71   1.118  -1.168   0.532
  569    H    SER  72           H        SER  72   8.002   2.717   2.839
  570    HA   SER  72           HA       SER  72  10.006   2.269   4.790
  571   1HB   SER  72          2HB       SER  72  10.217   0.676   2.324
  572   2HB   SER  72          3HB       SER  72  11.661   1.663   2.589
  573    HG   SER  72           HG       SER  72  10.323  -0.043   4.421
  574    HA   PRO  73           HA       PRO  73  11.426   6.150   2.960
  575   1HB   PRO  73          2HB       PRO  73  14.154   6.118   3.117
  576   2HB   PRO  73          3HB       PRO  73  13.099   6.292   4.552
  577   1HG   PRO  73          2HG       PRO  73  14.399   3.764   3.502
  578   2HG   PRO  73          3HG       PRO  73  14.392   4.390   5.183
  579   1HD   PRO  73          2HD       PRO  73  12.652   2.495   4.319
  580   2HD   PRO  73          3HD       PRO  73  12.161   3.716   5.519
  581    H    ASP  74           H        ASP  74  12.742   6.947   1.163
  582    HA   ASP  74           HA       ASP  74  13.019   7.166  -1.048
  583   1HB   ASP  74          2HB       ASP  74  14.931   5.576  -0.505
  584   2HB   ASP  74          3HB       ASP  74  13.969   4.312  -1.278
  585    H    ALA  75           H        ALA  75  10.625   5.808   0.110
  586    HA   ALA  75           HA       ALA  75   8.807   4.779  -1.715
  587   1HB   ALA  75          1HB       ALA  75   8.811   6.811   0.564
  588   2HB   ALA  75          2HB       ALA  75   7.324   6.379  -0.245
  589   3HB   ALA  75          3HB       ALA  75   8.301   5.113   0.559
  590    H    ARG  76           H        ARG  76   9.493   8.182  -1.100
  591    HA   ARG  76           HA       ARG  76   9.186  10.148  -2.179
  592   1HB   ARG  76          2HB       ARG  76   8.969   8.698  -4.840
  593   2HB   ARG  76          3HB       ARG  76   9.528  10.346  -4.512
  594   1HG   ARG  76          2HG       ARG  76  11.346   9.210  -3.046
  595   2HG   ARG  76          3HG       ARG  76  10.893   7.723  -3.902
  596   1HD   ARG  76          2HD       ARG  76  11.594   8.644  -6.018
  597   2HD   ARG  76          3HD       ARG  76  11.837  10.246  -5.281
  598    HE   ARG  76           HE       ARG  76  13.399   7.987  -4.102
  599   1HH1  ARG  76          1HH2      ARG  76  13.645  10.770  -6.227
  600   2HH1  ARG  76          2HH2      ARG  76  15.372  10.885  -5.960
  601   1HH2  ARG  76          1HH1      ARG  76  15.336   8.126  -3.825
  602   2HH2  ARG  76          2HH1      ARG  76  16.412   9.328  -4.579
  603    H    ASP  77           H        ASP  77   7.716  11.229  -3.992
  604    HA   ASP  77           HA       ASP  77   4.918  10.810  -3.123
  605   1HB   ASP  77          2HB       ASP  77   6.143  13.035  -2.855
  606   2HB   ASP  77          3HB       ASP  77   6.157  13.163  -4.610
  607    H    LEU  78           H        LEU  78   3.822   9.522  -4.475
  608    HA   LEU  78           HA       LEU  78   4.728   8.999  -7.224
  609   1HB   LEU  78          2HB       LEU  78   2.693   7.605  -7.475
  610   2HB   LEU  78          3HB       LEU  78   3.851   7.068  -6.300
  611    HG   LEU  78           HG       LEU  78   1.318   6.834  -5.842
  612   1HD1  LEU  78          1HD1      LEU  78   3.231   7.885  -3.760
  613   2HD1  LEU  78          2HD1      LEU  78   1.651   7.148  -3.432
  614   3HD1  LEU  78          3HD1      LEU  78   2.907   6.219  -4.253
  615   1HD2  LEU  78          1HD2      LEU  78   0.608   9.061  -6.434
  616   2HD2  LEU  78          2HD2      LEU  78   0.158   8.622  -4.792
  617   3HD2  LEU  78          3HD2      LEU  78   1.516   9.736  -5.084
  618    H    SER  79           H        SER  79   3.010   8.940  -8.997
  619    HA   SER  79           HA       SER  79   2.491  11.662  -9.731
  620   1HB   SER  79          2HB       SER  79   2.916   9.922 -11.377
  621   2HB   SER  79          3HB       SER  79   1.435   9.059 -10.915
  622    HG   SER  79           HG       SER  79   1.369  10.532 -12.803
  623    H    ALA  80           H        ALA  80   0.690  12.878  -9.897
  624    HA   ALA  80           HA       ALA  80  -1.529  12.666  -8.184
  625   1HB   ALA  80          1HB       ALA  80  -1.262  14.052 -10.882
  626   2HB   ALA  80          2HB       ALA  80  -2.501  14.401  -9.651
  627   3HB   ALA  80          3HB       ALA  80  -0.792  14.731  -9.301
  628    H    LYS  81           H        LYS  81  -1.004  11.254 -11.372
  629    HA   LYS  81           HA       LYS  81  -3.739  10.374 -11.896
  630   1HB   LYS  81          2HB       LYS  81  -1.145   9.071 -12.827
  631   2HB   LYS  81          3HB       LYS  81  -2.752   8.914 -13.528
  632   1HG   LYS  81          2HG       LYS  81  -2.476  11.567 -13.868
  633   2HG   LYS  81          3HG       LYS  81  -0.757  11.166 -13.654
  634   1HD   LYS  81          2HD       LYS  81  -1.168  11.116 -16.012
  635   2HD   LYS  81          3HD       LYS  81  -1.015   9.431 -15.476
  636   1HE   LYS  81          2HE       LYS  81  -3.594   9.444 -15.260
  637   2HE   LYS  81          3HE       LYS  81  -3.562  10.985 -16.127
  638   1HZ   LYS  81          1HZ       LYS  81  -2.493   8.395 -17.076
  639   2HZ   LYS  81          2HZ       LYS  81  -3.875   9.109 -17.621
  640   3HZ   LYS  81          3HZ       LYS  81  -2.413   9.803 -17.937
  641    H    GLU  82           H        GLU  82  -0.922   9.020 -10.236
  642    HA   GLU  82           HA       GLU  82  -1.878   6.360 -10.036
  643   1HB   GLU  82          2HB       GLU  82   0.516   7.334  -9.820
  644   2HB   GLU  82          3HB       GLU  82   0.118   7.636  -8.126
  645   1HG   GLU  82          2HG       GLU  82  -0.410   5.273  -7.786
  646   2HG   GLU  82          3HG       GLU  82  -0.173   4.954  -9.509
  647    H    THR  83           H        THR  83  -1.641   8.925  -7.492
  648    HA   THR  83           HA       THR  83  -3.227   7.660  -5.541
  649    HB   THR  83           HB       THR  83  -2.122   9.557  -4.823
  650    HG1  THR  83           1HG      THR  83  -3.831  10.850  -4.029
  651   1HG2  THR  83          1HG       THR  83  -3.672  11.280  -6.794
  652   2HG2  THR  83          2HG       THR  83  -2.551  11.854  -5.543
  653   3HG2  THR  83          3HG       THR  83  -1.935  10.884  -6.877
  654    H    LYS  84           H        LYS  84  -4.482   9.609  -8.284
  655    HA   LYS  84           HA       LYS  84  -7.240   9.397  -7.697
  656   1HB   LYS  84          2HB       LYS  84  -5.604  10.201  -9.950
  657   2HB   LYS  84          3HB       LYS  84  -6.852   9.121 -10.551
  658   1HG   LYS  84          2HG       LYS  84  -8.579  10.502  -9.370
  659   2HG   LYS  84          3HG       LYS  84  -7.294  11.632  -8.888
  660   1HD   LYS  84          2HD       LYS  84  -6.769  12.065 -11.268
  661   2HD   LYS  84          3HD       LYS  84  -8.010  10.889 -11.763
  662   1HE   LYS  84          2HE       LYS  84  -9.736  12.250 -10.574
  663   2HE   LYS  84          3HE       LYS  84  -8.495  13.448 -10.174
  664   1HZ   LYS  84          1HZ       LYS  84  -9.313  12.680 -12.917
  665   2HZ   LYS  84          2HZ       LYS  84  -9.736  14.073 -12.154
  666   3HZ   LYS  84          3HZ       LYS  84  -8.163  13.797 -12.549
  667    H    MET  85           H        MET  85  -5.350   7.131  -9.740
  668    HA   MET  85           HA       MET  85  -7.632   5.334 -10.039
  669   1HB   MET  85          2HB       MET  85  -5.603   5.780 -11.610
  670   2HB   MET  85          3HB       MET  85  -4.731   4.614 -10.618
  671   1HG   MET  85          2HG       MET  85  -7.401   4.062 -11.992
  672   2HG   MET  85          3HG       MET  85  -5.838   3.784 -12.743
  673   1HE   MET  85          1HE       MET  85  -4.671   1.583 -12.753
  674   2HE   MET  85          2HE       MET  85  -5.612   0.160 -12.252
  675   3HE   MET  85          3HE       MET  85  -6.333   1.357 -13.352
  676    H    LEU  86           H        LEU  86  -4.705   5.293  -8.062
  677    HA   LEU  86           HA       LEU  86  -4.838   2.822  -6.746
  678   1HB   LEU  86          2HB       LEU  86  -3.036   4.605  -6.852
  679   2HB   LEU  86          3HB       LEU  86  -3.911   5.490  -5.594
  680    HG   LEU  86           HG       LEU  86  -2.579   2.792  -5.490
  681   1HD1  LEU  86          1HD1      LEU  86  -1.854   5.446  -4.174
  682   2HD1  LEU  86          2HD1      LEU  86  -0.967   3.917  -3.982
  683   3HD1  LEU  86          3HD1      LEU  86  -1.031   4.697  -5.560
  684   1HD2  LEU  86          1HD2      LEU  86  -4.307   2.557  -3.901
  685   2HD2  LEU  86          2HD2      LEU  86  -2.861   2.939  -2.979
  686   3HD2  LEU  86          3HD2      LEU  86  -4.067   4.215  -3.279
  687    H    MET  87           H        MET  87  -6.333   5.980  -5.798
  688    HA   MET  87           HA       MET  87  -7.726   5.171  -3.492
  689   1HB   MET  87          2HB       MET  87  -7.567   7.507  -4.372
  690   2HB   MET  87          3HB       MET  87  -8.670   7.078  -5.675
  691   1HG   MET  87          2HG       MET  87 -10.319   6.405  -3.774
  692   2HG   MET  87          3HG       MET  87  -9.232   7.295  -2.711
  693   1HE   MET  87          1HE       MET  87  -8.348   9.714  -4.898
  694   2HE   MET  87          2HE       MET  87  -9.480  10.947  -4.302
  695   3HE   MET  87          3HE       MET  87  -8.618   9.905  -3.148
  696    H    ALA  88           H        ALA  88  -9.111   5.263  -6.813
  697    HA   ALA  88           HA       ALA  88 -11.513   3.936  -6.163
  698   1HB   ALA  88          1HB       ALA  88 -10.020   4.122  -8.821
  699   2HB   ALA  88          2HB       ALA  88 -11.739   3.706  -8.617
  700   3HB   ALA  88          3HB       ALA  88 -11.157   5.321  -8.166
  701    H    ALA  89           H        ALA  89  -8.436   2.494  -7.366
  702    HA   ALA  89           HA       ALA  89  -9.551  -0.170  -7.557
  703   1HB   ALA  89          1HB       ALA  89  -6.661   0.800  -7.458
  704   2HB   ALA  89          2HB       ALA  89  -7.201  -0.829  -7.933
  705   3HB   ALA  89          3HB       ALA  89  -7.656   0.577  -8.913
  706    H    GLY  90           H        GLY  90  -7.560   1.441  -4.994
  707   1HA   GLY  90          2HA       GLY  90  -7.340  -0.949  -3.364
  708   2HA   GLY  90          3HA       GLY  90  -6.965   0.712  -2.889
  709    H    ASP  91           H        ASP  91  -9.575   1.867  -3.398
  710    HA   ASP  91           HA       ASP  91 -11.209   0.960  -1.167
  711   1HB   ASP  91          2HB       ASP  91 -11.099   3.288  -1.689
  712   2HB   ASP  91          3HB       ASP  91 -11.658   2.979  -3.348
  713    H    LYS  92           H        LYS  92 -11.054  -1.339  -2.344
  714    HA   LYS  92           HA       LYS  92 -12.883  -1.735  -4.537
  715   1HB   LYS  92          2HB       LYS  92 -12.586  -4.049  -4.200
  716   2HB   LYS  92          3HB       LYS  92 -11.056  -3.153  -4.143
  717   1HG   LYS  92          2HG       LYS  92 -10.534  -3.938  -2.115
  718   2HG   LYS  92          3HG       LYS  92 -12.091  -3.473  -1.443
  719   1HD   LYS  92          2HD       LYS  92 -11.902  -5.980  -3.146
  720   2HD   LYS  92          3HD       LYS  92 -11.398  -6.015  -1.463
  721   1HE   LYS  92          2HE       LYS  92 -13.602  -5.073  -0.755
  722   2HE   LYS  92          3HE       LYS  92 -14.136  -5.085  -2.435
  723   1HZ   LYS  92          1HZ       LYS  92 -13.278  -7.496  -0.942
  724   2HZ   LYS  92          2HZ       LYS  92 -14.845  -7.042  -1.170
  725   3HZ   LYS  92          3HZ       LYS  92 -13.914  -7.468  -2.462
  726    H    ASP  93           H        ASP  93 -13.853  -0.834  -1.633
  727    HA   ASP  93           HA       ASP  93 -16.470  -2.313  -1.696
  728   1HB   ASP  93          2HB       ASP  93 -15.273  -0.357   0.278
  729   2HB   ASP  93          3HB       ASP  93 -16.922  -0.965   0.391
  730    H    GLY  94           H        GLY  94 -15.027   0.792  -2.676
  731   1HA   GLY  94          2HA       GLY  94 -16.106   2.527  -3.776
  732   2HA   GLY  94          3HA       GLY  94 -17.679   1.838  -3.403
  733    H    ASP  95           H        ASP  95 -15.281   2.454  -0.894
  734    HA   ASP  95           HA       ASP  95 -17.159   4.473   0.409
  735   1HB   ASP  95          2HB       ASP  95 -14.523   3.438   1.505
  736   2HB   ASP  95          3HB       ASP  95 -15.710   4.412   2.361
  737    H    GLY  96           H        GLY  96 -14.516   4.514  -1.652
  738   1HA   GLY  96          2HA       GLY  96 -13.013   5.958  -2.417
  739   2HA   GLY  96          3HA       GLY  96 -13.658   7.266  -1.397
  740    H    LYS  97           H        LYS  97 -12.730   4.483   0.417
  741    HA   LYS  97           HA       LYS  97  -9.872   5.376   0.754
  742   1HB   LYS  97          2HB       LYS  97 -11.802   4.836   3.024
  743   2HB   LYS  97          3HB       LYS  97 -10.046   4.979   3.141
  744   1HG   LYS  97          2HG       LYS  97 -10.236   7.120   3.450
  745   2HG   LYS  97          3HG       LYS  97 -10.705   7.314   1.778
  746   1HD   LYS  97          2HD       LYS  97 -12.370   8.435   3.071
  747   2HD   LYS  97          3HD       LYS  97 -13.127   6.922   2.526
  748   1HE   LYS  97          2HE       LYS  97 -12.399   5.899   4.761
  749   2HE   LYS  97          3HE       LYS  97 -11.865   7.506   5.254
  750   1HZ   LYS  97          1HZ       LYS  97 -14.631   6.804   4.470
  751   2HZ   LYS  97          2HZ       LYS  97 -14.101   6.997   6.022
  752   3HZ   LYS  97          3HZ       LYS  97 -14.123   8.282   4.990
  753    H    ILE  98           H        ILE  98  -8.494   3.829   1.269
  754    HA   ILE  98           HA       ILE  98  -8.975   1.030   0.603
  755    HB   ILE  98           HB       ILE  98  -6.585   2.407   1.888
  756   1HG1  ILE  98          2HG       ILE  98  -7.474   2.006  -0.983
  757   2HG1  ILE  98          3HG       ILE  98  -6.975   3.496  -0.194
  758   1HG2  ILE  98          1HG       ILE  98  -6.439  -0.113   0.288
  759   2HG2  ILE  98          2HG       ILE  98  -5.184   0.544   1.329
  760   3HG2  ILE  98          3HG       ILE  98  -6.569  -0.189   2.071
  761   1HD1  ILE  98          1HD1      ILE  98  -5.155   1.235  -1.103
  762   2HD1  ILE  98          2HD1      ILE  98  -5.365   2.834  -1.812
  763   3HD1  ILE  98          3HD1      ILE  98  -4.618   2.688  -0.209
  764    H    GLY  99           H        GLY  99  -9.279  -0.687   1.959
  765   1HA   GLY  99          2HA       GLY  99  -8.949  -0.328   4.918
  766   2HA   GLY  99          3HA       GLY  99 -10.228  -1.306   4.243
  767    H    VAL 100           H        VAL 100  -8.512  -2.262   6.054
  768    HA   VAL 100           HA       VAL 100  -6.170  -3.505   5.281
  769    HB   VAL 100           HB       VAL 100  -6.853  -3.119   7.564
  770   1HG1  VAL 100          1HG       VAL 100  -8.756  -5.483   7.461
  771   2HG1  VAL 100          2HG       VAL 100  -8.387  -4.430   8.829
  772   3HG1  VAL 100          3HG       VAL 100  -9.275  -3.780   7.450
  773   1HG2  VAL 100          1HG       VAL 100  -5.124  -4.818   7.069
  774   2HG2  VAL 100          2HG       VAL 100  -6.015  -5.131   8.572
  775   3HG2  VAL 100          3HG       VAL 100  -6.385  -6.078   7.130
  776    H    ASP 101           H        ASP 101  -9.354  -5.090   5.325
  777    HA   ASP 101           HA       ASP 101  -8.338  -7.658   4.356
  778   1HB   ASP 101          2HB       ASP 101 -10.226  -7.271   5.991
  779   2HB   ASP 101          3HB       ASP 101 -11.171  -6.565   4.681
  780    H    GLU 102           H        GLU 102 -10.168  -4.957   3.168
  781    HA   GLU 102           HA       GLU 102 -10.958  -5.633   0.593
  782   1HB   GLU 102          2HB       GLU 102 -10.014  -3.025   1.837
  783   2HB   GLU 102          3HB       GLU 102 -10.704  -3.086   0.232
  784   1HG   GLU 102          2HG       GLU 102 -12.826  -3.752   1.059
  785   2HG   GLU 102          3HG       GLU 102 -12.180  -4.187   2.654
  786    H    PHE 103           H        PHE 103  -8.078  -3.600   1.351
  787    HA   PHE 103           HA       PHE 103  -7.131  -3.779  -1.325
  788   1HB   PHE 103          2HB       PHE 103  -5.713  -2.187  -0.740
  789   2HB   PHE 103          3HB       PHE 103  -6.812  -2.091   0.632
  790    HD1  PHE 103           1HD      PHE 103  -3.638  -1.459   0.017
  791    HD2  PHE 103           2HD      PHE 103  -5.894  -4.142   2.494
  792    HE1  PHE 103           1HE      PHE 103  -1.730  -1.621   1.583
  793    HE2  PHE 103           2HE      PHE 103  -3.981  -4.369   4.028
  794    HZ   PHE 103           HZ       PHE 103  -1.871  -3.107   3.584
  795    H    SER 104           H        SER 104  -6.682  -5.882   1.360
  796    HA   SER 104           HA       SER 104  -4.341  -7.266   0.325
  797   1HB   SER 104          2HB       SER 104  -4.926  -7.356   2.719
  798   2HB   SER 104          3HB       SER 104  -6.461  -8.154   2.326
  799    HG   SER 104           HG       SER 104  -4.916  -9.701   2.845
  800    H    THR 105           H        THR 105  -7.794  -8.212   0.504
  801    HA   THR 105           HA       THR 105  -7.395 -10.456  -1.255
  802    HB   THR 105           HB       THR 105  -9.876 -10.603  -1.207
  803    HG1  THR 105           1HG      THR 105  -9.771  -8.434   0.641
  804   1HG2  THR 105          1HG       THR 105  -8.504 -10.132   1.488
  805   2HG2  THR 105          2HG       THR 105  -9.941 -11.132   1.200
  806   3HG2  THR 105          3HG       THR 105  -8.356 -11.600   0.523
  807    H    LEU 106           H        LEU 106  -8.359  -7.171  -1.888
  808    HA   LEU 106           HA       LEU 106  -8.961  -7.151  -4.628
  809   1HB   LEU 106          2HB       LEU 106  -9.023  -5.231  -3.249
  810   2HB   LEU 106          3HB       LEU 106  -7.331  -5.367  -2.818
  811    HG   LEU 106           HG       LEU 106  -7.986  -3.451  -4.220
  812   1HD1  LEU 106          1HD1      LEU 106  -5.829  -5.143  -5.508
  813   2HD1  LEU 106          2HD1      LEU 106  -5.992  -3.386  -5.500
  814   3HD1  LEU 106          3HD1      LEU 106  -5.654  -4.248  -3.980
  815   1HD2  LEU 106          1HD2      LEU 106  -9.545  -4.594  -5.752
  816   2HD2  LEU 106          2HD2      LEU 106  -8.298  -3.669  -6.600
  817   3HD2  LEU 106          3HD2      LEU 106  -8.177  -5.435  -6.516
  818    H    VAL 107           H        VAL 107  -5.646  -7.664  -3.182
  819    HA   VAL 107           HA       VAL 107  -4.481  -7.453  -5.867
  820    HB   VAL 107           HB       VAL 107  -2.469  -7.812  -5.018
  821   1HG1  VAL 107          1HG       VAL 107  -3.474  -6.718  -2.444
  822   2HG1  VAL 107          2HG       VAL 107  -2.114  -6.205  -3.453
  823   3HG1  VAL 107          3HG       VAL 107  -3.753  -5.795  -3.944
  824   1HG2  VAL 107          1HG       VAL 107  -2.354  -9.841  -4.012
  825   2HG2  VAL 107          2HG       VAL 107  -2.067  -8.764  -2.662
  826   3HG2  VAL 107          3HG       VAL 107  -3.642  -9.482  -2.841
  827    H    ALA 108           H        ALA 108  -5.851  -9.962  -4.068
  828    HA   ALA 108           HA       ALA 108  -4.744 -12.213  -5.599
  829   1HB   ALA 108          1HB       ALA 108  -7.239 -12.132  -3.859
  830   2HB   ALA 108          2HB       ALA 108  -6.375 -13.569  -4.429
  831   3HB   ALA 108          3HB       ALA 108  -5.597 -12.467  -3.267
  832    H    GLU 109           H        GLU 109  -7.763 -10.248  -5.708
  833    HA   GLU 109           HA       GLU 109  -8.635 -11.286  -8.274
  834   1HB   GLU 109          2HB       GLU 109  -9.019  -8.532  -7.026
  835   2HB   GLU 109          3HB       GLU 109  -9.834  -9.104  -8.470
  836   1HG   GLU 109          2HG       GLU 109 -10.090 -10.475  -5.754
  837   2HG   GLU 109          3HG       GLU 109 -11.153  -9.191  -6.309
  838    H    SER 110           H        SER 110  -6.056  -9.029  -7.318
  839    HA   SER 110           HA       SER 110  -4.383  -8.075  -8.506
  840   1HB   SER 110          2HB       SER 110  -3.266  -9.511 -10.052
  841   2HB   SER 110          3HB       SER 110  -4.072 -10.569  -8.894
  842    HG   SER 110           HG       SER 110  -5.899 -10.425 -10.542
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1   3.407  -2.509  11.358
    2   2H    MET   1           H2       MET   1   2.463  -1.466  12.202
    3   3H    MET   1           H3       MET   1   2.968  -2.877  12.896
    4    HA   MET   1           HA       MET   1   4.759  -0.693  12.114
    5   1HB   MET   1          2HB       MET   1   3.296  -0.099  14.009
    6   2HB   MET   1          3HB       MET   1   3.857  -1.517  14.904
    7   1HG   MET   1          2HG       MET   1   6.090  -0.619  15.067
    8   2HG   MET   1          3HG       MET   1   5.736   0.640  13.872
    9   1HE   MET   1          1HE       MET   1   6.763   2.486  15.364
   10   2HE   MET   1          2HE       MET   1   6.230   2.871  17.015
   11   3HE   MET   1          3HE       MET   1   7.131   1.371  16.705
   12    H    SER   2           H        SER   2   6.814  -1.309  11.893
   13    HA   SER   2           HA       SER   2   8.769  -2.418  12.067
   14   1HB   SER   2          2HB       SER   2   7.457  -4.619  13.685
   15   2HB   SER   2          3HB       SER   2   9.179  -4.400  13.364
   16    HG   SER   2           HG       SER   2   8.548  -3.509  15.372
   17    H    MET   3           H        MET   3   7.217  -2.497   9.806
   18    HA   MET   3           HA       MET   3   6.648  -4.932   8.656
   19   1HB   MET   3          2HB       MET   3   6.933  -3.805   6.455
   20   2HB   MET   3          3HB       MET   3   5.946  -2.934   7.619
   21   1HG   MET   3          2HG       MET   3   7.258  -1.307   6.525
   22   2HG   MET   3          3HG       MET   3   7.915  -1.462   8.143
   23   1HE   MET   3          1HE       MET   3  10.309  -0.581   8.001
   24   2HE   MET   3          2HE       MET   3  11.253  -0.644   6.498
   25   3HE   MET   3          3HE       MET   3   9.671   0.171   6.518
   26    H    THR   4           H        THR   4   9.857  -3.502   8.764
   27    HA   THR   4           HA       THR   4  11.458  -5.189   7.321
   28    HB   THR   4           HB       THR   4  11.791  -3.858  10.014
   29    HG1  THR   4           1HG      THR   4  13.253  -2.644   8.574
   30   1HG2  THR   4          1HG       THR   4  13.984  -5.339   8.512
   31   2HG2  THR   4          2HG       THR   4  14.282  -4.083   9.734
   32   3HG2  THR   4          3HG       THR   4  13.462  -5.580  10.185
   33    H    ASP   5           H        ASP   5   9.992  -5.937  10.447
   34    HA   ASP   5           HA       ASP   5  11.412  -8.545  10.669
   35   1HB   ASP   5          2HB       ASP   5  11.589  -6.852  12.493
   36   2HB   ASP   5          3HB       ASP   5   9.835  -6.874  12.677
   37    H    LEU   6           H        LEU   6   8.149  -7.061  10.789
   38    HA   LEU   6           HA       LEU   6   6.652  -9.493  11.042
   39   1HB   LEU   6          2HB       LEU   6   5.952  -6.809   9.796
   40   2HB   LEU   6          3HB       LEU   6   4.784  -8.096  10.070
   41    HG   LEU   6           HG       LEU   6   6.340  -6.676  12.277
   42   1HD1  LEU   6          1HD1      LEU   6   3.495  -6.375  11.237
   43   2HD1  LEU   6          2HD1      LEU   6   4.107  -5.648  12.741
   44   3HD1  LEU   6          3HD1      LEU   6   4.792  -5.158  11.176
   45   1HD2  LEU   6          1HD2      LEU   6   5.647  -8.939  12.966
   46   2HD2  LEU   6          2HD2      LEU   6   4.662  -7.720  13.777
   47   3HD2  LEU   6          3HD2      LEU   6   3.995  -8.626  12.392
   48    H    LEU   7           H        LEU   7   7.740  -7.732   8.104
   49    HA   LEU   7           HA       LEU   7   6.545  -9.856   6.396
   50   1HB   LEU   7          2HB       LEU   7   7.498  -7.049   5.753
   51   2HB   LEU   7          3HB       LEU   7   7.040  -8.206   4.535
   52    HG   LEU   7           HG       LEU   7   5.358  -6.465   5.046
   53   1HD1  LEU   7          1HD1      LEU   7   4.579  -9.374   5.448
   54   2HD1  LEU   7          2HD1      LEU   7   3.425  -8.080   5.181
   55   3HD1  LEU   7          3HD1      LEU   7   4.633  -8.467   3.923
   56   1HD2  LEU   7          1HD2      LEU   7   5.667  -6.425   7.519
   57   2HD2  LEU   7          2HD2      LEU   7   3.988  -6.507   6.997
   58   3HD2  LEU   7          3HD2      LEU   7   4.763  -7.960   7.601
   59    H    ASN   8           H        ASN   8   9.404  -7.871   6.280
   60    HA   ASN   8           HA       ASN   8  11.608  -9.270   6.216
   61   1HB   ASN   8          2HB       ASN   8  10.119 -10.049   3.711
   62   2HB   ASN   8          3HB       ASN   8  11.873  -9.924   3.655
   63   1HD2  ASN   8          2HD2      ASN   8  10.298 -12.218   3.123
   64   2HD2  ASN   8          1HD2      ASN   8  10.891 -13.436   4.304
   65    H    ALA   9           H        ALA   9  12.888  -7.425   6.125
   66    HA   ALA   9           HA       ALA   9  12.461  -5.132   4.544
   67   1HB   ALA   9          1HB       ALA   9  15.051  -6.321   5.601
   68   2HB   ALA   9          2HB       ALA   9  14.900  -4.696   4.893
   69   3HB   ALA   9          3HB       ALA   9  14.004  -5.093   6.361
   70    H    GLU  10           H        GLU  10  14.186  -8.119   3.536
   71    HA   GLU  10           HA       GLU  10  15.174  -7.223   1.012
   72   1HB   GLU  10          2HB       GLU  10  14.416  -9.889   2.219
   73   2HB   GLU  10          3HB       GLU  10  14.657  -9.796   0.471
   74   1HG   GLU  10          2HG       GLU  10  16.885  -8.806   0.786
   75   2HG   GLU  10          3HG       GLU  10  16.698  -8.915   2.544
   76    H    ASP  11           H        ASP  11  12.088  -8.815   1.787
   77    HA   ASP  11           HA       ASP  11  11.031  -8.712  -0.862
   78   1HB   ASP  11          2HB       ASP  11   9.541  -8.926   1.779
   79   2HB   ASP  11          3HB       ASP  11   8.947  -9.348   0.179
   80    H    ILE  12           H        ILE  12  10.628  -6.524   1.955
   81    HA   ILE  12           HA       ILE  12   9.061  -4.497   0.663
   82    HB   ILE  12           HB       ILE  12  10.728  -4.693   3.123
   83   1HG1  ILE  12          2HG       ILE  12   8.618  -3.266   3.895
   84   2HG1  ILE  12          3HG       ILE  12   7.937  -3.751   2.352
   85   1HG2  ILE  12          1HG       ILE  12  10.057  -1.952   2.038
   86   2HG2  ILE  12          2HG       ILE  12  10.654  -2.368   3.665
   87   3HG2  ILE  12          3HG       ILE  12  11.699  -2.623   2.280
   88   1HD1  ILE  12          1HD1      ILE  12   8.969  -5.523   4.595
   89   2HD1  ILE  12          2HD1      ILE  12   7.272  -5.288   4.108
   90   3HD1  ILE  12          3HD1      ILE  12   8.395  -6.158   3.034
   91    H    LYS  13           H        LYS  13  12.634  -4.864   0.657
   92    HA   LYS  13           HA       LYS  13  13.164  -2.529  -0.853
   93   1HB   LYS  13          2HB       LYS  13  15.107  -3.435  -0.110
   94   2HB   LYS  13          3HB       LYS  13  14.566  -5.083  -0.279
   95   1HG   LYS  13          2HG       LYS  13  16.422  -4.717  -1.742
   96   2HG   LYS  13          3HG       LYS  13  14.979  -5.061  -2.673
   97   1HD   LYS  13          2HD       LYS  13  15.084  -2.210  -2.429
   98   2HD   LYS  13          3HD       LYS  13  16.742  -2.702  -2.743
   99   1HE   LYS  13          2HE       LYS  13  14.418  -3.787  -4.375
  100   2HE   LYS  13          3HE       LYS  13  15.092  -2.193  -4.729
  101   1HZ   LYS  13          1HZ       LYS  13  16.640  -4.715  -4.730
  102   2HZ   LYS  13          2HZ       LYS  13  16.122  -3.912  -6.074
  103   3HZ   LYS  13          3HZ       LYS  13  17.236  -3.222  -5.086
  104    H    LYS  14           H        LYS  14  12.308  -5.776  -2.081
  105    HA   LYS  14           HA       LYS  14  12.142  -4.880  -4.865
  106   1HB   LYS  14          2HB       LYS  14  11.592  -7.391  -3.358
  107   2HB   LYS  14          3HB       LYS  14  10.505  -7.104  -4.718
  108   1HG   LYS  14          2HG       LYS  14  12.409  -6.749  -6.234
  109   2HG   LYS  14          3HG       LYS  14  13.545  -7.038  -4.901
  110   1HD   LYS  14          2HD       LYS  14  12.769  -9.339  -4.672
  111   2HD   LYS  14          3HD       LYS  14  11.475  -9.066  -5.861
  112   1HE   LYS  14          2HE       LYS  14  13.155  -8.585  -7.608
  113   2HE   LYS  14          3HE       LYS  14  14.461  -8.843  -6.441
  114   1HZ   LYS  14          1HZ       LYS  14  12.488 -10.900  -7.248
  115   2HZ   LYS  14          2HZ       LYS  14  14.038 -10.815  -7.793
  116   3HZ   LYS  14          3HZ       LYS  14  13.737 -11.127  -6.207
  117    H    ALA  15           H        ALA  15   9.749  -5.031  -2.281
  118    HA   ALA  15           HA       ALA  15   7.462  -4.395  -3.777
  119   1HB   ALA  15          1HB       ALA  15   7.918  -3.323  -0.969
  120   2HB   ALA  15          2HB       ALA  15   6.476  -4.042  -1.692
  121   3HB   ALA  15          3HB       ALA  15   7.858  -5.061  -1.278
  122    H    VAL  16           H        VAL  16   9.496  -2.062  -1.920
  123    HA   VAL  16           HA       VAL  16   8.224   0.312  -2.881
  124    HB   VAL  16           HB       VAL  16  11.102  -0.091  -1.963
  125   1HG1  VAL  16          1HG       VAL  16   9.444   2.462  -2.174
  126   2HG1  VAL  16          2HG       VAL  16  11.043   2.327  -1.413
  127   3HG1  VAL  16          3HG       VAL  16  10.875   2.065  -3.151
  128   1HG2  VAL  16          1HG       VAL  16   9.440  -0.705  -0.211
  129   2HG2  VAL  16          2HG       VAL  16  10.312   0.782   0.167
  130   3HG2  VAL  16          3HG       VAL  16   8.640   0.866  -0.425
  131    H    GLY  17           H        GLY  17  10.933  -1.585  -4.208
  132   1HA   GLY  17          2HA       GLY  17  11.570   0.147  -6.402
  133   2HA   GLY  17          3HA       GLY  17  11.983  -1.562  -6.250
  134    H    ALA  18           H        ALA  18   8.701  -1.653  -5.971
  135    HA   ALA  18           HA       ALA  18   8.254  -2.009  -8.886
  136   1HB   ALA  18          1HB       ALA  18   6.583  -2.904  -6.503
  137   2HB   ALA  18          2HB       ALA  18   6.378  -3.384  -8.201
  138   3HB   ALA  18          3HB       ALA  18   7.830  -3.881  -7.293
  139    H    PHE  19           H        PHE  19   6.684  -0.423  -6.042
  140    HA   PHE  19           HA       PHE  19   4.810   1.162  -7.717
  141   1HB   PHE  19          2HB       PHE  19   5.635   1.193  -4.796
  142   2HB   PHE  19          3HB       PHE  19   4.538   2.377  -5.496
  143    HD1  PHE  19           1HD      PHE  19   3.860   0.675  -3.113
  144    HD2  PHE  19           2HD      PHE  19   3.070   0.173  -7.337
  145    HE1  PHE  19           1HE      PHE  19   1.814  -0.577  -2.582
  146    HE2  PHE  19           2HE      PHE  19   1.010  -1.027  -6.764
  147    HZ   PHE  19           HZ       PHE  19   0.390  -1.423  -4.435
  148    H    SER  20           H        SER  20   8.169   1.741  -6.507
  149    HA   SER  20           HA       SER  20   8.099   4.575  -6.758
  150   1HB   SER  20          2HB       SER  20  10.358   2.575  -6.760
  151   2HB   SER  20          3HB       SER  20  10.646   4.292  -7.091
  152    HG   SER  20           HG       SER  20  10.803   4.115  -4.916
  153    H    ALA  21           H        ALA  21   6.788   4.716  -8.632
  154    HA   ALA  21           HA       ALA  21   8.360   5.410 -11.049
  155   1HB   ALA  21          1HB       ALA  21   5.766   3.794 -10.984
  156   2HB   ALA  21          2HB       ALA  21   6.581   4.369 -12.460
  157   3HB   ALA  21          3HB       ALA  21   7.365   3.161 -11.425
  158    H    THR  22           H        THR  22   6.489   6.616 -12.600
  159    HA   THR  22           HA       THR  22   5.404   8.833 -11.040
  160    HB   THR  22           HB       THR  22   4.349   9.497 -13.206
  161    HG1  THR  22           1HG      THR  22   4.085   7.981 -14.591
  162   1HG2  THR  22          1HG       THR  22   7.334   8.918 -13.355
  163   2HG2  THR  22          2HG       THR  22   6.435  10.091 -14.342
  164   3HG2  THR  22          3HG       THR  22   6.573  10.332 -12.586
  165    H    ASP  23           H        ASP  23   3.721   6.761 -13.287
  166    HA   ASP  23           HA       ASP  23   1.452   6.292 -11.487
  167   1HB   ASP  23          2HB       ASP  23   0.304   6.757 -13.961
  168   2HB   ASP  23          3HB       ASP  23   0.362   7.779 -12.556
  169    H    SER  24           H        SER  24   3.238   4.369 -11.620
  170    HA   SER  24           HA       SER  24   2.082   2.260 -13.415
  171   1HB   SER  24          2HB       SER  24   4.523   3.061 -13.761
  172   2HB   SER  24          3HB       SER  24   4.876   2.110 -12.302
  173    HG   SER  24           HG       SER  24   5.082   0.756 -14.037
  174    H    PHE  25           H        PHE  25   0.676   2.662 -11.223
  175    HA   PHE  25           HA       PHE  25   1.508   1.299  -8.865
  176   1HB   PHE  25          2HB       PHE  25  -0.332   3.004  -9.005
  177   2HB   PHE  25          3HB       PHE  25  -1.288   1.945  -9.989
  178    HD1  PHE  25           1HD      PHE  25  -2.936   0.629  -8.952
  179    HD2  PHE  25           2HD      PHE  25   0.416   2.038  -6.634
  180    HE1  PHE  25           1HE      PHE  25  -3.958  -0.317  -6.890
  181    HE2  PHE  25           2HE      PHE  25  -0.582   1.050  -4.595
  182    HZ   PHE  25           HZ       PHE  25  -2.772  -0.088  -4.709
  183    H    ASP  26           H        ASP  26   1.972  -0.927  -8.934
  184    HA   ASP  26           HA       ASP  26  -0.192  -2.739  -9.938
  185   1HB   ASP  26          2HB       ASP  26   1.861  -2.647 -11.367
  186   2HB   ASP  26          3HB       ASP  26   2.755  -3.384 -10.039
  187    H    HIS  27           H        HIS  27  -1.084  -2.518  -7.835
  188    HA   HIS  27           HA       HIS  27   0.117  -3.203  -5.439
  189   1HB   HIS  27          2HB       HIS  27  -2.324  -2.326  -6.163
  190   2HB   HIS  27          3HB       HIS  27  -2.772  -3.979  -5.882
  191    HD1  HIS  27           HD1      HIS  27  -4.207  -2.166  -4.046
  192    HD2  HIS  27           HD2      HIS  27  -0.218  -3.262  -3.267
  193    HE1  HIS  27           HE1      HIS  27  -3.682  -1.409  -1.669
  194    H    LYS  28           H        LYS  28  -1.296  -5.269  -7.718
  195    HA   LYS  28           HA       LYS  28  -1.408  -7.861  -6.503
  196   1HB   LYS  28          2HB       LYS  28  -0.804  -7.378  -9.453
  197   2HB   LYS  28          3HB       LYS  28  -1.701  -8.667  -8.680
  198   1HG   LYS  28          2HG       LYS  28  -3.416  -7.455  -9.603
  199   2HG   LYS  28          3HG       LYS  28  -3.375  -6.744  -7.991
  200   1HD   LYS  28          2HD       LYS  28  -1.686  -5.043  -9.395
  201   2HD   LYS  28          3HD       LYS  28  -2.685  -5.598 -10.694
  202   1HE   LYS  28          2HE       LYS  28  -4.001  -4.670  -8.123
  203   2HE   LYS  28          3HE       LYS  28  -3.270  -3.455  -9.183
  204   1HZ   LYS  28          1HZ       LYS  28  -5.344  -5.401 -10.003
  205   2HZ   LYS  28          2HZ       LYS  28  -5.598  -3.801  -9.722
  206   3HZ   LYS  28          3HZ       LYS  28  -4.653  -4.277 -10.986
  207    H    LYS  29           H        LYS  29   1.106  -6.379  -8.691
  208    HA   LYS  29           HA       LYS  29   3.095  -8.428  -8.272
  209   1HB   LYS  29          2HB       LYS  29   3.016  -5.644  -9.388
  210   2HB   LYS  29          3HB       LYS  29   4.547  -6.149  -8.802
  211   1HG   LYS  29          2HG       LYS  29   3.399  -8.261 -10.513
  212   2HG   LYS  29          3HG       LYS  29   3.442  -6.695 -11.331
  213   1HD   LYS  29          2HD       LYS  29   5.849  -6.451 -10.509
  214   2HD   LYS  29          3HD       LYS  29   5.773  -8.171 -10.069
  215   1HE   LYS  29          2HE       LYS  29   5.480  -8.819 -12.361
  216   2HE   LYS  29          3HE       LYS  29   5.046  -7.168 -12.842
  217   1HZ   LYS  29          1HZ       LYS  29   7.729  -8.009 -11.926
  218   2HZ   LYS  29          2HZ       LYS  29   7.312  -7.659 -13.480
  219   3HZ   LYS  29          3HZ       LYS  29   7.299  -6.477 -12.339
  220    H    PHE  30           H        PHE  30   2.662  -5.203  -6.786
  221    HA   PHE  30           HA       PHE  30   4.836  -5.196  -5.027
  222   1HB   PHE  30          2HB       PHE  30   3.395  -3.280  -5.423
  223   2HB   PHE  30          3HB       PHE  30   2.034  -4.083  -4.662
  224    HD1  PHE  30           1HD      PHE  30   1.980  -4.469  -2.192
  225    HD2  PHE  30           2HD      PHE  30   5.098  -2.199  -4.107
  226    HE1  PHE  30           1HE      PHE  30   2.699  -3.603   0.012
  227    HE2  PHE  30           2HE      PHE  30   5.797  -1.302  -1.892
  228    HZ   PHE  30           HZ       PHE  30   4.646  -2.087   0.169
  229    H    PHE  31           H        PHE  31   1.513  -6.404  -4.190
  230    HA   PHE  31           HA       PHE  31   2.192  -7.436  -1.654
  231   1HB   PHE  31          2HB       PHE  31  -0.063  -7.767  -3.540
  232   2HB   PHE  31          3HB       PHE  31   0.200  -9.110  -2.463
  233    HD1  PHE  31           1HD      PHE  31  -0.825  -9.132  -0.383
  234    HD2  PHE  31           2HD      PHE  31  -0.102  -5.372  -2.316
  235    HE1  PHE  31           1HE      PHE  31  -2.104  -8.008   1.394
  236    HE2  PHE  31           2HE      PHE  31  -1.355  -4.224  -0.504
  237    HZ   PHE  31           HZ       PHE  31  -2.384  -5.552   1.340
  238    H    GLN  32           H        GLN  32   2.595  -8.945  -4.834
  239    HA   GLN  32           HA       GLN  32   3.272 -11.564  -3.761
  240   1HB   GLN  32          2HB       GLN  32   3.659 -10.243  -6.494
  241   2HB   GLN  32          3HB       GLN  32   4.166 -11.895  -6.154
  242   1HG   GLN  32          2HG       GLN  32   1.953 -12.660  -5.853
  243   2HG   GLN  32          3HG       GLN  32   1.305 -11.041  -5.616
  244   1HE2  GLN  32          2HE       GLN  32   0.158 -10.288  -7.350
  245   2HE2  GLN  32          1HE       GLN  32   0.425 -10.875  -9.009
  246    H    MET  33           H        MET  33   5.243  -8.905  -5.208
  247    HA   MET  33           HA       MET  33   7.833  -9.889  -4.724
  248   1HB   MET  33          2HB       MET  33   6.593  -7.200  -5.197
  249   2HB   MET  33          3HB       MET  33   8.112  -7.165  -4.333
  250   1HG   MET  33          2HG       MET  33   8.601  -6.902  -6.612
  251   2HG   MET  33          3HG       MET  33   9.207  -8.472  -6.096
  252   1HE   MET  33          1HE       MET  33   9.669  -8.733  -8.658
  253   2HE   MET  33          2HE       MET  33   8.408  -8.818  -9.908
  254   3HE   MET  33          3HE       MET  33   8.783  -7.262  -9.122
  255    H    VAL  34           H        VAL  34   5.852  -7.850  -2.583
  256    HA   VAL  34           HA       VAL  34   7.788  -7.721  -0.446
  257    HB   VAL  34           HB       VAL  34   5.963  -6.091  -1.161
  258   1HG1  VAL  34          1HG       VAL  34   4.274  -7.640   0.726
  259   2HG1  VAL  34          2HG       VAL  34   3.841  -6.231  -0.290
  260   3HG1  VAL  34          3HG       VAL  34   4.170  -7.821  -1.014
  261   1HG2  VAL  34          1HG       VAL  34   7.383  -5.844   0.909
  262   2HG2  VAL  34          2HG       VAL  34   5.785  -5.079   1.005
  263   3HG2  VAL  34          3HG       VAL  34   6.093  -6.621   1.832
  264    H    GLY  35           H        GLY  35   5.834 -10.327  -1.364
  265   1HA   GLY  35          2HA       GLY  35   5.102 -12.222  -0.337
  266   2HA   GLY  35          3HA       GLY  35   6.175 -11.833   1.014
  267    H    LEU  36           H        LEU  36   3.623  -9.549   0.252
  268    HA   LEU  36           HA       LEU  36   2.627  -9.611   2.927
  269   1HB   LEU  36          2HB       LEU  36   1.841  -8.258   0.367
  270   2HB   LEU  36          3HB       LEU  36   0.561  -8.468   1.562
  271    HG   LEU  36           HG       LEU  36   3.150  -7.183   2.375
  272   1HD1  LEU  36          1HD1      LEU  36   0.603  -5.672   1.691
  273   2HD1  LEU  36          2HD1      LEU  36   2.218  -5.030   2.035
  274   3HD1  LEU  36          3HD1      LEU  36   1.880  -5.863   0.503
  275   1HD2  LEU  36          1HD2      LEU  36   1.539  -8.198   4.057
  276   2HD2  LEU  36          2HD2      LEU  36   1.920  -6.479   4.167
  277   3HD2  LEU  36          3HD2      LEU  36   0.346  -7.030   3.500
  278    H    LYS  37           H        LYS  37   0.956 -10.517   0.047
  279    HA   LYS  37           HA       LYS  37  -1.184 -12.152   1.100
  280   1HB   LYS  37          2HB       LYS  37   0.257 -12.192  -1.565
  281   2HB   LYS  37          3HB       LYS  37  -0.755 -13.570  -1.138
  282   1HG   LYS  37          2HG       LYS  37  -2.612 -11.878  -0.575
  283   2HG   LYS  37          3HG       LYS  37  -1.630 -10.713  -1.449
  284   1HD   LYS  37          2HD       LYS  37  -2.826 -13.275  -2.554
  285   2HD   LYS  37          3HD       LYS  37  -3.366 -11.622  -2.855
  286   1HE   LYS  37          2HE       LYS  37  -1.079 -11.159  -3.885
  287   2HE   LYS  37          3HE       LYS  37  -0.779 -12.902  -3.780
  288   1HZ   LYS  37          1HZ       LYS  37  -2.894 -11.532  -5.356
  289   2HZ   LYS  37          2HZ       LYS  37  -1.658 -12.445  -5.934
  290   3HZ   LYS  37          3HZ       LYS  37  -2.880 -13.163  -5.107
  291    H    LYS  38           H        LYS  38   2.207 -12.935   1.233
  292    HA   LYS  38           HA       LYS  38   1.693 -15.825   1.762
  293   1HB   LYS  38          2HB       LYS  38   4.373 -14.393   1.829
  294   2HB   LYS  38          3HB       LYS  38   4.068 -16.117   1.795
  295   1HG   LYS  38          2HG       LYS  38   3.283 -15.985  -0.535
  296   2HG   LYS  38          3HG       LYS  38   3.407 -14.222  -0.506
  297   1HD   LYS  38          2HD       LYS  38   5.358 -14.981  -1.638
  298   2HD   LYS  38          3HD       LYS  38   5.858 -14.407  -0.055
  299   1HE   LYS  38          2HE       LYS  38   7.086 -16.378  -0.390
  300   2HE   LYS  38          3HE       LYS  38   5.815 -16.818   0.754
  301   1HZ   LYS  38          1HZ       LYS  38   5.800 -17.350  -2.162
  302   2HZ   LYS  38          2HZ       LYS  38   6.025 -18.472  -0.984
  303   3HZ   LYS  38          3HZ       LYS  38   4.565 -17.728  -1.144
  304    H    LYS  39           H        LYS  39   2.125 -12.821   3.428
  305    HA   LYS  39           HA       LYS  39   2.635 -14.063   6.056
  306   1HB   LYS  39          2HB       LYS  39   2.790 -11.330   4.897
  307   2HB   LYS  39          3HB       LYS  39   1.930 -11.358   6.423
  308   1HG   LYS  39          2HG       LYS  39   4.188 -11.005   7.004
  309   2HG   LYS  39          3HG       LYS  39   3.851 -12.681   7.416
  310   1HD   LYS  39          2HD       LYS  39   4.880 -13.282   5.087
  311   2HD   LYS  39          3HD       LYS  39   5.387 -11.595   5.009
  312   1HE   LYS  39          2HE       LYS  39   7.268 -12.759   5.855
  313   2HE   LYS  39          3HE       LYS  39   6.563 -11.932   7.234
  314   1HZ   LYS  39          1HZ       LYS  39   6.196 -14.785   6.571
  315   2HZ   LYS  39          2HZ       LYS  39   7.089 -14.169   7.815
  316   3HZ   LYS  39          3HZ       LYS  39   5.455 -14.005   7.825
  317    H    SER  40           H        SER  40   1.109 -13.127   7.816
  318    HA   SER  40           HA       SER  40  -1.352 -14.605   7.283
  319   1HB   SER  40          2HB       SER  40  -0.004 -14.928   9.321
  320   2HB   SER  40          3HB       SER  40  -0.360 -13.266   9.832
  321    HG   SER  40           HG       SER  40  -1.740 -15.054  10.659
  322    H    ALA  41           H        ALA  41  -3.447 -13.916   8.014
  323    HA   ALA  41           HA       ALA  41  -4.445 -11.407   7.045
  324   1HB   ALA  41          1HB       ALA  41  -5.588 -13.341   9.106
  325   2HB   ALA  41          2HB       ALA  41  -6.491 -12.083   8.248
  326   3HB   ALA  41          3HB       ALA  41  -5.820 -13.460   7.338
  327    H    ASP  42           H        ASP  42  -3.492 -12.528  10.315
  328    HA   ASP  42           HA       ASP  42  -4.224 -10.074  11.636
  329   1HB   ASP  42          2HB       ASP  42  -3.994 -12.097  12.945
  330   2HB   ASP  42          3HB       ASP  42  -2.315 -12.309  12.424
  331    H    ASP  43           H        ASP  43  -1.353 -11.142   9.867
  332    HA   ASP  43           HA       ASP  43   0.420  -9.029  10.759
  333   1HB   ASP  43          2HB       ASP  43   0.971 -11.265   9.494
  334   2HB   ASP  43          3HB       ASP  43   0.612 -10.331   8.037
  335    H    VAL  44           H        VAL  44  -1.714  -9.467   7.926
  336    HA   VAL  44           HA       VAL  44  -1.456  -7.014   6.656
  337    HB   VAL  44           HB       VAL  44  -3.369  -9.234   6.727
  338   1HG1  VAL  44          1HG       VAL  44  -4.361  -6.584   5.642
  339   2HG1  VAL  44          2HG       VAL  44  -5.092  -8.189   5.384
  340   3HG1  VAL  44          3HG       VAL  44  -5.040  -7.518   7.009
  341   1HG2  VAL  44          1HG       VAL  44  -1.473  -8.969   5.148
  342   2HG2  VAL  44          2HG       VAL  44  -3.033  -9.140   4.344
  343   3HG2  VAL  44          3HG       VAL  44  -2.275  -7.537   4.458
  344    H    LYS  45           H        LYS  45  -3.285  -7.557   9.635
  345    HA   LYS  45           HA       LYS  45  -4.489  -4.915   9.776
  346   1HB   LYS  45          2HB       LYS  45  -3.982  -7.167  11.650
  347   2HB   LYS  45          3HB       LYS  45  -3.930  -5.582  12.407
  348   1HG   LYS  45          2HG       LYS  45  -6.193  -5.096  11.523
  349   2HG   LYS  45          3HG       LYS  45  -6.244  -6.714  10.782
  350   1HD   LYS  45          2HD       LYS  45  -5.978  -7.761  13.008
  351   2HD   LYS  45          3HD       LYS  45  -5.838  -6.158  13.759
  352   1HE   LYS  45          2HE       LYS  45  -8.137  -5.607  12.914
  353   2HE   LYS  45          3HE       LYS  45  -8.275  -7.262  12.300
  354   1HZ   LYS  45          1HZ       LYS  45  -7.865  -6.507  15.138
  355   2HZ   LYS  45          2HZ       LYS  45  -9.275  -7.054  14.491
  356   3HZ   LYS  45          3HZ       LYS  45  -7.966  -8.049  14.582
  357    H    LYS  46           H        LYS  46  -1.269  -6.062  10.706
  358    HA   LYS  46           HA       LYS  46  -0.466  -3.445  11.828
  359   1HB   LYS  46          2HB       LYS  46   1.090  -6.034  11.374
  360   2HB   LYS  46          3HB       LYS  46   1.751  -4.570  12.075
  361   1HG   LYS  46          2HG       LYS  46   1.307  -5.964  13.890
  362   2HG   LYS  46          3HG       LYS  46   0.049  -4.724  13.937
  363   1HD   LYS  46          2HD       LYS  46  -1.598  -6.295  13.075
  364   2HD   LYS  46          3HD       LYS  46  -0.336  -7.478  12.699
  365   1HE   LYS  46          2HE       LYS  46  -0.588  -6.585  15.545
  366   2HE   LYS  46          3HE       LYS  46  -1.929  -7.549  14.897
  367   1HZ   LYS  46          1HZ       LYS  46   0.826  -8.504  14.555
  368   2HZ   LYS  46          2HZ       LYS  46  -0.041  -8.835  15.929
  369   3HZ   LYS  46          3HZ       LYS  46  -0.592  -9.352  14.496
  370    H    VAL  47           H        VAL  47  -0.219  -5.175   8.819
  371    HA   VAL  47           HA       VAL  47   1.575  -3.423   7.394
  372    HB   VAL  47           HB       VAL  47  -0.776  -4.988   6.288
  373   1HG1  VAL  47          1HG       VAL  47   1.736  -4.223   4.778
  374   2HG1  VAL  47          2HG       VAL  47   0.222  -4.889   4.145
  375   3HG1  VAL  47          3HG       VAL  47   0.282  -3.226   4.743
  376   1HG2  VAL  47          1HG       VAL  47   1.086  -6.342   7.586
  377   2HG2  VAL  47          2HG       VAL  47   0.635  -6.865   5.978
  378   3HG2  VAL  47          3HG       VAL  47   2.104  -5.903   6.246
  379    H    PHE  48           H        PHE  48  -2.137  -3.436   7.217
  380    HA   PHE  48           HA       PHE  48  -2.503  -0.978   6.217
  381   1HB   PHE  48          2HB       PHE  48  -4.212  -2.724   6.996
  382   2HB   PHE  48          3HB       PHE  48  -4.026  -2.082   8.602
  383    HD1  PHE  48           1HD      PHE  48  -4.243  -0.252   5.263
  384    HD2  PHE  48           2HD      PHE  48  -6.029  -1.011   9.132
  385    HE1  PHE  48           1HE      PHE  48  -5.967   1.433   4.801
  386    HE2  PHE  48           2HE      PHE  48  -7.831   0.576   8.589
  387    HZ   PHE  48           HZ       PHE  48  -7.781   1.826   6.434
  388    H    HIS  49           H        HIS  49  -1.887  -1.532   9.725
  389    HA   HIS  49           HA       HIS  49  -2.058   1.177  10.546
  390   1HB   HIS  49          2HB       HIS  49  -1.907  -0.770  12.061
  391   2HB   HIS  49          3HB       HIS  49  -0.236  -1.037  11.571
  392    HD1  HIS  49           HD1      HIS  49  -2.185   0.759  14.159
  393    HD2  HIS  49           HD2      HIS  49   1.528   1.134  12.208
  394    HE1  HIS  49           HE1      HIS  49  -0.754   2.337  15.584
  395    H    MET  50           H        MET  50   0.507  -0.390   8.685
  396    HA   MET  50           HA       MET  50   2.560   1.556   9.267
  397   1HB   MET  50          2HB       MET  50   2.594  -0.993   8.342
  398   2HB   MET  50          3HB       MET  50   2.599  -0.153   6.800
  399   1HG   MET  50          2HG       MET  50   4.840  -0.456   7.249
  400   2HG   MET  50          3HG       MET  50   4.594   1.194   7.814
  401   1HE   MET  50          1HE       MET  50   4.026   1.515  10.777
  402   2HE   MET  50          2HE       MET  50   5.655   1.182  11.390
  403   3HE   MET  50          3HE       MET  50   5.454   2.032   9.847
  404    H    LEU  51           H        LEU  51   0.315   1.057   6.519
  405    HA   LEU  51           HA       LEU  51   1.129   3.578   5.175
  406   1HB   LEU  51          2HB       LEU  51  -0.853   3.070   3.734
  407   2HB   LEU  51          3HB       LEU  51   0.565   2.072   3.585
  408    HG   LEU  51           HG       LEU  51  -1.606   1.031   5.365
  409   1HD1  LEU  51          1HD1      LEU  51  -1.913   1.219   2.350
  410   2HD1  LEU  51          2HD1      LEU  51  -2.810   0.079   3.368
  411   3HD1  LEU  51          3HD1      LEU  51  -3.026   1.817   3.604
  412   1HD2  LEU  51          1HD2      LEU  51   0.577  -0.178   4.756
  413   2HD2  LEU  51          2HD2      LEU  51  -0.916  -1.076   4.439
  414   3HD2  LEU  51          3HD2      LEU  51  -0.060  -0.279   3.107
  415    H    ASP  52           H        ASP  52  -1.747   2.550   7.157
  416    HA   ASP  52           HA       ASP  52  -3.116   5.059   6.915
  417   1HB   ASP  52          2HB       ASP  52  -4.175   2.925   7.633
  418   2HB   ASP  52          3HB       ASP  52  -3.269   2.994   9.144
  419    H    LYS  53           H        LYS  53  -1.929   6.841   7.279
  420    HA   LYS  53           HA       LYS  53   0.133   6.755   9.371
  421   1HB   LYS  53          2HB       LYS  53  -0.233   7.871   6.683
  422   2HB   LYS  53          3HB       LYS  53   0.469   9.060   7.761
  423   1HG   LYS  53          2HG       LYS  53   1.629   6.294   8.023
  424   2HG   LYS  53          3HG       LYS  53   1.822   6.997   6.446
  425   1HD   LYS  53          2HD       LYS  53   2.507   8.581   8.966
  426   2HD   LYS  53          3HD       LYS  53   3.662   7.440   8.270
  427   1HE   LYS  53          2HE       LYS  53   2.383   9.763   6.758
  428   2HE   LYS  53          3HE       LYS  53   4.001   9.795   7.481
  429   1HZ   LYS  53          1HZ       LYS  53   3.088   7.928   5.370
  430   2HZ   LYS  53          2HZ       LYS  53   4.105   9.194   5.141
  431   3HZ   LYS  53          3HZ       LYS  53   4.572   7.898   6.063
  432    H    ASP  54           H        ASP  54  -2.800   7.548   9.793
  433    HA   ASP  54           HA       ASP  54  -2.293   9.746  11.750
  434   1HB   ASP  54          2HB       ASP  54  -4.591  10.471  11.258
  435   2HB   ASP  54          3HB       ASP  54  -3.615  10.466   9.787
  436    H    LYS  55           H        LYS  55  -3.298   6.480  11.379
  437    HA   LYS  55           HA       LYS  55  -4.183   4.899  12.724
  438   1HB   LYS  55          2HB       LYS  55  -3.400   6.910  14.836
  439   2HB   LYS  55          3HB       LYS  55  -4.507   5.644  15.292
  440   1HG   LYS  55          2HG       LYS  55  -2.339   4.967  15.849
  441   2HG   LYS  55          3HG       LYS  55  -2.957   3.911  14.583
  442   1HD   LYS  55          2HD       LYS  55  -1.159   6.241  13.842
  443   2HD   LYS  55          3HD       LYS  55  -0.474   4.784  14.580
  444   1HE   LYS  55          2HE       LYS  55  -1.788   3.439  12.814
  445   2HE   LYS  55          3HE       LYS  55  -2.016   4.969  11.967
  446   1HZ   LYS  55          1HZ       LYS  55   0.552   3.693  12.673
  447   2HZ   LYS  55          2HZ       LYS  55  -0.104   3.815  11.163
  448   3HZ   LYS  55          3HZ       LYS  55   0.412   5.183  11.921
  449    H    SER  56           H        SER  56  -5.857   6.717  11.181
  450    HA   SER  56           HA       SER  56  -8.388   6.521  12.796
  451   1HB   SER  56          2HB       SER  56  -9.519   7.843  11.210
  452   2HB   SER  56          3HB       SER  56  -8.034   8.679  11.690
  453    HG   SER  56           HG       SER  56  -7.318   8.591   9.723
  454    H    GLY  57           H        GLY  57  -6.639   4.577  10.614
  455   1HA   GLY  57          2HA       GLY  57  -7.212   2.463   9.919
  456   2HA   GLY  57          3HA       GLY  57  -8.806   2.645  10.660
  457    H    PHE  58           H        PHE  58  -7.530   4.813   8.195
  458    HA   PHE  58           HA       PHE  58  -8.840   3.628   5.921
  459   1HB   PHE  58          2HB       PHE  58 -10.124   6.161   7.033
  460   2HB   PHE  58          3HB       PHE  58 -10.329   5.576   5.448
  461    HD1  PHE  58           1HD      PHE  58 -11.050   3.015   5.140
  462    HD2  PHE  58           2HD      PHE  58 -11.841   5.440   8.623
  463    HE1  PHE  58           1HE      PHE  58 -12.976   1.566   5.706
  464    HE2  PHE  58           2HE      PHE  58 -13.778   3.985   9.177
  465    HZ   PHE  58           HZ       PHE  58 -14.352   2.057   7.714
  466    H    ILE  59           H        ILE  59  -7.305   4.126   4.340
  467    HA   ILE  59           HA       ILE  59  -5.882   6.705   4.501
  468    HB   ILE  59           HB       ILE  59  -5.428   4.132   3.260
  469   1HG1  ILE  59          2HG       ILE  59  -3.799   6.638   3.808
  470   2HG1  ILE  59          3HG       ILE  59  -3.911   5.181   4.804
  471   1HG2  ILE  59          1HG       ILE  59  -4.853   6.485   1.434
  472   2HG2  ILE  59          2HG       ILE  59  -4.390   4.800   1.148
  473   3HG2  ILE  59          3HG       ILE  59  -6.077   5.224   1.091
  474   1HD1  ILE  59          1HD1      ILE  59  -2.507   5.524   2.129
  475   2HD1  ILE  59          2HD1      ILE  59  -1.793   5.168   3.690
  476   3HD1  ILE  59          3HD1      ILE  59  -2.814   3.941   2.886
  477    H    GLU  60           H        GLU  60  -6.422   8.517   3.567
  478    HA   GLU  60           HA       GLU  60  -8.110   8.488   1.142
  479   1HB   GLU  60          2HB       GLU  60  -8.415  10.946   1.536
  480   2HB   GLU  60          3HB       GLU  60  -9.154   9.893   2.697
  481   1HG   GLU  60          2HG       GLU  60  -6.406  11.031   3.301
  482   2HG   GLU  60          3HG       GLU  60  -7.838  12.053   3.461
  483    H    GLU  61           H        GLU  61  -7.533  10.492  -0.292
  484    HA   GLU  61           HA       GLU  61  -5.295  10.189  -1.783
  485   1HB   GLU  61          2HB       GLU  61  -5.891  12.205  -2.869
  486   2HB   GLU  61          3HB       GLU  61  -7.332  11.298  -2.420
  487   1HG   GLU  61          2HG       GLU  61  -7.513  12.828  -0.364
  488   2HG   GLU  61          3HG       GLU  61  -6.279  13.836  -1.129
  489    H    ASP  62           H        ASP  62  -5.431  12.259   1.083
  490    HA   ASP  62           HA       ASP  62  -3.070  13.797   0.557
  491   1HB   ASP  62          2HB       ASP  62  -4.931  14.396   2.118
  492   2HB   ASP  62          3HB       ASP  62  -4.392  13.132   3.223
  493    H    GLU  63           H        GLU  63  -3.536  11.058   2.825
  494    HA   GLU  63           HA       GLU  63  -0.750  10.482   3.357
  495   1HB   GLU  63          2HB       GLU  63  -3.292   8.841   3.475
  496   2HB   GLU  63          3HB       GLU  63  -1.699   8.188   3.902
  497   1HG   GLU  63          2HG       GLU  63  -1.412   9.847   5.660
  498   2HG   GLU  63          3HG       GLU  63  -2.911  10.666   5.190
  499    H    LEU  64           H        LEU  64  -3.056   9.397   0.919
  500    HA   LEU  64           HA       LEU  64  -1.836   7.284  -0.309
  501   1HB   LEU  64          2HB       LEU  64  -3.979   8.943  -0.759
  502   2HB   LEU  64          3HB       LEU  64  -3.035   9.289  -2.172
  503    HG   LEU  64           HG       LEU  64  -3.185   6.422  -1.691
  504   1HD1  LEU  64          1HD1      LEU  64  -5.854   7.867  -2.026
  505   2HD1  LEU  64          2HD1      LEU  64  -5.608   6.099  -2.003
  506   3HD1  LEU  64          3HD1      LEU  64  -5.348   7.073  -0.549
  507   1HD2  LEU  64          1HD2      LEU  64  -2.716   7.318  -3.877
  508   2HD2  LEU  64          2HD2      LEU  64  -4.324   6.543  -3.976
  509   3HD2  LEU  64          3HD2      LEU  64  -4.209   8.286  -3.861
  510    H    GLY  65           H        GLY  65  -1.230  10.704  -1.058
  511   1HA   GLY  65          2HA       GLY  65   0.492  10.690  -3.198
  512   2HA   GLY  65          3HA       GLY  65   0.628  11.772  -1.829
  513    H    PHE  66           H        PHE  66   1.320   9.688   0.100
  514    HA   PHE  66           HA       PHE  66   3.935   8.632  -0.792
  515   1HB   PHE  66          2HB       PHE  66   5.087   9.769   1.128
  516   2HB   PHE  66          3HB       PHE  66   4.599  10.797  -0.196
  517    HD1  PHE  66           1HD      PHE  66   3.883   9.907   3.304
  518    HD2  PHE  66           2HD      PHE  66   2.900  12.530   0.051
  519    HE1  PHE  66           1HE      PHE  66   2.602  11.394   4.883
  520    HE2  PHE  66           2HE      PHE  66   1.611  13.978   1.598
  521    HZ   PHE  66           HZ       PHE  66   1.463  13.412   4.006
  522    H    ILE  67           H        ILE  67   1.581   7.249  -0.217
  523    HA   ILE  67           HA       ILE  67   1.150   6.018   2.258
  524    HB   ILE  67           HB       ILE  67  -0.223   5.943   0.279
  525   1HG1  ILE  67          2HG       ILE  67  -0.177   4.063   1.944
  526   2HG1  ILE  67          3HG       ILE  67  -1.098   3.852   0.462
  527   1HG2  ILE  67          1HG       ILE  67   1.842   4.214  -1.131
  528   2HG2  ILE  67          2HG       ILE  67   0.208   4.603  -1.686
  529   3HG2  ILE  67          3HG       ILE  67   1.423   5.873  -1.563
  530   1HD1  ILE  67          1HD1      ILE  67   1.688   2.729   0.897
  531   2HD1  ILE  67          2HD1      ILE  67   0.181   1.816   1.145
  532   3HD1  ILE  67          3HD1      ILE  67   0.609   2.411  -0.470
  533    H    LEU  68           H        LEU  68   3.534   5.343  -0.204
  534    HA   LEU  68           HA       LEU  68   4.771   3.059   0.876
  535   1HB   LEU  68          2HB       LEU  68   5.661   5.313  -0.944
  536   2HB   LEU  68          3HB       LEU  68   6.764   4.018  -0.497
  537    HG   LEU  68           HG       LEU  68   4.170   2.934  -1.336
  538   1HD1  LEU  68          1HD1      LEU  68   5.703   4.459  -3.468
  539   2HD1  LEU  68          2HD1      LEU  68   4.219   3.491  -3.648
  540   3HD1  LEU  68          3HD1      LEU  68   4.170   4.996  -2.743
  541   1HD2  LEU  68          1HD2      LEU  68   6.353   1.710  -1.039
  542   2HD2  LEU  68          2HD2      LEU  68   5.707   1.504  -2.661
  543   3HD2  LEU  68          3HD2      LEU  68   7.026   2.636  -2.401
  544    H    LYS  69           H        LYS  69   5.058   6.378   2.101
  545    HA   LYS  69           HA       LYS  69   7.587   5.898   3.467
  546   1HB   LYS  69          2HB       LYS  69   5.406   7.974   3.826
  547   2HB   LYS  69          3HB       LYS  69   6.754   7.851   4.948
  548   1HG   LYS  69          2HG       LYS  69   8.324   8.107   2.977
  549   2HG   LYS  69          3HG       LYS  69   6.894   8.444   1.985
  550   1HD   LYS  69          2HD       LYS  69   7.426  10.582   2.480
  551   2HD   LYS  69          3HD       LYS  69   6.471  10.286   3.927
  552   1HE   LYS  69          2HE       LYS  69   9.510  10.072   3.638
  553   2HE   LYS  69          3HE       LYS  69   8.647  11.422   4.376
  554   1HZ   LYS  69          1HZ       LYS  69   8.645   8.648   5.416
  555   2HZ   LYS  69          2HZ       LYS  69   9.534   9.886   6.023
  556   3HZ   LYS  69          3HZ       LYS  69   7.898   9.940   6.118
  557    H    GLY  70           H        GLY  70   4.543   4.539   3.998
  558   1HA   GLY  70          2HA       GLY  70   5.183   3.710   6.776
  559   2HA   GLY  70          3HA       GLY  70   3.866   3.115   5.725
  560    H    PHE  71           H        PHE  71   5.039   2.214   3.510
  561    HA   PHE  71           HA       PHE  71   6.131  -0.277   4.328
  562   1HB   PHE  71          2HB       PHE  71   6.194   1.069   1.606
  563   2HB   PHE  71          3HB       PHE  71   6.615  -0.607   1.917
  564    HD1  PHE  71           1HD      PHE  71   4.198   1.037   0.327
  565    HD2  PHE  71           2HD      PHE  71   4.544  -1.671   3.676
  566    HE1  PHE  71           1HE      PHE  71   1.912   0.206  -0.096
  567    HE2  PHE  71           2HE      PHE  71   2.249  -2.471   3.248
  568    HZ   PHE  71           HZ       PHE  71   0.934  -1.556   1.348
  569    H    SER  72           H        SER  72   7.949   2.727   3.166
  570    HA   SER  72           HA       SER  72  10.175   2.175   4.790
  571   1HB   SER  72          2HB       SER  72  10.030   0.764   2.203
  572   2HB   SER  72          3HB       SER  72  11.582   1.594   2.468
  573    HG   SER  72           HG       SER  72  10.186  -0.200   4.136
  574    HA   PRO  73           HA       PRO  73  11.452   6.064   2.873
  575   1HB   PRO  73          2HB       PRO  73  14.184   6.015   2.807
  576   2HB   PRO  73          3HB       PRO  73  13.246   6.147   4.327
  577   1HG   PRO  73          2HG       PRO  73  14.419   3.641   3.082
  578   2HG   PRO  73          3HG       PRO  73  14.584   4.215   4.774
  579   1HD   PRO  73          2HD       PRO  73  12.739   2.367   4.057
  580   2HD   PRO  73          3HD       PRO  73  12.369   3.592   5.298
  581    H    ASP  74           H        ASP  74  12.647   6.917   1.092
  582    HA   ASP  74           HA       ASP  74  12.806   7.346  -1.112
  583   1HB   ASP  74          2HB       ASP  74  14.549   5.549  -1.193
  584   2HB   ASP  74          3HB       ASP  74  13.293   4.441  -1.767
  585    H    ALA  75           H        ALA  75  10.395   6.039   0.322
  586    HA   ALA  75           HA       ALA  75   8.321   5.763  -1.614
  587   1HB   ALA  75          1HB       ALA  75   8.572   6.867   1.200
  588   2HB   ALA  75          2HB       ALA  75   7.023   6.612   0.367
  589   3HB   ALA  75          3HB       ALA  75   8.122   5.234   0.729
  590    H    ARG  76           H        ARG  76   8.953   7.253  -3.264
  591    HA   ARG  76           HA       ARG  76   8.993  10.119  -2.802
  592   1HB   ARG  76          2HB       ARG  76   8.665   8.683  -5.484
  593   2HB   ARG  76          3HB       ARG  76   9.265  10.329  -5.192
  594   1HG   ARG  76          2HG       ARG  76  11.020   9.106  -3.649
  595   2HG   ARG  76          3HG       ARG  76  10.588   7.678  -4.602
  596   1HD   ARG  76          2HD       ARG  76  11.598   8.450  -6.519
  597   2HD   ARG  76          3HD       ARG  76  11.472  10.149  -6.045
  598    HE   ARG  76           HE       ARG  76  13.311   8.144  -4.704
  599   1HH1  ARG  76          1HH2      ARG  76  12.726  11.523  -5.463
  600   2HH1  ARG  76          2HH2      ARG  76  14.006  12.046  -4.394
  601   1HH2  ARG  76          1HH1      ARG  76  14.724   8.773  -3.452
  602   2HH2  ARG  76          2HH1      ARG  76  15.260  10.461  -3.274
  603    H    ASP  77           H        ASP  77   7.594  11.638  -3.998
  604    HA   ASP  77           HA       ASP  77   4.786  11.302  -3.418
  605   1HB   ASP  77          2HB       ASP  77   6.050  13.459  -3.338
  606   2HB   ASP  77          3HB       ASP  77   6.216  13.407  -5.091
  607    H    LEU  78           H        LEU  78   3.772   9.710  -4.545
  608    HA   LEU  78           HA       LEU  78   4.422   9.067  -7.320
  609   1HB   LEU  78          2HB       LEU  78   2.298   7.656  -7.197
  610   2HB   LEU  78          3HB       LEU  78   3.678   7.220  -6.210
  611    HG   LEU  78           HG       LEU  78   2.596   8.116  -4.183
  612   1HD1  LEU  78          1HD1      LEU  78   0.283   8.713  -6.095
  613   2HD1  LEU  78          2HD1      LEU  78   0.140   8.689  -4.329
  614   3HD1  LEU  78          3HD1      LEU  78   1.184   9.886  -5.111
  615   1HD2  LEU  78          1HD2      LEU  78   2.219   5.744  -4.966
  616   2HD2  LEU  78          2HD2      LEU  78   1.022   6.429  -3.841
  617   3HD2  LEU  78          3HD2      LEU  78   0.640   6.308  -5.553
  618    H    SER  79           H        SER  79   2.889   9.177  -9.151
  619    HA   SER  79           HA       SER  79   2.190  11.924  -9.610
  620   1HB   SER  79          2HB       SER  79   2.905  10.342 -11.349
  621   2HB   SER  79          3HB       SER  79   1.453   9.368 -11.075
  622    HG   SER  79           HG       SER  79   1.240  10.527 -12.878
  623    H    ALA  80           H        ALA  80   0.190  12.959  -9.817
  624    HA   ALA  80           HA       ALA  80  -1.961  12.184  -8.143
  625   1HB   ALA  80          1HB       ALA  80  -1.989  14.016 -10.573
  626   2HB   ALA  80          2HB       ALA  80  -3.233  13.939  -9.303
  627   3HB   ALA  80          3HB       ALA  80  -1.594  14.484  -8.899
  628    H    LYS  81           H        LYS  81  -1.225  11.256 -11.467
  629    HA   LYS  81           HA       LYS  81  -3.822  10.065 -12.043
  630   1HB   LYS  81          2HB       LYS  81  -1.349   9.004 -13.376
  631   2HB   LYS  81          3HB       LYS  81  -2.960   9.262 -14.010
  632   1HG   LYS  81          2HG       LYS  81  -2.322  11.842 -13.779
  633   2HG   LYS  81          3HG       LYS  81  -0.678  11.195 -13.653
  634   1HD   LYS  81          2HD       LYS  81  -0.848  11.618 -15.931
  635   2HD   LYS  81          3HD       LYS  81  -1.166   9.891 -15.807
  636   1HE   LYS  81          2HE       LYS  81  -2.911  10.532 -17.198
  637   2HE   LYS  81          3HE       LYS  81  -3.699  10.643 -15.618
  638   1HZ   LYS  81          1HZ       LYS  81  -2.516  12.884 -17.151
  639   2HZ   LYS  81          2HZ       LYS  81  -4.121  12.626 -16.907
  640   3HZ   LYS  81          3HZ       LYS  81  -3.146  13.037 -15.643
  641    H    GLU  82           H        GLU  82  -0.783   8.890 -10.623
  642    HA   GLU  82           HA       GLU  82  -1.434   6.120 -10.316
  643   1HB   GLU  82          2HB       GLU  82   0.775   7.653  -9.948
  644   2HB   GLU  82          3HB       GLU  82   0.265   7.570  -8.287
  645   1HG   GLU  82          2HG       GLU  82   0.575   5.052  -9.970
  646   2HG   GLU  82          3HG       GLU  82   1.970   5.839  -9.235
  647    H    THR  83           H        THR  83  -1.562   8.871  -8.016
  648    HA   THR  83           HA       THR  83  -3.053   7.766  -5.989
  649    HB   THR  83           HB       THR  83  -2.633  10.505  -7.004
  650    HG1  THR  83           1HG      THR  83  -2.057  10.731  -4.841
  651   1HG2  THR  83          1HG       THR  83  -4.929  10.027  -5.057
  652   2HG2  THR  83          2HG       THR  83  -4.104  11.573  -5.313
  653   3HG2  THR  83          3HG       THR  83  -5.014  10.840  -6.636
  654    H    LYS  84           H        LYS  84  -4.548   9.255  -8.892
  655    HA   LYS  84           HA       LYS  84  -7.223   8.722  -8.076
  656   1HB   LYS  84          2HB       LYS  84  -6.074  10.118 -10.113
  657   2HB   LYS  84          3HB       LYS  84  -6.625   8.712 -11.024
  658   1HG   LYS  84          2HG       LYS  84  -8.935   9.099 -10.231
  659   2HG   LYS  84          3HG       LYS  84  -8.362  10.375  -9.138
  660   1HD   LYS  84          2HD       LYS  84  -7.537  11.657 -11.149
  661   2HD   LYS  84          3HD       LYS  84  -8.349  10.457 -12.182
  662   1HE   LYS  84          2HE       LYS  84 -10.511  10.987 -11.096
  663   2HE   LYS  84          3HE       LYS  84  -9.700  12.109  -9.995
  664   1HZ   LYS  84          1HZ       LYS  84  -9.858  12.426 -12.934
  665   2HZ   LYS  84          2HZ       LYS  84 -10.714  13.289 -11.827
  666   3HZ   LYS  84          3HZ       LYS  84  -9.082  13.453 -11.909
  667    H    MET  85           H        MET  85  -5.056   6.704 -10.072
  668    HA   MET  85           HA       MET  85  -6.970   4.546 -10.460
  669   1HB   MET  85          2HB       MET  85  -3.924   4.624 -10.640
  670   2HB   MET  85          3HB       MET  85  -4.926   3.239 -11.097
  671   1HG   MET  85          2HG       MET  85  -6.093   4.606 -12.780
  672   2HG   MET  85          3HG       MET  85  -5.117   6.009 -12.337
  673   1HE   MET  85          1HE       MET  85  -4.336   6.478 -14.763
  674   2HE   MET  85          2HE       MET  85  -3.717   5.227 -15.866
  675   3HE   MET  85          3HE       MET  85  -5.401   5.154 -15.298
  676    H    LEU  86           H        LEU  86  -4.317   5.078  -8.128
  677    HA   LEU  86           HA       LEU  86  -4.481   2.678  -6.679
  678   1HB   LEU  86          2HB       LEU  86  -2.684   4.364  -6.674
  679   2HB   LEU  86          3HB       LEU  86  -3.638   5.438  -5.684
  680    HG   LEU  86           HG       LEU  86  -2.803   2.629  -4.935
  681   1HD1  LEU  86          1HD1      LEU  86  -1.453   5.229  -4.125
  682   2HD1  LEU  86          2HD1      LEU  86  -1.042   3.615  -3.492
  683   3HD1  LEU  86          3HD1      LEU  86  -0.782   3.987  -5.191
  684   1HD2  LEU  86          1HD2      LEU  86  -4.648   3.415  -3.527
  685   2HD2  LEU  86          2HD2      LEU  86  -3.170   3.049  -2.650
  686   3HD2  LEU  86          3HD2      LEU  86  -3.619   4.723  -2.961
  687    H    MET  87           H        MET  87  -6.195   5.833  -6.031
  688    HA   MET  87           HA       MET  87  -7.765   4.864  -3.859
  689   1HB   MET  87          2HB       MET  87  -8.371   6.948  -5.996
  690   2HB   MET  87          3HB       MET  87  -9.504   6.537  -4.700
  691   1HG   MET  87          2HG       MET  87  -7.694   7.008  -3.031
  692   2HG   MET  87          3HG       MET  87  -6.696   7.616  -4.355
  693   1HE   MET  87          1HE       MET  87  -9.366   8.289  -1.743
  694   2HE   MET  87          2HE       MET  87 -10.345   9.624  -2.393
  695   3HE   MET  87          3HE       MET  87 -10.482   7.995  -3.094
  696    H    ALA  88           H        ALA  88  -8.696   4.887  -7.352
  697    HA   ALA  88           HA       ALA  88 -11.152   3.556  -6.989
  698   1HB   ALA  88          1HB       ALA  88  -9.308   3.583  -9.417
  699   2HB   ALA  88          2HB       ALA  88 -11.041   3.185  -9.423
  700   3HB   ALA  88          3HB       ALA  88 -10.510   4.826  -9.000
  701    H    ALA  89           H        ALA  89  -7.925   2.081  -7.563
  702    HA   ALA  89           HA       ALA  89  -8.987  -0.643  -7.591
  703   1HB   ALA  89          1HB       ALA  89  -6.163   0.466  -7.252
  704   2HB   ALA  89          2HB       ALA  89  -6.575  -1.247  -7.518
  705   3HB   ALA  89          3HB       ALA  89  -6.923  -0.038  -8.774
  706    H    GLY  90           H        GLY  90  -7.162   1.285  -5.211
  707   1HA   GLY  90          2HA       GLY  90  -6.752  -0.365  -3.034
  708   2HA   GLY  90          3HA       GLY  90  -7.025   1.362  -3.002
  709    H    ASP  91           H        ASP  91  -9.490   1.894  -3.506
  710    HA   ASP  91           HA       ASP  91 -11.062   0.760  -1.309
  711   1HB   ASP  91          2HB       ASP  91 -11.086   3.127  -1.706
  712   2HB   ASP  91          3HB       ASP  91 -11.583   2.891  -3.393
  713    H    LYS  92           H        LYS  92 -10.605  -1.396  -2.717
  714    HA   LYS  92           HA       LYS  92 -12.376  -2.050  -4.856
  715   1HB   LYS  92          2HB       LYS  92 -12.028  -4.302  -4.248
  716   2HB   LYS  92          3HB       LYS  92 -10.512  -3.370  -4.135
  717   1HG   LYS  92          2HG       LYS  92 -10.213  -3.902  -1.971
  718   2HG   LYS  92          3HG       LYS  92 -11.844  -3.490  -1.527
  719   1HD   LYS  92          2HD       LYS  92 -11.397  -6.115  -2.968
  720   2HD   LYS  92          3HD       LYS  92 -10.956  -5.980  -1.270
  721   1HE   LYS  92          2HE       LYS  92 -13.213  -5.141  -0.706
  722   2HE   LYS  92          3HE       LYS  92 -13.714  -5.359  -2.388
  723   1HZ   LYS  92          1HZ       LYS  92 -12.659  -7.536  -0.664
  724   2HZ   LYS  92          2HZ       LYS  92 -14.265  -7.251  -0.907
  725   3HZ   LYS  92          3HZ       LYS  92 -13.306  -7.708  -2.166
  726    H    ASP  93           H        ASP  93 -13.239  -1.241  -1.839
  727    HA   ASP  93           HA       ASP  93 -15.666  -2.902  -1.505
  728   1HB   ASP  93          2HB       ASP  93 -13.757  -2.459   0.182
  729   2HB   ASP  93          3HB       ASP  93 -14.397  -0.818   0.286
  730    H    GLY  94           H        GLY  94 -14.784   0.155  -2.863
  731   1HA   GLY  94          2HA       GLY  94 -16.113   1.642  -3.933
  732   2HA   GLY  94          3HA       GLY  94 -17.537   0.738  -3.416
  733    H    ASP  95           H        ASP  95 -15.260   2.132  -1.182
  734    HA   ASP  95           HA       ASP  95 -17.443   4.088  -0.217
  735   1HB   ASP  95          2HB       ASP  95 -14.768   3.564   1.138
  736   2HB   ASP  95          3HB       ASP  95 -16.026   4.658   1.693
  737    H    GLY  96           H        GLY  96 -14.128   3.972  -1.113
  738   1HA   GLY  96          2HA       GLY  96 -13.044   5.659  -2.491
  739   2HA   GLY  96          3HA       GLY  96 -13.704   6.921  -1.423
  740    H    LYS  97           H        LYS  97 -13.045   4.772   0.790
  741    HA   LYS  97           HA       LYS  97 -10.204   5.541   1.285
  742   1HB   LYS  97          2HB       LYS  97 -12.424   4.462   3.077
  743   2HB   LYS  97          3HB       LYS  97 -10.771   4.733   3.585
  744   1HG   LYS  97          2HG       LYS  97 -12.633   6.943   2.591
  745   2HG   LYS  97          3HG       LYS  97 -12.393   6.467   4.279
  746   1HD   LYS  97          2HD       LYS  97  -9.858   6.870   3.731
  747   2HD   LYS  97          3HD       LYS  97 -10.476   7.896   2.445
  748   1HE   LYS  97          2HE       LYS  97 -11.594   8.169   5.266
  749   2HE   LYS  97          3HE       LYS  97  -9.937   8.686   4.990
  750   1HZ   LYS  97          1HZ       LYS  97 -12.313   9.810   3.646
  751   2HZ   LYS  97          2HZ       LYS  97 -11.237  10.533   4.711
  752   3HZ   LYS  97          3HZ       LYS  97 -10.742  10.140   3.236
  753    H    ILE  98           H        ILE  98  -8.646   4.086   1.408
  754    HA   ILE  98           HA       ILE  98  -8.929   1.204   0.959
  755    HB   ILE  98           HB       ILE  98  -6.626   2.961   1.876
  756   1HG1  ILE  98          2HG       ILE  98  -7.402   1.598  -0.715
  757   2HG1  ILE  98          3HG       ILE  98  -7.301   3.330  -0.421
  758   1HG2  ILE  98          1HG       ILE  98  -6.025   0.211   0.883
  759   2HG2  ILE  98          2HG       ILE  98  -5.077   1.218   1.945
  760   3HG2  ILE  98          3HG       ILE  98  -6.443   0.344   2.608
  761   1HD1  ILE  98          1HD1      ILE  98  -4.942   1.402  -0.638
  762   2HD1  ILE  98          2HD1      ILE  98  -5.502   2.584  -1.802
  763   3HD1  ILE  98          3HD1      ILE  98  -4.822   3.140  -0.263
  764    H    GLY  99           H        GLY  99  -9.685  -0.159   2.407
  765   1HA   GLY  99          2HA       GLY  99  -9.067   0.159   5.337
  766   2HA   GLY  99          3HA       GLY  99 -10.352  -0.847   4.692
  767    H    VAL 100           H        VAL 100  -8.227  -1.590   6.437
  768    HA   VAL 100           HA       VAL 100  -6.129  -3.049   5.682
  769    HB   VAL 100           HB       VAL 100  -6.707  -2.932   7.940
  770   1HG1  VAL 100          1HG       VAL 100  -9.110  -4.758   7.709
  771   2HG1  VAL 100          2HG       VAL 100  -8.501  -3.892   9.114
  772   3HG1  VAL 100          3HG       VAL 100  -9.221  -2.982   7.792
  773   1HG2  VAL 100          1HG       VAL 100  -5.405  -4.909   7.355
  774   2HG2  VAL 100          2HG       VAL 100  -6.417  -5.167   8.790
  775   3HG2  VAL 100          3HG       VAL 100  -6.892  -5.875   7.249
  776    H    ASP 101           H        ASP 101  -9.190  -4.787   5.876
  777    HA   ASP 101           HA       ASP 101  -8.193  -7.173   4.674
  778   1HB   ASP 101          2HB       ASP 101 -10.083  -6.717   6.387
  779   2HB   ASP 101          3HB       ASP 101 -11.083  -6.268   5.013
  780    H    GLU 102           H        GLU 102  -9.967  -4.440   3.530
  781    HA   GLU 102           HA       GLU 102 -10.874  -5.280   0.971
  782   1HB   GLU 102          2HB       GLU 102 -10.075  -2.455   1.795
  783   2HB   GLU 102          3HB       GLU 102 -11.201  -2.912   0.544
  784   1HG   GLU 102          2HG       GLU 102 -12.851  -3.611   2.147
  785   2HG   GLU 102          3HG       GLU 102 -11.695  -3.582   3.482
  786    H    PHE 103           H        PHE 103  -8.040  -3.191   1.814
  787    HA   PHE 103           HA       PHE 103  -7.017  -3.351  -0.836
  788   1HB   PHE 103          2HB       PHE 103  -5.574  -1.785  -0.209
  789   2HB   PHE 103          3HB       PHE 103  -6.669  -1.698   1.170
  790    HD1  PHE 103           1HD      PHE 103  -5.885  -2.195   3.409
  791    HD2  PHE 103           2HD      PHE 103  -3.330  -2.931   0.033
  792    HE1  PHE 103           1HE      PHE 103  -4.007  -2.663   4.918
  793    HE2  PHE 103           2HE      PHE 103  -1.402  -3.229   1.570
  794    HZ   PHE 103           HZ       PHE 103  -1.777  -3.187   4.025
  795    H    SER 104           H        SER 104  -6.399  -5.345   1.988
  796    HA   SER 104           HA       SER 104  -4.248  -6.913   0.892
  797   1HB   SER 104          2HB       SER 104  -4.867  -7.041   3.238
  798   2HB   SER 104          3HB       SER 104  -6.482  -7.646   2.818
  799    HG   SER 104           HG       SER 104  -5.136  -9.380   3.306
  800    H    THR 105           H        THR 105  -7.766  -7.712   0.958
  801    HA   THR 105           HA       THR 105  -7.304  -9.949  -0.786
  802    HB   THR 105           HB       THR 105  -9.759 -10.221  -0.715
  803    HG1  THR 105           1HG      THR 105  -9.748  -7.991   1.058
  804   1HG2  THR 105          1HG       THR 105  -8.385  -9.619   1.952
  805   2HG2  THR 105          2HG       THR 105  -9.767 -10.705   1.704
  806   3HG2  THR 105          3HG       THR 105  -8.162 -11.092   1.014
  807    H    LEU 106           H        LEU 106  -8.189  -6.707  -1.478
  808    HA   LEU 106           HA       LEU 106  -8.838  -6.594  -4.187
  809   1HB   LEU 106          2HB       LEU 106  -8.557  -4.561  -3.242
  810   2HB   LEU 106          3HB       LEU 106  -7.177  -5.048  -2.290
  811    HG   LEU 106           HG       LEU 106  -5.630  -4.615  -4.057
  812   1HD1  LEU 106          1HD1      LEU 106  -8.065  -3.712  -5.694
  813   2HD1  LEU 106          2HD1      LEU 106  -6.369  -3.456  -6.155
  814   3HD1  LEU 106          3HD1      LEU 106  -7.035  -5.082  -6.123
  815   1HD2  LEU 106          1HD2      LEU 106  -5.990  -2.836  -2.665
  816   2HD2  LEU 106          2HD2      LEU 106  -6.116  -2.149  -4.298
  817   3HD2  LEU 106          3HD2      LEU 106  -7.582  -2.478  -3.361
  818    H    VAL 107           H        VAL 107  -5.557  -7.414  -2.904
  819    HA   VAL 107           HA       VAL 107  -4.546  -7.577  -5.665
  820    HB   VAL 107           HB       VAL 107  -2.458  -8.045  -4.704
  821   1HG1  VAL 107          1HG       VAL 107  -3.739  -5.951  -2.905
  822   2HG1  VAL 107          2HG       VAL 107  -2.095  -5.979  -3.549
  823   3HG1  VAL 107          3HG       VAL 107  -3.461  -5.699  -4.636
  824   1HG2  VAL 107          1HG       VAL 107  -2.052  -9.060  -2.813
  825   2HG2  VAL 107          2HG       VAL 107  -3.014  -7.890  -1.872
  826   3HG2  VAL 107          3HG       VAL 107  -3.768  -9.307  -2.560
  827    H    ALA 108           H        ALA 108  -6.041  -9.712  -3.623
  828    HA   ALA 108           HA       ALA 108  -4.998 -12.227  -4.799
  829   1HB   ALA 108          1HB       ALA 108  -7.266 -11.772  -2.836
  830   2HB   ALA 108          2HB       ALA 108  -6.433 -13.301  -3.203
  831   3HB   ALA 108          3HB       ALA 108  -5.562 -11.978  -2.384
  832    H    GLU 109           H        GLU 109  -8.034 -10.302  -4.746
  833    HA   GLU 109           HA       GLU 109  -9.187 -11.500  -7.133
  834   1HB   GLU 109          2HB       GLU 109  -9.488  -8.821  -5.718
  835   2HB   GLU 109          3HB       GLU 109 -10.405  -9.226  -7.167
  836   1HG   GLU 109          2HG       GLU 109 -10.474 -10.986  -4.679
  837   2HG   GLU 109          3HG       GLU 109 -11.538  -9.603  -4.897
  838    H    SER 110           H        SER 110  -6.438  -9.544  -6.666
  839    HA   SER 110           HA       SER 110  -5.122  -8.268  -7.988
  840   1HB   SER 110          2HB       SER 110  -3.920  -9.541  -9.554
  841   2HB   SER 110          3HB       SER 110  -4.519 -10.718  -8.386
  842    HG   SER 110           HG       SER 110  -5.774 -11.550  -9.903
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1   7.136  -1.696  16.344
    2   2H    MET   1           H2       MET   1   5.612  -1.439  16.917
    3   3H    MET   1           H3       MET   1   6.045  -0.843  15.451
    4    HA   MET   1           HA       MET   1   5.758  -3.656  16.218
    5   1HB   MET   1          2HB       MET   1   3.898  -3.841  14.781
    6   2HB   MET   1          3HB       MET   1   3.637  -2.459  15.837
    7   1HG   MET   1          2HG       MET   1   4.505  -1.005  13.887
    8   2HG   MET   1          3HG       MET   1   4.334  -2.454  12.884
    9   1HE   MET   1          1HE       MET   1   2.705  -1.078  11.238
   10   2HE   MET   1          2HE       MET   1   1.339  -0.115  11.838
   11   3HE   MET   1          3HE       MET   1   2.999   0.336  12.284
   12    H    SER   2           H        SER   2   6.842  -1.507  13.520
   13    HA   SER   2           HA       SER   2   8.590  -1.717  12.198
   14   1HB   SER   2          2HB       SER   2   9.402  -4.126  13.843
   15   2HB   SER   2          3HB       SER   2  10.423  -3.170  12.753
   16    HG   SER   2           HG       SER   2  10.620  -2.465  14.907
   17    H    MET   3           H        MET   3   7.400  -2.019  10.376
   18    HA   MET   3           HA       MET   3   6.315  -4.241   9.175
   19   1HB   MET   3          2HB       MET   3   7.955  -2.064   7.803
   20   2HB   MET   3          3HB       MET   3   6.777  -3.115   7.012
   21   1HG   MET   3          2HG       MET   3   6.125  -1.213   9.281
   22   2HG   MET   3          3HG       MET   3   5.997  -0.794   7.580
   23   1HE   MET   3          1HE       MET   3   4.600  -2.708   5.906
   24   2HE   MET   3          2HE       MET   3   2.886  -2.401   6.258
   25   3HE   MET   3          3HE       MET   3   4.028  -1.048   6.198
   26    H    THR   4           H        THR   4   9.706  -3.272   9.020
   27    HA   THR   4           HA       THR   4  10.869  -5.201   7.379
   28    HB   THR   4           HB       THR   4  11.659  -3.497   9.715
   29    HG1  THR   4           1HG      THR   4  13.071  -2.774   7.987
   30   1HG2  THR   4          1HG       THR   4  13.533  -5.536   8.500
   31   2HG2  THR   4          2HG       THR   4  14.048  -4.075   9.389
   32   3HG2  THR   4          3HG       THR   4  13.095  -5.319  10.208
   33    H    ASP   5           H        ASP   5   9.750  -5.682  10.731
   34    HA   ASP   5           HA       ASP   5  11.121  -8.317  10.909
   35   1HB   ASP   5          2HB       ASP   5  11.321  -6.465  12.672
   36   2HB   ASP   5          3HB       ASP   5   9.621  -6.750  13.045
   37    H    LEU   6           H        LEU   6   7.927  -6.787  10.985
   38    HA   LEU   6           HA       LEU   6   6.290  -9.157  11.296
   39   1HB   LEU   6          2HB       LEU   6   5.832  -6.454   9.948
   40   2HB   LEU   6          3HB       LEU   6   4.570  -7.638  10.195
   41    HG   LEU   6           HG       LEU   6   6.129  -6.254  12.417
   42   1HD1  LEU   6          1HD1      LEU   6   3.312  -5.899  11.337
   43   2HD1  LEU   6          2HD1      LEU   6   3.942  -5.110  12.801
   44   3HD1  LEU   6          3HD1      LEU   6   4.643  -4.731  11.215
   45   1HD2  LEU   6          1HD2      LEU   6   5.370  -8.454  13.190
   46   2HD2  LEU   6          2HD2      LEU   6   4.376  -7.191  13.919
   47   3HD2  LEU   6          3HD2      LEU   6   3.742  -8.145  12.554
   48    H    LEU   7           H        LEU   7   7.455  -7.395   8.449
   49    HA   LEU   7           HA       LEU   7   6.628  -9.595   6.645
   50   1HB   LEU   7          2HB       LEU   7   7.451  -6.739   5.968
   51   2HB   LEU   7          3HB       LEU   7   6.783  -7.920   4.853
   52    HG   LEU   7           HG       LEU   7   5.273  -6.727   7.242
   53   1HD1  LEU   7          1HD1      LEU   7   5.163  -6.000   4.292
   54   2HD1  LEU   7          2HD1      LEU   7   4.088  -5.381   5.557
   55   3HD1  LEU   7          3HD1      LEU   7   5.795  -4.989   5.628
   56   1HD2  LEU   7          1HD2      LEU   7   4.433  -8.906   6.554
   57   2HD2  LEU   7          2HD2      LEU   7   3.307  -7.666   6.095
   58   3HD2  LEU   7          3HD2      LEU   7   4.358  -8.368   4.839
   59    H    ASN   8           H        ASN   8   9.061  -7.542   5.485
   60    HA   ASN   8           HA       ASN   8  11.446  -8.879   6.357
   61   1HB   ASN   8          2HB       ASN   8   9.919  -9.934   3.975
   62   2HB   ASN   8          3HB       ASN   8  11.651  -9.702   3.734
   63   1HD2  ASN   8          2HD2      ASN   8  13.043 -10.518   5.532
   64   2HD2  ASN   8          1HD2      ASN   8  12.602 -12.140   6.167
   65    H    ALA   9           H        ALA   9  12.840  -7.131   6.172
   66    HA   ALA   9           HA       ALA   9  12.469  -4.805   4.557
   67   1HB   ALA   9          1HB       ALA   9  15.016  -6.094   5.622
   68   2HB   ALA   9          2HB       ALA   9  14.897  -4.449   4.956
   69   3HB   ALA   9          3HB       ALA   9  14.018  -4.862   6.432
   70    H    GLU  10           H        GLU  10  13.871  -7.905   3.823
   71    HA   GLU  10           HA       GLU  10  15.254  -7.387   1.377
   72   1HB   GLU  10          2HB       GLU  10  13.885  -9.963   2.308
   73   2HB   GLU  10          3HB       GLU  10  15.178  -9.806   1.130
   74   1HG   GLU  10          2HG       GLU  10  16.142 -10.643   3.138
   75   2HG   GLU  10          3HG       GLU  10  16.701  -8.986   2.927
   76    H    ASP  11           H        ASP  11  12.060  -8.805   1.991
   77    HA   ASP  11           HA       ASP  11  11.056  -8.764  -0.674
   78   1HB   ASP  11          2HB       ASP  11   9.405  -8.608   1.881
   79   2HB   ASP  11          3HB       ASP  11   8.941  -9.197   0.289
   80    H    ILE  12           H        ILE  12  10.754  -6.448   2.036
   81    HA   ILE  12           HA       ILE  12   9.137  -4.493   0.774
   82    HB   ILE  12           HB       ILE  12  10.787  -4.630   3.206
   83   1HG1  ILE  12          2HG       ILE  12   8.767  -3.093   3.941
   84   2HG1  ILE  12          3HG       ILE  12   8.083  -3.513   2.375
   85   1HG2  ILE  12          1HG       ILE  12  10.317  -1.919   2.008
   86   2HG2  ILE  12          2HG       ILE  12  10.813  -2.282   3.685
   87   3HG2  ILE  12          3HG       ILE  12  11.907  -2.675   2.348
   88   1HD1  ILE  12          1HD1      ILE  12   8.896  -5.336   4.661
   89   2HD1  ILE  12          2HD1      ILE  12   7.269  -5.054   3.994
   90   3HD1  ILE  12          3HD1      ILE  12   8.456  -5.972   3.057
   91    H    LYS  13           H        LYS  13  12.698  -4.819   0.505
   92    HA   LYS  13           HA       LYS  13  13.015  -2.420  -1.031
   93   1HB   LYS  13          2HB       LYS  13  14.506  -5.063  -0.950
   94   2HB   LYS  13          3HB       LYS  13  14.838  -3.895  -2.235
   95   1HG   LYS  13          2HG       LYS  13  15.086  -2.146  -0.331
   96   2HG   LYS  13          3HG       LYS  13  15.208  -3.549   0.758
   97   1HD   LYS  13          2HD       LYS  13  17.176  -4.343  -0.382
   98   2HD   LYS  13          3HD       LYS  13  16.892  -3.265  -1.766
   99   1HE   LYS  13          2HE       LYS  13  17.200  -1.287  -0.253
  100   2HE   LYS  13          3HE       LYS  13  17.691  -2.392   1.040
  101   1HZ   LYS  13          1HZ       LYS  13  19.026  -2.126  -1.595
  102   2HZ   LYS  13          2HZ       LYS  13  19.585  -1.487  -0.189
  103   3HZ   LYS  13          3HZ       LYS  13  19.516  -3.122  -0.379
  104    H    LYS  14           H        LYS  14  12.088  -5.657  -2.149
  105    HA   LYS  14           HA       LYS  14  11.750  -4.814  -4.940
  106   1HB   LYS  14          2HB       LYS  14  10.608  -7.267  -3.539
  107   2HB   LYS  14          3HB       LYS  14  10.761  -7.018  -5.277
  108   1HG   LYS  14          2HG       LYS  14  13.017  -7.380  -3.259
  109   2HG   LYS  14          3HG       LYS  14  12.500  -8.536  -4.473
  110   1HD   LYS  14          2HD       LYS  14  13.716  -5.802  -5.102
  111   2HD   LYS  14          3HD       LYS  14  14.629  -7.292  -5.026
  112   1HE   LYS  14          2HE       LYS  14  12.233  -6.988  -6.878
  113   2HE   LYS  14          3HE       LYS  14  13.846  -6.440  -7.344
  114   1HZ   LYS  14          1HZ       LYS  14  13.203  -9.208  -6.527
  115   2HZ   LYS  14          2HZ       LYS  14  13.424  -8.709  -8.081
  116   3HZ   LYS  14          3HZ       LYS  14  14.674  -8.667  -7.016
  117    H    ALA  15           H        ALA  15   9.678  -4.938  -2.136
  118    HA   ALA  15           HA       ALA  15   7.217  -4.244  -3.407
  119   1HB   ALA  15          1HB       ALA  15   7.925  -3.095  -0.690
  120   2HB   ALA  15          2HB       ALA  15   6.424  -3.809  -1.267
  121   3HB   ALA  15          3HB       ALA  15   7.833  -4.839  -0.915
  122    H    VAL  16           H        VAL  16   9.470  -1.991  -1.714
  123    HA   VAL  16           HA       VAL  16   8.262   0.397  -2.634
  124    HB   VAL  16           HB       VAL  16  11.175  -0.098  -1.881
  125   1HG1  VAL  16          1HG       VAL  16   9.546   2.463  -1.975
  126   2HG1  VAL  16          2HG       VAL  16  11.210   2.316  -1.368
  127   3HG1  VAL  16          3HG       VAL  16  10.877   2.063  -3.083
  128   1HG2  VAL  16          1HG       VAL  16   9.575  -0.642  -0.025
  129   2HG2  VAL  16          2HG       VAL  16  10.495   0.827   0.312
  130   3HG2  VAL  16          3HG       VAL  16   8.809   0.941  -0.228
  131    H    GLY  17           H        GLY  17  10.865  -1.551  -4.170
  132   1HA   GLY  17          2HA       GLY  17  11.378   0.186  -6.372
  133   2HA   GLY  17          3HA       GLY  17  11.702  -1.547  -6.304
  134    H    ALA  18           H        ALA  18   8.666  -2.030  -5.838
  135    HA   ALA  18           HA       ALA  18   7.855  -2.107  -8.647
  136   1HB   ALA  18          1HB       ALA  18   6.364  -2.890  -6.118
  137   2HB   ALA  18          2HB       ALA  18   5.993  -3.396  -7.779
  138   3HB   ALA  18          3HB       ALA  18   7.490  -3.944  -6.980
  139    H    PHE  19           H        PHE  19   7.506   0.188  -6.077
  140    HA   PHE  19           HA       PHE  19   5.401   1.630  -7.655
  141   1HB   PHE  19          2HB       PHE  19   5.863   1.808  -4.681
  142   2HB   PHE  19          3HB       PHE  19   4.677   2.715  -5.658
  143    HD1  PHE  19           1HD      PHE  19   3.994   1.338  -3.124
  144    HD2  PHE  19           2HD      PHE  19   3.821   0.026  -7.219
  145    HE1  PHE  19           1HE      PHE  19   1.981  -0.061  -2.591
  146    HE2  PHE  19           2HE      PHE  19   1.944  -1.428  -6.655
  147    HZ   PHE  19           HZ       PHE  19   1.024  -1.509  -4.361
  148    H    SER  20           H        SER  20   8.685   1.832  -6.621
  149    HA   SER  20           HA       SER  20   9.131   4.602  -6.576
  150   1HB   SER  20          2HB       SER  20  10.917   2.337  -7.546
  151   2HB   SER  20          3HB       SER  20  11.463   4.002  -7.265
  152    HG   SER  20           HG       SER  20  11.854   3.017  -5.390
  153    H    ALA  21           H        ALA  21   7.243   4.484  -8.582
  154    HA   ALA  21           HA       ALA  21   8.584   5.733 -10.869
  155   1HB   ALA  21          1HB       ALA  21   6.836   3.246 -11.149
  156   2HB   ALA  21          2HB       ALA  21   7.425   4.244 -12.504
  157   3HB   ALA  21          3HB       ALA  21   8.574   3.337 -11.501
  158    H    THR  22           H        THR  22   6.967   6.812 -12.315
  159    HA   THR  22           HA       THR  22   4.671   7.802 -10.765
  160    HB   THR  22           HB       THR  22   4.634   9.494 -12.676
  161    HG1  THR  22           1HG      THR  22   6.615   9.667 -13.780
  162   1HG2  THR  22          1HG       THR  22   7.180   9.312 -10.999
  163   2HG2  THR  22          2HG       THR  22   6.496  10.782 -11.719
  164   3HG2  THR  22          3HG       THR  22   5.625   9.942 -10.423
  165    H    ASP  23           H        ASP  23   2.819   6.806 -10.999
  166    HA   ASP  23           HA       ASP  23   0.915   5.946 -11.861
  167   1HB   ASP  23          2HB       ASP  23   1.417   7.759 -13.646
  168   2HB   ASP  23          3HB       ASP  23   1.804   6.378 -14.684
  169    H    SER  24           H        SER  24   3.874   4.478 -12.361
  170    HA   SER  24           HA       SER  24   2.949   2.264 -14.062
  171   1HB   SER  24          2HB       SER  24   5.311   3.475 -13.926
  172   2HB   SER  24          3HB       SER  24   5.627   2.218 -12.714
  173    HG   SER  24           HG       SER  24   6.144   1.567 -14.864
  174    H    PHE  25           H        PHE  25   1.457   2.427 -11.760
  175    HA   PHE  25           HA       PHE  25   2.691   1.257  -9.503
  176   1HB   PHE  25          2HB       PHE  25   0.926   3.023  -9.557
  177   2HB   PHE  25          3HB       PHE  25  -0.269   1.775  -9.876
  178    HD1  PHE  25           1HD      PHE  25   2.198   3.101  -7.432
  179    HD2  PHE  25           2HD      PHE  25  -1.028   0.311  -8.064
  180    HE1  PHE  25           1HE      PHE  25   1.845   2.954  -4.992
  181    HE2  PHE  25           2HE      PHE  25  -1.393   0.217  -5.589
  182    HZ   PHE  25           HZ       PHE  25   0.011   1.562  -4.077
  183    H    ASP  26           H        ASP  26   3.160  -0.832  -9.247
  184    HA   ASP  26           HA       ASP  26   1.400  -2.753 -10.480
  185   1HB   ASP  26          2HB       ASP  26   4.061  -2.407 -10.651
  186   2HB   ASP  26          3HB       ASP  26   4.003  -3.717  -9.488
  187    H    HIS  27           H        HIS  27   0.056  -2.019  -8.324
  188    HA   HIS  27           HA       HIS  27   0.419  -3.059  -5.875
  189   1HB   HIS  27          2HB       HIS  27  -1.978  -3.108  -5.486
  190   2HB   HIS  27          3HB       HIS  27  -1.472  -1.700  -6.387
  191    HD1  HIS  27           HD1      HIS  27  -3.893  -4.585  -6.681
  192    HD2  HIS  27           HD2      HIS  27  -2.215  -1.484  -8.996
  193    HE1  HIS  27           HE1      HIS  27  -5.291  -4.410  -8.794
  194    H    LYS  28           H        LYS  28  -1.123  -4.953  -8.354
  195    HA   LYS  28           HA       LYS  28  -1.379  -7.563  -7.471
  196   1HB   LYS  28          2HB       LYS  28   0.145  -6.717 -10.017
  197   2HB   LYS  28          3HB       LYS  28  -0.801  -8.166  -9.798
  198   1HG   LYS  28          2HG       LYS  28  -2.574  -7.164 -10.665
  199   2HG   LYS  28          3HG       LYS  28  -2.547  -5.844  -9.506
  200   1HD   LYS  28          2HD       LYS  28  -0.782  -5.940 -12.000
  201   2HD   LYS  28          3HD       LYS  28  -2.428  -5.297 -12.018
  202   1HE   LYS  28          2HE       LYS  28  -1.920  -3.526 -10.541
  203   2HE   LYS  28          3HE       LYS  28  -0.351  -4.236 -10.097
  204   1HZ   LYS  28          1HZ       LYS  28  -0.936  -3.292 -12.834
  205   2HZ   LYS  28          2HZ       LYS  28  -0.196  -2.360 -11.676
  206   3HZ   LYS  28          3HZ       LYS  28   0.524  -3.760 -12.173
  207    H    LYS  29           H        LYS  29   1.673  -6.309  -8.760
  208    HA   LYS  29           HA       LYS  29   3.181  -8.703  -7.942
  209   1HB   LYS  29          2HB       LYS  29   3.623  -6.353  -9.750
  210   2HB   LYS  29          3HB       LYS  29   5.046  -7.096  -9.012
  211   1HG   LYS  29          2HG       LYS  29   4.603  -9.236  -9.965
  212   2HG   LYS  29          3HG       LYS  29   2.953  -8.786 -10.418
  213   1HD   LYS  29          2HD       LYS  29   4.417  -8.839 -12.390
  214   2HD   LYS  29          3HD       LYS  29   3.737  -7.240 -12.090
  215   1HE   LYS  29          2HE       LYS  29   6.074  -6.947 -10.751
  216   2HE   LYS  29          3HE       LYS  29   6.596  -8.198 -11.890
  217   1HZ   LYS  29          1HZ       LYS  29   5.332  -5.610 -12.542
  218   2HZ   LYS  29          2HZ       LYS  29   6.924  -5.902 -12.735
  219   3HZ   LYS  29          3HZ       LYS  29   5.794  -6.683 -13.681
  220    H    PHE  30           H        PHE  30   2.774  -5.357  -6.887
  221    HA   PHE  30           HA       PHE  30   4.938  -5.156  -5.072
  222   1HB   PHE  30          2HB       PHE  30   3.489  -3.304  -5.649
  223   2HB   PHE  30          3HB       PHE  30   2.104  -4.083  -4.904
  224    HD1  PHE  30           1HD      PHE  30   5.224  -2.296  -4.281
  225    HD2  PHE  30           2HD      PHE  30   1.756  -4.043  -2.500
  226    HE1  PHE  30           1HE      PHE  30   5.763  -1.150  -2.135
  227    HE2  PHE  30           2HE      PHE  30   2.244  -2.885  -0.361
  228    HZ   PHE  30           HZ       PHE  30   4.288  -1.465  -0.178
  229    H    PHE  31           H        PHE  31   1.562  -6.201  -4.251
  230    HA   PHE  31           HA       PHE  31   2.230  -7.196  -1.662
  231   1HB   PHE  31          2HB       PHE  31  -0.088  -7.285  -3.442
  232   2HB   PHE  31          3HB       PHE  31   0.074  -8.703  -2.437
  233    HD1  PHE  31           1HD      PHE  31  -0.782  -8.719  -0.240
  234    HD2  PHE  31           2HD      PHE  31  -0.070  -4.962  -2.203
  235    HE1  PHE  31           1HE      PHE  31  -1.844  -7.539   1.643
  236    HE2  PHE  31           2HE      PHE  31  -1.148  -3.771  -0.313
  237    HZ   PHE  31           HZ       PHE  31  -2.045  -5.060   1.612
  238    H    GLN  32           H        GLN  32   2.420  -8.798  -4.829
  239    HA   GLN  32           HA       GLN  32   3.070 -11.410  -3.745
  240   1HB   GLN  32          2HB       GLN  32   3.560 -10.143  -6.461
  241   2HB   GLN  32          3HB       GLN  32   3.910 -11.829  -6.103
  242   1HG   GLN  32          2HG       GLN  32   1.628 -12.383  -5.779
  243   2HG   GLN  32          3HG       GLN  32   1.126 -10.707  -5.620
  244   1HE2  GLN  32          2HE       GLN  32  -0.277 -10.344  -7.357
  245   2HE2  GLN  32          1HE       GLN  32   0.140 -10.865  -9.001
  246    H    MET  33           H        MET  33   5.227  -8.839  -5.094
  247    HA   MET  33           HA       MET  33   7.730 -10.115  -4.650
  248   1HB   MET  33          2HB       MET  33   6.867  -7.209  -4.983
  249   2HB   MET  33          3HB       MET  33   8.543  -7.657  -4.736
  250   1HG   MET  33          2HG       MET  33   8.638  -8.945  -6.744
  251   2HG   MET  33          3HG       MET  33   6.901  -8.771  -7.027
  252   1HE   MET  33          1HE       MET  33   8.138  -8.139  -9.525
  253   2HE   MET  33          2HE       MET  33   9.002  -6.600  -9.767
  254   3HE   MET  33          3HE       MET  33   9.762  -7.905  -8.834
  255    H    VAL  34           H        VAL  34   5.966  -7.714  -2.662
  256    HA   VAL  34           HA       VAL  34   7.825  -7.681  -0.455
  257    HB   VAL  34           HB       VAL  34   6.049  -6.012  -1.129
  258   1HG1  VAL  34          1HG       VAL  34   4.279  -7.643   0.605
  259   2HG1  VAL  34          2HG       VAL  34   3.888  -6.177  -0.348
  260   3HG1  VAL  34          3HG       VAL  34   4.230  -7.742  -1.130
  261   1HG2  VAL  34          1HG       VAL  34   7.399  -5.918   1.016
  262   2HG2  VAL  34          2HG       VAL  34   5.801  -5.154   1.123
  263   3HG2  VAL  34          3HG       VAL  34   6.080  -6.757   1.834
  264    H    GLY  35           H        GLY  35   5.799 -10.152  -1.594
  265   1HA   GLY  35          2HA       GLY  35   4.921 -12.065  -0.824
  266   2HA   GLY  35          3HA       GLY  35   6.077 -11.960   0.508
  267    H    LEU  36           H        LEU  36   3.664  -9.431   0.230
  268    HA   LEU  36           HA       LEU  36   2.810  -9.651   2.911
  269   1HB   LEU  36          2HB       LEU  36   1.849  -8.233   0.447
  270   2HB   LEU  36          3HB       LEU  36   0.666  -8.425   1.737
  271    HG   LEU  36           HG       LEU  36   3.369  -7.247   2.364
  272   1HD1  LEU  36          1HD1      LEU  36   0.923  -5.527   1.938
  273   2HD1  LEU  36          2HD1      LEU  36   2.644  -5.097   1.891
  274   3HD1  LEU  36          3HD1      LEU  36   1.899  -5.944   0.536
  275   1HD2  LEU  36          1HD2      LEU  36   1.981  -8.123   4.197
  276   2HD2  LEU  36          2HD2      LEU  36   2.211  -6.370   4.225
  277   3HD2  LEU  36          3HD2      LEU  36   0.658  -7.078   3.674
  278    H    LYS  37           H        LYS  37   0.920 -10.417   0.123
  279    HA   LYS  37           HA       LYS  37  -1.174 -12.031   1.160
  280   1HB   LYS  37          2HB       LYS  37   0.292 -12.204  -1.499
  281   2HB   LYS  37          3HB       LYS  37  -0.967 -13.353  -1.072
  282   1HG   LYS  37          2HG       LYS  37  -2.429 -11.203  -0.581
  283   2HG   LYS  37          3HG       LYS  37  -1.263 -10.419  -1.653
  284   1HD   LYS  37          2HD       LYS  37  -2.891 -12.899  -2.317
  285   2HD   LYS  37          3HD       LYS  37  -3.301 -11.248  -2.800
  286   1HE   LYS  37          2HE       LYS  37  -1.448 -11.050  -4.256
  287   2HE   LYS  37          3HE       LYS  37  -0.622 -12.451  -3.550
  288   1HZ   LYS  37          1HZ       LYS  37  -3.142 -12.605  -5.082
  289   2HZ   LYS  37          2HZ       LYS  37  -1.664 -12.961  -5.694
  290   3HZ   LYS  37          3HZ       LYS  37  -2.298 -13.880  -4.487
  291    H    LYS  38           H        LYS  38   2.168 -12.965   1.258
  292    HA   LYS  38           HA       LYS  38   1.508 -15.840   1.740
  293   1HB   LYS  38          2HB       LYS  38   4.255 -14.546   1.514
  294   2HB   LYS  38          3HB       LYS  38   3.877 -16.254   1.549
  295   1HG   LYS  38          2HG       LYS  38   2.937 -16.212  -0.657
  296   2HG   LYS  38          3HG       LYS  38   2.894 -14.447  -0.705
  297   1HD   LYS  38          2HD       LYS  38   4.702 -15.316  -2.074
  298   2HD   LYS  38          3HD       LYS  38   5.310 -14.292  -0.775
  299   1HE   LYS  38          2HE       LYS  38   6.413 -15.960   0.281
  300   2HE   LYS  38          3HE       LYS  38   5.161 -17.159  -0.053
  301   1HZ   LYS  38          1HZ       LYS  38   7.125 -16.200  -2.056
  302   2HZ   LYS  38          2HZ       LYS  38   7.216 -17.639  -1.262
  303   3HZ   LYS  38          3HZ       LYS  38   5.978 -17.352  -2.304
  304    H    LYS  39           H        LYS  39   2.210 -12.910   3.408
  305    HA   LYS  39           HA       LYS  39   2.983 -14.225   5.957
  306   1HB   LYS  39          2HB       LYS  39   2.278 -11.320   5.453
  307   2HB   LYS  39          3HB       LYS  39   3.126 -11.972   6.844
  308   1HG   LYS  39          2HG       LYS  39   4.258 -11.810   4.025
  309   2HG   LYS  39          3HG       LYS  39   4.460 -10.616   5.259
  310   1HD   LYS  39          2HD       LYS  39   5.714 -12.203   6.656
  311   2HD   LYS  39          3HD       LYS  39   5.605 -13.422   5.377
  312   1HE   LYS  39          2HE       LYS  39   6.834 -10.638   5.015
  313   2HE   LYS  39          3HE       LYS  39   7.787 -12.040   5.488
  314   1HZ   LYS  39          1HZ       LYS  39   6.291 -11.759   2.944
  315   2HZ   LYS  39          2HZ       LYS  39   7.918 -11.630   3.081
  316   3HZ   LYS  39          3HZ       LYS  39   7.212 -13.064   3.385
  317    H    SER  40           H        SER  40   1.490 -13.563   7.870
  318    HA   SER  40           HA       SER  40  -1.041 -14.742   7.270
  319   1HB   SER  40          2HB       SER  40  -0.006 -13.477   9.838
  320   2HB   SER  40          3HB       SER  40  -1.450 -14.507   9.704
  321    HG   SER  40           HG       SER  40   0.403 -15.724  10.288
  322    H    ALA  41           H        ALA  41  -3.187 -14.022   7.655
  323    HA   ALA  41           HA       ALA  41  -3.992 -11.445   6.898
  324   1HB   ALA  41          1HB       ALA  41  -5.407 -13.415   8.746
  325   2HB   ALA  41          2HB       ALA  41  -6.163 -12.061   7.892
  326   3HB   ALA  41          3HB       ALA  41  -5.483 -13.416   6.963
  327    H    ASP  42           H        ASP  42  -3.366 -12.686  10.223
  328    HA   ASP  42           HA       ASP  42  -4.136 -10.165  11.376
  329   1HB   ASP  42          2HB       ASP  42  -3.949 -12.619  12.475
  330   2HB   ASP  42          3HB       ASP  42  -2.393 -11.960  12.990
  331    H    ASP  43           H        ASP  43  -1.252 -11.091   9.757
  332    HA   ASP  43           HA       ASP  43   0.486  -9.046  10.947
  333   1HB   ASP  43          2HB       ASP  43   1.277 -11.211   9.760
  334   2HB   ASP  43          3HB       ASP  43   0.911 -10.349   8.254
  335    H    VAL  44           H        VAL  44  -1.429  -9.576   7.991
  336    HA   VAL  44           HA       VAL  44  -1.221  -7.118   6.692
  337    HB   VAL  44           HB       VAL  44  -2.981  -9.434   6.662
  338   1HG1  VAL  44          1HG       VAL  44  -4.247  -6.880   5.636
  339   2HG1  VAL  44          2HG       VAL  44  -4.845  -8.549   5.471
  340   3HG1  VAL  44          3HG       VAL  44  -4.799  -7.812   7.059
  341   1HG2  VAL  44          1HG       VAL  44  -1.191  -8.980   5.052
  342   2HG2  VAL  44          2HG       VAL  44  -2.765  -9.157   4.266
  343   3HG2  VAL  44          3HG       VAL  44  -2.067  -7.536   4.482
  344    H    LYS  45           H        LYS  45  -3.213  -7.877   9.475
  345    HA   LYS  45           HA       LYS  45  -4.593  -5.439   9.723
  346   1HB   LYS  45          2HB       LYS  45  -4.539  -7.855  11.053
  347   2HB   LYS  45          3HB       LYS  45  -3.872  -6.748  12.271
  348   1HG   LYS  45          2HG       LYS  45  -5.752  -5.192  11.803
  349   2HG   LYS  45          3HG       LYS  45  -6.423  -6.331  10.640
  350   1HD   LYS  45          2HD       LYS  45  -6.014  -6.968  13.604
  351   2HD   LYS  45          3HD       LYS  45  -7.542  -6.398  12.904
  352   1HE   LYS  45          2HE       LYS  45  -7.647  -8.351  11.416
  353   2HE   LYS  45          3HE       LYS  45  -6.081  -8.925  12.015
  354   1HZ   LYS  45          1HZ       LYS  45  -8.464  -8.652  13.738
  355   2HZ   LYS  45          2HZ       LYS  45  -7.904 -10.061  13.061
  356   3HZ   LYS  45          3HZ       LYS  45  -6.964  -9.316  14.117
  357    H    LYS  46           H        LYS  46  -1.284  -6.117  10.588
  358    HA   LYS  46           HA       LYS  46  -0.933  -3.445  11.885
  359   1HB   LYS  46          2HB       LYS  46   1.019  -5.761  11.510
  360   2HB   LYS  46          3HB       LYS  46   1.397  -4.208  12.241
  361   1HG   LYS  46          2HG       LYS  46   1.069  -5.519  14.094
  362   2HG   LYS  46          3HG       LYS  46  -0.507  -4.725  13.938
  363   1HD   LYS  46          2HD       LYS  46  -1.409  -6.766  12.869
  364   2HD   LYS  46          3HD       LYS  46   0.201  -7.512  12.918
  365   1HE   LYS  46          2HE       LYS  46   0.068  -7.238  15.463
  366   2HE   LYS  46          3HE       LYS  46  -1.633  -6.790  15.235
  367   1HZ   LYS  46          1HZ       LYS  46  -0.403  -9.357  14.390
  368   2HZ   LYS  46          2HZ       LYS  46  -1.492  -9.177  15.625
  369   3HZ   LYS  46          3HZ       LYS  46  -1.954  -8.975  14.104
  370    H    VAL  47           H        VAL  47  -0.122  -5.267   8.970
  371    HA   VAL  47           HA       VAL  47   1.611  -3.526   7.632
  372    HB   VAL  47           HB       VAL  47  -0.716  -5.062   6.442
  373   1HG1  VAL  47          1HG       VAL  47   1.673  -4.014   4.924
  374   2HG1  VAL  47          2HG       VAL  47   0.309  -4.960   4.292
  375   3HG1  VAL  47          3HG       VAL  47   0.041  -3.316   4.842
  376   1HG2  VAL  47          1HG       VAL  47   1.123  -6.373   7.693
  377   2HG2  VAL  47          2HG       VAL  47   0.852  -6.827   6.027
  378   3HG2  VAL  47          3HG       VAL  47   2.219  -5.778   6.484
  379    H    PHE  48           H        PHE  48  -2.022  -3.392   7.027
  380    HA   PHE  48           HA       PHE  48  -2.120  -0.910   5.888
  381   1HB   PHE  48          2HB       PHE  48  -3.920  -2.482   5.953
  382   2HB   PHE  48          3HB       PHE  48  -3.986  -2.422   7.723
  383    HD1  PHE  48           1HD      PHE  48  -5.048  -0.618   8.901
  384    HD2  PHE  48           2HD      PHE  48  -4.642  -0.504   4.599
  385    HE1  PHE  48           1HE      PHE  48  -6.409   1.441   8.826
  386    HE2  PHE  48           2HE      PHE  48  -6.049   1.539   4.539
  387    HZ   PHE  48           HZ       PHE  48  -6.876   2.523   6.639
  388    H    HIS  49           H        HIS  49  -1.837  -1.572   9.377
  389    HA   HIS  49           HA       HIS  49  -2.737   1.019  10.221
  390   1HB   HIS  49          2HB       HIS  49  -2.769  -1.078  11.600
  391   2HB   HIS  49          3HB       HIS  49  -1.013  -0.965  11.748
  392    HD1  HIS  49           HD1      HIS  49  -4.031   1.425  12.454
  393    HD2  HIS  49           HD2      HIS  49  -0.215   0.317  13.868
  394    HE1  HIS  49           HE1      HIS  49  -3.630   2.770  14.580
  395    H    MET  50           H        MET  50   0.363  -0.026   8.947
  396    HA   MET  50           HA       MET  50   1.817   2.277  10.042
  397   1HB   MET  50          2HB       MET  50   2.587  -0.108   8.956
  398   2HB   MET  50          3HB       MET  50   2.774   0.923   7.553
  399   1HG   MET  50          2HG       MET  50   4.062   1.115  10.292
  400   2HG   MET  50          3HG       MET  50   4.868   0.868   8.753
  401   1HE   MET  50          1HE       MET  50   6.604   2.612  10.010
  402   2HE   MET  50          2HE       MET  50   6.139   4.275  10.443
  403   3HE   MET  50          3HE       MET  50   5.434   2.901  11.323
  404    H    LEU  51           H        LEU  51   0.148   1.488   7.018
  405    HA   LEU  51           HA       LEU  51   0.832   3.907   5.523
  406   1HB   LEU  51          2HB       LEU  51  -1.425   1.893   5.205
  407   2HB   LEU  51          3HB       LEU  51  -0.955   3.107   4.044
  408    HG   LEU  51           HG       LEU  51   0.173   1.453   3.056
  409   1HD1  LEU  51          1HD1      LEU  51   2.165   1.492   5.360
  410   2HD1  LEU  51          2HD1      LEU  51   2.456   1.048   3.694
  411   3HD1  LEU  51          3HD1      LEU  51   2.107   2.729   4.086
  412   1HD2  LEU  51          1HD2      LEU  51  -0.952  -0.236   4.206
  413   2HD2  LEU  51          2HD2      LEU  51   0.766  -0.693   4.130
  414   3HD2  LEU  51          3HD2      LEU  51   0.087  -0.018   5.621
  415    H    ASP  52           H        ASP  52  -1.822   2.929   7.634
  416    HA   ASP  52           HA       ASP  52  -3.304   5.411   7.552
  417   1HB   ASP  52          2HB       ASP  52  -4.216   3.316   8.440
  418   2HB   ASP  52          3HB       ASP  52  -2.976   3.277   9.698
  419    H    LYS  53           H        LYS  53  -1.344   6.739   7.306
  420    HA   LYS  53           HA       LYS  53   0.460   7.153   9.499
  421   1HB   LYS  53          2HB       LYS  53   0.157   7.979   6.720
  422   2HB   LYS  53          3HB       LYS  53   0.625   9.369   7.685
  423   1HG   LYS  53          2HG       LYS  53   2.043   6.693   7.987
  424   2HG   LYS  53          3HG       LYS  53   2.455   7.775   6.665
  425   1HD   LYS  53          2HD       LYS  53   3.495   9.300   7.975
  426   2HD   LYS  53          3HD       LYS  53   2.406   9.083   9.352
  427   1HE   LYS  53          2HE       LYS  53   3.496   7.138  10.110
  428   2HE   LYS  53          3HE       LYS  53   4.353   6.893   8.583
  429   1HZ   LYS  53          1HZ       LYS  53   4.824   9.200  10.378
  430   2HZ   LYS  53          2HZ       LYS  53   5.755   7.841  10.369
  431   3HZ   LYS  53          3HZ       LYS  53   5.691   8.804   9.037
  432    H    ASP  54           H        ASP  54  -2.604   7.869   9.701
  433    HA   ASP  54           HA       ASP  54  -2.050  10.117  11.589
  434   1HB   ASP  54          2HB       ASP  54  -3.726  11.429  10.926
  435   2HB   ASP  54          3HB       ASP  54  -3.463  10.629   9.386
  436    H    LYS  55           H        LYS  55  -3.748   7.059  11.142
  437    HA   LYS  55           HA       LYS  55  -4.042   5.466  12.763
  438   1HB   LYS  55          2HB       LYS  55  -4.330   7.561  14.928
  439   2HB   LYS  55          3HB       LYS  55  -4.216   5.835  15.136
  440   1HG   LYS  55          2HG       LYS  55  -1.904   7.547  14.099
  441   2HG   LYS  55          3HG       LYS  55  -2.187   7.112  15.770
  442   1HD   LYS  55          2HD       LYS  55  -0.564   5.619  15.035
  443   2HD   LYS  55          3HD       LYS  55  -2.054   4.673  15.096
  444   1HE   LYS  55          2HE       LYS  55  -2.290   4.933  12.621
  445   2HE   LYS  55          3HE       LYS  55  -0.849   5.935  12.574
  446   1HZ   LYS  55          1HZ       LYS  55  -0.910   3.137  13.545
  447   2HZ   LYS  55          2HZ       LYS  55  -0.533   3.547  12.007
  448   3HZ   LYS  55          3HZ       LYS  55   0.441   4.047  13.252
  449    H    SER  56           H        SER  56  -5.970   7.126  11.144
  450    HA   SER  56           HA       SER  56  -8.435   6.991  12.730
  451   1HB   SER  56          2HB       SER  56  -9.535   8.011  10.960
  452   2HB   SER  56          3HB       SER  56  -7.941   8.767  11.001
  453    HG   SER  56           HG       SER  56  -8.870   8.084   8.917
  454    H    GLY  57           H        GLY  57  -6.843   4.505  10.950
  455   1HA   GLY  57          2HA       GLY  57  -7.660   2.350  10.598
  456   2HA   GLY  57          3HA       GLY  57  -9.310   2.880  10.886
  457    H    PHE  58           H        PHE  58  -8.038   5.002   8.647
  458    HA   PHE  58           HA       PHE  58  -8.790   3.419   6.188
  459   1HB   PHE  58          2HB       PHE  58  -9.805   6.205   6.756
  460   2HB   PHE  58          3HB       PHE  58 -10.323   5.050   5.526
  461    HD1  PHE  58           1HD      PHE  58 -11.634   2.973   6.237
  462    HD2  PHE  58           2HD      PHE  58 -10.836   6.255   8.922
  463    HE1  PHE  58           1HE      PHE  58 -13.443   2.191   7.749
  464    HE2  PHE  58           2HE      PHE  58 -12.625   5.464  10.426
  465    HZ   PHE  58           HZ       PHE  58 -13.940   3.434   9.846
  466    H    ILE  59           H        ILE  59  -7.732   4.122   4.253
  467    HA   ILE  59           HA       ILE  59  -5.923   6.512   4.517
  468    HB   ILE  59           HB       ILE  59  -5.734   4.252   2.558
  469   1HG1  ILE  59          2HG       ILE  59  -3.640   4.792   4.679
  470   2HG1  ILE  59          3HG       ILE  59  -5.026   3.769   5.042
  471   1HG2  ILE  59          1HG       ILE  59  -3.868   6.614   2.975
  472   2HG2  ILE  59          2HG       ILE  59  -3.543   5.240   1.903
  473   3HG2  ILE  59          3HG       ILE  59  -4.887   6.306   1.555
  474   1HD1  ILE  59          1HD1      ILE  59  -2.958   3.287   2.877
  475   2HD1  ILE  59          2HD1      ILE  59  -3.352   2.284   4.298
  476   3HD1  ILE  59          3HD1      ILE  59  -4.493   2.405   2.964
  477    H    GLU  60           H        GLU  60  -6.329   8.134   3.428
  478    HA   GLU  60           HA       GLU  60  -8.062   8.282   1.011
  479   1HB   GLU  60          2HB       GLU  60  -8.433  10.659   1.722
  480   2HB   GLU  60          3HB       GLU  60  -9.149   9.466   2.773
  481   1HG   GLU  60          2HG       GLU  60  -6.447  10.699   3.433
  482   2HG   GLU  60          3HG       GLU  60  -7.949  11.534   3.808
  483    H    GLU  61           H        GLU  61  -7.526  10.195  -0.369
  484    HA   GLU  61           HA       GLU  61  -5.157   9.727  -1.627
  485   1HB   GLU  61          2HB       GLU  61  -5.674  11.595  -3.052
  486   2HB   GLU  61          3HB       GLU  61  -7.068  10.599  -2.694
  487   1HG   GLU  61          2HG       GLU  61  -8.132  12.541  -2.375
  488   2HG   GLU  61          3HG       GLU  61  -7.411  12.516  -0.773
  489    H    ASP  62           H        ASP  62  -5.618  12.248   0.790
  490    HA   ASP  62           HA       ASP  62  -3.251  13.692   0.646
  491   1HB   ASP  62          2HB       ASP  62  -5.301  14.081   2.060
  492   2HB   ASP  62          3HB       ASP  62  -4.754  12.819   3.156
  493    H    GLU  63           H        GLU  63  -3.794  10.710   2.571
  494    HA   GLU  63           HA       GLU  63  -0.935  10.479   3.365
  495   1HB   GLU  63          2HB       GLU  63  -3.484   8.950   3.915
  496   2HB   GLU  63          3HB       GLU  63  -1.916   8.184   4.208
  497   1HG   GLU  63          2HG       GLU  63  -1.321   9.623   5.910
  498   2HG   GLU  63          3HG       GLU  63  -2.267  10.965   5.280
  499    H    LEU  64           H        LEU  64  -3.240   9.108   1.048
  500    HA   LEU  64           HA       LEU  64  -1.672   6.987   0.127
  501   1HB   LEU  64          2HB       LEU  64  -4.133   7.662  -0.351
  502   2HB   LEU  64          3HB       LEU  64  -3.466   8.562  -1.720
  503    HG   LEU  64           HG       LEU  64  -2.580   5.725  -1.373
  504   1HD1  LEU  64          1HD1      LEU  64  -5.364   6.438  -2.374
  505   2HD1  LEU  64          2HD1      LEU  64  -4.610   4.822  -2.403
  506   3HD1  LEU  64          3HD1      LEU  64  -4.989   5.595  -0.856
  507   1HD2  LEU  64          1HD2      LEU  64  -1.901   7.283  -3.304
  508   2HD2  LEU  64          2HD2      LEU  64  -2.538   5.716  -3.760
  509   3HD2  LEU  64          3HD2      LEU  64  -3.576   7.155  -3.865
  510    H    GLY  65           H        GLY  65  -1.594  10.426  -0.959
  511   1HA   GLY  65          2HA       GLY  65   0.082  10.341  -3.122
  512   2HA   GLY  65          3HA       GLY  65   0.192  11.590  -1.882
  513    H    PHE  66           H        PHE  66   1.151   9.448   0.119
  514    HA   PHE  66           HA       PHE  66   3.747   8.642  -1.027
  515   1HB   PHE  66          2HB       PHE  66   5.073   9.642   0.691
  516   2HB   PHE  66          3HB       PHE  66   4.165  10.866  -0.158
  517    HD1  PHE  66           1HD      PHE  66   5.062   9.604   3.045
  518    HD2  PHE  66           2HD      PHE  66   1.945  11.757   0.990
  519    HE1  PHE  66           1HE      PHE  66   4.294  10.564   5.204
  520    HE2  PHE  66           2HE      PHE  66   1.160  12.681   3.135
  521    HZ   PHE  66           HZ       PHE  66   2.337  12.106   5.252
  522    H    ILE  67           H        ILE  67   1.298   7.126  -0.118
  523    HA   ILE  67           HA       ILE  67   1.415   5.876   2.346
  524    HB   ILE  67           HB       ILE  67  -0.401   5.494   1.045
  525   1HG1  ILE  67          2HG       ILE  67   0.300   3.601   2.369
  526   2HG1  ILE  67          3HG       ILE  67  -0.820   3.211   1.077
  527   1HG2  ILE  67          1HG       ILE  67   1.315   4.926  -1.271
  528   2HG2  ILE  67          2HG       ILE  67  -0.071   3.825  -1.102
  529   3HG2  ILE  67          3HG       ILE  67  -0.347   5.517  -1.183
  530   1HD1  ILE  67          1HD1      ILE  67   1.991   2.311   1.496
  531   2HD1  ILE  67          2HD1      ILE  67   0.616   1.438   0.808
  532   3HD1  ILE  67          3HD1      ILE  67   1.528   2.591  -0.182
  533    H    LEU  68           H        LEU  68   3.284   4.780  -0.461
  534    HA   LEU  68           HA       LEU  68   4.512   2.559   0.752
  535   1HB   LEU  68          2HB       LEU  68   6.430   3.223  -1.015
  536   2HB   LEU  68          3HB       LEU  68   4.972   2.371  -1.428
  537    HG   LEU  68           HG       LEU  68   4.966   5.388  -1.544
  538   1HD1  LEU  68          1HD1      LEU  68   5.781   3.852  -4.003
  539   2HD1  LEU  68          2HD1      LEU  68   5.850   5.577  -3.665
  540   3HD1  LEU  68          3HD1      LEU  68   6.970   4.448  -2.882
  541   1HD2  LEU  68          1HD2      LEU  68   2.949   3.619  -1.970
  542   2HD2  LEU  68          2HD2      LEU  68   3.131   5.124  -2.899
  543   3HD2  LEU  68          3HD2      LEU  68   3.653   3.576  -3.566
  544    H    LYS  69           H        LYS  69   5.255   5.950   1.406
  545    HA   LYS  69           HA       LYS  69   7.900   5.392   2.390
  546   1HB   LYS  69          2HB       LYS  69   6.747   7.656   1.581
  547   2HB   LYS  69          3HB       LYS  69   6.298   7.757   3.286
  548   1HG   LYS  69          2HG       LYS  69   9.041   6.991   3.277
  549   2HG   LYS  69          3HG       LYS  69   8.907   8.122   1.932
  550   1HD   LYS  69          2HD       LYS  69   8.387   9.916   3.316
  551   2HD   LYS  69          3HD       LYS  69   7.691   8.884   4.589
  552   1HE   LYS  69          2HE       LYS  69   9.859   8.020   5.213
  553   2HE   LYS  69          3HE       LYS  69  10.653   8.864   3.877
  554   1HZ   LYS  69          1HZ       LYS  69   9.269  10.213   6.120
  555   2HZ   LYS  69          2HZ       LYS  69  10.897  10.016   6.009
  556   3HZ   LYS  69          3HZ       LYS  69  10.108  10.955   4.914
  557    H    GLY  70           H        GLY  70   4.866   4.584   3.634
  558   1HA   GLY  70          2HA       GLY  70   5.880   4.253   6.418
  559   2HA   GLY  70          3HA       GLY  70   4.250   3.902   5.837
  560    H    PHE  71           H        PHE  71   5.817   2.437   3.435
  561    HA   PHE  71           HA       PHE  71   6.178  -0.160   4.808
  562   1HB   PHE  71          2HB       PHE  71   6.228   0.722   1.912
  563   2HB   PHE  71          3HB       PHE  71   7.043  -0.746   2.402
  564    HD1  PHE  71           1HD      PHE  71   5.777  -2.570   3.615
  565    HD2  PHE  71           2HD      PHE  71   3.817   0.694   1.599
  566    HE1  PHE  71           1HE      PHE  71   3.672  -3.867   3.553
  567    HE2  PHE  71           2HE      PHE  71   1.714  -0.618   1.517
  568    HZ   PHE  71           HZ       PHE  71   1.629  -2.894   2.503
  569    H    SER  72           H        SER  72   8.239   2.352   3.114
  570    HA   SER  72           HA       SER  72  10.411   1.933   4.941
  571   1HB   SER  72          2HB       SER  72  10.248   0.179   2.653
  572   2HB   SER  72          3HB       SER  72  11.587   1.298   2.380
  573    HG   SER  72           HG       SER  72  12.027  -0.680   3.638
  574    HA   PRO  73           HA       PRO  73  11.602   5.772   2.803
  575   1HB   PRO  73          2HB       PRO  73  14.340   5.708   2.642
  576   2HB   PRO  73          3HB       PRO  73  13.458   5.993   4.174
  577   1HG   PRO  73          2HG       PRO  73  14.580   3.376   3.133
  578   2HG   PRO  73          3HG       PRO  73  14.807   4.106   4.755
  579   1HD   PRO  73          2HD       PRO  73  12.943   2.212   4.285
  580   2HD   PRO  73          3HD       PRO  73  12.601   3.553   5.409
  581    H    ASP  74           H        ASP  74  12.925   6.416   0.902
  582    HA   ASP  74           HA       ASP  74  13.520   6.463  -1.278
  583   1HB   ASP  74          2HB       ASP  74  13.508   3.435  -1.345
  584   2HB   ASP  74          3HB       ASP  74  14.262   4.537  -2.487
  585    H    ALA  75           H        ALA  75  10.685   5.257  -0.221
  586    HA   ALA  75           HA       ALA  75   9.077   4.506  -2.291
  587   1HB   ALA  75          1HB       ALA  75   8.549   6.257   0.149
  588   2HB   ALA  75          2HB       ALA  75   7.269   5.525  -0.814
  589   3HB   ALA  75          3HB       ALA  75   8.438   4.487   0.043
  590    H    ARG  76           H        ARG  76   9.417   7.869  -1.275
  591    HA   ARG  76           HA       ARG  76   9.201   9.893  -2.317
  592   1HB   ARG  76          2HB       ARG  76   8.728   8.714  -5.050
  593   2HB   ARG  76          3HB       ARG  76   9.513  10.215  -4.584
  594   1HG   ARG  76          2HG       ARG  76  11.271   8.508  -3.468
  595   2HG   ARG  76          3HG       ARG  76  10.566   7.415  -4.669
  596   1HD   ARG  76          2HD       ARG  76  12.502   8.387  -5.671
  597   2HD   ARG  76          3HD       ARG  76  11.090   9.161  -6.427
  598    HE   ARG  76           HE       ARG  76  12.110  10.544  -4.066
  599   1HH1  ARG  76          1HH2      ARG  76  12.489  10.379  -7.521
  600   2HH1  ARG  76          2HH2      ARG  76  13.111  12.005  -7.658
  601   1HH2  ARG  76          1HH1      ARG  76  12.874  12.615  -4.245
  602   2HH2  ARG  76          2HH1      ARG  76  13.338  13.243  -5.796
  603    H    ASP  77           H        ASP  77   7.754  11.126  -3.962
  604    HA   ASP  77           HA       ASP  77   4.988  10.901  -3.191
  605   1HB   ASP  77          2HB       ASP  77   4.876  12.963  -4.655
  606   2HB   ASP  77          3HB       ASP  77   5.925  13.074  -3.250
  607    H    LEU  78           H        LEU  78   3.632   9.710  -4.217
  608    HA   LEU  78           HA       LEU  78   3.877   8.474  -6.805
  609   1HB   LEU  78          2HB       LEU  78   1.444   9.109  -5.086
  610   2HB   LEU  78          3HB       LEU  78   1.372   8.093  -6.518
  611    HG   LEU  78           HG       LEU  78   3.128   7.464  -4.102
  612   1HD1  LEU  78          1HD1      LEU  78   0.878   5.678  -4.434
  613   2HD1  LEU  78          2HD1      LEU  78   1.461   6.559  -3.026
  614   3HD1  LEU  78          3HD1      LEU  78   0.346   7.335  -4.151
  615   1HD2  LEU  78          1HD2      LEU  78   3.974   6.370  -6.107
  616   2HD2  LEU  78          2HD2      LEU  78   3.105   5.155  -5.178
  617   3HD2  LEU  78          3HD2      LEU  78   2.330   5.876  -6.581
  618    H    SER  79           H        SER  79   2.395   8.729  -8.593
  619    HA   SER  79           HA       SER  79   2.267  11.469  -9.666
  620   1HB   SER  79          2HB       SER  79   2.817   9.631 -11.171
  621   2HB   SER  79          3HB       SER  79   1.332   8.767 -10.730
  622    HG   SER  79           HG       SER  79   1.248   9.966 -12.729
  623    H    ALA  80           H        ALA  80   0.450  12.712 -10.002
  624    HA   ALA  80           HA       ALA  80  -1.909  12.349  -8.470
  625   1HB   ALA  80          1HB       ALA  80  -1.488  13.924 -11.052
  626   2HB   ALA  80          2HB       ALA  80  -2.824  14.151  -9.899
  627   3HB   ALA  80          3HB       ALA  80  -1.159  14.515  -9.403
  628    H    LYS  81           H        LYS  81  -1.022  10.964 -11.554
  629    HA   LYS  81           HA       LYS  81  -3.732  10.140 -12.370
  630   1HB   LYS  81          2HB       LYS  81  -1.059   8.973 -13.237
  631   2HB   LYS  81          3HB       LYS  81  -2.601   8.837 -14.075
  632   1HG   LYS  81          2HG       LYS  81  -0.759  11.235 -13.827
  633   2HG   LYS  81          3HG       LYS  81  -1.228  10.353 -15.282
  634   1HD   LYS  81          2HD       LYS  81  -3.588  11.186 -14.954
  635   2HD   LYS  81          3HD       LYS  81  -2.995  12.161 -13.586
  636   1HE   LYS  81          2HE       LYS  81  -1.269  13.150 -15.200
  637   2HE   LYS  81          3HE       LYS  81  -2.161  12.367 -16.510
  638   1HZ   LYS  81          1HZ       LYS  81  -3.244  14.391 -14.640
  639   2HZ   LYS  81          2HZ       LYS  81  -2.868  14.647 -16.218
  640   3HZ   LYS  81          3HZ       LYS  81  -4.115  13.650 -15.830
  641    H    GLU  82           H        GLU  82  -0.968   8.716 -10.686
  642    HA   GLU  82           HA       GLU  82  -2.014   6.099 -10.311
  643   1HB   GLU  82          2HB       GLU  82   0.357   6.747 -10.074
  644   2HB   GLU  82          3HB       GLU  82   0.022   7.665  -8.642
  645   1HG   GLU  82          2HG       GLU  82  -0.685   4.728  -8.855
  646   2HG   GLU  82          3HG       GLU  82   0.941   5.272  -8.448
  647    H    THR  83           H        THR  83  -1.928   8.952  -8.066
  648    HA   THR  83           HA       THR  83  -3.347   7.892  -6.027
  649    HB   THR  83           HB       THR  83  -3.707  10.779  -6.923
  650    HG1  THR  83           1HG      THR  83  -1.834  10.898  -5.361
  651   1HG2  THR  83          1HG       THR  83  -3.578   9.531  -4.139
  652   2HG2  THR  83          2HG       THR  83  -3.763  11.257  -4.508
  653   3HG2  THR  83          3HG       THR  83  -5.056  10.124  -4.931
  654    H    LYS  84           H        LYS  84  -4.798   9.417  -8.877
  655    HA   LYS  84           HA       LYS  84  -7.579   9.163  -8.153
  656   1HB   LYS  84          2HB       LYS  84  -6.078   9.429 -10.788
  657   2HB   LYS  84          3HB       LYS  84  -7.831   9.190 -10.747
  658   1HG   LYS  84          2HG       LYS  84  -8.149  11.174  -9.385
  659   2HG   LYS  84          3HG       LYS  84  -6.398  11.443  -9.271
  660   1HD   LYS  84          2HD       LYS  84  -6.230  11.886 -11.643
  661   2HD   LYS  84          3HD       LYS  84  -7.918  11.380 -11.914
  662   1HE   LYS  84          2HE       LYS  84  -8.699  13.205 -10.421
  663   2HE   LYS  84          3HE       LYS  84  -7.028  13.740 -10.194
  664   1HZ   LYS  84          1HZ       LYS  84  -8.451  13.657 -12.793
  665   2HZ   LYS  84          2HZ       LYS  84  -8.191  15.016 -11.904
  666   3HZ   LYS  84          3HZ       LYS  84  -6.917  14.204 -12.555
  667    H    MET  85           H        MET  85  -5.527   7.005 -10.190
  668    HA   MET  85           HA       MET  85  -7.581   4.995 -10.468
  669   1HB   MET  85          2HB       MET  85  -4.537   4.869 -10.689
  670   2HB   MET  85          3HB       MET  85  -5.583   3.467 -10.958
  671   1HG   MET  85          2HG       MET  85  -6.799   4.693 -12.724
  672   2HG   MET  85          3HG       MET  85  -5.707   6.073 -12.515
  673   1HE   MET  85          1HE       MET  85  -5.389   5.947 -15.134
  674   2HE   MET  85          2HE       MET  85  -4.673   4.566 -15.997
  675   3HE   MET  85          3HE       MET  85  -6.315   4.436 -15.323
  676    H    LEU  86           H        LEU  86  -5.029   5.420  -8.004
  677    HA   LEU  86           HA       LEU  86  -5.565   2.977  -6.641
  678   1HB   LEU  86          2HB       LEU  86  -3.971   5.438  -6.163
  679   2HB   LEU  86          3HB       LEU  86  -4.656   4.808  -4.689
  680    HG   LEU  86           HG       LEU  86  -2.499   3.923  -5.095
  681   1HD1  LEU  86          1HD1      LEU  86  -4.458   1.635  -5.336
  682   2HD1  LEU  86          2HD1      LEU  86  -2.848   1.648  -4.585
  683   3HD1  LEU  86          3HD1      LEU  86  -4.154   2.583  -3.863
  684   1HD2  LEU  86          1HD2      LEU  86  -2.928   3.952  -7.715
  685   2HD2  LEU  86          2HD2      LEU  86  -1.849   2.787  -7.031
  686   3HD2  LEU  86          3HD2      LEU  86  -3.502   2.285  -7.464
  687    H    MET  87           H        MET  87  -6.872   6.269  -6.069
  688    HA   MET  87           HA       MET  87  -8.346   5.549  -3.792
  689   1HB   MET  87          2HB       MET  87  -8.120   7.878  -4.602
  690   2HB   MET  87          3HB       MET  87  -9.077   7.489  -6.036
  691   1HG   MET  87          2HG       MET  87 -10.989   6.876  -4.455
  692   2HG   MET  87          3HG       MET  87 -10.001   7.519  -3.142
  693   1HE   MET  87          1HE       MET  87 -12.282   8.142  -6.159
  694   2HE   MET  87          2HE       MET  87 -12.081   9.866  -6.538
  695   3HE   MET  87          3HE       MET  87 -10.773   8.721  -6.901
  696    H    ALA  88           H        ALA  88  -9.310   5.386  -7.251
  697    HA   ALA  88           HA       ALA  88 -11.871   4.188  -6.837
  698   1HB   ALA  88          1HB       ALA  88 -10.034   4.180  -9.276
  699   2HB   ALA  88          2HB       ALA  88 -11.769   3.791  -9.274
  700   3HB   ALA  88          3HB       ALA  88 -11.227   5.431  -8.863
  701    H    ALA  89           H        ALA  89  -8.745   2.602  -7.784
  702    HA   ALA  89           HA       ALA  89  -9.923  -0.038  -7.829
  703   1HB   ALA  89          1HB       ALA  89  -6.999   0.853  -7.726
  704   2HB   ALA  89          2HB       ALA  89  -7.584  -0.773  -8.138
  705   3HB   ALA  89          3HB       ALA  89  -7.962   0.601  -9.197
  706    H    GLY  90           H        GLY  90  -7.836   1.680  -5.461
  707   1HA   GLY  90          2HA       GLY  90  -7.204  -0.405  -3.712
  708   2HA   GLY  90          3HA       GLY  90  -7.254   1.310  -3.334
  709    H    ASP  91           H        ASP  91  -9.863   2.018  -3.517
  710    HA   ASP  91           HA       ASP  91 -11.250   0.700  -1.304
  711   1HB   ASP  91          2HB       ASP  91 -11.462   3.056  -1.538
  712   2HB   ASP  91          3HB       ASP  91 -12.039   2.888  -3.206
  713    H    LYS  92           H        LYS  92 -10.935  -1.413  -2.550
  714    HA   LYS  92           HA       LYS  92 -12.576  -2.146  -4.745
  715   1HB   LYS  92          2HB       LYS  92 -11.038  -3.481  -2.609
  716   2HB   LYS  92          3HB       LYS  92 -12.423  -4.431  -3.085
  717   1HG   LYS  92          2HG       LYS  92 -10.286  -3.390  -5.005
  718   2HG   LYS  92          3HG       LYS  92 -10.382  -5.020  -4.335
  719   1HD   LYS  92          2HD       LYS  92 -12.755  -5.135  -5.366
  720   2HD   LYS  92          3HD       LYS  92 -12.287  -3.711  -6.315
  721   1HE   LYS  92          2HE       LYS  92 -10.365  -4.974  -7.260
  722   2HE   LYS  92          3HE       LYS  92 -10.778  -6.351  -6.228
  723   1HZ   LYS  92          1HZ       LYS  92 -12.184  -5.427  -8.619
  724   2HZ   LYS  92          2HZ       LYS  92 -11.862  -6.978  -8.103
  725   3HZ   LYS  92          3HZ       LYS  92 -13.052  -6.154  -7.414
  726    H    ASP  93           H        ASP  93 -13.703  -1.172  -1.808
  727    HA   ASP  93           HA       ASP  93 -16.151  -2.876  -1.712
  728   1HB   ASP  93          2HB       ASP  93 -14.565  -2.985   0.123
  729   2HB   ASP  93          3HB       ASP  93 -14.600  -1.224   0.288
  730    H    GLY  94           H        GLY  94 -15.188   0.556  -2.111
  731   1HA   GLY  94          2HA       GLY  94 -16.647   2.035  -3.184
  732   2HA   GLY  94          3HA       GLY  94 -18.049   1.199  -2.547
  733    H    ASP  95           H        ASP  95 -15.428   2.157  -0.386
  734    HA   ASP  95           HA       ASP  95 -17.267   4.138   1.005
  735   1HB   ASP  95          2HB       ASP  95 -14.418   3.313   1.691
  736   2HB   ASP  95          3HB       ASP  95 -15.402   4.435   2.622
  737    H    GLY  96           H        GLY  96 -14.718   4.066  -1.282
  738   1HA   GLY  96          2HA       GLY  96 -13.436   5.582  -2.331
  739   2HA   GLY  96          3HA       GLY  96 -14.003   6.903  -1.279
  740    H    LYS  97           H        LYS  97 -13.021   4.816   1.051
  741    HA   LYS  97           HA       LYS  97 -10.119   5.440   0.815
  742   1HB   LYS  97          2HB       LYS  97 -11.919   4.944   3.216
  743   2HB   LYS  97          3HB       LYS  97 -10.170   5.218   3.270
  744   1HG   LYS  97          2HG       LYS  97 -10.481   7.434   2.166
  745   2HG   LYS  97          3HG       LYS  97 -12.246   7.201   2.202
  746   1HD   LYS  97          2HD       LYS  97 -12.245   7.062   4.624
  747   2HD   LYS  97          3HD       LYS  97 -10.474   7.084   4.623
  748   1HE   LYS  97          2HE       LYS  97 -10.309   9.296   4.427
  749   2HE   LYS  97          3HE       LYS  97 -11.561   9.391   3.191
  750   1HZ   LYS  97          1HZ       LYS  97 -12.056   9.138   6.094
  751   2HZ   LYS  97          2HZ       LYS  97 -12.115  10.547   5.259
  752   3HZ   LYS  97          3HZ       LYS  97 -13.210   9.352   4.929
  753    H    ILE  98           H        ILE  98  -8.603   4.018   1.535
  754    HA   ILE  98           HA       ILE  98  -9.093   1.165   0.866
  755    HB   ILE  98           HB       ILE  98  -6.565   2.677   1.579
  756   1HG1  ILE  98          2HG       ILE  98  -7.659   1.443  -0.949
  757   2HG1  ILE  98          3HG       ILE  98  -7.421   3.156  -0.619
  758   1HG2  ILE  98          1HG       ILE  98  -6.657  -0.286   0.881
  759   2HG2  ILE  98          2HG       ILE  98  -5.205   0.684   1.172
  760   3HG2  ILE  98          3HG       ILE  98  -6.279   0.345   2.499
  761   1HD1  ILE  98          1HD1      ILE  98  -5.314   1.062  -1.187
  762   2HD1  ILE  98          2HD1      ILE  98  -5.713   2.511  -2.110
  763   3HD1  ILE  98          3HD1      ILE  98  -4.916   2.679  -0.531
  764    H    GLY  99           H        GLY  99  -9.680  -0.226   2.303
  765   1HA   GLY  99          2HA       GLY  99  -8.939   0.117   5.183
  766   2HA   GLY  99          3HA       GLY  99 -10.373  -0.760   4.623
  767    H    VAL 100           H        VAL 100  -8.127  -1.683   6.179
  768    HA   VAL 100           HA       VAL 100  -6.161  -3.093   5.013
  769    HB   VAL 100           HB       VAL 100  -6.410  -2.711   7.365
  770   1HG1  VAL 100          1HG       VAL 100  -8.418  -4.971   7.598
  771   2HG1  VAL 100          2HG       VAL 100  -7.704  -4.007   8.897
  772   3HG1  VAL 100          3HG       VAL 100  -8.801  -3.239   7.746
  773   1HG2  VAL 100          1HG       VAL 100  -4.974  -4.607   6.359
  774   2HG2  VAL 100          2HG       VAL 100  -5.260  -4.540   8.089
  775   3HG2  VAL 100          3HG       VAL 100  -6.166  -5.705   7.091
  776    H    ASP 101           H        ASP 101  -9.373  -4.570   5.547
  777    HA   ASP 101           HA       ASP 101  -8.626  -7.187   4.672
  778   1HB   ASP 101          2HB       ASP 101 -10.578  -6.468   6.144
  779   2HB   ASP 101          3HB       ASP 101 -11.409  -5.950   4.675
  780    H    GLU 102           H        GLU 102 -10.066  -4.409   2.985
  781    HA   GLU 102           HA       GLU 102 -10.251  -5.617   0.362
  782   1HB   GLU 102          2HB       GLU 102  -9.738  -2.700   1.071
  783   2HB   GLU 102          3HB       GLU 102 -10.253  -3.322  -0.479
  784   1HG   GLU 102          2HG       GLU 102 -12.390  -3.294   0.106
  785   2HG   GLU 102          3HG       GLU 102 -12.125  -4.229   1.574
  786    H    PHE 103           H        PHE 103  -7.722  -3.559   1.933
  787    HA   PHE 103           HA       PHE 103  -5.980  -3.490  -0.239
  788   1HB   PHE 103          2HB       PHE 103  -5.982  -2.285   2.092
  789   2HB   PHE 103          3HB       PHE 103  -4.985  -3.621   2.624
  790    HD1  PHE 103           1HD      PHE 103  -2.833  -2.704   2.947
  791    HD2  PHE 103           2HD      PHE 103  -5.069  -1.556  -0.561
  792    HE1  PHE 103           1HE      PHE 103  -0.967  -1.273   2.203
  793    HE2  PHE 103           2HE      PHE 103  -3.214  -0.120  -1.280
  794    HZ   PHE 103           HZ       PHE 103  -1.131   0.014   0.071
  795    H    SER 104           H        SER 104  -6.212  -5.996   2.207
  796    HA   SER 104           HA       SER 104  -4.042  -7.689   1.427
  797   1HB   SER 104          2HB       SER 104  -5.437  -7.746   3.529
  798   2HB   SER 104          3HB       SER 104  -6.746  -8.469   2.587
  799    HG   SER 104           HG       SER 104  -5.574 -10.119   3.495
  800    H    THR 105           H        THR 105  -7.254  -7.308  -0.020
  801    HA   THR 105           HA       THR 105  -6.964  -9.862  -1.528
  802    HB   THR 105           HB       THR 105  -9.463  -9.764  -1.550
  803    HG1  THR 105           1HG      THR 105  -9.345  -7.971   0.633
  804   1HG2  THR 105          1HG       THR 105  -8.172  -9.780   1.210
  805   2HG2  THR 105          2HG       THR 105  -9.698 -10.565   0.747
  806   3HG2  THR 105          3HG       THR 105  -8.155 -11.137   0.070
  807    H    LEU 106           H        LEU 106  -7.722  -6.511  -1.866
  808    HA   LEU 106           HA       LEU 106  -8.246  -5.792  -4.438
  809   1HB   LEU 106          2HB       LEU 106  -7.608  -4.257  -2.658
  810   2HB   LEU 106          3HB       LEU 106  -6.024  -5.004  -2.512
  811    HG   LEU 106           HG       LEU 106  -5.423  -4.082  -4.790
  812   1HD1  LEU 106          1HD1      LEU 106  -8.036  -2.585  -4.358
  813   2HD1  LEU 106          2HD1      LEU 106  -6.839  -2.211  -5.617
  814   3HD1  LEU 106          3HD1      LEU 106  -7.717  -3.748  -5.661
  815   1HD2  LEU 106          1HD2      LEU 106  -4.681  -3.019  -2.730
  816   2HD2  LEU 106          2HD2      LEU 106  -5.087  -1.796  -3.945
  817   3HD2  LEU 106          3HD2      LEU 106  -6.216  -2.129  -2.606
  818    H    VAL 107           H        VAL 107  -5.266  -7.176  -3.321
  819    HA   VAL 107           HA       VAL 107  -3.911  -7.091  -5.942
  820    HB   VAL 107           HB       VAL 107  -1.980  -7.732  -4.549
  821   1HG1  VAL 107          1HG       VAL 107  -3.486  -5.358  -3.352
  822   2HG1  VAL 107          2HG       VAL 107  -1.742  -5.551  -3.567
  823   3HG1  VAL 107          3HG       VAL 107  -2.763  -5.343  -4.976
  824   1HG2  VAL 107          1HG       VAL 107  -3.934  -8.586  -2.633
  825   2HG2  VAL 107          2HG       VAL 107  -2.202  -8.598  -2.493
  826   3HG2  VAL 107          3HG       VAL 107  -3.117  -7.196  -1.918
  827    H    ALA 108           H        ALA 108  -5.671  -9.380  -4.221
  828    HA   ALA 108           HA       ALA 108  -4.564 -11.713  -5.699
  829   1HB   ALA 108          1HB       ALA 108  -7.007 -11.517  -3.889
  830   2HB   ALA 108          2HB       ALA 108  -6.224 -12.994  -4.491
  831   3HB   ALA 108          3HB       ALA 108  -5.387 -11.951  -3.318
  832    H    GLU 109           H        GLU 109  -7.503  -9.687  -5.447
  833    HA   GLU 109           HA       GLU 109  -8.689 -10.313  -7.971
  834   1HB   GLU 109          2HB       GLU 109  -8.628  -7.924  -6.100
  835   2HB   GLU 109          3HB       GLU 109  -9.395  -7.770  -7.674
  836   1HG   GLU 109          2HG       GLU 109 -10.121 -10.003  -5.727
  837   2HG   GLU 109          3HG       GLU 109 -10.904  -8.422  -5.714
  838    H    SER 110           H        SER 110  -5.739  -8.711  -7.240
  839    HA   SER 110           HA       SER 110  -4.242  -7.488  -8.549
  840   1HB   SER 110          2HB       SER 110  -3.071  -9.100  -9.849
  841   2HB   SER 110          3HB       SER 110  -3.846  -9.993  -8.545
  842    HG   SER 110           HG       SER 110  -5.510 -10.546 -10.007
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1   4.152   0.238  14.160
    2   2H    MET   1           H2       MET   1   2.678  -0.508  14.294
    3   3H    MET   1           H3       MET   1   3.393  -0.330  12.818
    4    HA   MET   1           HA       MET   1   4.317  -1.990  15.049
    5   1HB   MET   1          2HB       MET   1   2.395  -2.736  13.442
    6   2HB   MET   1          3HB       MET   1   3.680  -2.997  12.260
    7   1HG   MET   1          2HG       MET   1   3.261  -5.067  13.457
    8   2HG   MET   1          3HG       MET   1   4.827  -4.482  13.992
    9   1HE   MET   1          1HE       MET   1   4.406  -6.400  15.967
   10   2HE   MET   1          2HE       MET   1   2.989  -6.345  17.037
   11   3HE   MET   1          3HE       MET   1   2.776  -6.670  15.303
   12    H    SER   2           H        SER   2   5.839  -3.555  12.807
   13    HA   SER   2           HA       SER   2   8.080  -1.673  12.337
   14   1HB   SER   2          2HB       SER   2   9.510  -3.693  13.079
   15   2HB   SER   2          3HB       SER   2   8.728  -2.691  14.316
   16    HG   SER   2           HG       SER   2   8.498  -5.047  14.559
   17    H    MET   3           H        MET   3   7.664  -1.536  10.156
   18    HA   MET   3           HA       MET   3   7.167  -3.830   8.484
   19   1HB   MET   3          2HB       MET   3   6.648  -1.124   8.259
   20   2HB   MET   3          3HB       MET   3   7.966  -1.308   7.131
   21   1HG   MET   3          2HG       MET   3   6.228  -1.789   5.761
   22   2HG   MET   3          3HG       MET   3   6.579  -3.417   6.305
   23   1HE   MET   3          1HE       MET   3   5.093  -3.312   9.370
   24   2HE   MET   3          2HE       MET   3   3.498  -3.922   8.904
   25   3HE   MET   3          3HE       MET   3   4.956  -4.688   8.244
   26    H    THR   4           H        THR   4   8.945  -4.969   9.281
   27    HA   THR   4           HA       THR   4  11.237  -5.288   7.490
   28    HB   THR   4           HB       THR   4  11.551  -3.865  10.156
   29    HG1  THR   4           1HG      THR   4  11.470  -2.898   7.970
   30   1HG2  THR   4          1HG       THR   4  13.736  -5.451   8.750
   31   2HG2  THR   4          2HG       THR   4  14.013  -4.208   9.986
   32   3HG2  THR   4          3HG       THR   4  13.146  -5.689  10.409
   33    H    ASP   5           H        ASP   5  10.036  -5.778  10.827
   34    HA   ASP   5           HA       ASP   5  11.281  -8.402  11.062
   35   1HB   ASP   5          2HB       ASP   5  11.207  -6.603  12.818
   36   2HB   ASP   5          3HB       ASP   5   9.460  -6.811  12.923
   37    H    LEU   6           H        LEU   6   7.952  -7.129  11.006
   38    HA   LEU   6           HA       LEU   6   6.571  -9.662  11.118
   39   1HB   LEU   6          2HB       LEU   6   5.846  -6.839  10.218
   40   2HB   LEU   6          3HB       LEU   6   4.722  -8.160  10.037
   41    HG   LEU   6           HG       LEU   6   4.317  -6.721  11.991
   42   1HD1  LEU   6          1HD1      LEU   6   4.879  -9.623  12.708
   43   2HD1  LEU   6          2HD1      LEU   6   3.790  -8.513  13.564
   44   3HD1  LEU   6          3HD1      LEU   6   3.420  -9.009  11.901
   45   1HD2  LEU   6          1HD2      LEU   6   6.669  -6.343  12.684
   46   2HD2  LEU   6          2HD2      LEU   6   5.625  -6.874  14.013
   47   3HD2  LEU   6          3HD2      LEU   6   6.750  -8.019  13.270
   48    H    LEU   7           H        LEU   7   7.005  -7.428   8.413
   49    HA   LEU   7           HA       LEU   7   6.236  -9.322   6.430
   50   1HB   LEU   7          2HB       LEU   7   7.070  -6.475   6.426
   51   2HB   LEU   7          3HB       LEU   7   7.307  -7.373   4.918
   52    HG   LEU   7           HG       LEU   7   4.639  -7.448   6.343
   53   1HD1  LEU   7          1HD1      LEU   7   5.529  -5.482   4.181
   54   2HD1  LEU   7          2HD1      LEU   7   3.879  -5.708   4.732
   55   3HD1  LEU   7          3HD1      LEU   7   5.088  -5.086   5.861
   56   1HD2  LEU   7          1HD2      LEU   7   5.334  -9.098   4.431
   57   2HD2  LEU   7          2HD2      LEU   7   3.816  -8.210   4.258
   58   3HD2  LEU   7          3HD2      LEU   7   5.266  -7.711   3.373
   59    H    ASN   8           H        ASN   8   9.304  -7.693   6.432
   60    HA   ASN   8           HA       ASN   8  11.346  -9.219   6.532
   61   1HB   ASN   8          2HB       ASN   8  10.001 -10.080   3.978
   62   2HB   ASN   8          3HB       ASN   8  11.755 -10.159   4.137
   63   1HD2  ASN   8          2HD2      ASN   8  10.020 -12.235   3.574
   64   2HD2  ASN   8          1HD2      ASN   8  10.249 -13.450   4.902
   65    H    ALA   9           H        ALA   9  12.825  -7.570   6.282
   66    HA   ALA   9           HA       ALA   9  12.595  -5.244   4.753
   67   1HB   ALA   9          1HB       ALA   9  15.102  -6.741   5.608
   68   2HB   ALA   9          2HB       ALA   9  15.039  -5.042   5.084
   69   3HB   ALA   9          3HB       ALA   9  14.197  -5.539   6.559
   70    H    GLU  10           H        GLU  10  14.157  -8.308   3.695
   71    HA   GLU  10           HA       GLU  10  15.156  -7.380   1.207
   72   1HB   GLU  10          2HB       GLU  10  14.239 -10.216   1.879
   73   2HB   GLU  10          3HB       GLU  10  15.349  -9.721   0.608
   74   1HG   GLU  10          2HG       GLU  10  16.893 -10.362   2.125
   75   2HG   GLU  10          3HG       GLU  10  16.733  -8.697   2.664
   76    H    ASP  11           H        ASP  11  12.068  -8.871   2.014
   77    HA   ASP  11           HA       ASP  11  10.967  -8.911  -0.686
   78   1HB   ASP  11          2HB       ASP  11   9.586  -9.027   2.024
   79   2HB   ASP  11          3HB       ASP  11   8.847  -9.281   0.455
   80    H    ILE  12           H        ILE  12  10.627  -6.681   2.135
   81    HA   ILE  12           HA       ILE  12   9.154  -4.590   0.913
   82    HB   ILE  12           HB       ILE  12  10.935  -4.863   3.262
   83   1HG1  ILE  12          2HG       ILE  12   9.117  -3.136   4.120
   84   2HG1  ILE  12          3HG       ILE  12   8.265  -3.546   2.635
   85   1HG2  ILE  12          1HG       ILE  12  10.587  -2.104   2.099
   86   2HG2  ILE  12          2HG       ILE  12  11.197  -2.517   3.727
   87   3HG2  ILE  12          3HG       ILE  12  12.137  -2.973   2.325
   88   1HD1  ILE  12          1HD1      ILE  12   9.243  -5.485   4.774
   89   2HD1  ILE  12          2HD1      ILE  12   7.595  -4.880   4.600
   90   3HD1  ILE  12          3HD1      ILE  12   8.287  -5.929   3.330
   91    H    LYS  13           H        LYS  13  12.691  -5.055   0.766
   92    HA   LYS  13           HA       LYS  13  13.287  -2.754  -0.763
   93   1HB   LYS  13          2HB       LYS  13  15.108  -3.806   0.159
   94   2HB   LYS  13          3HB       LYS  13  14.543  -5.416  -0.208
   95   1HG   LYS  13          2HG       LYS  13  16.542  -4.924  -1.408
   96   2HG   LYS  13          3HG       LYS  13  15.214  -5.263  -2.501
   97   1HD   LYS  13          2HD       LYS  13  15.307  -3.213  -3.479
   98   2HD   LYS  13          3HD       LYS  13  15.494  -2.352  -1.953
   99   1HE   LYS  13          2HE       LYS  13  17.750  -3.925  -3.260
  100   2HE   LYS  13          3HE       LYS  13  17.436  -2.219  -3.617
  101   1HZ   LYS  13          1HZ       LYS  13  18.028  -3.298  -0.927
  102   2HZ   LYS  13          2HZ       LYS  13  19.083  -2.456  -1.868
  103   3HZ   LYS  13          3HZ       LYS  13  17.736  -1.720  -1.277
  104    H    LYS  14           H        LYS  14  12.439  -6.006  -1.982
  105    HA   LYS  14           HA       LYS  14  12.394  -5.152  -4.781
  106   1HB   LYS  14          2HB       LYS  14  11.239  -7.610  -3.392
  107   2HB   LYS  14          3HB       LYS  14  11.290  -7.370  -5.150
  108   1HG   LYS  14          2HG       LYS  14  13.761  -7.195  -5.087
  109   2HG   LYS  14          3HG       LYS  14  13.745  -7.357  -3.332
  110   1HD   LYS  14          2HD       LYS  14  14.363  -9.450  -4.056
  111   2HD   LYS  14          3HD       LYS  14  12.653  -9.645  -3.645
  112   1HE   LYS  14          2HE       LYS  14  12.036  -9.531  -6.018
  113   2HE   LYS  14          3HE       LYS  14  13.694  -9.097  -6.466
  114   1HZ   LYS  14          1HZ       LYS  14  12.885 -11.673  -5.255
  115   2HZ   LYS  14          2HZ       LYS  14  13.294 -11.447  -6.834
  116   3HZ   LYS  14          3HZ       LYS  14  14.421 -11.254  -5.655
  117    H    ALA  15           H        ALA  15   9.973  -5.203  -2.246
  118    HA   ALA  15           HA       ALA  15   7.688  -4.648  -3.835
  119   1HB   ALA  15          1HB       ALA  15   8.131  -3.649  -0.991
  120   2HB   ALA  15          2HB       ALA  15   6.669  -4.237  -1.768
  121   3HB   ALA  15          3HB       ALA  15   7.961  -5.371  -1.376
  122    H    VAL  16           H        VAL  16   9.660  -2.302  -1.879
  123    HA   VAL  16           HA       VAL  16   8.350   0.006  -2.983
  124    HB   VAL  16           HB       VAL  16  11.126  -0.188  -1.752
  125   1HG1  VAL  16          1HG       VAL  16   9.328   2.222  -2.274
  126   2HG1  VAL  16          2HG       VAL  16  10.794   2.234  -1.271
  127   3HG1  VAL  16          3HG       VAL  16  10.919   1.908  -3.002
  128   1HG2  VAL  16          1HG       VAL  16   9.404  -0.892  -0.151
  129   2HG2  VAL  16          2HG       VAL  16   9.945   0.744   0.248
  130   3HG2  VAL  16          3HG       VAL  16   8.394   0.512  -0.572
  131    H    GLY  17           H        GLY  17  11.145  -1.892  -4.118
  132   1HA   GLY  17          2HA       GLY  17  11.887  -0.218  -6.322
  133   2HA   GLY  17          3HA       GLY  17  12.208  -1.944  -6.150
  134    H    ALA  18           H        ALA  18   8.961  -1.974  -5.901
  135    HA   ALA  18           HA       ALA  18   8.470  -2.226  -8.815
  136   1HB   ALA  18          1HB       ALA  18   6.770  -3.143  -6.461
  137   2HB   ALA  18          2HB       ALA  18   6.600  -3.604  -8.166
  138   3HB   ALA  18          3HB       ALA  18   8.026  -4.127  -7.229
  139    H    PHE  19           H        PHE  19   7.049  -0.644  -5.886
  140    HA   PHE  19           HA       PHE  19   5.168   0.961  -7.541
  141   1HB   PHE  19          2HB       PHE  19   5.868   1.059  -4.580
  142   2HB   PHE  19          3HB       PHE  19   4.716   2.105  -5.406
  143    HD1  PHE  19           1HD      PHE  19   3.290   0.025  -7.151
  144    HD2  PHE  19           2HD      PHE  19   4.280   0.208  -2.962
  145    HE1  PHE  19           1HE      PHE  19   1.193  -1.154  -6.564
  146    HE2  PHE  19           2HE      PHE  19   2.104  -0.861  -2.396
  147    HZ   PHE  19           HZ       PHE  19   0.620  -1.615  -4.206
  148    H    SER  20           H        SER  20   8.524   1.522  -6.380
  149    HA   SER  20           HA       SER  20   8.433   4.362  -6.443
  150   1HB   SER  20          2HB       SER  20  10.692   2.376  -6.600
  151   2HB   SER  20          3HB       SER  20  10.984   4.098  -6.892
  152    HG   SER  20           HG       SER  20  11.281   3.781  -4.688
  153    H    ALA  21           H        ALA  21   7.064   4.630  -8.253
  154    HA   ALA  21           HA       ALA  21   8.546   5.574 -10.623
  155   1HB   ALA  21          1HB       ALA  21   6.096   3.746 -10.715
  156   2HB   ALA  21          2HB       ALA  21   6.855   4.519 -12.132
  157   3HB   ALA  21          3HB       ALA  21   7.741   3.296 -11.205
  158    H    THR  22           H        THR  22   6.637   6.776 -12.082
  159    HA   THR  22           HA       THR  22   5.482   8.832 -10.376
  160    HB   THR  22           HB       THR  22   4.530   9.665 -12.549
  161    HG1  THR  22           1HG      THR  22   4.353   8.237 -14.033
  162   1HG2  THR  22          1HG       THR  22   7.522   9.108 -12.588
  163   2HG2  THR  22          2HG       THR  22   6.662  10.350 -13.521
  164   3HG2  THR  22          3HG       THR  22   6.716  10.457 -11.750
  165    H    ASP  23           H        ASP  23   3.887   6.893 -12.843
  166    HA   ASP  23           HA       ASP  23   1.376   6.767 -11.295
  167   1HB   ASP  23          2HB       ASP  23   1.432   6.336 -14.239
  168   2HB   ASP  23          3HB       ASP  23   0.245   7.151 -13.232
  169    H    SER  24           H        SER  24   3.835   4.654 -11.833
  170    HA   SER  24           HA       SER  24   2.354   2.529 -13.237
  171   1HB   SER  24          2HB       SER  24   4.748   3.295 -13.761
  172   2HB   SER  24          3HB       SER  24   5.232   2.341 -12.344
  173    HG   SER  24           HG       SER  24   5.179   0.753 -13.731
  174    H    PHE  25           H        PHE  25   1.030   2.722 -11.128
  175    HA   PHE  25           HA       PHE  25   1.978   1.352  -8.759
  176   1HB   PHE  25          2HB       PHE  25   0.268   3.118  -8.775
  177   2HB   PHE  25          3HB       PHE  25  -0.813   2.152  -9.746
  178    HD1  PHE  25           1HD      PHE  25   0.955   2.225  -6.432
  179    HD2  PHE  25           2HD      PHE  25  -2.339   0.660  -8.732
  180    HE1  PHE  25           1HE      PHE  25   0.033   1.196  -4.389
  181    HE2  PHE  25           2HE      PHE  25  -3.255  -0.395  -6.686
  182    HZ   PHE  25           HZ       PHE  25  -2.030  -0.184  -4.518
  183    H    ASP  26           H        ASP  26   2.408  -0.789  -8.835
  184    HA   ASP  26           HA       ASP  26   0.496  -2.615 -10.202
  185   1HB   ASP  26          2HB       ASP  26   2.959  -2.174 -10.950
  186   2HB   ASP  26          3HB       ASP  26   3.388  -3.273  -9.648
  187    H    HIS  27           H        HIS  27  -0.807  -2.540  -8.247
  188    HA   HIS  27           HA       HIS  27   0.052  -3.104  -5.639
  189   1HB   HIS  27          2HB       HIS  27  -2.321  -3.723  -5.113
  190   2HB   HIS  27          3HB       HIS  27  -2.099  -2.176  -5.827
  191    HD1  HIS  27           HD1      HIS  27  -4.374  -4.989  -6.119
  192    HD2  HIS  27           HD2      HIS  27  -2.639  -2.179  -8.741
  193    HE1  HIS  27           HE1      HIS  27  -5.765  -5.013  -8.240
  194    H    LYS  28           H        LYS  28  -1.587  -5.364  -7.775
  195    HA   LYS  28           HA       LYS  28  -1.446  -7.770  -6.468
  196   1HB   LYS  28          2HB       LYS  28  -2.244  -6.739  -8.868
  197   2HB   LYS  28          3HB       LYS  28  -0.802  -7.579  -9.430
  198   1HG   LYS  28          2HG       LYS  28  -2.974  -8.748  -7.681
  199   2HG   LYS  28          3HG       LYS  28  -3.013  -8.731  -9.449
  200   1HD   LYS  28          2HD       LYS  28  -0.821 -10.112  -7.831
  201   2HD   LYS  28          3HD       LYS  28  -2.267 -10.923  -8.425
  202   1HE   LYS  28          2HE       LYS  28  -1.609  -9.877 -10.749
  203   2HE   LYS  28          3HE       LYS  28  -0.016  -9.672 -10.016
  204   1HZ   LYS  28          1HZ       LYS  28  -1.514 -12.222 -10.327
  205   2HZ   LYS  28          2HZ       LYS  28  -0.134 -11.821 -11.119
  206   3HZ   LYS  28          3HZ       LYS  28  -0.117 -12.100  -9.474
  207    H    LYS  29           H        LYS  29   1.100  -6.368  -8.645
  208    HA   LYS  29           HA       LYS  29   2.865  -8.543  -8.327
  209   1HB   LYS  29          2HB       LYS  29   2.528  -6.632 -10.093
  210   2HB   LYS  29          3HB       LYS  29   3.779  -5.781  -9.181
  211   1HG   LYS  29          2HG       LYS  29   5.346  -7.621  -9.702
  212   2HG   LYS  29          3HG       LYS  29   4.013  -8.579 -10.390
  213   1HD   LYS  29          2HD       LYS  29   3.584  -6.739 -12.034
  214   2HD   LYS  29          3HD       LYS  29   5.040  -5.905 -11.470
  215   1HE   LYS  29          2HE       LYS  29   4.927  -8.738 -12.558
  216   2HE   LYS  29          3HE       LYS  29   5.178  -7.312 -13.581
  217   1HZ   LYS  29          1HZ       LYS  29   6.957  -8.109 -11.354
  218   2HZ   LYS  29          2HZ       LYS  29   7.291  -8.321 -12.958
  219   3HZ   LYS  29          3HZ       LYS  29   7.166  -6.804 -12.330
  220    H    PHE  30           H        PHE  30   2.889  -5.235  -6.913
  221    HA   PHE  30           HA       PHE  30   5.048  -5.402  -5.110
  222   1HB   PHE  30          2HB       PHE  30   3.840  -3.350  -5.470
  223   2HB   PHE  30          3HB       PHE  30   2.341  -4.040  -4.884
  224    HD1  PHE  30           1HD      PHE  30   2.009  -4.509  -2.431
  225    HD2  PHE  30           2HD      PHE  30   5.464  -2.460  -3.945
  226    HE1  PHE  30           1HE      PHE  30   2.542  -3.734  -0.142
  227    HE2  PHE  30           2HE      PHE  30   5.982  -1.640  -1.647
  228    HZ   PHE  30           HZ       PHE  30   4.553  -2.342   0.256
  229    H    PHE  31           H        PHE  31   1.608  -6.331  -4.398
  230    HA   PHE  31           HA       PHE  31   2.123  -7.307  -1.803
  231   1HB   PHE  31          2HB       PHE  31  -0.094  -7.538  -3.757
  232   2HB   PHE  31          3HB       PHE  31  -0.005  -8.820  -2.588
  233    HD1  PHE  31           1HD      PHE  31  -0.944  -8.604  -0.480
  234    HD2  PHE  31           2HD      PHE  31  -0.141  -5.070  -2.784
  235    HE1  PHE  31           1HE      PHE  31  -2.106  -7.243   1.227
  236    HE2  PHE  31           2HE      PHE  31  -1.328  -3.695  -1.076
  237    HZ   PHE  31           HZ       PHE  31  -2.327  -4.795   0.917
  238    H    GLN  32           H        GLN  32   2.690  -8.942  -4.860
  239    HA   GLN  32           HA       GLN  32   3.212 -11.550  -3.572
  240   1HB   GLN  32          2HB       GLN  32   3.729 -10.491  -6.371
  241   2HB   GLN  32          3HB       GLN  32   4.021 -12.158  -5.880
  242   1HG   GLN  32          2HG       GLN  32   1.720 -12.633  -5.573
  243   2HG   GLN  32          3HG       GLN  32   1.242 -10.949  -5.591
  244   1HE2  GLN  32          2HE       GLN  32   3.144 -10.581  -8.082
  245   2HE2  GLN  32          1HE       GLN  32   2.188 -11.255  -9.388
  246    H    MET  33           H        MET  33   5.158  -8.902  -5.076
  247    HA   MET  33           HA       MET  33   7.729 -10.100  -4.654
  248   1HB   MET  33          2HB       MET  33   6.846  -7.224  -5.128
  249   2HB   MET  33          3HB       MET  33   8.540  -7.729  -5.094
  250   1HG   MET  33          2HG       MET  33   8.250  -9.177  -6.999
  251   2HG   MET  33          3HG       MET  33   6.504  -9.005  -6.948
  252   1HE   MET  33          1HE       MET  33   9.460  -8.103  -8.938
  253   2HE   MET  33          2HE       MET  33   9.434  -6.340  -9.167
  254   3HE   MET  33          3HE       MET  33   9.878  -7.020  -7.584
  255    H    VAL  34           H        VAL  34   5.860  -7.832  -2.660
  256    HA   VAL  34           HA       VAL  34   7.770  -7.708  -0.455
  257    HB   VAL  34           HB       VAL  34   5.860  -6.081  -1.180
  258   1HG1  VAL  34          1HG       VAL  34   4.296  -7.690   0.764
  259   2HG1  VAL  34          2HG       VAL  34   3.796  -6.241  -0.147
  260   3HG1  VAL  34          3HG       VAL  34   4.071  -7.783  -0.986
  261   1HG2  VAL  34          1HG       VAL  34   7.373  -5.750   0.784
  262   2HG2  VAL  34          2HG       VAL  34   5.729  -5.155   1.074
  263   3HG2  VAL  34          3HG       VAL  34   6.276  -6.696   1.769
  264    H    GLY  35           H        GLY  35   5.769 -10.195  -1.623
  265   1HA   GLY  35          2HA       GLY  35   4.840 -12.094  -0.824
  266   2HA   GLY  35          3HA       GLY  35   5.972 -11.961   0.520
  267    H    LEU  36           H        LEU  36   3.446  -9.512   0.041
  268    HA   LEU  36           HA       LEU  36   2.696  -9.568   2.757
  269   1HB   LEU  36          2HB       LEU  36   1.749  -8.230   0.279
  270   2HB   LEU  36          3HB       LEU  36   0.442  -8.530   1.422
  271    HG   LEU  36           HG       LEU  36   3.004  -7.197   2.294
  272   1HD1  LEU  36          1HD1      LEU  36   0.427  -5.723   1.728
  273   2HD1  LEU  36          2HD1      LEU  36   2.037  -5.071   2.066
  274   3HD1  LEU  36          3HD1      LEU  36   1.696  -5.852   0.508
  275   1HD2  LEU  36          1HD2      LEU  36   1.484  -8.340   3.990
  276   2HD2  LEU  36          2HD2      LEU  36   1.826  -6.630   4.162
  277   3HD2  LEU  36          3HD2      LEU  36   0.242  -7.171   3.522
  278    H    LYS  37           H        LYS  37   0.769 -10.578   0.133
  279    HA   LYS  37           HA       LYS  37  -1.222 -12.242   1.315
  280   1HB   LYS  37          2HB       LYS  37   0.183 -12.635  -1.356
  281   2HB   LYS  37          3HB       LYS  37  -1.184 -13.612  -0.816
  282   1HG   LYS  37          2HG       LYS  37  -2.531 -11.473  -0.562
  283   2HG   LYS  37          3HG       LYS  37  -1.215 -10.635  -1.394
  284   1HD   LYS  37          2HD       LYS  37  -2.805 -12.983  -2.514
  285   2HD   LYS  37          3HD       LYS  37  -3.094 -11.280  -2.882
  286   1HE   LYS  37          2HE       LYS  37  -0.793 -11.086  -3.812
  287   2HE   LYS  37          3HE       LYS  37  -0.535 -12.811  -3.494
  288   1HZ   LYS  37          1HZ       LYS  37  -2.568 -11.651  -5.323
  289   2HZ   LYS  37          2HZ       LYS  37  -1.215 -12.479  -5.775
  290   3HZ   LYS  37          3HZ       LYS  37  -2.428 -13.260  -4.983
  291    H    LYS  38           H        LYS  38   2.192 -13.021   1.377
  292    HA   LYS  38           HA       LYS  38   1.688 -15.885   1.976
  293   1HB   LYS  38          2HB       LYS  38   3.753 -16.284   1.257
  294   2HB   LYS  38          3HB       LYS  38   3.747 -14.658   0.614
  295   1HG   LYS  38          2HG       LYS  38   4.813 -13.933   2.869
  296   2HG   LYS  38          3HG       LYS  38   5.018 -15.638   3.210
  297   1HD   LYS  38          2HD       LYS  38   6.675 -15.923   1.630
  298   2HD   LYS  38          3HD       LYS  38   6.037 -14.673   0.551
  299   1HE   LYS  38          2HE       LYS  38   6.782 -12.908   2.114
  300   2HE   LYS  38          3HE       LYS  38   7.463 -14.123   3.191
  301   1HZ   LYS  38          1HZ       LYS  38   8.337 -13.773   0.371
  302   2HZ   LYS  38          2HZ       LYS  38   9.054 -13.024   1.618
  303   3HZ   LYS  38          3HZ       LYS  38   9.084 -14.670   1.541
  304    H    LYS  39           H        LYS  39   1.829 -12.915   3.628
  305    HA   LYS  39           HA       LYS  39   2.691 -14.049   6.222
  306   1HB   LYS  39          2HB       LYS  39   1.512 -11.306   5.664
  307   2HB   LYS  39          3HB       LYS  39   2.491 -11.789   7.031
  308   1HG   LYS  39          2HG       LYS  39   3.703 -11.759   4.240
  309   2HG   LYS  39          3HG       LYS  39   3.419 -10.291   5.133
  310   1HD   LYS  39          2HD       LYS  39   5.703 -11.077   5.339
  311   2HD   LYS  39          3HD       LYS  39   4.858 -10.877   6.875
  312   1HE   LYS  39          2HE       LYS  39   4.615 -13.621   6.197
  313   2HE   LYS  39          3HE       LYS  39   6.253 -13.151   5.718
  314   1HZ   LYS  39          1HZ       LYS  39   5.052 -12.678   8.387
  315   2HZ   LYS  39          2HZ       LYS  39   6.278 -13.760   8.051
  316   3HZ   LYS  39          3HZ       LYS  39   6.487 -12.113   7.957
  317    H    SER  40           H        SER  40   1.268 -13.607   8.108
  318    HA   SER  40           HA       SER  40  -1.285 -14.849   7.770
  319   1HB   SER  40          2HB       SER  40  -0.148 -13.328  10.157
  320   2HB   SER  40          3HB       SER  40  -1.486 -14.500  10.188
  321    HG   SER  40           HG       SER  40   0.518 -15.469  10.764
  322    H    ALA  41           H        ALA  41  -3.403 -13.989   8.293
  323    HA   ALA  41           HA       ALA  41  -4.120 -11.429   7.357
  324   1HB   ALA  41          1HB       ALA  41  -5.467 -13.152   9.472
  325   2HB   ALA  41          2HB       ALA  41  -6.231 -11.842   8.550
  326   3HB   ALA  41          3HB       ALA  41  -5.688 -13.313   7.703
  327    H    ASP  42           H        ASP  42  -3.280 -12.429  10.727
  328    HA   ASP  42           HA       ASP  42  -3.865  -9.858  11.828
  329   1HB   ASP  42          2HB       ASP  42  -3.670 -11.902  13.198
  330   2HB   ASP  42          3HB       ASP  42  -1.930 -11.968  12.857
  331    H    ASP  43           H        ASP  43  -1.091 -11.032  10.053
  332    HA   ASP  43           HA       ASP  43   0.804  -8.924  10.766
  333   1HB   ASP  43          2HB       ASP  43   1.255 -11.246   9.648
  334   2HB   ASP  43          3HB       ASP  43   0.751 -10.466   8.149
  335    H    VAL  44           H        VAL  44  -1.353  -9.577   7.973
  336    HA   VAL  44           HA       VAL  44  -1.241  -7.200   6.617
  337    HB   VAL  44           HB       VAL  44  -2.816  -9.563   6.624
  338   1HG1  VAL  44          1HG       VAL  44  -4.574  -7.148   6.166
  339   2HG1  VAL  44          2HG       VAL  44  -4.978  -8.855   5.861
  340   3HG1  VAL  44          3HG       VAL  44  -4.752  -8.282   7.506
  341   1HG2  VAL  44          1HG       VAL  44  -1.407  -8.703   4.848
  342   2HG2  VAL  44          2HG       VAL  44  -3.054  -9.010   4.270
  343   3HG2  VAL  44          3HG       VAL  44  -2.532  -7.340   4.586
  344    H    LYS  45           H        LYS  45  -3.240  -7.718   9.500
  345    HA   LYS  45           HA       LYS  45  -4.511  -5.162   9.611
  346   1HB   LYS  45          2HB       LYS  45  -3.998  -7.355  11.465
  347   2HB   LYS  45          3HB       LYS  45  -3.864  -5.783  12.268
  348   1HG   LYS  45          2HG       LYS  45  -6.043  -5.104  11.474
  349   2HG   LYS  45          3HG       LYS  45  -6.190  -6.559  10.470
  350   1HD   LYS  45          2HD       LYS  45  -6.176  -8.000  12.445
  351   2HD   LYS  45          3HD       LYS  45  -5.926  -6.625  13.523
  352   1HE   LYS  45          2HE       LYS  45  -8.299  -6.559  11.659
  353   2HE   LYS  45          3HE       LYS  45  -8.355  -7.709  12.999
  354   1HZ   LYS  45          1HZ       LYS  45  -7.880  -4.806  13.325
  355   2HZ   LYS  45          2HZ       LYS  45  -9.314  -5.566  13.600
  356   3HZ   LYS  45          3HZ       LYS  45  -8.009  -5.910  14.537
  357    H    LYS  46           H        LYS  46  -1.376  -6.084  10.916
  358    HA   LYS  46           HA       LYS  46  -0.655  -3.378  11.763
  359   1HB   LYS  46          2HB       LYS  46   0.864  -6.023  11.614
  360   2HB   LYS  46          3HB       LYS  46   1.589  -4.504  12.091
  361   1HG   LYS  46          2HG       LYS  46   1.052  -5.343  14.146
  362   2HG   LYS  46          3HG       LYS  46  -0.361  -4.341  13.847
  363   1HD   LYS  46          2HD       LYS  46  -1.633  -6.392  13.214
  364   2HD   LYS  46          3HD       LYS  46  -0.152  -7.360  13.438
  365   1HE   LYS  46          2HE       LYS  46  -0.072  -6.530  15.818
  366   2HE   LYS  46          3HE       LYS  46  -1.645  -5.759  15.557
  367   1HZ   LYS  46          1HZ       LYS  46  -1.152  -8.709  15.304
  368   2HZ   LYS  46          2HZ       LYS  46  -1.896  -7.973  16.571
  369   3HZ   LYS  46          3HZ       LYS  46  -2.538  -8.056  15.054
  370    H    VAL  47           H        VAL  47  -0.154  -5.238   8.842
  371    HA   VAL  47           HA       VAL  47   1.732  -3.547   7.515
  372    HB   VAL  47           HB       VAL  47  -0.572  -5.118   6.343
  373   1HG1  VAL  47          1HG       VAL  47   1.846  -4.174   4.808
  374   2HG1  VAL  47          2HG       VAL  47   0.380  -4.977   4.196
  375   3HG1  VAL  47          3HG       VAL  47   0.283  -3.329   4.766
  376   1HG2  VAL  47          1HG       VAL  47   1.350  -6.345   7.659
  377   2HG2  VAL  47          2HG       VAL  47   0.906  -6.938   6.076
  378   3HG2  VAL  47          3HG       VAL  47   2.348  -5.919   6.303
  379    H    PHE  48           H        PHE  48  -1.936  -3.358   6.970
  380    HA   PHE  48           HA       PHE  48  -1.955  -0.936   5.714
  381   1HB   PHE  48          2HB       PHE  48  -3.810  -2.439   5.907
  382   2HB   PHE  48          3HB       PHE  48  -3.836  -2.275   7.667
  383    HD1  PHE  48           1HD      PHE  48  -4.474  -0.476   4.461
  384    HD2  PHE  48           2HD      PHE  48  -4.960  -0.492   8.749
  385    HE1  PHE  48           1HE      PHE  48  -6.052   1.434   4.307
  386    HE2  PHE  48           2HE      PHE  48  -6.508   1.441   8.584
  387    HZ   PHE  48           HZ       PHE  48  -7.054   2.374   6.352
  388    H    HIS  49           H        HIS  49  -1.877  -1.387   9.294
  389    HA   HIS  49           HA       HIS  49  -2.250   1.321  10.030
  390   1HB   HIS  49          2HB       HIS  49  -0.458  -0.743  11.366
  391   2HB   HIS  49          3HB       HIS  49  -1.035   0.750  12.099
  392    HD1  HIS  49           HD1      HIS  49  -4.136   0.080  10.808
  393    HD2  HIS  49           HD2      HIS  49  -1.656  -2.042  13.460
  394    HE1  HIS  49           HE1      HIS  49  -5.652  -1.505  12.127
  395    H    MET  50           H        MET  50   0.639  -0.091   8.512
  396    HA   MET  50           HA       MET  50   2.429   2.027   9.391
  397   1HB   MET  50          2HB       MET  50   2.975  -0.381   8.593
  398   2HB   MET  50          3HB       MET  50   2.740   0.227   6.962
  399   1HG   MET  50          2HG       MET  50   5.080   0.320   7.487
  400   2HG   MET  50          3HG       MET  50   4.459   1.955   7.356
  401   1HE   MET  50          1HE       MET  50   5.219  -0.922   9.861
  402   2HE   MET  50          2HE       MET  50   5.500  -0.044  11.378
  403   3HE   MET  50          3HE       MET  50   3.849  -0.189  10.718
  404    H    LEU  51           H        LEU  51   0.113   1.688   6.820
  405    HA   LEU  51           HA       LEU  51   1.182   3.839   5.098
  406   1HB   LEU  51          2HB       LEU  51  -1.321   2.104   5.047
  407   2HB   LEU  51          3HB       LEU  51  -0.946   3.333   3.858
  408    HG   LEU  51           HG       LEU  51   1.046   2.033   3.127
  409   1HD1  LEU  51          1HD1      LEU  51   0.069   0.062   5.218
  410   2HD1  LEU  51          2HD1      LEU  51   1.044  -0.443   3.840
  411   3HD1  LEU  51          3HD1      LEU  51   1.718   0.703   4.986
  412   1HD2  LEU  51          1HD2      LEU  51  -1.236   1.746   2.106
  413   2HD2  LEU  51          2HD2      LEU  51  -0.241   0.296   2.007
  414   3HD2  LEU  51          3HD2      LEU  51  -1.538   0.407   3.224
  415    H    ASP  52           H        ASP  52  -1.650   3.168   7.128
  416    HA   ASP  52           HA       ASP  52  -2.953   5.742   6.975
  417   1HB   ASP  52          2HB       ASP  52  -4.085   3.605   7.410
  418   2HB   ASP  52          3HB       ASP  52  -3.140   3.376   8.875
  419    H    LYS  53           H        LYS  53  -0.746   6.822   7.310
  420    HA   LYS  53           HA       LYS  53   0.616   6.843   9.767
  421   1HB   LYS  53          2HB       LYS  53   0.371   9.136   7.773
  422   2HB   LYS  53          3HB       LYS  53   1.534   9.037   9.096
  423   1HG   LYS  53          2HG       LYS  53   1.984   6.621   7.825
  424   2HG   LYS  53          3HG       LYS  53   1.538   7.649   6.459
  425   1HD   LYS  53          2HD       LYS  53   3.728   8.175   8.514
  426   2HD   LYS  53          3HD       LYS  53   3.980   7.623   6.852
  427   1HE   LYS  53          2HE       LYS  53   3.168   9.715   5.939
  428   2HE   LYS  53          3HE       LYS  53   2.605  10.259   7.525
  429   1HZ   LYS  53          1HZ       LYS  53   5.435   9.809   6.802
  430   2HZ   LYS  53          2HZ       LYS  53   4.709  11.279   6.999
  431   3HZ   LYS  53          3HZ       LYS  53   4.898  10.276   8.283
  432    H    ASP  54           H        ASP  54  -2.331   8.623   9.023
  433    HA   ASP  54           HA       ASP  54  -2.318  10.203  11.490
  434   1HB   ASP  54          2HB       ASP  54  -4.502  10.947  10.650
  435   2HB   ASP  54          3HB       ASP  54  -3.247  11.131   9.429
  436    H    LYS  55           H        LYS  55  -2.856   6.951  10.840
  437    HA   LYS  55           HA       LYS  55  -3.971   5.244  11.789
  438   1HB   LYS  55          2HB       LYS  55  -3.508   6.934  14.265
  439   2HB   LYS  55          3HB       LYS  55  -3.903   5.212  14.283
  440   1HG   LYS  55          2HG       LYS  55  -1.446   6.343  12.873
  441   2HG   LYS  55          3HG       LYS  55  -1.449   5.787  14.544
  442   1HD   LYS  55          2HD       LYS  55  -1.848   3.527  13.953
  443   2HD   LYS  55          3HD       LYS  55  -2.403   3.936  12.329
  444   1HE   LYS  55          2HE       LYS  55  -0.184   2.959  12.282
  445   2HE   LYS  55          3HE       LYS  55  -0.252   4.572  11.586
  446   1HZ   LYS  55          1HZ       LYS  55   0.722   3.939  14.315
  447   2HZ   LYS  55          2HZ       LYS  55   1.678   4.307  13.016
  448   3HZ   LYS  55          3HZ       LYS  55   0.665   5.440  13.644
  449    H    SER  56           H        SER  56  -5.675   6.541  10.470
  450    HA   SER  56           HA       SER  56  -8.080   7.333  12.033
  451   1HB   SER  56          2HB       SER  56  -7.681   8.840  10.333
  452   2HB   SER  56          3HB       SER  56  -7.026   7.597   9.253
  453    HG   SER  56           HG       SER  56  -9.615   7.140   9.776
  454    H    GLY  57           H        GLY  57  -6.835   4.436  10.669
  455   1HA   GLY  57          2HA       GLY  57  -7.809   2.350  10.508
  456   2HA   GLY  57          3HA       GLY  57  -9.421   3.021  10.797
  457    H    PHE  58           H        PHE  58  -7.910   4.884   8.461
  458    HA   PHE  58           HA       PHE  58  -8.874   3.429   6.042
  459   1HB   PHE  58          2HB       PHE  58  -9.869   6.137   7.027
  460   2HB   PHE  58          3HB       PHE  58 -10.162   5.454   5.440
  461    HD1  PHE  58           1HD      PHE  58 -11.451   3.238   5.244
  462    HD2  PHE  58           2HD      PHE  58 -11.277   5.540   8.882
  463    HE1  PHE  58           1HE      PHE  58 -13.428   2.009   6.124
  464    HE2  PHE  58           2HE      PHE  58 -13.213   4.285   9.776
  465    HZ   PHE  58           HZ       PHE  58 -14.299   2.520   8.395
  466    H    ILE  59           H        ILE  59  -7.578   3.944   4.265
  467    HA   ILE  59           HA       ILE  59  -5.792   6.347   4.482
  468    HB   ILE  59           HB       ILE  59  -5.905   4.071   2.534
  469   1HG1  ILE  59          2HG       ILE  59  -3.592   4.711   4.405
  470   2HG1  ILE  59          3HG       ILE  59  -4.902   3.636   4.882
  471   1HG2  ILE  59          1HG       ILE  59  -3.899   6.332   2.571
  472   2HG2  ILE  59          2HG       ILE  59  -3.893   4.956   1.461
  473   3HG2  ILE  59          3HG       ILE  59  -5.201   6.126   1.388
  474   1HD1  ILE  59          1HD1      ILE  59  -2.963   3.228   2.597
  475   2HD1  ILE  59          2HD1      ILE  59  -3.251   2.200   4.024
  476   3HD1  ILE  59          3HD1      ILE  59  -4.462   2.291   2.750
  477    H    GLU  60           H        GLU  60  -6.221   8.057   3.350
  478    HA   GLU  60           HA       GLU  60  -8.280   8.119   1.227
  479   1HB   GLU  60          2HB       GLU  60  -7.847  10.653   2.757
  480   2HB   GLU  60          3HB       GLU  60  -9.254  10.048   1.915
  481   1HG   GLU  60          2HG       GLU  60  -9.958  10.096   4.111
  482   2HG   GLU  60          3HG       GLU  60  -9.548   8.401   3.882
  483    H    GLU  61           H        GLU  61  -7.949  10.264  -0.111
  484    HA   GLU  61           HA       GLU  61  -5.668   9.936  -1.592
  485   1HB   GLU  61          2HB       GLU  61  -6.241  11.838  -2.832
  486   2HB   GLU  61          3HB       GLU  61  -7.678  10.915  -2.407
  487   1HG   GLU  61          2HG       GLU  61  -8.085  12.585  -0.526
  488   2HG   GLU  61          3HG       GLU  61  -6.761  13.553  -1.190
  489    H    ASP  62           H        ASP  62  -5.897  11.902   1.261
  490    HA   ASP  62           HA       ASP  62  -3.623  13.586   0.903
  491   1HB   ASP  62          2HB       ASP  62  -5.654  13.710   2.551
  492   2HB   ASP  62          3HB       ASP  62  -4.679  12.688   3.601
  493    H    GLU  63           H        GLU  63  -3.927  10.446   2.711
  494    HA   GLU  63           HA       GLU  63  -1.003  10.303   3.187
  495   1HB   GLU  63          2HB       GLU  63  -3.174   8.168   3.332
  496   2HB   GLU  63          3HB       GLU  63  -1.472   7.886   3.685
  497   1HG   GLU  63          2HG       GLU  63  -2.240   8.144   5.801
  498   2HG   GLU  63          3HG       GLU  63  -1.780   9.811   5.458
  499    H    LEU  64           H        LEU  64  -3.424   8.993   0.957
  500    HA   LEU  64           HA       LEU  64  -1.853   7.091  -0.374
  501   1HB   LEU  64          2HB       LEU  64  -4.340   7.445  -0.135
  502   2HB   LEU  64          3HB       LEU  64  -4.209   8.645  -1.405
  503    HG   LEU  64           HG       LEU  64  -3.054   5.997  -2.013
  504   1HD1  LEU  64          1HD1      LEU  64  -6.059   6.446  -1.541
  505   2HD1  LEU  64          2HD1      LEU  64  -5.454   5.088  -2.485
  506   3HD1  LEU  64          3HD1      LEU  64  -5.024   5.218  -0.778
  507   1HD2  LEU  64          1HD2      LEU  64  -3.277   7.738  -3.722
  508   2HD2  LEU  64          2HD2      LEU  64  -4.354   6.419  -4.162
  509   3HD2  LEU  64          3HD2      LEU  64  -5.024   7.872  -3.433
  510    H    GLY  65           H        GLY  65  -1.696  10.535  -0.687
  511   1HA   GLY  65          2HA       GLY  65  -0.338  10.748  -3.202
  512   2HA   GLY  65          3HA       GLY  65  -0.103  11.787  -1.792
  513    H    PHE  66           H        PHE  66   0.935   9.803   0.072
  514    HA   PHE  66           HA       PHE  66   3.487   8.980  -1.249
  515   1HB   PHE  66          2HB       PHE  66   4.864  10.246   0.217
  516   2HB   PHE  66          3HB       PHE  66   3.764  11.312  -0.624
  517    HD1  PHE  66           1HD      PHE  66   4.994  10.284   2.589
  518    HD2  PHE  66           2HD      PHE  66   1.684  12.205   0.607
  519    HE1  PHE  66           1HE      PHE  66   4.358  11.402   4.709
  520    HE2  PHE  66           2HE      PHE  66   0.990  13.236   2.738
  521    HZ   PHE  66           HZ       PHE  66   2.329  12.862   4.798
  522    H    ILE  67           H        ILE  67   1.141   7.777   0.405
  523    HA   ILE  67           HA       ILE  67   1.475   6.174   2.417
  524    HB   ILE  67           HB       ILE  67  -0.333   6.135   0.997
  525   1HG1  ILE  67          2HG       ILE  67   0.154   3.982   2.043
  526   2HG1  ILE  67          3HG       ILE  67  -0.948   3.936   0.679
  527   1HG2  ILE  67          1HG       ILE  67   1.403   5.230  -1.315
  528   2HG2  ILE  67          2HG       ILE  67  -0.370   5.209  -1.307
  529   3HG2  ILE  67          3HG       ILE  67   0.494   6.738  -1.165
  530   1HD1  ILE  67          1HD1      ILE  67   1.919   2.965   0.766
  531   2HD1  ILE  67          2HD1      ILE  67   0.456   2.021   0.477
  532   3HD1  ILE  67          3HD1      ILE  67   1.014   3.150  -0.750
  533    H    LEU  68           H        LEU  68   3.351   5.614  -0.551
  534    HA   LEU  68           HA       LEU  68   4.603   3.198   0.117
  535   1HB   LEU  68          2HB       LEU  68   5.753   5.577  -1.384
  536   2HB   LEU  68          3HB       LEU  68   6.366   3.910  -1.434
  537    HG   LEU  68           HG       LEU  68   3.782   5.022  -2.596
  538   1HD1  LEU  68          1HD1      LEU  68   6.306   3.710  -3.740
  539   2HD1  LEU  68          2HD1      LEU  68   4.897   4.173  -4.690
  540   3HD1  LEU  68          3HD1      LEU  68   5.840   5.422  -3.878
  541   1HD2  LEU  68          1HD2      LEU  68   3.243   2.820  -1.681
  542   2HD2  LEU  68          2HD2      LEU  68   3.413   2.697  -3.432
  543   3HD2  LEU  68          3HD2      LEU  68   4.748   2.163  -2.364
  544    H    LYS  69           H        LYS  69   5.409   6.431   1.259
  545    HA   LYS  69           HA       LYS  69   8.018   5.856   2.332
  546   1HB   LYS  69          2HB       LYS  69   6.732   8.073   1.695
  547   2HB   LYS  69          3HB       LYS  69   6.171   8.033   3.356
  548   1HG   LYS  69          2HG       LYS  69   9.095   8.050   2.435
  549   2HG   LYS  69          3HG       LYS  69   8.144   9.483   2.816
  550   1HD   LYS  69          2HD       LYS  69   7.796   8.411   5.160
  551   2HD   LYS  69          3HD       LYS  69   9.169   7.376   4.732
  552   1HE   LYS  69          2HE       LYS  69   9.189  10.420   4.692
  553   2HE   LYS  69          3HE       LYS  69   9.791   9.425   6.026
  554   1HZ   LYS  69          1HZ       LYS  69  10.837   9.361   3.259
  555   2HZ   LYS  69          2HZ       LYS  69  11.574  10.094   4.536
  556   3HZ   LYS  69          3HZ       LYS  69  11.398   8.458   4.514
  557    H    GLY  70           H        GLY  70   4.887   4.922   3.452
  558   1HA   GLY  70          2HA       GLY  70   5.753   4.386   6.219
  559   2HA   GLY  70          3HA       GLY  70   4.254   3.848   5.435
  560    H    PHE  71           H        PHE  71   5.353   2.498   3.165
  561    HA   PHE  71           HA       PHE  71   6.042  -0.030   4.344
  562   1HB   PHE  71          2HB       PHE  71   6.226   0.989   1.488
  563   2HB   PHE  71          3HB       PHE  71   6.674  -0.635   1.959
  564    HD1  PHE  71           1HD      PHE  71   4.762  -1.835   3.563
  565    HD2  PHE  71           2HD      PHE  71   4.108   1.084   0.451
  566    HE1  PHE  71           1HE      PHE  71   2.523  -2.785   3.127
  567    HE2  PHE  71           2HE      PHE  71   1.862   0.131   0.035
  568    HZ   PHE  71           HZ       PHE  71   1.077  -1.827   1.350
  569    H    SER  72           H        SER  72   8.106   2.537   2.789
  570    HA   SER  72           HA       SER  72  10.196   2.102   4.613
  571   1HB   SER  72          2HB       SER  72  10.166   0.275   2.306
  572   2HB   SER  72          3HB       SER  72  11.687   1.175   2.407
  573    HG   SER  72           HG       SER  72  10.337  -0.315   4.409
  574    HA   PRO  73           HA       PRO  73  11.763   5.709   2.433
  575   1HB   PRO  73          2HB       PRO  73  14.469   5.633   2.707
  576   2HB   PRO  73          3HB       PRO  73  13.378   5.868   4.110
  577   1HG   PRO  73          2HG       PRO  73  14.646   3.279   3.161
  578   2HG   PRO  73          3HG       PRO  73  14.636   3.960   4.821
  579   1HD   PRO  73          2HD       PRO  73  12.853   2.087   3.979
  580   2HD   PRO  73          3HD       PRO  73  12.387   3.345   5.154
  581    H    ASP  74           H        ASP  74  12.999   6.355   0.662
  582    HA   ASP  74           HA       ASP  74  14.090   6.173  -1.502
  583   1HB   ASP  74          2HB       ASP  74  14.343   3.725  -1.602
  584   2HB   ASP  74          3HB       ASP  74  12.590   3.533  -1.756
  585    H    ALA  75           H        ALA  75  10.910   5.003  -0.725
  586    HA   ALA  75           HA       ALA  75   9.198   5.939  -2.622
  587   1HB   ALA  75          1HB       ALA  75   9.036   5.719   0.401
  588   2HB   ALA  75          2HB       ALA  75   7.633   6.054  -0.598
  589   3HB   ALA  75          3HB       ALA  75   8.530   4.517  -0.806
  590    H    ARG  76           H        ARG  76   7.856   7.649  -2.925
  591    HA   ARG  76           HA       ARG  76   8.299  10.262  -1.617
  592   1HB   ARG  76          2HB       ARG  76   8.328   9.983  -4.649
  593   2HB   ARG  76          3HB       ARG  76   8.728  11.397  -3.669
  594   1HG   ARG  76          2HG       ARG  76  10.768  10.131  -2.841
  595   2HG   ARG  76          3HG       ARG  76  10.356   8.858  -4.011
  596   1HD   ARG  76          2HD       ARG  76  12.003  10.235  -5.063
  597   2HD   ARG  76          3HD       ARG  76  10.461  10.543  -5.851
  598    HE   ARG  76           HE       ARG  76  10.414  12.710  -4.993
  599   1HH1  ARG  76          1HH2      ARG  76  13.090  11.036  -3.506
  600   2HH1  ARG  76          2HH2      ARG  76  13.797  12.485  -2.838
  601   1HH2  ARG  76          1HH1      ARG  76  11.291  14.553  -4.078
  602   2HH2  ARG  76          2HH1      ARG  76  12.761  14.450  -3.157
  603    H    ASP  77           H        ASP  77   6.759  11.915  -2.730
  604    HA   ASP  77           HA       ASP  77   4.073  11.211  -2.858
  605   1HB   ASP  77          2HB       ASP  77   5.443  13.511  -4.283
  606   2HB   ASP  77          3HB       ASP  77   3.767  13.422  -3.727
  607    H    LEU  78           H        LEU  78   3.192   9.866  -4.148
  608    HA   LEU  78           HA       LEU  78   3.850   8.945  -6.765
  609   1HB   LEU  78          2HB       LEU  78   1.234   9.051  -5.175
  610   2HB   LEU  78          3HB       LEU  78   1.467   8.109  -6.630
  611    HG   LEU  78           HG       LEU  78   3.029   7.637  -4.056
  612   1HD1  LEU  78          1HD1      LEU  78   0.531   6.349  -5.078
  613   2HD1  LEU  78          2HD1      LEU  78   1.638   5.555  -3.945
  614   3HD1  LEU  78          3HD1      LEU  78   0.876   7.092  -3.522
  615   1HD2  LEU  78          1HD2      LEU  78   4.385   6.780  -5.794
  616   2HD2  LEU  78          2HD2      LEU  78   3.328   5.387  -5.447
  617   3HD2  LEU  78          3HD2      LEU  78   2.997   6.398  -6.830
  618    H    SER  79           H        SER  79   2.635   9.256  -8.765
  619    HA   SER  79           HA       SER  79   2.130  12.000  -9.485
  620   1HB   SER  79          2HB       SER  79   2.852  10.431 -11.142
  621   2HB   SER  79          3HB       SER  79   1.510   9.341 -10.790
  622    HG   SER  79           HG       SER  79   1.119  10.345 -12.669
  623    H    ALA  80           H        ALA  80   0.249  13.012 -10.097
  624    HA   ALA  80           HA       ALA  80  -2.126  12.780  -8.584
  625   1HB   ALA  80          1HB       ALA  80  -1.658  14.019 -11.321
  626   2HB   ALA  80          2HB       ALA  80  -3.046  14.337 -10.251
  627   3HB   ALA  80          3HB       ALA  80  -1.413  14.811  -9.745
  628    H    LYS  81           H        LYS  81  -1.137  11.163 -11.570
  629    HA   LYS  81           HA       LYS  81  -3.812  10.132 -12.252
  630   1HB   LYS  81          2HB       LYS  81  -1.139   9.062 -13.216
  631   2HB   LYS  81          3HB       LYS  81  -2.702   8.908 -13.994
  632   1HG   LYS  81          2HG       LYS  81  -0.964  11.399 -13.772
  633   2HG   LYS  81          3HG       LYS  81  -1.376  10.490 -15.221
  634   1HD   LYS  81          2HD       LYS  81  -3.795  11.115 -14.883
  635   2HD   LYS  81          3HD       LYS  81  -3.307  12.110 -13.495
  636   1HE   LYS  81          2HE       LYS  81  -1.817  13.438 -14.987
  637   2HE   LYS  81          3HE       LYS  81  -2.391  12.494 -16.372
  638   1HZ   LYS  81          1HZ       LYS  81  -4.081  14.180 -14.617
  639   2HZ   LYS  81          2HZ       LYS  81  -3.625  14.558 -16.151
  640   3HZ   LYS  81          3HZ       LYS  81  -4.634  13.287 -15.884
  641    H    GLU  82           H        GLU  82  -0.942   8.967 -10.645
  642    HA   GLU  82           HA       GLU  82  -1.659   6.269 -10.101
  643   1HB   GLU  82          2HB       GLU  82   0.546   7.815  -9.728
  644   2HB   GLU  82          3HB       GLU  82  -0.055   7.850  -8.104
  645   1HG   GLU  82          2HG       GLU  82   0.268   5.233  -9.606
  646   2HG   GLU  82          3HG       GLU  82   1.642   6.023  -8.851
  647    H    THR  83           H        THR  83  -1.789   9.087  -7.857
  648    HA   THR  83           HA       THR  83  -3.238   7.751  -5.895
  649    HB   THR  83           HB       THR  83  -2.156   9.788  -5.331
  650    HG1  THR  83           1HG      THR  83  -3.745  10.729  -4.117
  651   1HG2  THR  83          1HG       THR  83  -4.239  11.309  -6.957
  652   2HG2  THR  83          2HG       THR  83  -2.968  12.008  -5.927
  653   3HG2  THR  83          3HG       THR  83  -2.528  11.102  -7.375
  654    H    LYS  84           H        LYS  84  -4.680   9.518  -8.643
  655    HA   LYS  84           HA       LYS  84  -7.416   9.036  -7.887
  656   1HB   LYS  84          2HB       LYS  84  -6.002   9.664 -10.493
  657   2HB   LYS  84          3HB       LYS  84  -7.674   9.075 -10.536
  658   1HG   LYS  84          2HG       LYS  84  -8.350  10.805  -8.911
  659   2HG   LYS  84          3HG       LYS  84  -6.717  11.490  -8.936
  660   1HD   LYS  84          2HD       LYS  84  -6.961  12.315 -11.122
  661   2HD   LYS  84          3HD       LYS  84  -8.263  11.171 -11.529
  662   1HE   LYS  84          2HE       LYS  84  -9.810  12.261 -10.013
  663   2HE   LYS  84          3HE       LYS  84  -8.554  13.355  -9.424
  664   1HZ   LYS  84          1HZ       LYS  84  -9.540  13.283 -12.217
  665   2HZ   LYS  84          2HZ       LYS  84 -10.014  14.376 -11.085
  666   3HZ   LYS  84          3HZ       LYS  84  -8.453  14.356 -11.596
  667    H    MET  85           H        MET  85  -5.288   7.012  -9.988
  668    HA   MET  85           HA       MET  85  -7.347   5.016 -10.328
  669   1HB   MET  85          2HB       MET  85  -5.392   5.367 -11.867
  670   2HB   MET  85          3HB       MET  85  -4.336   4.640 -10.641
  671   1HG   MET  85          2HG       MET  85  -5.638   2.544 -10.751
  672   2HG   MET  85          3HG       MET  85  -6.799   3.303 -11.839
  673   1HE   MET  85          1HE       MET  85  -6.727   3.058 -14.338
  674   2HE   MET  85          2HE       MET  85  -5.681   1.779 -14.993
  675   3HE   MET  85          3HE       MET  85  -6.724   1.442 -13.591
  676    H    LEU  86           H        LEU  86  -4.559   5.213  -8.074
  677    HA   LEU  86           HA       LEU  86  -5.004   2.718  -6.772
  678   1HB   LEU  86          2HB       LEU  86  -2.888   3.754  -6.616
  679   2HB   LEU  86          3HB       LEU  86  -3.555   5.270  -6.028
  680    HG   LEU  86           HG       LEU  86  -4.034   4.318  -3.865
  681   1HD1  LEU  86          1HD1      LEU  86  -3.668   1.729  -5.164
  682   2HD1  LEU  86          2HD1      LEU  86  -2.996   1.871  -3.510
  683   3HD1  LEU  86          3HD1      LEU  86  -4.699   2.181  -3.843
  684   1HD2  LEU  86          1HD2      LEU  86  -1.798   5.182  -4.237
  685   2HD2  LEU  86          2HD2      LEU  86  -1.749   3.820  -3.102
  686   3HD2  LEU  86          3HD2      LEU  86  -1.249   3.609  -4.801
  687    H    MET  87           H        MET  87  -6.248   6.041  -5.918
  688    HA   MET  87           HA       MET  87  -7.747   5.236  -3.647
  689   1HB   MET  87          2HB       MET  87  -7.437   7.594  -4.347
  690   2HB   MET  87          3HB       MET  87  -8.430   7.300  -5.775
  691   1HG   MET  87          2HG       MET  87 -10.246   6.543  -3.977
  692   2HG   MET  87          3HG       MET  87  -9.226   7.452  -2.869
  693   1HE   MET  87          1HE       MET  87 -11.830   7.437  -5.691
  694   2HE   MET  87          2HE       MET  87 -11.773   9.080  -6.368
  695   3HE   MET  87          3HE       MET  87 -10.433   7.953  -6.666
  696    H    ALA  88           H        ALA  88  -8.877   5.434  -7.080
  697    HA   ALA  88           HA       ALA  88 -11.437   4.338  -6.584
  698   1HB   ALA  88          1HB       ALA  88  -9.775   4.371  -9.142
  699   2HB   ALA  88          2HB       ALA  88 -11.532   4.109  -9.043
  700   3HB   ALA  88          3HB       ALA  88 -10.839   5.672  -8.562
  701    H    ALA  89           H        ALA  89  -8.490   2.612  -7.790
  702    HA   ALA  89           HA       ALA  89  -9.863   0.059  -7.946
  703   1HB   ALA  89          1HB       ALA  89  -6.884   0.737  -7.947
  704   2HB   ALA  89          2HB       ALA  89  -7.610  -0.809  -8.437
  705   3HB   ALA  89          3HB       ALA  89  -7.932   0.661  -9.381
  706    H    GLY  90           H        GLY  90  -7.634   1.557  -5.532
  707   1HA   GLY  90          2HA       GLY  90  -7.271  -0.751  -3.926
  708   2HA   GLY  90          3HA       GLY  90  -6.993   0.928  -3.445
  709    H    ASP  91           H        ASP  91  -9.615   1.982  -3.697
  710    HA   ASP  91           HA       ASP  91 -11.146   0.718  -1.541
  711   1HB   ASP  91          2HB       ASP  91 -11.177   3.103  -1.739
  712   2HB   ASP  91          3HB       ASP  91 -11.765   2.999  -3.415
  713    H    LYS  92           H        LYS  92 -10.855  -1.337  -2.998
  714    HA   LYS  92           HA       LYS  92 -12.566  -1.932  -5.172
  715   1HB   LYS  92          2HB       LYS  92 -12.245  -4.208  -4.515
  716   2HB   LYS  92          3HB       LYS  92 -10.749  -3.261  -4.336
  717   1HG   LYS  92          2HG       LYS  92 -10.524  -4.057  -2.245
  718   2HG   LYS  92          3HG       LYS  92 -11.959  -3.136  -1.801
  719   1HD   LYS  92          2HD       LYS  92 -12.364  -5.363  -1.069
  720   2HD   LYS  92          3HD       LYS  92 -13.364  -5.123  -2.515
  721   1HE   LYS  92          2HE       LYS  92 -11.432  -6.135  -3.851
  722   2HE   LYS  92          3HE       LYS  92 -10.673  -6.576  -2.316
  723   1HZ   LYS  92          1HZ       LYS  92 -13.416  -7.391  -3.043
  724   2HZ   LYS  92          2HZ       LYS  92 -12.112  -8.240  -3.509
  725   3HZ   LYS  92          3HZ       LYS  92 -12.432  -8.066  -1.876
  726    H    ASP  93           H        ASP  93 -13.582  -1.038  -2.215
  727    HA   ASP  93           HA       ASP  93 -16.045  -2.713  -2.019
  728   1HB   ASP  93          2HB       ASP  93 -14.189  -2.782  -0.324
  729   2HB   ASP  93          3HB       ASP  93 -14.482  -1.073  -0.008
  730    H    GLY  94           H        GLY  94 -15.071   0.484  -2.893
  731   1HA   GLY  94          2HA       GLY  94 -16.414   2.186  -3.617
  732   2HA   GLY  94          3HA       GLY  94 -17.839   1.340  -3.025
  733    H    ASP  95           H        ASP  95 -15.210   2.050  -0.850
  734    HA   ASP  95           HA       ASP  95 -17.027   3.905   0.767
  735   1HB   ASP  95          2HB       ASP  95 -14.263   2.769   1.341
  736   2HB   ASP  95          3HB       ASP  95 -14.943   4.048   2.313
  737    H    GLY  96           H        GLY  96 -14.670   4.233  -1.634
  738   1HA   GLY  96          2HA       GLY  96 -13.169   5.682  -2.371
  739   2HA   GLY  96          3HA       GLY  96 -13.884   6.996  -1.410
  740    H    LYS  97           H        LYS  97 -12.871   4.196   0.387
  741    HA   LYS  97           HA       LYS  97 -10.120   5.259   0.902
  742   1HB   LYS  97          2HB       LYS  97 -12.110   4.466   3.062
  743   2HB   LYS  97          3HB       LYS  97 -10.387   4.709   3.286
  744   1HG   LYS  97          2HG       LYS  97 -11.051   6.765   3.934
  745   2HG   LYS  97          3HG       LYS  97 -10.822   7.093   2.223
  746   1HD   LYS  97          2HD       LYS  97 -12.859   8.122   2.971
  747   2HD   LYS  97          3HD       LYS  97 -13.282   6.778   1.915
  748   1HE   LYS  97          2HE       LYS  97 -13.403   5.415   4.208
  749   2HE   LYS  97          3HE       LYS  97 -13.558   7.012   4.928
  750   1HZ   LYS  97          1HZ       LYS  97 -15.288   6.043   2.707
  751   2HZ   LYS  97          2HZ       LYS  97 -15.702   5.890   4.307
  752   3HZ   LYS  97          3HZ       LYS  97 -15.523   7.378   3.614
  753    H    ILE  98           H        ILE  98  -8.652   3.789   1.392
  754    HA   ILE  98           HA       ILE  98  -9.106   0.931   0.739
  755    HB   ILE  98           HB       ILE  98  -6.635   2.463   1.587
  756   1HG1  ILE  98          2HG       ILE  98  -7.440   1.238  -1.065
  757   2HG1  ILE  98          3HG       ILE  98  -7.481   2.958  -0.684
  758   1HG2  ILE  98          1HG       ILE  98  -6.717  -0.437   0.738
  759   2HG2  ILE  98          2HG       ILE  98  -5.260   0.479   1.150
  760   3HG2  ILE  98          3HG       ILE  98  -6.403   0.096   2.410
  761   1HD1  ILE  98          1HD1      ILE  98  -5.062   1.208  -1.103
  762   2HD1  ILE  98          2HD1      ILE  98  -5.546   2.698  -1.924
  763   3HD1  ILE  98          3HD1      ILE  98  -4.949   2.780  -0.258
  764    H    GLY  99           H        GLY  99  -9.873  -0.354   2.202
  765   1HA   GLY  99          2HA       GLY  99  -9.134  -0.009   5.102
  766   2HA   GLY  99          3HA       GLY  99 -10.536  -0.921   4.539
  767    H    VAL 100           H        VAL 100  -8.235  -1.732   6.149
  768    HA   VAL 100           HA       VAL 100  -6.242  -3.052   4.893
  769    HB   VAL 100           HB       VAL 100  -6.283  -2.600   7.215
  770   1HG1  VAL 100          1HG       VAL 100  -8.191  -4.890   7.759
  771   2HG1  VAL 100          2HG       VAL 100  -7.380  -3.840   8.928
  772   3HG1  VAL 100          3HG       VAL 100  -8.605  -3.161   7.854
  773   1HG2  VAL 100          1HG       VAL 100  -4.930  -4.562   6.133
  774   2HG2  VAL 100          2HG       VAL 100  -4.959  -4.317   7.867
  775   3HG2  VAL 100          3HG       VAL 100  -5.975  -5.589   7.144
  776    H    ASP 101           H        ASP 101  -9.247  -4.750   5.818
  777    HA   ASP 101           HA       ASP 101  -8.468  -7.359   4.945
  778   1HB   ASP 101          2HB       ASP 101 -10.337  -6.604   6.549
  779   2HB   ASP 101          3HB       ASP 101 -11.305  -6.267   5.120
  780    H    GLU 102           H        GLU 102 -10.060  -4.700   3.346
  781    HA   GLU 102           HA       GLU 102 -10.702  -5.949   0.823
  782   1HB   GLU 102          2HB       GLU 102 -10.167  -3.029   1.487
  783   2HB   GLU 102          3HB       GLU 102 -10.995  -3.614   0.089
  784   1HG   GLU 102          2HG       GLU 102 -12.969  -4.006   1.223
  785   2HG   GLU 102          3HG       GLU 102 -12.178  -4.392   2.749
  786    H    PHE 103           H        PHE 103  -8.093  -3.695   1.843
  787    HA   PHE 103           HA       PHE 103  -6.550  -3.627  -0.478
  788   1HB   PHE 103          2HB       PHE 103  -6.422  -2.334   1.759
  789   2HB   PHE 103          3HB       PHE 103  -5.486  -3.664   2.375
  790    HD1  PHE 103           1HD      PHE 103  -5.436  -1.726  -0.887
  791    HD2  PHE 103           2HD      PHE 103  -3.296  -2.936   2.657
  792    HE1  PHE 103           1HE      PHE 103  -3.471  -0.460  -1.646
  793    HE2  PHE 103           2HE      PHE 103  -1.333  -1.698   1.893
  794    HZ   PHE 103           HZ       PHE 103  -1.381  -0.453  -0.290
  795    H    SER 104           H        SER 104  -6.596  -6.012   2.055
  796    HA   SER 104           HA       SER 104  -4.286  -7.571   1.335
  797   1HB   SER 104          2HB       SER 104  -6.770  -8.351   2.923
  798   2HB   SER 104          3HB       SER 104  -5.193  -9.167   2.948
  799    HG   SER 104           HG       SER 104  -5.872  -6.538   3.865
  800    H    THR 105           H        THR 105  -7.555  -7.506   0.085
  801    HA   THR 105           HA       THR 105  -7.232 -10.173  -1.189
  802    HB   THR 105           HB       THR 105  -9.723 -10.205  -1.080
  803    HG1  THR 105           1HG      THR 105  -9.584  -8.264   0.955
  804   1HG2  THR 105          1HG       THR 105  -8.257  -9.930   1.580
  805   2HG2  THR 105          2HG       THR 105  -9.773 -10.812   1.306
  806   3HG2  THR 105          3HG       THR 105  -8.256 -11.376   0.562
  807    H    LEU 106           H        LEU 106  -8.108  -6.881  -1.741
  808    HA   LEU 106           HA       LEU 106  -8.652  -6.386  -4.381
  809   1HB   LEU 106          2HB       LEU 106  -8.137  -4.698  -2.736
  810   2HB   LEU 106          3HB       LEU 106  -6.556  -5.395  -2.433
  811    HG   LEU 106           HG       LEU 106  -5.778  -4.616  -4.673
  812   1HD1  LEU 106          1HD1      LEU 106  -8.429  -3.125  -4.636
  813   2HD1  LEU 106          2HD1      LEU 106  -7.127  -2.889  -5.817
  814   3HD1  LEU 106          3HD1      LEU 106  -8.016  -4.423  -5.772
  815   1HD2  LEU 106          1HD2      LEU 106  -5.244  -3.416  -2.668
  816   2HD2  LEU 106          2HD2      LEU 106  -5.563  -2.284  -3.990
  817   3HD2  LEU 106          3HD2      LEU 106  -6.799  -2.552  -2.727
  818    H    VAL 107           H        VAL 107  -5.617  -7.675  -3.155
  819    HA   VAL 107           HA       VAL 107  -4.369  -7.817  -5.851
  820    HB   VAL 107           HB       VAL 107  -2.373  -8.432  -4.498
  821   1HG1  VAL 107          1HG       VAL 107  -3.692  -5.825  -3.612
  822   2HG1  VAL 107          2HG       VAL 107  -1.969  -6.161  -3.828
  823   3HG1  VAL 107          3HG       VAL 107  -3.004  -6.117  -5.230
  824   1HG2  VAL 107          1HG       VAL 107  -4.097  -9.100  -2.434
  825   2HG2  VAL 107          2HG       VAL 107  -2.388  -8.802  -2.291
  826   3HG2  VAL 107          3HG       VAL 107  -3.541  -7.499  -1.932
  827    H    ALA 108           H        ALA 108  -6.131  -9.849  -3.895
  828    HA   ALA 108           HA       ALA 108  -4.817 -12.348  -4.818
  829   1HB   ALA 108          1HB       ALA 108  -7.061 -11.933  -2.799
  830   2HB   ALA 108          2HB       ALA 108  -6.159 -13.434  -3.103
  831   3HB   ALA 108          3HB       ALA 108  -5.336 -12.026  -2.387
  832    H    GLU 109           H        GLU 109  -7.968 -10.586  -4.908
  833    HA   GLU 109           HA       GLU 109  -8.953 -12.139  -7.176
  834   1HB   GLU 109          2HB       GLU 109 -10.550 -10.390  -7.483
  835   2HB   GLU 109          3HB       GLU 109 -10.398 -10.747  -5.765
  836   1HG   GLU 109          2HG       GLU 109  -8.740  -8.721  -5.722
  837   2HG   GLU 109          3HG       GLU 109  -9.364  -8.333  -7.320
  838    H    SER 110           H        SER 110  -6.420  -9.700  -6.788
  839    HA   SER 110           HA       SER 110  -5.021  -8.783  -8.280
  840   1HB   SER 110          2HB       SER 110  -4.129 -10.341  -9.958
  841   2HB   SER 110          3HB       SER 110  -4.491 -11.183  -8.450
  842    HG   SER 110           HG       SER 110  -6.688 -11.413  -9.774
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1   5.009   0.392  14.192
    2   2H    MET   1           H2       MET   1   4.319  -0.471  15.433
    3   3H    MET   1           H3       MET   1   4.066  -0.905  13.859
    4    HA   MET   1           HA       MET   1   6.532  -1.113  15.419
    5   1HB   MET   1          2HB       MET   1   6.448  -3.463  14.889
    6   2HB   MET   1          3HB       MET   1   4.892  -2.960  15.536
    7   1HG   MET   1          2HG       MET   1   4.329  -2.654  12.911
    8   2HG   MET   1          3HG       MET   1   5.602  -3.863  12.762
    9   1HE   MET   1          1HE       MET   1   5.107  -5.624  15.518
   10   2HE   MET   1          2HE       MET   1   4.086  -6.883  14.793
   11   3HE   MET   1          3HE       MET   1   5.496  -6.267  13.904
   12    H    SER   2           H        SER   2   7.843  -2.812  13.406
   13    HA   SER   2           HA       SER   2   8.423  -0.759  11.310
   14   1HB   SER   2          2HB       SER   2  10.163  -2.064  13.171
   15   2HB   SER   2          3HB       SER   2  10.488  -2.776  11.582
   16    HG   SER   2           HG       SER   2  11.644  -0.784  12.083
   17    H    MET   3           H        MET   3   7.889  -1.364   9.258
   18    HA   MET   3           HA       MET   3   6.502  -3.749   8.751
   19   1HB   MET   3          2HB       MET   3   6.699  -1.391   7.471
   20   2HB   MET   3          3HB       MET   3   7.867  -2.288   6.506
   21   1HG   MET   3          2HG       MET   3   5.947  -2.602   5.330
   22   2HG   MET   3          3HG       MET   3   5.938  -4.072   6.302
   23   1HE   MET   3          1HE       MET   3   4.762  -2.389   9.139
   24   2HE   MET   3          2HE       MET   3   3.057  -2.819   8.948
   25   3HE   MET   3          3HE       MET   3   4.305  -4.052   8.677
   26    H    THR   4           H        THR   4   9.934  -3.136   8.307
   27    HA   THR   4           HA       THR   4  10.951  -5.479   7.167
   28    HB   THR   4           HB       THR   4  11.846  -3.758   9.501
   29    HG1  THR   4           1HG      THR   4  13.280  -3.066   7.876
   30   1HG2  THR   4          1HG       THR   4  13.290  -6.102   8.230
   31   2HG2  THR   4          2HG       THR   4  14.143  -4.775   9.066
   32   3HG2  THR   4          3HG       THR   4  13.001  -5.795   9.950
   33    H    ASP   5           H        ASP   5   9.873  -5.039  10.565
   34    HA   ASP   5           HA       ASP   5  10.549  -7.776  11.359
   35   1HB   ASP   5          2HB       ASP   5  10.956  -5.646  12.705
   36   2HB   ASP   5          3HB       ASP   5   9.209  -5.521  12.909
   37    H    LEU   6           H        LEU   6   8.180  -6.695   9.520
   38    HA   LEU   6           HA       LEU   6   6.037  -8.374  10.729
   39   1HB   LEU   6          2HB       LEU   6   5.767  -5.819  10.297
   40   2HB   LEU   6          3HB       LEU   6   5.674  -6.236   8.596
   41    HG   LEU   6           HG       LEU   6   3.499  -5.864   9.678
   42   1HD1  LEU   6          1HD1      LEU   6   3.735  -8.756   8.818
   43   2HD1  LEU   6          2HD1      LEU   6   2.329  -7.699   8.744
   44   3HD1  LEU   6          3HD1      LEU   6   3.718  -7.373   7.693
   45   1HD2  LEU   6          1HD2      LEU   6   4.114  -6.835  11.916
   46   2HD2  LEU   6          2HD2      LEU   6   2.530  -7.330  11.286
   47   3HD2  LEU   6          3HD2      LEU   6   3.891  -8.453  11.218
   48    H    LEU   7           H        LEU   7   7.644  -7.550   7.624
   49    HA   LEU   7           HA       LEU   7   6.840 -10.270   6.687
   50   1HB   LEU   7          2HB       LEU   7   6.412  -9.373   4.472
   51   2HB   LEU   7          3HB       LEU   7   5.415  -8.664   5.739
   52    HG   LEU   7           HG       LEU   7   7.260  -6.746   5.662
   53   1HD1  LEU   7          1HD1      LEU   7   7.369  -7.683   2.786
   54   2HD1  LEU   7          2HD1      LEU   7   8.451  -6.559   3.638
   55   3HD1  LEU   7          3HD1      LEU   7   8.548  -8.263   3.926
   56   1HD2  LEU   7          1HD2      LEU   7   4.876  -6.488   5.225
   57   2HD2  LEU   7          2HD2      LEU   7   5.755  -5.663   3.944
   58   3HD2  LEU   7          3HD2      LEU   7   5.057  -7.261   3.637
   59    H    ASN   8           H        ASN   8   9.602  -8.296   6.896
   60    HA   ASN   8           HA       ASN   8  11.791  -9.295   6.579
   61   1HB   ASN   8          2HB       ASN   8  10.711 -10.066   3.852
   62   2HB   ASN   8          3HB       ASN   8  12.421 -10.019   4.231
   63   1HD2  ASN   8          2HD2      ASN   8  10.745 -12.174   3.261
   64   2HD2  ASN   8          1HD2      ASN   8  11.181 -13.485   4.416
   65    H    ALA   9           H        ALA   9  13.094  -7.489   6.374
   66    HA   ALA   9           HA       ALA   9  12.667  -5.199   4.795
   67   1HB   ALA   9          1HB       ALA   9  15.283  -6.538   5.618
   68   2HB   ALA   9          2HB       ALA   9  15.142  -4.898   4.951
   69   3HB   ALA   9          3HB       ALA   9  14.400  -5.272   6.502
   70    H    GLU  10           H        GLU  10  14.216  -8.284   3.775
   71    HA   GLU  10           HA       GLU  10  15.178  -7.422   1.246
   72   1HB   GLU  10          2HB       GLU  10  14.261 -10.145   2.246
   73   2HB   GLU  10          3HB       GLU  10  15.102  -9.887   0.708
   74   1HG   GLU  10          2HG       GLU  10  17.081  -9.053   1.825
   75   2HG   GLU  10          3HG       GLU  10  16.267  -9.025   3.392
   76    H    ASP  11           H        ASP  11  12.031  -8.764   2.136
   77    HA   ASP  11           HA       ASP  11  10.869  -8.779  -0.546
   78   1HB   ASP  11          2HB       ASP  11   9.808  -8.984   2.280
   79   2HB   ASP  11          3HB       ASP  11   8.744  -8.782   0.933
   80    H    ILE  12           H        ILE  12  10.596  -6.532   2.319
   81    HA   ILE  12           HA       ILE  12   9.152  -4.496   0.974
   82    HB   ILE  12           HB       ILE  12  10.194  -4.803   3.557
   83   1HG1  ILE  12          2HG       ILE  12   9.036  -2.420   3.819
   84   2HG1  ILE  12          3HG       ILE  12   8.552  -2.674   2.139
   85   1HG2  ILE  12          1HG       ILE  12  11.114  -2.213   2.360
   86   2HG2  ILE  12          2HG       ILE  12  11.230  -2.728   4.080
   87   3HG2  ILE  12          3HG       ILE  12  12.203  -3.547   2.850
   88   1HD1  ILE  12          1HD1      ILE  12   8.012  -4.488   4.520
   89   2HD1  ILE  12          2HD1      ILE  12   6.838  -3.442   3.696
   90   3HD1  ILE  12          3HD1      ILE  12   7.525  -4.807   2.827
   91    H    LYS  13           H        LYS  13  12.645  -5.014   0.900
   92    HA   LYS  13           HA       LYS  13  13.427  -2.762  -0.580
   93   1HB   LYS  13          2HB       LYS  13  14.483  -5.365   0.109
   94   2HB   LYS  13          3HB       LYS  13  14.809  -5.122  -1.587
   95   1HG   LYS  13          2HG       LYS  13  15.477  -3.041   0.543
   96   2HG   LYS  13          3HG       LYS  13  16.540  -4.395   0.149
   97   1HD   LYS  13          2HD       LYS  13  16.559  -3.669  -2.249
   98   2HD   LYS  13          3HD       LYS  13  15.648  -2.212  -1.791
   99   1HE   LYS  13          2HE       LYS  13  17.440  -1.424  -0.390
  100   2HE   LYS  13          3HE       LYS  13  18.253  -2.996  -0.428
  101   1HZ   LYS  13          1HZ       LYS  13  17.949  -1.195  -2.754
  102   2HZ   LYS  13          2HZ       LYS  13  19.335  -1.435  -1.900
  103   3HZ   LYS  13          3HZ       LYS  13  18.690  -2.666  -2.776
  104    H    LYS  14           H        LYS  14  12.094  -5.804  -1.866
  105    HA   LYS  14           HA       LYS  14  12.049  -4.862  -4.649
  106   1HB   LYS  14          2HB       LYS  14  10.549  -7.185  -3.368
  107   2HB   LYS  14          3HB       LYS  14  10.796  -6.920  -5.092
  108   1HG   LYS  14          2HG       LYS  14  12.968  -7.532  -3.043
  109   2HG   LYS  14          3HG       LYS  14  12.273  -8.676  -4.174
  110   1HD   LYS  14          2HD       LYS  14  13.870  -6.200  -4.982
  111   2HD   LYS  14          3HD       LYS  14  14.510  -7.839  -4.835
  112   1HE   LYS  14          2HE       LYS  14  12.818  -8.619  -6.522
  113   2HE   LYS  14          3HE       LYS  14  12.322  -6.937  -6.759
  114   1HZ   LYS  14          1HZ       LYS  14  15.051  -7.997  -7.224
  115   2HZ   LYS  14          2HZ       LYS  14  13.963  -7.638  -8.402
  116   3HZ   LYS  14          3HZ       LYS  14  14.587  -6.437  -7.467
  117    H    ALA  15           H        ALA  15   9.677  -4.970  -2.031
  118    HA   ALA  15           HA       ALA  15   7.415  -4.072  -3.447
  119   1HB   ALA  15          1HB       ALA  15   7.999  -3.050  -0.641
  120   2HB   ALA  15          2HB       ALA  15   6.507  -3.710  -1.318
  121   3HB   ALA  15          3HB       ALA  15   7.879  -4.779  -0.932
  122    H    VAL  16           H        VAL  16   9.764  -2.018  -1.618
  123    HA   VAL  16           HA       VAL  16   8.696   0.490  -2.467
  124    HB   VAL  16           HB       VAL  16  11.569  -0.142  -1.701
  125   1HG1  VAL  16          1HG       VAL  16  10.031   2.478  -1.604
  126   2HG1  VAL  16          2HG       VAL  16  11.699   2.216  -1.062
  127   3HG1  VAL  16          3HG       VAL  16  11.307   2.092  -2.784
  128   1HG2  VAL  16          1HG       VAL  16   9.925  -0.738   0.128
  129   2HG2  VAL  16          2HG       VAL  16  10.985   0.611   0.525
  130   3HG2  VAL  16          3HG       VAL  16   9.302   0.914   0.059
  131    H    GLY  17           H        GLY  17  11.086  -1.645  -4.020
  132   1HA   GLY  17          2HA       GLY  17  11.827   0.069  -6.186
  133   2HA   GLY  17          3HA       GLY  17  11.902  -1.699  -6.174
  134    H    ALA  18           H        ALA  18   9.060  -2.187  -5.807
  135    HA   ALA  18           HA       ALA  18   8.127  -2.013  -8.500
  136   1HB   ALA  18          1HB       ALA  18   6.587  -2.641  -5.958
  137   2HB   ALA  18          2HB       ALA  18   6.112  -3.066  -7.611
  138   3HB   ALA  18          3HB       ALA  18   7.558  -3.802  -6.873
  139    H    PHE  19           H        PHE  19   7.029  -0.165  -5.570
  140    HA   PHE  19           HA       PHE  19   5.342   1.545  -7.325
  141   1HB   PHE  19          2HB       PHE  19   5.800   1.610  -4.356
  142   2HB   PHE  19          3HB       PHE  19   4.773   2.753  -5.234
  143    HD1  PHE  19           1HD      PHE  19   3.534   1.738  -3.036
  144    HD2  PHE  19           2HD      PHE  19   4.102  -0.250  -6.800
  145    HE1  PHE  19           1HE      PHE  19   1.515   0.310  -2.591
  146    HE2  PHE  19           2HE      PHE  19   2.051  -1.569  -6.402
  147    HZ   PHE  19           HZ       PHE  19   0.822  -1.374  -4.319
  148    H    SER  20           H        SER  20   8.623   1.674  -6.610
  149    HA   SER  20           HA       SER  20   9.084   4.489  -6.404
  150   1HB   SER  20          2HB       SER  20  10.798   2.936  -5.771
  151   2HB   SER  20          3HB       SER  20  10.811   2.197  -7.388
  152    HG   SER  20           HG       SER  20  11.360   4.297  -8.165
  153    H    ALA  21           H        ALA  21   7.158   4.621  -8.174
  154    HA   ALA  21           HA       ALA  21   8.309   5.684 -10.663
  155   1HB   ALA  21          1HB       ALA  21   6.214   3.460 -10.566
  156   2HB   ALA  21          2HB       ALA  21   6.740   4.315 -12.040
  157   3HB   ALA  21          3HB       ALA  21   7.881   3.291 -11.152
  158    H    THR  22           H        THR  22   6.206   6.541 -12.031
  159    HA   THR  22           HA       THR  22   4.874   8.426 -10.266
  160    HB   THR  22           HB       THR  22   3.821   9.138 -12.514
  161    HG1  THR  22           1HG      THR  22   4.076   7.694 -14.031
  162   1HG2  THR  22          1HG       THR  22   6.854   9.140 -12.278
  163   2HG2  THR  22          2HG       THR  22   5.862  10.255 -13.241
  164   3HG2  THR  22          3HG       THR  22   5.752  10.279 -11.468
  165    H    ASP  23           H        ASP  23   3.401   6.537 -12.842
  166    HA   ASP  23           HA       ASP  23   0.979   5.989 -11.282
  167   1HB   ASP  23          2HB       ASP  23   0.483   5.915 -14.070
  168   2HB   ASP  23          3HB       ASP  23  -0.048   7.067 -12.862
  169    H    SER  24           H        SER  24   3.580   4.301 -11.949
  170    HA   SER  24           HA       SER  24   2.391   1.955 -13.315
  171   1HB   SER  24          2HB       SER  24   5.251   2.440 -12.411
  172   2HB   SER  24          3HB       SER  24   4.673   1.128 -13.449
  173    HG   SER  24           HG       SER  24   5.532   2.813 -14.691
  174    H    PHE  25           H        PHE  25   1.408   2.558 -10.715
  175    HA   PHE  25           HA       PHE  25   2.645   1.545  -8.478
  176   1HB   PHE  25          2HB       PHE  25   0.469   2.832  -8.771
  177   2HB   PHE  25          3HB       PHE  25  -0.343   1.307  -8.996
  178    HD1  PHE  25           1HD      PHE  25   1.496   3.463  -6.612
  179    HD2  PHE  25           2HD      PHE  25  -0.938  -0.044  -7.052
  180    HE1  PHE  25           1HE      PHE  25   0.878   3.577  -4.198
  181    HE2  PHE  25           2HE      PHE  25  -1.458   0.034  -4.590
  182    HZ   PHE  25           HZ       PHE  25  -0.623   1.892  -3.216
  183    H    ASP  26           H        ASP  26   0.262  -0.404 -10.347
  184    HA   ASP  26           HA       ASP  26  -0.101  -2.684 -10.371
  185   1HB   ASP  26          2HB       ASP  26   1.948  -2.323 -11.760
  186   2HB   ASP  26          3HB       ASP  26   2.922  -2.885 -10.401
  187    H    HIS  27           H        HIS  27  -0.901  -2.146  -8.129
  188    HA   HIS  27           HA       HIS  27   0.297  -2.946  -5.753
  189   1HB   HIS  27          2HB       HIS  27  -1.982  -3.243  -4.879
  190   2HB   HIS  27          3HB       HIS  27  -1.788  -1.769  -5.790
  191    HD1  HIS  27           HD1      HIS  27  -3.358  -5.263  -6.367
  192    HD2  HIS  27           HD2      HIS  27  -3.584  -1.252  -7.584
  193    HE1  HIS  27           HE1      HIS  27  -5.468  -5.055  -7.811
  194    H    LYS  28           H        LYS  28  -1.008  -4.935  -8.207
  195    HA   LYS  28           HA       LYS  28  -1.135  -7.532  -7.009
  196   1HB   LYS  28          2HB       LYS  28  -0.292  -7.185  -9.904
  197   2HB   LYS  28          3HB       LYS  28  -1.360  -8.343  -9.155
  198   1HG   LYS  28          2HG       LYS  28  -2.875  -7.098 -10.320
  199   2HG   LYS  28          3HG       LYS  28  -2.931  -6.244  -8.780
  200   1HD   LYS  28          2HD       LYS  28  -1.113  -4.696  -9.966
  201   2HD   LYS  28          3HD       LYS  28  -1.714  -5.457 -11.441
  202   1HE   LYS  28          2HE       LYS  28  -4.052  -4.733 -10.200
  203   2HE   LYS  28          3HE       LYS  28  -2.957  -3.549  -9.495
  204   1HZ   LYS  28          1HZ       LYS  28  -3.451  -3.979 -12.378
  205   2HZ   LYS  28          2HZ       LYS  28  -3.985  -2.709 -11.487
  206   3HZ   LYS  28          3HZ       LYS  28  -2.370  -2.888 -11.784
  207    H    LYS  29           H        LYS  29   1.512  -5.996  -8.997
  208    HA   LYS  29           HA       LYS  29   3.429  -8.117  -8.435
  209   1HB   LYS  29          2HB       LYS  29   3.512  -5.516  -9.867
  210   2HB   LYS  29          3HB       LYS  29   4.945  -5.794  -8.928
  211   1HG   LYS  29          2HG       LYS  29   5.372  -6.627 -11.085
  212   2HG   LYS  29          3HG       LYS  29   5.279  -8.004  -9.981
  213   1HD   LYS  29          2HD       LYS  29   3.017  -8.556 -10.813
  214   2HD   LYS  29          3HD       LYS  29   2.990  -7.069 -11.769
  215   1HE   LYS  29          2HE       LYS  29   3.525  -8.789 -13.310
  216   2HE   LYS  29          3HE       LYS  29   5.011  -7.877 -13.024
  217   1HZ   LYS  29          1HZ       LYS  29   4.306 -10.468 -11.765
  218   2HZ   LYS  29          2HZ       LYS  29   5.426 -10.250 -12.953
  219   3HZ   LYS  29          3HZ       LYS  29   5.677  -9.619 -11.454
  220    H    PHE  30           H        PHE  30   2.807  -4.946  -6.971
  221    HA   PHE  30           HA       PHE  30   4.958  -4.917  -5.092
  222   1HB   PHE  30          2HB       PHE  30   3.558  -3.082  -5.610
  223   2HB   PHE  30          3HB       PHE  30   2.127  -3.857  -4.939
  224    HD1  PHE  30           1HD      PHE  30   1.515  -3.399  -2.696
  225    HD2  PHE  30           2HD      PHE  30   5.486  -2.548  -4.053
  226    HE1  PHE  30           1HE      PHE  30   1.887  -2.012  -0.688
  227    HE2  PHE  30           2HE      PHE  30   5.892  -1.177  -2.019
  228    HZ   PHE  30           HZ       PHE  30   4.074  -0.845  -0.383
  229    H    PHE  31           H        PHE  31   1.561  -6.020  -4.343
  230    HA   PHE  31           HA       PHE  31   2.229  -7.104  -1.807
  231   1HB   PHE  31          2HB       PHE  31  -0.094  -7.290  -3.615
  232   2HB   PHE  31          3HB       PHE  31   0.105  -8.607  -2.491
  233    HD1  PHE  31           1HD      PHE  31  -0.811  -8.456  -0.339
  234    HD2  PHE  31           2HD      PHE  31   0.035  -4.868  -2.535
  235    HE1  PHE  31           1HE      PHE  31  -1.934  -7.136   1.415
  236    HE2  PHE  31           2HE      PHE  31  -1.065  -3.519  -0.746
  237    HZ   PHE  31           HZ       PHE  31  -2.074  -4.673   1.217
  238    H    GLN  32           H        GLN  32   2.622  -8.545  -4.993
  239    HA   GLN  32           HA       GLN  32   3.158 -11.228  -3.974
  240   1HB   GLN  32          2HB       GLN  32   3.599  -9.838  -6.661
  241   2HB   GLN  32          3HB       GLN  32   4.052 -11.519  -6.380
  242   1HG   GLN  32          2HG       GLN  32   1.815 -12.226  -6.116
  243   2HG   GLN  32          3HG       GLN  32   1.217 -10.595  -5.829
  244   1HE2  GLN  32          2HE       GLN  32  -0.217 -10.183  -7.543
  245   2HE2  GLN  32          1HE       GLN  32   0.230 -10.551  -9.217
  246    H    MET  33           H        MET  33   5.256  -8.607  -5.315
  247    HA   MET  33           HA       MET  33   7.796  -9.830  -4.923
  248   1HB   MET  33          2HB       MET  33   6.836  -6.945  -5.123
  249   2HB   MET  33          3HB       MET  33   8.528  -7.325  -4.886
  250   1HG   MET  33          2HG       MET  33   6.960  -8.449  -7.222
  251   2HG   MET  33          3HG       MET  33   7.795  -6.895  -7.249
  252   1HE   MET  33          1HE       MET  33   9.804  -6.841  -8.694
  253   2HE   MET  33          2HE       MET  33  10.550  -8.337  -9.299
  254   3HE   MET  33          3HE       MET  33   8.803  -8.070  -9.501
  255    H    VAL  34           H        VAL  34   5.938  -7.656  -2.821
  256    HA   VAL  34           HA       VAL  34   7.817  -7.632  -0.590
  257    HB   VAL  34           HB       VAL  34   6.075  -5.934  -1.334
  258   1HG1  VAL  34          1HG       VAL  34   4.250  -7.584   0.349
  259   2HG1  VAL  34          2HG       VAL  34   3.868  -6.085  -0.549
  260   3HG1  VAL  34          3HG       VAL  34   4.225  -7.635  -1.368
  261   1HG2  VAL  34          1HG       VAL  34   7.374  -5.992   0.906
  262   2HG2  VAL  34          2HG       VAL  34   5.894  -5.011   0.832
  263   3HG2  VAL  34          3HG       VAL  34   5.870  -6.600   1.606
  264    H    GLY  35           H        GLY  35   5.740 -10.096  -1.801
  265   1HA   GLY  35          2HA       GLY  35   4.669 -11.916  -0.968
  266   2HA   GLY  35          3HA       GLY  35   5.872 -11.847   0.326
  267    H    LEU  36           H        LEU  36   3.414  -9.315  -0.081
  268    HA   LEU  36           HA       LEU  36   2.764  -9.476   2.717
  269   1HB   LEU  36          2HB       LEU  36   1.781  -7.904   0.351
  270   2HB   LEU  36          3HB       LEU  36   0.660  -8.065   1.697
  271    HG   LEU  36           HG       LEU  36   3.460  -6.923   2.053
  272   1HD1  LEU  36          1HD1      LEU  36   0.749  -5.567   1.845
  273   2HD1  LEU  36          2HD1      LEU  36   2.278  -4.787   2.266
  274   3HD1  LEU  36          3HD1      LEU  36   2.037  -5.448   0.638
  275   1HD2  LEU  36          1HD2      LEU  36   2.626  -7.940   4.080
  276   2HD2  LEU  36          2HD2      LEU  36   2.563  -6.193   4.150
  277   3HD2  LEU  36          3HD2      LEU  36   1.062  -7.132   3.827
  278    H    LYS  37           H        LYS  37   0.939 -10.323  -0.070
  279    HA   LYS  37           HA       LYS  37  -1.233 -11.857   1.118
  280   1HB   LYS  37          2HB       LYS  37   0.146 -12.087  -1.580
  281   2HB   LYS  37          3HB       LYS  37  -1.108 -13.225  -1.083
  282   1HG   LYS  37          2HG       LYS  37  -2.654 -11.251  -0.664
  283   2HG   LYS  37          3HG       LYS  37  -1.441 -10.247  -1.463
  284   1HD   LYS  37          2HD       LYS  37  -2.835 -12.662  -2.677
  285   2HD   LYS  37          3HD       LYS  37  -3.271 -10.974  -2.962
  286   1HE   LYS  37          2HE       LYS  37  -1.103 -10.516  -3.995
  287   2HE   LYS  37          3HE       LYS  37  -0.554 -12.163  -3.631
  288   1HZ   LYS  37          1HZ       LYS  37  -2.685 -11.345  -5.505
  289   2HZ   LYS  37          2HZ       LYS  37  -1.291 -12.143  -5.866
  290   3HZ   LYS  37          3HZ       LYS  37  -2.463 -12.923  -5.030
  291    H    LYS  38           H        LYS  38   2.148 -12.723   0.957
  292    HA   LYS  38           HA       LYS  38   1.613 -15.592   1.516
  293   1HB   LYS  38          2HB       LYS  38   3.596 -16.006   0.591
  294   2HB   LYS  38          3HB       LYS  38   3.618 -14.339   0.062
  295   1HG   LYS  38          2HG       LYS  38   4.801 -13.874   2.376
  296   2HG   LYS  38          3HG       LYS  38   5.049 -15.605   2.427
  297   1HD   LYS  38          2HD       LYS  38   6.540 -15.570   0.598
  298   2HD   LYS  38          3HD       LYS  38   5.894 -14.053  -0.040
  299   1HE   LYS  38          2HE       LYS  38   6.764 -12.860   2.001
  300   2HE   LYS  38          3HE       LYS  38   7.524 -14.370   2.515
  301   1HZ   LYS  38          1HZ       LYS  38   8.232 -12.752   0.102
  302   2HZ   LYS  38          2HZ       LYS  38   9.097 -12.903   1.369
  303   3HZ   LYS  38          3HZ       LYS  38   8.868 -14.256   0.427
  304    H    LYS  39           H        LYS  39   2.253 -12.641   3.153
  305    HA   LYS  39           HA       LYS  39   2.856 -13.864   5.763
  306   1HB   LYS  39          2HB       LYS  39   3.006 -11.194   4.557
  307   2HB   LYS  39          3HB       LYS  39   2.000 -11.128   5.996
  308   1HG   LYS  39          2HG       LYS  39   4.271 -10.713   6.662
  309   2HG   LYS  39          3HG       LYS  39   3.798 -12.295   7.275
  310   1HD   LYS  39          2HD       LYS  39   4.966 -13.228   5.090
  311   2HD   LYS  39          3HD       LYS  39   5.713 -11.624   5.029
  312   1HE   LYS  39          2HE       LYS  39   6.345 -12.016   7.512
  313   2HE   LYS  39          3HE       LYS  39   5.813 -13.680   7.286
  314   1HZ   LYS  39          1HZ       LYS  39   7.992 -12.332   5.765
  315   2HZ   LYS  39          2HZ       LYS  39   8.195 -13.464   6.936
  316   3HZ   LYS  39          3HZ       LYS  39   7.482 -13.885   5.512
  317    H    SER  40           H        SER  40   1.354 -13.140   7.658
  318    HA   SER  40           HA       SER  40  -1.037 -14.632   7.109
  319   1HB   SER  40          2HB       SER  40   0.304 -14.725   9.214
  320   2HB   SER  40          3HB       SER  40  -0.304 -13.113   9.634
  321    HG   SER  40           HG       SER  40  -1.464 -15.065  10.437
  322    H    ALA  41           H        ALA  41  -3.185 -13.980   7.890
  323    HA   ALA  41           HA       ALA  41  -4.220 -11.484   6.804
  324   1HB   ALA  41          1HB       ALA  41  -5.385 -13.425   8.855
  325   2HB   ALA  41          2HB       ALA  41  -6.278 -12.159   7.990
  326   3HB   ALA  41          3HB       ALA  41  -5.603 -13.537   7.089
  327    H    ASP  42           H        ASP  42  -3.368 -12.675  10.080
  328    HA   ASP  42           HA       ASP  42  -4.029 -10.207  11.379
  329   1HB   ASP  42          2HB       ASP  42  -3.189 -12.825  12.208
  330   2HB   ASP  42          3HB       ASP  42  -2.056 -11.669  12.904
  331    H    ASP  43           H        ASP  43  -1.151 -11.299   9.750
  332    HA   ASP  43           HA       ASP  43   0.697  -9.222  10.616
  333   1HB   ASP  43          2HB       ASP  43   0.536 -11.018   8.174
  334   2HB   ASP  43          3HB       ASP  43   1.778  -9.855   8.327
  335    H    VAL  44           H        VAL  44  -1.272  -9.675   7.649
  336    HA   VAL  44           HA       VAL  44  -1.045  -7.182   6.464
  337    HB   VAL  44           HB       VAL  44  -2.787  -9.489   6.294
  338   1HG1  VAL  44          1HG       VAL  44  -4.159  -6.964   5.388
  339   2HG1  VAL  44          2HG       VAL  44  -4.694  -8.659   5.267
  340   3HG1  VAL  44          3HG       VAL  44  -4.625  -7.912   6.837
  341   1HG2  VAL  44          1HG       VAL  44  -1.045  -8.877   4.677
  342   2HG2  VAL  44          2HG       VAL  44  -2.632  -9.002   3.904
  343   3HG2  VAL  44          3HG       VAL  44  -1.949  -7.400   4.249
  344    H    LYS  45           H        LYS  45  -3.224  -7.996   9.115
  345    HA   LYS  45           HA       LYS  45  -4.620  -5.590   9.354
  346   1HB   LYS  45          2HB       LYS  45  -4.402  -7.919  10.904
  347   2HB   LYS  45          3HB       LYS  45  -3.959  -6.598  11.995
  348   1HG   LYS  45          2HG       LYS  45  -6.025  -5.359  11.055
  349   2HG   LYS  45          3HG       LYS  45  -6.477  -6.911  10.331
  350   1HD   LYS  45          2HD       LYS  45  -6.341  -7.917  12.691
  351   2HD   LYS  45          3HD       LYS  45  -6.111  -6.256  13.289
  352   1HE   LYS  45          2HE       LYS  45  -8.282  -5.669  12.024
  353   2HE   LYS  45          3HE       LYS  45  -8.514  -7.412  11.815
  354   1HZ   LYS  45          1HZ       LYS  45  -8.318  -5.971  14.395
  355   2HZ   LYS  45          2HZ       LYS  45  -9.673  -6.655  13.767
  356   3HZ   LYS  45          3HZ       LYS  45  -8.424  -7.607  14.258
  357    H    LYS  46           H        LYS  46  -1.289  -6.129  10.300
  358    HA   LYS  46           HA       LYS  46  -1.084  -3.415  11.542
  359   1HB   LYS  46          2HB       LYS  46   0.947  -5.671  11.353
  360   2HB   LYS  46          3HB       LYS  46   1.227  -4.099  12.082
  361   1HG   LYS  46          2HG       LYS  46   0.846  -5.571  13.873
  362   2HG   LYS  46          3HG       LYS  46  -0.621  -4.584  13.752
  363   1HD   LYS  46          2HD       LYS  46  -1.805  -6.432  12.728
  364   2HD   LYS  46          3HD       LYS  46  -0.284  -7.335  12.537
  365   1HE   LYS  46          2HE       LYS  46  -0.125  -7.650  14.924
  366   2HE   LYS  46          3HE       LYS  46  -1.553  -6.629  15.218
  367   1HZ   LYS  46          1HZ       LYS  46  -1.768  -8.922  13.393
  368   2HZ   LYS  46          2HZ       LYS  46  -1.876  -9.225  15.012
  369   3HZ   LYS  46          3HZ       LYS  46  -2.949  -8.298  14.256
  370    H    VAL  47           H        VAL  47  -0.349  -5.119   8.604
  371    HA   VAL  47           HA       VAL  47   1.584  -3.372   7.423
  372    HB   VAL  47           HB       VAL  47  -0.580  -5.015   6.087
  373   1HG1  VAL  47          1HG       VAL  47   1.896  -3.869   4.780
  374   2HG1  VAL  47          2HG       VAL  47   0.609  -4.866   4.047
  375   3HG1  VAL  47          3HG       VAL  47   0.252  -3.233   4.565
  376   1HG2  VAL  47          1HG       VAL  47   1.195  -6.204   7.537
  377   2HG2  VAL  47          2HG       VAL  47   1.018  -6.759   5.899
  378   3HG2  VAL  47          3HG       VAL  47   2.372  -5.680   6.335
  379    H    PHE  48           H        PHE  48  -2.031  -3.375   6.873
  380    HA   PHE  48           HA       PHE  48  -2.198  -0.928   5.527
  381   1HB   PHE  48          2HB       PHE  48  -3.992  -2.484   5.751
  382   2HB   PHE  48          3HB       PHE  48  -3.963  -2.353   7.516
  383    HD1  PHE  48           1HD      PHE  48  -4.517  -0.292   4.425
  384    HD2  PHE  48           2HD      PHE  48  -5.399  -0.866   8.618
  385    HE1  PHE  48           1HE      PHE  48  -6.202   1.523   4.342
  386    HE2  PHE  48           2HE      PHE  48  -7.120   0.904   8.497
  387    HZ   PHE  48           HZ       PHE  48  -7.504   2.105   6.350
  388    H    HIS  49           H        HIS  49  -2.162  -1.511   9.007
  389    HA   HIS  49           HA       HIS  49  -2.609   1.064  10.009
  390   1HB   HIS  49          2HB       HIS  49  -2.170  -1.497  11.000
  391   2HB   HIS  49          3HB       HIS  49  -0.734  -0.652  11.554
  392    HD1  HIS  49           HD1      HIS  49  -2.024   2.109  12.351
  393    HD2  HIS  49           HD2      HIS  49  -3.682  -1.689  13.049
  394    HE1  HIS  49           HE1      HIS  49  -3.683   2.367  14.332
  395    H    MET  50           H        MET  50   0.251  -0.067   8.395
  396    HA   MET  50           HA       MET  50   2.054   1.939   9.551
  397   1HB   MET  50          2HB       MET  50   2.559  -0.509   8.780
  398   2HB   MET  50          3HB       MET  50   2.511   0.151   7.148
  399   1HG   MET  50          2HG       MET  50   4.728   0.185   7.611
  400   2HG   MET  50          3HG       MET  50   4.300   1.840   8.017
  401   1HE   MET  50          1HE       MET  50   3.661   2.326  10.924
  402   2HE   MET  50          2HE       MET  50   5.296   2.216  11.613
  403   3HE   MET  50          3HE       MET  50   5.061   2.937  10.006
  404    H    LEU  51           H        LEU  51  -0.032   1.598   6.726
  405    HA   LEU  51           HA       LEU  51   1.201   3.786   5.175
  406   1HB   LEU  51          2HB       LEU  51  -1.426   2.275   4.849
  407   2HB   LEU  51          3HB       LEU  51  -0.825   3.512   3.756
  408    HG   LEU  51           HG       LEU  51   1.147   2.050   3.212
  409   1HD1  LEU  51          1HD1      LEU  51  -0.386   0.140   4.993
  410   2HD1  LEU  51          2HD1      LEU  51   0.617  -0.494   3.700
  411   3HD1  LEU  51          3HD1      LEU  51   1.359   0.468   4.980
  412   1HD2  LEU  51          1HD2      LEU  51  -0.951   2.161   1.825
  413   2HD2  LEU  51          2HD2      LEU  51  -0.135   0.606   1.720
  414   3HD2  LEU  51          3HD2      LEU  51  -1.579   0.775   2.732
  415    H    ASP  52           H        ASP  52  -1.624   3.251   7.261
  416    HA   ASP  52           HA       ASP  52  -2.702   5.915   7.147
  417   1HB   ASP  52          2HB       ASP  52  -3.219   3.400   8.585
  418   2HB   ASP  52          3HB       ASP  52  -3.385   4.787   9.645
  419    H    LYS  53           H        LYS  53  -1.149   7.423   7.355
  420    HA   LYS  53           HA       LYS  53   0.942   7.421   9.396
  421   1HB   LYS  53          2HB       LYS  53   0.001   9.646   7.524
  422   2HB   LYS  53          3HB       LYS  53   1.491   9.611   8.457
  423   1HG   LYS  53          2HG       LYS  53   1.635   7.213   6.979
  424   2HG   LYS  53          3HG       LYS  53   0.806   8.315   5.873
  425   1HD   LYS  53          2HD       LYS  53   3.134   8.566   5.417
  426   2HD   LYS  53          3HD       LYS  53   2.674   9.995   6.369
  427   1HE   LYS  53          2HE       LYS  53   3.335   8.417   8.421
  428   2HE   LYS  53          3HE       LYS  53   4.240   7.524   7.194
  429   1HZ   LYS  53          1HZ       LYS  53   4.541  10.396   7.856
  430   2HZ   LYS  53          2HZ       LYS  53   5.603   9.204   8.252
  431   3HZ   LYS  53          3HZ       LYS  53   5.377   9.624   6.668
  432    H    ASP  54           H        ASP  54  -2.139   9.065   8.862
  433    HA   ASP  54           HA       ASP  54  -2.115  10.508  11.428
  434   1HB   ASP  54          2HB       ASP  54  -4.421  11.063  10.910
  435   2HB   ASP  54          3HB       ASP  54  -3.395  11.335   9.504
  436    H    LYS  55           H        LYS  55  -2.447   7.260  10.704
  437    HA   LYS  55           HA       LYS  55  -3.239   5.393  11.681
  438   1HB   LYS  55          2HB       LYS  55  -2.849   7.039  14.197
  439   2HB   LYS  55          3HB       LYS  55  -3.088   5.296  14.186
  440   1HG   LYS  55          2HG       LYS  55  -0.807   6.635  12.671
  441   2HG   LYS  55          3HG       LYS  55  -0.682   6.119  14.349
  442   1HD   LYS  55          2HD       LYS  55  -0.926   3.818  13.812
  443   2HD   LYS  55          3HD       LYS  55  -1.555   4.161  12.198
  444   1HE   LYS  55          2HE       LYS  55   0.749   3.334  12.121
  445   2HE   LYS  55          3HE       LYS  55   0.533   4.917  11.379
  446   1HZ   LYS  55          1HZ       LYS  55   1.595   4.469  14.109
  447   2HZ   LYS  55          2HZ       LYS  55   2.508   4.840  12.782
  448   3HZ   LYS  55          3HZ       LYS  55   1.422   5.928  13.368
  449    H    SER  56           H        SER  56  -5.360   7.472  10.897
  450    HA   SER  56           HA       SER  56  -7.484   7.075  12.831
  451   1HB   SER  56          2HB       SER  56  -8.899   8.277  11.407
  452   2HB   SER  56          3HB       SER  56  -7.313   9.051  11.317
  453    HG   SER  56           HG       SER  56  -8.453   8.769   9.312
  454    H    GLY  57           H        GLY  57  -6.440   5.164  10.110
  455   1HA   GLY  57          2HA       GLY  57  -6.918   2.803  10.134
  456   2HA   GLY  57          3HA       GLY  57  -8.531   3.123  10.781
  457    H    PHE  58           H        PHE  58  -7.209   5.046   8.145
  458    HA   PHE  58           HA       PHE  58  -8.826   3.769   6.030
  459   1HB   PHE  58          2HB       PHE  58  -9.536   6.605   6.876
  460   2HB   PHE  58          3HB       PHE  58 -10.317   5.585   5.687
  461    HD1  PHE  58           1HD      PHE  58 -10.133   6.540   9.190
  462    HD2  PHE  58           2HD      PHE  58 -11.714   3.595   6.466
  463    HE1  PHE  58           1HE      PHE  58 -11.721   5.791  10.930
  464    HE2  PHE  58           2HE      PHE  58 -13.315   2.852   8.215
  465    HZ   PHE  58           HZ       PHE  58 -13.321   3.950  10.448
  466    H    ILE  59           H        ILE  59  -7.345   3.936   4.274
  467    HA   ILE  59           HA       ILE  59  -5.588   6.344   4.205
  468    HB   ILE  59           HB       ILE  59  -5.671   4.179   2.122
  469   1HG1  ILE  59          2HG       ILE  59  -3.539   4.363   4.288
  470   2HG1  ILE  59          3HG       ILE  59  -4.994   3.415   4.550
  471   1HG2  ILE  59          1HG       ILE  59  -3.578   6.290   2.799
  472   2HG2  ILE  59          2HG       ILE  59  -3.421   5.059   1.536
  473   3HG2  ILE  59          3HG       ILE  59  -4.648   6.306   1.386
  474   1HD1  ILE  59          1HD1      ILE  59  -3.022   2.979   2.304
  475   2HD1  ILE  59          2HD1      ILE  59  -3.332   1.934   3.715
  476   3HD1  ILE  59          3HD1      ILE  59  -4.568   2.128   2.473
  477    H    GLU  60           H        GLU  60  -5.931   8.011   3.027
  478    HA   GLU  60           HA       GLU  60  -7.904   8.163   0.836
  479   1HB   GLU  60          2HB       GLU  60  -8.734  10.311   1.728
  480   2HB   GLU  60          3HB       GLU  60  -9.072   8.955   2.784
  481   1HG   GLU  60          2HG       GLU  60  -6.640   9.953   3.804
  482   2HG   GLU  60          3HG       GLU  60  -7.503  11.396   3.307
  483    H    GLU  61           H        GLU  61  -7.570  10.231  -0.413
  484    HA   GLU  61           HA       GLU  61  -5.248   9.942  -1.760
  485   1HB   GLU  61          2HB       GLU  61  -6.869  12.497  -1.708
  486   2HB   GLU  61          3HB       GLU  61  -5.641  12.072  -2.910
  487   1HG   GLU  61          2HG       GLU  61  -6.970   9.938  -3.366
  488   2HG   GLU  61          3HG       GLU  61  -8.227  10.614  -2.329
  489    H    ASP  62           H        ASP  62  -5.620  12.248   0.819
  490    HA   ASP  62           HA       ASP  62  -3.343  13.845   0.758
  491   1HB   ASP  62          2HB       ASP  62  -5.384  13.890   2.266
  492   2HB   ASP  62          3HB       ASP  62  -4.676  12.578   3.195
  493    H    GLU  63           H        GLU  63  -3.654  10.654   2.349
  494    HA   GLU  63           HA       GLU  63  -0.736  10.461   2.896
  495   1HB   GLU  63          2HB       GLU  63  -3.087   8.593   3.374
  496   2HB   GLU  63          3HB       GLU  63  -1.423   8.228   3.850
  497   1HG   GLU  63          2HG       GLU  63  -1.355  10.037   5.426
  498   2HG   GLU  63          3HG       GLU  63  -2.899  10.694   4.862
  499    H    LEU  64           H        LEU  64  -3.222   9.116   0.724
  500    HA   LEU  64           HA       LEU  64  -1.833   6.950  -0.302
  501   1HB   LEU  64          2HB       LEU  64  -4.276   7.732  -0.554
  502   2HB   LEU  64          3HB       LEU  64  -3.697   8.614  -1.966
  503    HG   LEU  64           HG       LEU  64  -2.825   5.776  -1.882
  504   1HD1  LEU  64          1HD1      LEU  64  -5.796   6.464  -2.112
  505   2HD1  LEU  64          2HD1      LEU  64  -5.081   4.897  -2.532
  506   3HD1  LEU  64          3HD1      LEU  64  -5.040   5.460  -0.854
  507   1HD2  LEU  64          1HD2      LEU  64  -2.645   7.363  -3.845
  508   2HD2  LEU  64          2HD2      LEU  64  -3.417   5.831  -4.203
  509   3HD2  LEU  64          3HD2      LEU  64  -4.432   7.261  -3.977
  510    H    GLY  65           H        GLY  65  -1.440  10.345  -1.099
  511   1HA   GLY  65          2HA       GLY  65   0.199  10.290  -3.370
  512   2HA   GLY  65          3HA       GLY  65   0.363  11.427  -2.035
  513    H    PHE  66           H        PHE  66   1.160   9.091  -0.110
  514    HA   PHE  66           HA       PHE  66   3.703   8.196  -1.310
  515   1HB   PHE  66          2HB       PHE  66   5.130   9.271   0.401
  516   2HB   PHE  66          3HB       PHE  66   4.423  10.341  -0.767
  517    HD1  PHE  66           1HD      PHE  66   4.492   9.446   2.804
  518    HD2  PHE  66           2HD      PHE  66   2.802  12.060  -0.172
  519    HE1  PHE  66           1HE      PHE  66   3.790  11.037   4.585
  520    HE2  PHE  66           2HE      PHE  66   2.026  13.591   1.611
  521    HZ   PHE  66           HZ       PHE  66   2.532  13.094   3.992
  522    H    ILE  67           H        ILE  67   1.691   6.527  -0.541
  523    HA   ILE  67           HA       ILE  67   1.671   5.470   2.046
  524    HB   ILE  67           HB       ILE  67   0.671   3.584   1.277
  525   1HG1  ILE  67          2HG       ILE  67   0.647   3.198  -1.405
  526   2HG1  ILE  67          3HG       ILE  67   2.251   3.911  -1.258
  527   1HG2  ILE  67          1HG       ILE  67  -0.037   5.601  -0.828
  528   2HG2  ILE  67          2HG       ILE  67  -1.068   4.332  -0.141
  529   3HG2  ILE  67          3HG       ILE  67  -0.544   5.687   0.887
  530   1HD1  ILE  67          1HD1      ILE  67   1.130   1.360  -0.098
  531   2HD1  ILE  67          2HD1      ILE  67   2.696   1.620  -0.900
  532   3HD1  ILE  67          3HD1      ILE  67   2.439   2.162   0.773
  533    H    LEU  68           H        LEU  68   4.021   4.866  -0.425
  534    HA   LEU  68           HA       LEU  68   5.433   2.692   0.702
  535   1HB   LEU  68          2HB       LEU  68   6.297   5.030  -1.035
  536   2HB   LEU  68          3HB       LEU  68   7.477   3.878  -0.404
  537    HG   LEU  68           HG       LEU  68   5.219   3.233  -2.307
  538   1HD1  LEU  68          1HD1      LEU  68   8.249   3.597  -2.496
  539   2HD1  LEU  68          2HD1      LEU  68   7.420   2.674  -3.698
  540   3HD1  LEU  68          3HD1      LEU  68   6.980   4.369  -3.458
  541   1HD2  LEU  68          1HD2      LEU  68   5.514   1.275  -0.924
  542   2HD2  LEU  68          2HD2      LEU  68   6.457   0.977  -2.379
  543   3HD2  LEU  68          3HD2      LEU  68   7.280   1.480  -0.893
  544    H    LYS  69           H        LYS  69   5.437   6.041   1.811
  545    HA   LYS  69           HA       LYS  69   7.921   5.860   3.280
  546   1HB   LYS  69          2HB       LYS  69   6.135   7.879   2.585
  547   2HB   LYS  69          3HB       LYS  69   5.871   7.744   4.317
  548   1HG   LYS  69          2HG       LYS  69   8.478   8.326   2.835
  549   2HG   LYS  69          3HG       LYS  69   7.494   9.451   3.768
  550   1HD   LYS  69          2HD       LYS  69   7.976   8.032   5.818
  551   2HD   LYS  69          3HD       LYS  69   9.175   7.150   4.847
  552   1HE   LYS  69          2HE       LYS  69  10.577   9.007   4.617
  553   2HE   LYS  69          3HE       LYS  69   9.259  10.161   4.839
  554   1HZ   LYS  69          1HZ       LYS  69  10.428   8.498   6.987
  555   2HZ   LYS  69          2HZ       LYS  69  10.675  10.114   6.776
  556   3HZ   LYS  69          3HZ       LYS  69   9.185   9.555   7.175
  557    H    GLY  70           H        GLY  70   4.869   4.434   3.871
  558   1HA   GLY  70          2HA       GLY  70   5.444   3.894   6.733
  559   2HA   GLY  70          3HA       GLY  70   4.108   3.241   5.757
  560    H    PHE  71           H        PHE  71   5.633   2.220   3.586
  561    HA   PHE  71           HA       PHE  71   6.427  -0.344   4.615
  562   1HB   PHE  71          2HB       PHE  71   6.699   1.003   1.905
  563   2HB   PHE  71          3HB       PHE  71   7.446  -0.541   2.242
  564    HD1  PHE  71           1HD      PHE  71   6.242  -2.503   1.812
  565    HD2  PHE  71           2HD      PHE  71   4.074   1.167   2.469
  566    HE1  PHE  71           1HE      PHE  71   4.115  -3.716   1.541
  567    HE2  PHE  71           2HE      PHE  71   1.971  -0.029   2.066
  568    HZ   PHE  71           HZ       PHE  71   1.949  -2.490   1.715
  569    H    SER  72           H        SER  72   8.449   2.451   3.354
  570    HA   SER  72           HA       SER  72  10.624   1.853   5.158
  571   1HB   SER  72          2HB       SER  72  10.344   0.318   2.753
  572   2HB   SER  72          3HB       SER  72  11.690   1.442   2.500
  573    HG   SER  72           HG       SER  72  12.113  -0.685   3.567
  574    HA   PRO  73           HA       PRO  73  11.808   5.865   3.390
  575   1HB   PRO  73          2HB       PRO  73  14.531   5.889   3.256
  576   2HB   PRO  73          3HB       PRO  73  13.644   5.910   4.811
  577   1HG   PRO  73          2HG       PRO  73  14.852   3.521   3.388
  578   2HG   PRO  73          3HG       PRO  73  15.039   3.996   5.108
  579   1HD   PRO  73          2HD       PRO  73  13.230   2.147   4.257
  580   2HD   PRO  73          3HD       PRO  73  12.888   3.209   5.650
  581    H    ASP  74           H        ASP  74  13.164   6.724   1.590
  582    HA   ASP  74           HA       ASP  74  13.668   7.059  -0.604
  583   1HB   ASP  74          2HB       ASP  74  13.885   4.041  -0.857
  584   2HB   ASP  74          3HB       ASP  74  14.342   5.216  -2.082
  585    H    ALA  75           H        ALA  75  10.959   5.993   0.457
  586    HA   ALA  75           HA       ALA  75   9.178   5.049  -1.243
  587   1HB   ALA  75          1HB       ALA  75   8.954   7.267   0.827
  588   2HB   ALA  75          2HB       ALA  75   7.550   6.444   0.151
  589   3HB   ALA  75          3HB       ALA  75   8.773   5.516   1.067
  590    H    ARG  76           H        ARG  76   9.562   8.547  -0.955
  591    HA   ARG  76           HA       ARG  76   9.147  10.350  -2.256
  592   1HB   ARG  76          2HB       ARG  76   8.806   8.709  -4.771
  593   2HB   ARG  76          3HB       ARG  76   9.491  10.328  -4.559
  594   1HG   ARG  76          2HG       ARG  76  11.326   9.109  -3.151
  595   2HG   ARG  76          3HG       ARG  76  10.675   7.643  -3.913
  596   1HD   ARG  76          2HD       ARG  76  11.310   8.366  -6.098
  597   2HD   ARG  76          3HD       ARG  76  11.814   9.958  -5.463
  598    HE   ARG  76           HE       ARG  76  13.043   7.637  -4.160
  599   1HH1  ARG  76          1HH2      ARG  76  13.488   9.788  -6.859
  600   2HH1  ARG  76          2HH2      ARG  76  15.232   9.780  -6.769
  601   1HH2  ARG  76          1HH1      ARG  76  15.291   7.693  -3.983
  602   2HH2  ARG  76          2HH1      ARG  76  16.231   8.578  -5.143
  603    H    ASP  77           H        ASP  77   7.623  11.471  -3.666
  604    HA   ASP  77           HA       ASP  77   4.857  10.851  -3.020
  605   1HB   ASP  77          2HB       ASP  77   6.161  13.130  -4.554
  606   2HB   ASP  77          3HB       ASP  77   4.445  13.025  -4.134
  607    H    LEU  78           H        LEU  78   3.701   9.574  -4.189
  608    HA   LEU  78           HA       LEU  78   4.266   8.674  -6.895
  609   1HB   LEU  78          2HB       LEU  78   1.583   8.494  -5.489
  610   2HB   LEU  78          3HB       LEU  78   2.223   7.471  -6.755
  611    HG   LEU  78           HG       LEU  78   3.146   7.565  -3.835
  612   1HD1  LEU  78          1HD1      LEU  78   1.794   5.392  -5.428
  613   2HD1  LEU  78          2HD1      LEU  78   2.280   5.322  -3.712
  614   3HD1  LEU  78          3HD1      LEU  78   1.006   6.441  -4.237
  615   1HD2  LEU  78          1HD2      LEU  78   5.122   7.077  -5.237
  616   2HD2  LEU  78          2HD2      LEU  78   4.598   5.625  -4.387
  617   3HD2  LEU  78          3HD2      LEU  78   4.214   5.827  -6.111
  618    H    SER  79           H        SER  79   2.446   8.801  -8.600
  619    HA   SER  79           HA       SER  79   1.915  11.688  -9.036
  620   1HB   SER  79          2HB       SER  79   2.767   9.590 -10.661
  621   2HB   SER  79          3HB       SER  79   1.105   9.837 -11.172
  622    HG   SER  79           HG       SER  79   3.209  11.738 -10.898
  623    H    ALA  80           H        ALA  80  -0.076  12.613  -9.157
  624    HA   ALA  80           HA       ALA  80  -2.297  11.586  -7.894
  625   1HB   ALA  80          1HB       ALA  80  -2.225  13.661 -10.107
  626   2HB   ALA  80          2HB       ALA  80  -3.514  13.457  -8.898
  627   3HB   ALA  80          3HB       ALA  80  -1.892  13.958  -8.376
  628    H    LYS  81           H        LYS  81  -1.399  10.941 -11.186
  629    HA   LYS  81           HA       LYS  81  -3.934   9.969 -12.201
  630   1HB   LYS  81          2HB       LYS  81  -1.212   8.864 -12.965
  631   2HB   LYS  81          3HB       LYS  81  -2.693   8.830 -13.890
  632   1HG   LYS  81          2HG       LYS  81  -1.226  10.250 -14.935
  633   2HG   LYS  81          3HG       LYS  81  -2.464  11.320 -14.223
  634   1HD   LYS  81          2HD       LYS  81  -0.897  12.255 -12.718
  635   2HD   LYS  81          3HD       LYS  81   0.080  10.775 -12.723
  636   1HE   LYS  81          2HE       LYS  81   0.753  11.200 -15.053
  637   2HE   LYS  81          3HE       LYS  81  -0.069  12.778 -14.994
  638   1HZ   LYS  81          1HZ       LYS  81   2.029  11.930 -13.085
  639   2HZ   LYS  81          2HZ       LYS  81   2.372  12.791 -14.456
  640   3HZ   LYS  81          3HZ       LYS  81   1.433  13.441 -13.259
  641    H    GLU  82           H        GLU  82  -1.188   8.467 -10.389
  642    HA   GLU  82           HA       GLU  82  -2.245   5.795 -10.373
  643   1HB   GLU  82          2HB       GLU  82  -0.226   5.381  -9.669
  644   2HB   GLU  82          3HB       GLU  82   0.157   7.094  -9.716
  645   1HG   GLU  82          2HG       GLU  82   0.849   6.101  -7.671
  646   2HG   GLU  82          3HG       GLU  82  -0.371   7.345  -7.368
  647    H    THR  83           H        THR  83  -2.127   8.561  -8.039
  648    HA   THR  83           HA       THR  83  -3.631   7.568  -6.022
  649    HB   THR  83           HB       THR  83  -3.971  10.382  -7.112
  650    HG1  THR  83           1HG      THR  83  -2.183   9.665  -5.093
  651   1HG2  THR  83          1HG       THR  83  -4.169   9.468  -4.223
  652   2HG2  THR  83          2HG       THR  83  -4.393  11.101  -4.865
  653   3HG2  THR  83          3HG       THR  83  -5.555   9.838  -5.274
  654    H    LYS  84           H        LYS  84  -5.113   9.276  -8.803
  655    HA   LYS  84           HA       LYS  84  -7.815   8.834  -8.086
  656   1HB   LYS  84          2HB       LYS  84  -6.822  10.453  -9.751
  657   2HB   LYS  84          3HB       LYS  84  -6.662   9.118 -10.896
  658   1HG   LYS  84          2HG       LYS  84  -9.131   8.811 -10.866
  659   2HG   LYS  84          3HG       LYS  84  -9.276  10.097  -9.649
  660   1HD   LYS  84          2HD       LYS  84  -8.222  11.706 -11.282
  661   2HD   LYS  84          3HD       LYS  84  -8.156  10.400 -12.471
  662   1HE   LYS  84          2HE       LYS  84 -10.078  11.581 -13.078
  663   2HE   LYS  84          3HE       LYS  84 -10.700  10.185 -12.188
  664   1HZ   LYS  84          1HZ       LYS  84 -10.339  12.924 -11.103
  665   2HZ   LYS  84          2HZ       LYS  84 -11.776  12.224 -11.479
  666   3HZ   LYS  84          3HZ       LYS  84 -10.877  11.641 -10.230
  667    H    MET  85           H        MET  85  -5.755   6.800 -10.222
  668    HA   MET  85           HA       MET  85  -7.864   4.885 -10.834
  669   1HB   MET  85          2HB       MET  85  -4.820   4.694 -10.997
  670   2HB   MET  85          3HB       MET  85  -5.937   3.493 -11.657
  671   1HG   MET  85          2HG       MET  85  -6.843   5.097 -13.235
  672   2HG   MET  85          3HG       MET  85  -5.931   6.411 -12.494
  673   1HE   MET  85          1HE       MET  85  -4.617   7.409 -14.300
  674   2HE   MET  85          2HE       MET  85  -3.873   6.516 -15.646
  675   3HE   MET  85          3HE       MET  85  -5.640   6.490 -15.432
  676    H    LEU  86           H        LEU  86  -5.160   4.886  -8.474
  677    HA   LEU  86           HA       LEU  86  -5.691   2.246  -7.544
  678   1HB   LEU  86          2HB       LEU  86  -3.530   3.459  -7.527
  679   2HB   LEU  86          3HB       LEU  86  -4.087   4.496  -6.233
  680    HG   LEU  86           HG       LEU  86  -2.541   2.568  -5.719
  681   1HD1  LEU  86          1HD1      LEU  86  -5.051   2.634  -4.050
  682   2HD1  LEU  86          2HD1      LEU  86  -3.483   1.958  -3.575
  683   3HD1  LEU  86          3HD1      LEU  86  -3.622   3.679  -3.900
  684   1HD2  LEU  86          1HD2      LEU  86  -3.642   0.856  -7.074
  685   2HD2  LEU  86          2HD2      LEU  86  -3.480   0.322  -5.384
  686   3HD2  LEU  86          3HD2      LEU  86  -5.044   0.855  -5.968
  687    H    MET  87           H        MET  87  -6.622   5.493  -6.299
  688    HA   MET  87           HA       MET  87  -7.993   4.704  -3.967
  689   1HB   MET  87          2HB       MET  87  -7.650   7.038  -4.828
  690   2HB   MET  87          3HB       MET  87  -8.868   6.736  -6.066
  691   1HG   MET  87          2HG       MET  87 -10.204   7.727  -4.571
  692   2HG   MET  87          3HG       MET  87 -10.311   6.131  -3.826
  693   1HE   MET  87          1HE       MET  87 -11.226   8.402  -2.240
  694   2HE   MET  87          2HE       MET  87 -10.083   9.336  -1.249
  695   3HE   MET  87          3HE       MET  87 -10.226   9.651  -2.996
  696    H    ALA  88           H        ALA  88  -9.304   4.868  -7.332
  697    HA   ALA  88           HA       ALA  88 -11.800   3.677  -6.813
  698   1HB   ALA  88          1HB       ALA  88 -10.154   3.698  -9.385
  699   2HB   ALA  88          2HB       ALA  88 -11.898   3.400  -9.260
  700   3HB   ALA  88          3HB       ALA  88 -11.235   4.989  -8.825
  701    H    ALA  89           H        ALA  89  -8.724   2.013  -7.650
  702    HA   ALA  89           HA       ALA  89  -9.975  -0.626  -7.709
  703   1HB   ALA  89          1HB       ALA  89  -7.049   0.204  -7.419
  704   2HB   ALA  89          2HB       ALA  89  -7.638  -1.437  -7.758
  705   3HB   ALA  89          3HB       ALA  89  -7.902  -0.140  -8.937
  706    H    GLY  90           H        GLY  90  -7.807   0.936  -5.358
  707   1HA   GLY  90          2HA       GLY  90  -7.508  -0.921  -3.345
  708   2HA   GLY  90          3HA       GLY  90  -7.483   0.820  -3.155
  709    H    ASP  91           H        ASP  91  -9.914   1.735  -3.433
  710    HA   ASP  91           HA       ASP  91 -11.453   0.918  -1.101
  711   1HB   ASP  91          2HB       ASP  91 -11.240   3.222  -1.696
  712   2HB   ASP  91          3HB       ASP  91 -11.834   2.908  -3.339
  713    H    LYS  92           H        LYS  92 -11.400  -1.415  -2.391
  714    HA   LYS  92           HA       LYS  92 -13.263  -1.749  -4.518
  715   1HB   LYS  92          2HB       LYS  92 -13.196  -4.105  -4.093
  716   2HB   LYS  92          3HB       LYS  92 -11.597  -3.330  -4.147
  717   1HG   LYS  92          2HG       LYS  92 -11.046  -4.230  -2.177
  718   2HG   LYS  92          3HG       LYS  92 -12.371  -3.353  -1.433
  719   1HD   LYS  92          2HD       LYS  92 -12.786  -5.504  -0.762
  720   2HD   LYS  92          3HD       LYS  92 -13.892  -5.340  -2.112
  721   1HE   LYS  92          2HE       LYS  92 -11.100  -6.599  -2.267
  722   2HE   LYS  92          3HE       LYS  92 -12.565  -7.518  -1.933
  723   1HZ   LYS  92          1HZ       LYS  92 -12.069  -5.994  -4.423
  724   2HZ   LYS  92          2HZ       LYS  92 -12.013  -7.627  -4.282
  725   3HZ   LYS  92          3HZ       LYS  92 -13.434  -6.839  -4.091
  726    H    ASP  93           H        ASP  93 -14.098  -1.316  -1.192
  727    HA   ASP  93           HA       ASP  93 -16.847  -2.323  -1.572
  728   1HB   ASP  93          2HB       ASP  93 -15.755  -0.404   0.491
  729   2HB   ASP  93          3HB       ASP  93 -17.320  -1.203   0.557
  730    H    GLY  94           H        GLY  94 -15.236   0.601  -2.657
  731   1HA   GLY  94          2HA       GLY  94 -16.102   2.427  -3.733
  732   2HA   GLY  94          3HA       GLY  94 -17.726   1.769  -3.561
  733    H    ASP  95           H        ASP  95 -15.582   2.440  -0.850
  734    HA   ASP  95           HA       ASP  95 -17.645   4.337   0.340
  735   1HB   ASP  95          2HB       ASP  95 -14.945   3.575   1.525
  736   2HB   ASP  95          3HB       ASP  95 -16.244   4.445   2.326
  737    H    GLY  96           H        GLY  96 -14.546   4.290  -1.087
  738   1HA   GLY  96          2HA       GLY  96 -13.352   5.956  -2.101
  739   2HA   GLY  96          3HA       GLY  96 -13.938   7.187  -0.948
  740    H    LYS  97           H        LYS  97 -13.109   4.638   0.981
  741    HA   LYS  97           HA       LYS  97 -10.175   5.375   1.101
  742   1HB   LYS  97          2HB       LYS  97 -12.179   4.935   3.326
  743   2HB   LYS  97          3HB       LYS  97 -10.453   4.670   3.577
  744   1HG   LYS  97          2HG       LYS  97  -9.910   6.817   3.588
  745   2HG   LYS  97          3HG       LYS  97 -10.965   7.258   2.245
  746   1HD   LYS  97          2HD       LYS  97 -12.815   7.641   3.609
  747   2HD   LYS  97          3HD       LYS  97 -12.184   6.648   4.950
  748   1HE   LYS  97          2HE       LYS  97 -10.263   8.298   5.145
  749   2HE   LYS  97          3HE       LYS  97 -11.099   9.331   3.991
  750   1HZ   LYS  97          1HZ       LYS  97 -12.107   8.520   6.643
  751   2HZ   LYS  97          2HZ       LYS  97 -11.498   9.996   6.192
  752   3HZ   LYS  97          3HZ       LYS  97 -12.935   9.465   5.566
  753    H    ILE  98           H        ILE  98  -8.740   3.880   1.406
  754    HA   ILE  98           HA       ILE  98  -9.346   1.029   0.969
  755    HB   ILE  98           HB       ILE  98  -6.769   2.475   1.627
  756   1HG1  ILE  98          2HG       ILE  98  -7.733   1.058  -0.879
  757   2HG1  ILE  98          3HG       ILE  98  -7.785   2.805  -0.658
  758   1HG2  ILE  98          1HG       ILE  98  -7.104  -0.491   0.997
  759   2HG2  ILE  98          2HG       ILE  98  -5.551   0.349   1.194
  760   3HG2  ILE  98          3HG       ILE  98  -6.605   0.153   2.570
  761   1HD1  ILE  98          1HD1      ILE  98  -5.311   1.081  -0.913
  762   2HD1  ILE  98          2HD1      ILE  98  -5.913   2.324  -2.008
  763   3HD1  ILE  98          3HD1      ILE  98  -5.278   2.797  -0.418
  764    H    GLY  99           H        GLY  99  -9.864  -0.279   2.466
  765   1HA   GLY  99          2HA       GLY  99  -8.840   0.048   5.292
  766   2HA   GLY  99          3HA       GLY  99 -10.317  -0.835   4.886
  767    H    VAL 100           H        VAL 100  -7.889  -1.766   6.228
  768    HA   VAL 100           HA       VAL 100  -6.135  -3.239   4.846
  769    HB   VAL 100           HB       VAL 100  -6.206  -2.887   7.259
  770   1HG1  VAL 100          1HG       VAL 100  -8.017  -5.283   7.576
  771   2HG1  VAL 100          2HG       VAL 100  -7.241  -4.316   8.839
  772   3HG1  VAL 100          3HG       VAL 100  -8.497  -3.586   7.830
  773   1HG2  VAL 100          1HG       VAL 100  -4.829  -4.721   5.933
  774   2HG2  VAL 100          2HG       VAL 100  -4.763  -4.533   7.670
  775   3HG2  VAL 100          3HG       VAL 100  -5.771  -5.825   6.960
  776    H    ASP 101           H        ASP 101  -9.318  -4.582   5.682
  777    HA   ASP 101           HA       ASP 101  -8.798  -7.227   4.741
  778   1HB   ASP 101          2HB       ASP 101 -10.498  -6.449   6.435
  779   2HB   ASP 101          3HB       ASP 101 -11.467  -5.803   5.108
  780    H    GLU 102           H        GLU 102 -10.150  -4.363   3.167
  781    HA   GLU 102           HA       GLU 102 -10.662  -5.529   0.556
  782   1HB   GLU 102          2HB       GLU 102  -9.663  -2.734   1.200
  783   2HB   GLU 102          3HB       GLU 102 -10.325  -3.258  -0.304
  784   1HG   GLU 102          2HG       GLU 102 -12.565  -3.501   0.754
  785   2HG   GLU 102          3HG       GLU 102 -11.863  -3.031   2.310
  786    H    PHE 103           H        PHE 103  -7.917  -3.629   1.890
  787    HA   PHE 103           HA       PHE 103  -6.357  -3.706  -0.373
  788   1HB   PHE 103          2HB       PHE 103  -6.199  -2.399   1.893
  789   2HB   PHE 103          3HB       PHE 103  -5.162  -3.701   2.415
  790    HD1  PHE 103           1HD      PHE 103  -3.042  -2.731   2.594
  791    HD2  PHE 103           2HD      PHE 103  -5.419  -1.833  -0.898
  792    HE1  PHE 103           1HE      PHE 103  -1.182  -1.444   1.656
  793    HE2  PHE 103           2HE      PHE 103  -3.552  -0.529  -1.831
  794    HZ   PHE 103           HZ       PHE 103  -1.410  -0.328  -0.580
  795    H    SER 104           H        SER 104  -6.271  -6.040   2.264
  796    HA   SER 104           HA       SER 104  -4.194  -7.788   1.487
  797   1HB   SER 104          2HB       SER 104  -5.589  -7.789   3.576
  798   2HB   SER 104          3HB       SER 104  -6.911  -8.513   2.659
  799    HG   SER 104           HG       SER 104  -5.691 -10.149   3.622
  800    H    THR 105           H        THR 105  -7.549  -7.636   0.258
  801    HA   THR 105           HA       THR 105  -7.164 -10.168  -1.255
  802    HB   THR 105           HB       THR 105  -9.634 -10.192  -1.270
  803    HG1  THR 105           1HG      THR 105  -9.682  -8.236   0.776
  804   1HG2  THR 105          1HG       THR 105  -8.425  -9.981   1.521
  805   2HG2  THR 105          2HG       THR 105  -9.876 -10.895   1.052
  806   3HG2  THR 105          3HG       THR 105  -8.274 -11.386   0.453
  807    H    LEU 106           H        LEU 106  -8.020  -6.827  -1.634
  808    HA   LEU 106           HA       LEU 106  -8.763  -6.532  -4.313
  809   1HB   LEU 106          2HB       LEU 106  -8.750  -4.809  -2.643
  810   2HB   LEU 106          3HB       LEU 106  -7.022  -4.921  -2.410
  811    HG   LEU 106           HG       LEU 106  -8.032  -2.932  -3.617
  812   1HD1  LEU 106          1HD1      LEU 106  -5.693  -4.328  -4.935
  813   2HD1  LEU 106          2HD1      LEU 106  -6.056  -2.597  -4.987
  814   3HD1  LEU 106          3HD1      LEU 106  -5.620  -3.364  -3.448
  815   1HD2  LEU 106          1HD2      LEU 106  -9.461  -4.061  -5.220
  816   2HD2  LEU 106          2HD2      LEU 106  -8.256  -3.063  -6.043
  817   3HD2  LEU 106          3HD2      LEU 106  -8.054  -4.806  -6.013
  818    H    VAL 107           H        VAL 107  -5.478  -7.005  -2.989
  819    HA   VAL 107           HA       VAL 107  -4.228  -6.957  -5.642
  820    HB   VAL 107           HB       VAL 107  -2.234  -7.547  -4.445
  821   1HG1  VAL 107          1HG       VAL 107  -3.367  -5.414  -2.653
  822   2HG1  VAL 107          2HG       VAL 107  -1.915  -5.417  -3.668
  823   3HG1  VAL 107          3HG       VAL 107  -3.496  -5.134  -4.373
  824   1HG2  VAL 107          1HG       VAL 107  -3.904  -8.756  -2.535
  825   2HG2  VAL 107          2HG       VAL 107  -2.174  -8.520  -2.453
  826   3HG2  VAL 107          3HG       VAL 107  -3.267  -7.359  -1.691
  827    H    ALA 108           H        ALA 108  -5.888  -9.341  -4.027
  828    HA   ALA 108           HA       ALA 108  -4.656 -11.604  -5.529
  829   1HB   ALA 108          1HB       ALA 108  -7.046 -11.696  -3.671
  830   2HB   ALA 108          2HB       ALA 108  -6.009 -13.030  -4.217
  831   3HB   ALA 108          3HB       ALA 108  -5.373 -11.808  -3.094
  832    H    GLU 109           H        GLU 109  -7.730  -9.820  -5.229
  833    HA   GLU 109           HA       GLU 109  -8.951 -10.549  -7.706
  834   1HB   GLU 109          2HB       GLU 109  -8.978  -8.207  -5.812
  835   2HB   GLU 109          3HB       GLU 109  -9.677  -7.953  -7.399
  836   1HG   GLU 109          2HG       GLU 109 -10.507 -10.387  -5.793
  837   2HG   GLU 109          3HG       GLU 109 -11.128  -8.795  -5.356
  838    H    SER 110           H        SER 110  -6.072  -8.716  -7.095
  839    HA   SER 110           HA       SER 110  -4.651  -7.569  -8.490
  840   1HB   SER 110          2HB       SER 110  -3.517  -9.107  -9.897
  841   2HB   SER 110          3HB       SER 110  -4.174 -10.047  -8.556
  842    HG   SER 110           HG       SER 110  -5.624 -10.942  -9.895
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1   6.354  -0.997  15.722
    2   2H    MET   1           H2       MET   1   6.841  -2.068  16.876
    3   3H    MET   1           H3       MET   1   5.253  -1.635  16.762
    4    HA   MET   1           HA       MET   1   5.625  -3.838  15.904
    5   1HB   MET   1          2HB       MET   1   4.752  -1.772  13.845
    6   2HB   MET   1          3HB       MET   1   4.633  -3.524  13.626
    7   1HG   MET   1          2HG       MET   1   2.507  -2.789  14.389
    8   2HG   MET   1          3HG       MET   1   3.269  -3.675  15.709
    9   1HE   MET   1          1HE       MET   1   1.761  -2.822  17.649
   10   2HE   MET   1          2HE       MET   1   1.187  -1.145  17.769
   11   3HE   MET   1          3HE       MET   1   0.744  -2.135  16.359
   12    H    SER   2           H        SER   2   6.865  -1.792  13.235
   13    HA   SER   2           HA       SER   2   8.879  -1.748  12.182
   14   1HB   SER   2          2HB       SER   2  10.119  -2.555  14.187
   15   2HB   SER   2          3HB       SER   2   9.843  -4.227  13.632
   16    HG   SER   2           HG       SER   2  11.802  -3.394  12.835
   17    H    MET   3           H        MET   3   7.824  -2.070  10.282
   18    HA   MET   3           HA       MET   3   6.620  -4.476   9.489
   19   1HB   MET   3          2HB       MET   3   6.562  -1.944   8.532
   20   2HB   MET   3          3HB       MET   3   7.703  -2.640   7.378
   21   1HG   MET   3          2HG       MET   3   5.646  -2.987   6.364
   22   2HG   MET   3          3HG       MET   3   5.938  -4.549   7.134
   23   1HE   MET   3          1HE       MET   3   4.633  -5.185   9.612
   24   2HE   MET   3          2HE       MET   3   2.897  -5.035   9.334
   25   3HE   MET   3          3HE       MET   3   3.932  -5.735   8.077
   26    H    THR   4           H        THR   4   9.953  -3.519   9.226
   27    HA   THR   4           HA       THR   4  11.090  -5.426   7.480
   28    HB   THR   4           HB       THR   4  11.998  -4.078  10.039
   29    HG1  THR   4           1HG      THR   4  13.270  -2.986   8.447
   30   1HG2  THR   4          1HG       THR   4  13.588  -5.949   8.258
   31   2HG2  THR   4          2HG       THR   4  14.355  -4.700   9.275
   32   3HG2  THR   4          3HG       THR   4  13.410  -5.999  10.015
   33    H    ASP   5           H        ASP   5  10.210  -5.795  10.965
   34    HA   ASP   5           HA       ASP   5  11.395  -8.464  11.125
   35   1HB   ASP   5          2HB       ASP   5  11.323  -6.723  12.968
   36   2HB   ASP   5          3HB       ASP   5   9.580  -6.974  13.073
   37    H    LEU   6           H        LEU   6   8.185  -7.050  10.822
   38    HA   LEU   6           HA       LEU   6   6.718  -9.554  10.987
   39   1HB   LEU   6          2HB       LEU   6   6.059  -6.727  10.141
   40   2HB   LEU   6          3HB       LEU   6   4.863  -8.010  10.012
   41    HG   LEU   6           HG       LEU   6   6.269  -7.319  12.632
   42   1HD1  LEU   6          1HD1      LEU   6   3.547  -6.413  11.629
   43   2HD1  LEU   6          2HD1      LEU   6   4.205  -6.148  13.264
   44   3HD1  LEU   6          3HD1      LEU   6   4.981  -5.382  11.870
   45   1HD2  LEU   6          1HD2      LEU   6   5.268  -9.582  12.606
   46   2HD2  LEU   6          2HD2      LEU   6   4.347  -8.510  13.662
   47   3HD2  LEU   6          3HD2      LEU   6   3.731  -8.912  12.037
   48    H    LEU   7           H        LEU   7   7.506  -7.468   8.105
   49    HA   LEU   7           HA       LEU   7   6.550  -9.660   6.375
   50   1HB   LEU   7          2HB       LEU   7   7.450  -6.833   5.802
   51   2HB   LEU   7          3HB       LEU   7   7.058  -7.985   4.526
   52    HG   LEU   7           HG       LEU   7   5.111  -7.014   6.658
   53   1HD1  LEU   7          1HD1      LEU   7   5.363  -6.328   3.692
   54   2HD1  LEU   7          2HD1      LEU   7   4.050  -5.804   4.750
   55   3HD1  LEU   7          3HD1      LEU   7   5.686  -5.231   5.048
   56   1HD2  LEU   7          1HD2      LEU   7   4.551  -9.280   5.799
   57   2HD2  LEU   7          2HD2      LEU   7   3.390  -8.079   5.300
   58   3HD2  LEU   7          3HD2      LEU   7   4.616  -8.665   4.134
   59    H    ASN   8           H        ASN   8   9.531  -7.775   6.374
   60    HA   ASN   8           HA       ASN   8  11.628  -9.180   6.432
   61   1HB   ASN   8          2HB       ASN   8  10.338 -10.108   3.867
   62   2HB   ASN   8          3HB       ASN   8  12.091 -10.043   3.989
   63   1HD2  ASN   8          2HD2      ASN   8  10.651 -12.286   3.403
   64   2HD2  ASN   8          1HD2      ASN   8  11.020 -13.462   4.724
   65    H    ALA   9           H        ALA   9  13.018  -7.418   6.248
   66    HA   ALA   9           HA       ALA   9  12.798  -5.165   4.617
   67   1HB   ALA   9          1HB       ALA   9  15.282  -6.594   5.637
   68   2HB   ALA   9          2HB       ALA   9  15.297  -4.994   4.871
   69   3HB   ALA   9          3HB       ALA   9  14.416  -5.221   6.379
   70    H    GLU  10           H        GLU  10  14.503  -8.210   3.720
   71    HA   GLU  10           HA       GLU  10  15.489  -7.402   1.208
   72   1HB   GLU  10          2HB       GLU  10  14.644 -10.124   2.295
   73   2HB   GLU  10          3HB       GLU  10  15.385  -9.926   0.711
   74   1HG   GLU  10          2HG       GLU  10  17.062 -10.563   2.356
   75   2HG   GLU  10          3HG       GLU  10  17.393  -8.980   1.647
   76    H    ASP  11           H        ASP  11  12.354  -8.828   1.983
   77    HA   ASP  11           HA       ASP  11  11.399  -8.953  -0.781
   78   1HB   ASP  11          2HB       ASP  11   9.867  -9.121   1.835
   79   2HB   ASP  11          3HB       ASP  11   9.293  -9.540   0.224
   80    H    ILE  12           H        ILE  12  10.996  -6.690   1.990
   81    HA   ILE  12           HA       ILE  12   9.442  -4.739   0.639
   82    HB   ILE  12           HB       ILE  12  11.131  -4.799   3.098
   83   1HG1  ILE  12          2HG       ILE  12   9.026  -3.330   3.824
   84   2HG1  ILE  12          3HG       ILE  12   8.335  -3.904   2.313
   85   1HG2  ILE  12          1HG       ILE  12  10.448  -2.118   1.887
   86   2HG2  ILE  12          2HG       ILE  12  11.022  -2.438   3.547
   87   3HG2  ILE  12          3HG       ILE  12  12.095  -2.760   2.185
   88   1HD1  ILE  12          1HD1      ILE  12   9.375  -5.537   4.660
   89   2HD1  ILE  12          2HD1      ILE  12   7.695  -5.341   4.121
   90   3HD1  ILE  12          3HD1      ILE  12   8.836  -6.267   3.126
   91    H    LYS  13           H        LYS  13  13.000  -5.053   0.686
   92    HA   LYS  13           HA       LYS  13  13.673  -2.753  -0.774
   93   1HB   LYS  13          2HB       LYS  13  15.524  -3.806   0.020
   94   2HB   LYS  13          3HB       LYS  13  14.886  -5.411  -0.247
   95   1HG   LYS  13          2HG       LYS  13  16.837  -5.109  -1.595
   96   2HG   LYS  13          3HG       LYS  13  15.421  -5.339  -2.596
   97   1HD   LYS  13          2HD       LYS  13  15.667  -2.516  -2.323
   98   2HD   LYS  13          3HD       LYS  13  17.324  -3.096  -2.508
   99   1HE   LYS  13          2HE       LYS  13  16.808  -4.198  -4.593
  100   2HE   LYS  13          3HE       LYS  13  15.067  -4.026  -4.321
  101   1HZ   LYS  13          1HZ       LYS  13  16.895  -1.756  -4.790
  102   2HZ   LYS  13          2HZ       LYS  13  15.845  -2.383  -5.894
  103   3HZ   LYS  13          3HZ       LYS  13  15.269  -1.665  -4.533
  104    H    LYS  14           H        LYS  14  12.512  -5.828  -2.078
  105    HA   LYS  14           HA       LYS  14  12.577  -4.858  -4.882
  106   1HB   LYS  14          2HB       LYS  14  11.587  -7.395  -3.528
  107   2HB   LYS  14          3HB       LYS  14  11.391  -7.098  -5.266
  108   1HG   LYS  14          2HG       LYS  14  13.689  -7.114  -5.701
  109   2HG   LYS  14          3HG       LYS  14  14.136  -6.709  -4.047
  110   1HD   LYS  14          2HD       LYS  14  13.365  -9.003  -3.319
  111   2HD   LYS  14          3HD       LYS  14  13.170  -9.396  -5.048
  112   1HE   LYS  14          2HE       LYS  14  15.654  -8.295  -5.112
  113   2HE   LYS  14          3HE       LYS  14  15.654  -8.815  -3.422
  114   1HZ   LYS  14          1HZ       LYS  14  15.186 -10.547  -5.780
  115   2HZ   LYS  14          2HZ       LYS  14  16.551 -10.524  -4.864
  116   3HZ   LYS  14          3HZ       LYS  14  15.134 -11.063  -4.218
  117    H    ALA  15           H        ALA  15  10.143  -5.280  -2.346
  118    HA   ALA  15           HA       ALA  15   7.871  -4.596  -3.826
  119   1HB   ALA  15          1HB       ALA  15   8.268  -3.676  -0.969
  120   2HB   ALA  15          2HB       ALA  15   6.847  -4.376  -1.764
  121   3HB   ALA  15          3HB       ALA  15   8.223  -5.407  -1.369
  122    H    VAL  16           H        VAL  16   9.922  -2.300  -1.903
  123    HA   VAL  16           HA       VAL  16   8.565   0.068  -2.691
  124    HB   VAL  16           HB       VAL  16  11.502  -0.305  -1.982
  125   1HG1  VAL  16          1HG       VAL  16   9.818   2.240  -2.012
  126   2HG1  VAL  16          2HG       VAL  16  11.454   2.093  -1.338
  127   3HG1  VAL  16          3HG       VAL  16  11.201   1.894  -3.073
  128   1HG2  VAL  16          1HG       VAL  16   9.875  -0.993  -0.185
  129   2HG2  VAL  16          2HG       VAL  16  10.846   0.417   0.243
  130   3HG2  VAL  16          3HG       VAL  16   9.153   0.624  -0.259
  131    H    GLY  17           H        GLY  17  11.027  -1.786  -4.412
  132   1HA   GLY  17          2HA       GLY  17  11.519   0.045  -6.579
  133   2HA   GLY  17          3HA       GLY  17  11.807  -1.694  -6.578
  134    H    ALA  18           H        ALA  18   8.790  -2.128  -5.936
  135    HA   ALA  18           HA       ALA  18   7.879  -2.242  -8.703
  136   1HB   ALA  18          1HB       ALA  18   6.385  -2.922  -6.137
  137   2HB   ALA  18          2HB       ALA  18   6.017  -3.473  -7.779
  138   3HB   ALA  18          3HB       ALA  18   7.497  -4.032  -6.967
  139    H    PHE  19           H        PHE  19   7.205  -0.168  -5.882
  140    HA   PHE  19           HA       PHE  19   5.168   1.382  -7.435
  141   1HB   PHE  19          2HB       PHE  19   6.170   1.683  -4.583
  142   2HB   PHE  19          3HB       PHE  19   4.964   2.705  -5.355
  143    HD1  PHE  19           1HD      PHE  19   3.135   0.887  -6.717
  144    HD2  PHE  19           2HD      PHE  19   4.985   0.603  -2.840
  145    HE1  PHE  19           1HE      PHE  19   1.138  -0.298  -5.827
  146    HE2  PHE  19           2HE      PHE  19   2.960  -0.619  -1.994
  147    HZ   PHE  19           HZ       PHE  19   1.084  -1.080  -3.495
  148    H    SER  20           H        SER  20   8.512   1.370  -7.195
  149    HA   SER  20           HA       SER  20   9.186   4.140  -7.071
  150   1HB   SER  20          2HB       SER  20  10.772   2.387  -6.529
  151   2HB   SER  20          3HB       SER  20  10.673   1.739  -8.182
  152    HG   SER  20           HG       SER  20  11.389   3.792  -8.895
  153    H    ALA  21           H        ALA  21   7.171   4.390  -8.756
  154    HA   ALA  21           HA       ALA  21   8.313   5.285 -11.331
  155   1HB   ALA  21          1HB       ALA  21   5.991   3.324 -11.054
  156   2HB   ALA  21          2HB       ALA  21   6.552   4.043 -12.587
  157   3HB   ALA  21          3HB       ALA  21   7.602   2.932 -11.692
  158    H    THR  22           H        THR  22   6.070   6.137 -12.622
  159    HA   THR  22           HA       THR  22   4.707   8.015 -10.782
  160    HB   THR  22           HB       THR  22   3.776   9.008 -12.839
  161    HG1  THR  22           1HG      THR  22   3.704   7.733 -14.522
  162   1HG2  THR  22          1HG       THR  22   6.794   8.707 -13.015
  163   2HG2  THR  22          2HG       THR  22   5.800   9.996 -13.719
  164   3HG2  THR  22          3HG       THR  22   5.927   9.842 -11.954
  165    H    ASP  23           H        ASP  23   2.602   7.438 -13.163
  166    HA   ASP  23           HA       ASP  23   0.615   5.850 -11.897
  167   1HB   ASP  23          2HB       ASP  23  -0.401   6.205 -14.209
  168   2HB   ASP  23          3HB       ASP  23  -0.215   7.516 -13.081
  169    H    SER  24           H        SER  24   2.677   4.299 -11.672
  170    HA   SER  24           HA       SER  24   1.717   1.914 -13.183
  171   1HB   SER  24          2HB       SER  24   4.639   2.491 -12.594
  172   2HB   SER  24          3HB       SER  24   3.995   0.981 -13.253
  173    HG   SER  24           HG       SER  24   4.820   2.430 -14.859
  174    H    PHE  25           H        PHE  25   0.677   2.711 -10.776
  175    HA   PHE  25           HA       PHE  25   2.015   1.860  -8.479
  176   1HB   PHE  25          2HB       PHE  25   0.072   3.354  -8.564
  177   2HB   PHE  25          3HB       PHE  25  -0.996   2.023  -8.888
  178    HD1  PHE  25           1HD      PHE  25   1.517   3.296  -6.363
  179    HD2  PHE  25           2HD      PHE  25  -1.977   0.878  -7.041
  180    HE1  PHE  25           1HE      PHE  25   1.243   2.989  -3.925
  181    HE2  PHE  25           2HE      PHE  25  -2.184   0.514  -4.589
  182    HZ   PHE  25           HZ       PHE  25  -0.584   1.584  -3.026
  183    H    ASP  26           H        ASP  26   2.860  -0.227  -9.209
  184    HA   ASP  26           HA       ASP  26   1.211  -2.371  -9.867
  185   1HB   ASP  26          2HB       ASP  26   3.896  -1.693 -10.048
  186   2HB   ASP  26          3HB       ASP  26   3.974  -3.049  -8.965
  187    H    HIS  27           H        HIS  27   0.032  -1.690  -7.519
  188    HA   HIS  27           HA       HIS  27   0.823  -2.639  -5.073
  189   1HB   HIS  27          2HB       HIS  27  -1.537  -2.762  -4.396
  190   2HB   HIS  27          3HB       HIS  27  -1.163  -1.335  -5.335
  191    HD1  HIS  27           HD1      HIS  27  -3.390  -4.415  -5.466
  192    HD2  HIS  27           HD2      HIS  27  -2.252  -1.151  -7.861
  193    HE1  HIS  27           HE1      HIS  27  -4.915  -4.432  -7.514
  194    H    LYS  28           H        LYS  28  -1.095  -4.612  -7.246
  195    HA   LYS  28           HA       LYS  28  -1.052  -7.064  -5.826
  196   1HB   LYS  28          2HB       LYS  28  -1.685  -8.083  -7.864
  197   2HB   LYS  28          3HB       LYS  28  -2.527  -6.554  -7.637
  198   1HG   LYS  28          2HG       LYS  28  -0.242  -7.026  -9.568
  199   2HG   LYS  28          3HG       LYS  28  -1.964  -6.980  -9.942
  200   1HD   LYS  28          2HD       LYS  28  -1.939  -4.580  -8.962
  201   2HD   LYS  28          3HD       LYS  28  -0.182  -4.653  -9.175
  202   1HE   LYS  28          2HE       LYS  28  -2.285  -5.026 -11.331
  203   2HE   LYS  28          3HE       LYS  28  -1.390  -3.533 -11.005
  204   1HZ   LYS  28          1HZ       LYS  28  -0.092  -6.068 -11.799
  205   2HZ   LYS  28          2HZ       LYS  28  -0.398  -4.811 -12.820
  206   3HZ   LYS  28          3HZ       LYS  28   0.668  -4.629 -11.581
  207    H    LYS  29           H        LYS  29   1.381  -5.765  -8.032
  208    HA   LYS  29           HA       LYS  29   3.080  -8.140  -8.019
  209   1HB   LYS  29          2HB       LYS  29   2.906  -6.141  -9.771
  210   2HB   LYS  29          3HB       LYS  29   4.015  -5.342  -8.651
  211   1HG   LYS  29          2HG       LYS  29   5.326  -7.694  -8.877
  212   2HG   LYS  29          3HG       LYS  29   4.409  -7.771 -10.382
  213   1HD   LYS  29          2HD       LYS  29   5.533  -5.129 -10.228
  214   2HD   LYS  29          3HD       LYS  29   6.791  -6.219  -9.696
  215   1HE   LYS  29          2HE       LYS  29   6.511  -7.559 -11.772
  216   2HE   LYS  29          3HE       LYS  29   5.199  -6.475 -12.284
  217   1HZ   LYS  29          1HZ       LYS  29   7.974  -5.592 -11.790
  218   2HZ   LYS  29          2HZ       LYS  29   7.320  -5.851 -13.280
  219   3HZ   LYS  29          3HZ       LYS  29   6.714  -4.658 -12.312
  220    H    PHE  30           H        PHE  30   3.058  -4.961  -6.417
  221    HA   PHE  30           HA       PHE  30   5.326  -5.211  -4.730
  222   1HB   PHE  30          2HB       PHE  30   4.028  -3.129  -4.986
  223   2HB   PHE  30          3HB       PHE  30   2.668  -3.832  -4.144
  224    HD1  PHE  30           1HD      PHE  30   3.044  -4.628  -1.623
  225    HD2  PHE  30           2HD      PHE  30   5.601  -1.927  -3.780
  226    HE1  PHE  30           1HE      PHE  30   4.042  -3.887   0.502
  227    HE2  PHE  30           2HE      PHE  30   6.596  -1.165  -1.628
  228    HZ   PHE  30           HZ       PHE  30   5.871  -2.229   0.497
  229    H    PHE  31           H        PHE  31   1.901  -6.026  -3.902
  230    HA   PHE  31           HA       PHE  31   2.539  -7.171  -1.398
  231   1HB   PHE  31          2HB       PHE  31   0.181  -7.314  -3.225
  232   2HB   PHE  31          3HB       PHE  31   0.272  -8.432  -1.882
  233    HD1  PHE  31           1HD      PHE  31   0.895  -4.707  -2.282
  234    HD2  PHE  31           2HD      PHE  31  -1.150  -7.846  -0.149
  235    HE1  PHE  31           1HE      PHE  31  -0.158  -3.027  -0.804
  236    HE2  PHE  31           2HE      PHE  31  -2.240  -6.162   1.281
  237    HZ   PHE  31           HZ       PHE  31  -1.727  -3.758   0.981
  238    H    GLN  32           H        GLN  32   2.523  -8.653  -4.620
  239    HA   GLN  32           HA       GLN  32   2.961 -11.355  -3.651
  240   1HB   GLN  32          2HB       GLN  32   3.261  -9.975  -6.342
  241   2HB   GLN  32          3HB       GLN  32   3.616 -11.690  -6.112
  242   1HG   GLN  32          2HG       GLN  32   1.386 -12.250  -5.623
  243   2HG   GLN  32          3HG       GLN  32   0.944 -10.611  -5.161
  244   1HE2  GLN  32          2HE       GLN  32  -0.960 -10.402  -6.618
  245   2HE2  GLN  32          1HE       GLN  32  -0.596 -10.492  -8.347
  246    H    MET  33           H        MET  33   5.239  -8.889  -5.043
  247    HA   MET  33           HA       MET  33   7.618 -10.411  -4.612
  248   1HB   MET  33          2HB       MET  33   7.073  -7.443  -5.010
  249   2HB   MET  33          3HB       MET  33   8.705  -8.068  -4.749
  250   1HG   MET  33          2HG       MET  33   8.507  -9.567  -6.659
  251   2HG   MET  33          3HG       MET  33   6.863  -8.999  -6.979
  252   1HE   MET  33          1HE       MET  33   8.099  -8.901  -9.459
  253   2HE   MET  33          2HE       MET  33   9.355  -7.702  -9.862
  254   3HE   MET  33          3HE       MET  33   9.747  -9.077  -8.810
  255    H    VAL  34           H        VAL  34   6.112  -7.920  -2.507
  256    HA   VAL  34           HA       VAL  34   8.092  -8.042  -0.418
  257    HB   VAL  34           HB       VAL  34   6.274  -6.295  -0.914
  258   1HG1  VAL  34          1HG       VAL  34   4.720  -7.870   1.096
  259   2HG1  VAL  34          2HG       VAL  34   4.279  -6.366   0.253
  260   3HG1  VAL  34          3HG       VAL  34   4.380  -7.893  -0.647
  261   1HG2  VAL  34          1HG       VAL  34   7.921  -6.198   0.934
  262   2HG2  VAL  34          2HG       VAL  34   6.361  -5.487   1.378
  263   3HG2  VAL  34          3HG       VAL  34   6.813  -7.107   1.965
  264    H    GLY  35           H        GLY  35   5.670 -10.302  -1.443
  265   1HA   GLY  35          2HA       GLY  35   4.770 -12.213  -0.597
  266   2HA   GLY  35          3HA       GLY  35   5.959 -12.135   0.705
  267    H    LEU  36           H        LEU  36   3.487  -9.649   0.120
  268    HA   LEU  36           HA       LEU  36   2.764  -9.517   2.886
  269   1HB   LEU  36          2HB       LEU  36   2.011  -8.184   0.366
  270   2HB   LEU  36          3HB       LEU  36   0.609  -8.395   1.402
  271    HG   LEU  36           HG       LEU  36   3.208  -7.268   2.477
  272   1HD1  LEU  36          1HD1      LEU  36   0.848  -5.543   1.700
  273   2HD1  LEU  36          2HD1      LEU  36   2.467  -5.052   2.205
  274   3HD1  LEU  36          3HD1      LEU  36   2.211  -5.774   0.607
  275   1HD2  LEU  36          1HD2      LEU  36   1.477  -8.226   4.043
  276   2HD2  LEU  36          2HD2      LEU  36   1.863  -6.513   4.189
  277   3HD2  LEU  36          3HD2      LEU  36   0.334  -7.024   3.415
  278    H    LYS  37           H        LYS  37   0.812 -10.517   0.242
  279    HA   LYS  37           HA       LYS  37  -1.230 -12.103   1.430
  280   1HB   LYS  37          2HB       LYS  37   0.257 -12.678  -1.167
  281   2HB   LYS  37          3HB       LYS  37  -1.219 -13.487  -0.635
  282   1HG   LYS  37          2HG       LYS  37  -2.294 -11.138  -0.521
  283   2HG   LYS  37          3HG       LYS  37  -0.900 -10.592  -1.473
  284   1HD   LYS  37          2HD       LYS  37  -2.765 -12.883  -2.241
  285   2HD   LYS  37          3HD       LYS  37  -2.945 -11.230  -2.820
  286   1HE   LYS  37          2HE       LYS  37  -0.979 -11.277  -4.096
  287   2HE   LYS  37          3HE       LYS  37  -0.324 -12.676  -3.229
  288   1HZ   LYS  37          1HZ       LYS  37  -2.646 -12.732  -5.052
  289   2HZ   LYS  37          2HZ       LYS  37  -1.155 -13.315  -5.400
  290   3HZ   LYS  37          3HZ       LYS  37  -2.058 -14.034  -4.229
  291    H    LYS  38           H        LYS  38   2.181 -12.951   1.439
  292    HA   LYS  38           HA       LYS  38   1.647 -15.800   2.095
  293   1HB   LYS  38          2HB       LYS  38   3.677 -16.221   1.290
  294   2HB   LYS  38          3HB       LYS  38   3.720 -14.570   0.715
  295   1HG   LYS  38          2HG       LYS  38   4.781 -14.013   3.056
  296   2HG   LYS  38          3HG       LYS  38   5.007 -15.741   3.216
  297   1HD   LYS  38          2HD       LYS  38   6.651 -15.818   1.575
  298   2HD   LYS  38          3HD       LYS  38   5.964 -14.469   0.663
  299   1HE   LYS  38          2HE       LYS  38   6.671 -12.910   2.521
  300   2HE   LYS  38          3HE       LYS  38   7.539 -14.255   3.265
  301   1HZ   LYS  38          1HZ       LYS  38   8.048 -13.239   0.516
  302   2HZ   LYS  38          2HZ       LYS  38   8.949 -12.821   1.797
  303   3HZ   LYS  38          3HZ       LYS  38   8.934 -14.382   1.302
  304    H    LYS  39           H        LYS  39   2.148 -12.762   3.653
  305    HA   LYS  39           HA       LYS  39   2.631 -13.945   6.301
  306   1HB   LYS  39          2HB       LYS  39   3.010 -11.329   5.046
  307   2HB   LYS  39          3HB       LYS  39   1.937 -11.149   6.419
  308   1HG   LYS  39          2HG       LYS  39   4.168 -10.893   7.250
  309   2HG   LYS  39          3HG       LYS  39   3.595 -12.461   7.805
  310   1HD   LYS  39          2HD       LYS  39   4.817 -13.341   5.571
  311   2HD   LYS  39          3HD       LYS  39   5.621 -11.775   5.650
  312   1HE   LYS  39          2HE       LYS  39   7.055 -13.292   6.773
  313   2HE   LYS  39          3HE       LYS  39   6.277 -12.333   8.030
  314   1HZ   LYS  39          1HZ       LYS  39   5.447 -15.051   7.247
  315   2HZ   LYS  39          2HZ       LYS  39   6.267 -14.638   8.620
  316   3HZ   LYS  39          3HZ       LYS  39   4.729 -14.113   8.401
  317    H    SER  40           H        SER  40   1.148 -13.007   8.052
  318    HA   SER  40           HA       SER  40  -1.373 -14.392   7.518
  319   1HB   SER  40          2HB       SER  40   0.000 -14.762   9.556
  320   2HB   SER  40          3HB       SER  40  -0.363 -13.106  10.088
  321    HG   SER  40           HG       SER  40  -1.757 -14.906  10.873
  322    H    ALA  41           H        ALA  41  -3.420 -13.571   8.409
  323    HA   ALA  41           HA       ALA  41  -4.340 -11.062   7.360
  324   1HB   ALA  41          1HB       ALA  41  -5.448 -12.822   9.594
  325   2HB   ALA  41          2HB       ALA  41  -6.338 -11.552   8.736
  326   3HB   ALA  41          3HB       ALA  41  -5.806 -13.005   7.855
  327    H    ASP  42           H        ASP  42  -3.343 -12.076  10.631
  328    HA   ASP  42           HA       ASP  42  -3.822  -9.637  11.999
  329   1HB   ASP  42          2HB       ASP  42  -3.421 -11.848  13.066
  330   2HB   ASP  42          3HB       ASP  42  -1.745 -11.813  12.508
  331    H    ASP  43           H        ASP  43  -1.107 -10.762  10.074
  332    HA   ASP  43           HA       ASP  43   0.735  -8.592  10.648
  333   1HB   ASP  43          2HB       ASP  43   1.154 -11.003   9.631
  334   2HB   ASP  43          3HB       ASP  43   0.792 -10.211   8.099
  335    H    VAL  44           H        VAL  44  -1.388  -9.379   7.833
  336    HA   VAL  44           HA       VAL  44  -1.175  -7.021   6.370
  337    HB   VAL  44           HB       VAL  44  -3.015  -9.307   6.579
  338   1HG1  VAL  44          1HG       VAL  44  -4.014  -6.842   5.123
  339   2HG1  VAL  44          2HG       VAL  44  -4.663  -8.498   5.077
  340   3HG1  VAL  44          3HG       VAL  44  -4.735  -7.607   6.580
  341   1HG2  VAL  44          1HG       VAL  44  -1.084  -9.186   5.022
  342   2HG2  VAL  44          2HG       VAL  44  -2.625  -9.393   4.171
  343   3HG2  VAL  44          3HG       VAL  44  -1.851  -7.798   4.203
  344    H    LYS  45           H        LYS  45  -3.172  -7.539   9.227
  345    HA   LYS  45           HA       LYS  45  -4.451  -4.949   9.270
  346   1HB   LYS  45          2HB       LYS  45  -5.521  -6.186  10.806
  347   2HB   LYS  45          3HB       LYS  45  -4.209  -7.312  10.942
  348   1HG   LYS  45          2HG       LYS  45  -4.499  -6.574  13.089
  349   2HG   LYS  45          3HG       LYS  45  -3.047  -5.772  12.526
  350   1HD   LYS  45          2HD       LYS  45  -4.381  -4.265  13.876
  351   2HD   LYS  45          3HD       LYS  45  -4.324  -3.666  12.216
  352   1HE   LYS  45          2HE       LYS  45  -6.555  -4.569  11.767
  353   2HE   LYS  45          3HE       LYS  45  -6.624  -5.297  13.381
  354   1HZ   LYS  45          1HZ       LYS  45  -6.277  -2.388  12.945
  355   2HZ   LYS  45          2HZ       LYS  45  -7.768  -3.084  13.134
  356   3HZ   LYS  45          3HZ       LYS  45  -6.656  -3.142  14.348
  357    H    LYS  46           H        LYS  46  -1.354  -5.966  10.706
  358    HA   LYS  46           HA       LYS  46  -0.679  -3.307  11.743
  359   1HB   LYS  46          2HB       LYS  46   0.949  -5.833  11.241
  360   2HB   LYS  46          3HB       LYS  46   1.635  -4.368  11.938
  361   1HG   LYS  46          2HG       LYS  46   0.552  -4.600  13.952
  362   2HG   LYS  46          3HG       LYS  46  -0.858  -5.397  13.256
  363   1HD   LYS  46          2HD       LYS  46   0.424  -7.479  12.936
  364   2HD   LYS  46          3HD       LYS  46   1.852  -6.718  13.672
  365   1HE   LYS  46          2HE       LYS  46   0.642  -6.384  15.772
  366   2HE   LYS  46          3HE       LYS  46  -0.870  -6.953  15.035
  367   1HZ   LYS  46          1HZ       LYS  46   1.512  -8.690  15.267
  368   2HZ   LYS  46          2HZ       LYS  46   0.274  -8.666  16.371
  369   3HZ   LYS  46          3HZ       LYS  46  -0.020  -9.128  14.852
  370    H    VAL  47           H        VAL  47   0.015  -5.107   8.795
  371    HA   VAL  47           HA       VAL  47   1.617  -3.236   7.384
  372    HB   VAL  47           HB       VAL  47  -0.538  -5.039   6.302
  373   1HG1  VAL  47          1HG       VAL  47   1.820  -3.989   4.759
  374   2HG1  VAL  47          2HG       VAL  47   0.398  -4.867   4.152
  375   3HG1  VAL  47          3HG       VAL  47   0.216  -3.217   4.702
  376   1HG2  VAL  47          1HG       VAL  47   1.516  -6.079   7.637
  377   2HG2  VAL  47          2HG       VAL  47   1.029  -6.775   6.115
  378   3HG2  VAL  47          3HG       VAL  47   2.415  -5.661   6.212
  379    H    PHE  48           H        PHE  48  -2.074  -3.467   7.081
  380    HA   PHE  48           HA       PHE  48  -2.428  -1.071   5.822
  381   1HB   PHE  48          2HB       PHE  48  -4.106  -2.778   6.158
  382   2HB   PHE  48          3HB       PHE  48  -4.102  -2.508   7.898
  383    HD1  PHE  48           1HD      PHE  48  -4.428  -0.440   4.753
  384    HD2  PHE  48           2HD      PHE  48  -5.906  -1.268   8.726
  385    HE1  PHE  48           1HE      PHE  48  -6.136   1.323   4.498
  386    HE2  PHE  48           2HE      PHE  48  -7.672   0.437   8.421
  387    HZ   PHE  48           HZ       PHE  48  -7.771   1.750   6.301
  388    H    HIS  49           H        HIS  49  -2.241  -1.494   9.404
  389    HA   HIS  49           HA       HIS  49  -2.626   1.239  10.114
  390   1HB   HIS  49          2HB       HIS  49  -0.962  -0.953  11.409
  391   2HB   HIS  49          3HB       HIS  49  -1.134   0.648  12.097
  392    HD1  HIS  49           HD1      HIS  49  -2.143  -0.676  14.212
  393    HD2  HIS  49           HD2      HIS  49  -4.449  -0.579  10.695
  394    HE1  HIS  49           HE1      HIS  49  -4.530  -1.247  14.901
  395    H    MET  50           H        MET  50   0.339  -0.320   8.831
  396    HA   MET  50           HA       MET  50   2.114   1.748   9.687
  397   1HB   MET  50          2HB       MET  50   2.597  -0.697   9.009
  398   2HB   MET  50          3HB       MET  50   2.546  -0.126   7.336
  399   1HG   MET  50          2HG       MET  50   4.818  -0.174   8.065
  400   2HG   MET  50          3HG       MET  50   4.324   1.507   7.888
  401   1HE   MET  50          1HE       MET  50   4.050   3.221   9.817
  402   2HE   MET  50          2HE       MET  50   5.411   3.140  10.961
  403   3HE   MET  50          3HE       MET  50   5.702   2.962   9.214
  404    H    LEU  51           H        LEU  51   0.173   1.402   6.776
  405    HA   LEU  51           HA       LEU  51   1.219   3.728   5.255
  406   1HB   LEU  51          2HB       LEU  51  -1.448   2.259   5.197
  407   2HB   LEU  51          3HB       LEU  51  -0.896   3.425   4.037
  408    HG   LEU  51           HG       LEU  51  -0.317   1.669   2.806
  409   1HD1  LEU  51          1HD1      LEU  51   1.909   0.966   4.751
  410   2HD1  LEU  51          2HD1      LEU  51   1.853   0.732   3.003
  411   3HD1  LEU  51          3HD1      LEU  51   1.986   2.356   3.644
  412   1HD2  LEU  51          1HD2      LEU  51  -1.652   0.154   3.983
  413   2HD2  LEU  51          2HD2      LEU  51  -0.097  -0.659   3.662
  414   3HD2  LEU  51          3HD2      LEU  51  -0.454   0.017   5.263
  415    H    ASP  52           H        ASP  52  -1.536   3.016   7.381
  416    HA   ASP  52           HA       ASP  52  -2.793   5.554   7.084
  417   1HB   ASP  52          2HB       ASP  52  -3.872   3.334   7.477
  418   2HB   ASP  52          3HB       ASP  52  -3.253   3.350   9.131
  419    H    LYS  53           H        LYS  53  -0.823   6.830   7.592
  420    HA   LYS  53           HA       LYS  53   0.453   6.803  10.078
  421   1HB   LYS  53          2HB       LYS  53   0.156   9.225   8.255
  422   2HB   LYS  53          3HB       LYS  53   1.303   9.050   9.584
  423   1HG   LYS  53          2HG       LYS  53   2.016   6.824   8.245
  424   2HG   LYS  53          3HG       LYS  53   1.274   7.698   6.894
  425   1HD   LYS  53          2HD       LYS  53   3.501   8.394   6.781
  426   2HD   LYS  53          3HD       LYS  53   2.723   9.713   7.685
  427   1HE   LYS  53          2HE       LYS  53   3.424   8.491   9.826
  428   2HE   LYS  53          3HE       LYS  53   4.341   7.373   8.808
  429   1HZ   LYS  53          1HZ       LYS  53   4.785  10.294   9.023
  430   2HZ   LYS  53          2HZ       LYS  53   5.758   9.122   9.636
  431   3HZ   LYS  53          3HZ       LYS  53   5.612   9.298   8.008
  432    H    ASP  54           H        ASP  54  -2.534   8.611   9.389
  433    HA   ASP  54           HA       ASP  54  -2.441   9.984  11.983
  434   1HB   ASP  54          2HB       ASP  54  -4.424  10.993  11.426
  435   2HB   ASP  54          3HB       ASP  54  -3.675  10.773   9.848
  436    H    LYS  55           H        LYS  55  -2.992   6.804  11.135
  437    HA   LYS  55           HA       LYS  55  -3.938   4.986  11.998
  438   1HB   LYS  55          2HB       LYS  55  -3.490   6.450  14.611
  439   2HB   LYS  55          3HB       LYS  55  -3.806   4.721  14.478
  440   1HG   LYS  55          2HG       LYS  55  -1.442   6.094  13.120
  441   2HG   LYS  55          3HG       LYS  55  -1.375   5.372  14.722
  442   1HD   LYS  55          2HD       LYS  55  -1.742   3.160  13.885
  443   2HD   LYS  55          3HD       LYS  55  -2.254   3.744  12.302
  444   1HE   LYS  55          2HE       LYS  55  -0.009   2.840  12.178
  445   2HE   LYS  55          3HE       LYS  55  -0.067   4.546  11.747
  446   1HZ   LYS  55          1HZ       LYS  55   0.780   3.483  14.380
  447   2HZ   LYS  55          2HZ       LYS  55   1.797   4.030  13.203
  448   3HZ   LYS  55          3HZ       LYS  55   0.762   5.072  13.949
  449    H    SER  56           H        SER  56  -5.913   7.098  11.204
  450    HA   SER  56           HA       SER  56  -8.262   6.549  12.858
  451   1HB   SER  56          2HB       SER  56  -9.545   7.681  11.213
  452   2HB   SER  56          3HB       SER  56  -8.050   8.583  11.468
  453    HG   SER  56           HG       SER  56  -8.363   8.513   9.349
  454    H    GLY  57           H        GLY  57  -6.657   4.619  10.513
  455   1HA   GLY  57          2HA       GLY  57  -7.133   2.440   9.910
  456   2HA   GLY  57          3HA       GLY  57  -8.728   2.543  10.660
  457    H    PHE  58           H        PHE  58  -7.695   4.900   8.287
  458    HA   PHE  58           HA       PHE  58  -8.994   3.610   5.959
  459   1HB   PHE  58          2HB       PHE  58 -10.031   6.206   7.173
  460   2HB   PHE  58          3HB       PHE  58 -10.380   5.671   5.552
  461    HD1  PHE  58           1HD      PHE  58 -11.571   5.579   8.899
  462    HD2  PHE  58           2HD      PHE  58 -11.354   3.203   5.303
  463    HE1  PHE  58           1HE      PHE  58 -13.514   4.239   9.658
  464    HE2  PHE  58           2HE      PHE  58 -13.302   1.867   6.071
  465    HZ   PHE  58           HZ       PHE  58 -14.384   2.384   8.244
  466    H    ILE  59           H        ILE  59  -7.456   3.811   4.459
  467    HA   ILE  59           HA       ILE  59  -5.632   6.128   4.468
  468    HB   ILE  59           HB       ILE  59  -5.974   3.793   2.646
  469   1HG1  ILE  59          2HG       ILE  59  -3.589   4.427   4.420
  470   2HG1  ILE  59          3HG       ILE  59  -4.940   3.423   4.937
  471   1HG2  ILE  59          1HG       ILE  59  -3.849   5.966   2.429
  472   2HG2  ILE  59          2HG       ILE  59  -3.894   4.480   1.457
  473   3HG2  ILE  59          3HG       ILE  59  -5.160   5.676   1.266
  474   1HD1  ILE  59          1HD1      ILE  59  -2.951   2.817   2.732
  475   2HD1  ILE  59          2HD1      ILE  59  -3.354   1.872   4.182
  476   3HD1  ILE  59          3HD1      ILE  59  -4.506   1.971   2.857
  477    H    GLU  60           H        GLU  60  -5.701   7.809   3.166
  478    HA   GLU  60           HA       GLU  60  -7.958   8.298   1.334
  479   1HB   GLU  60          2HB       GLU  60  -8.510  10.366   2.548
  480   2HB   GLU  60          3HB       GLU  60  -8.688   8.937   3.559
  481   1HG   GLU  60          2HG       GLU  60  -6.163   9.605   4.298
  482   2HG   GLU  60          3HG       GLU  60  -6.718  11.197   3.779
  483    H    GLU  61           H        GLU  61  -7.642  10.534   0.212
  484    HA   GLU  61           HA       GLU  61  -5.465  10.256  -1.361
  485   1HB   GLU  61          2HB       GLU  61  -5.931  12.315  -2.422
  486   2HB   GLU  61          3HB       GLU  61  -7.367  11.340  -2.137
  487   1HG   GLU  61          2HG       GLU  61  -8.063  12.795  -0.302
  488   2HG   GLU  61          3HG       GLU  61  -6.564  13.731  -0.425
  489    H    ASP  62           H        ASP  62  -5.480  12.279   1.496
  490    HA   ASP  62           HA       ASP  62  -3.075  13.743   1.159
  491   1HB   ASP  62          2HB       ASP  62  -4.873  14.095   2.873
  492   2HB   ASP  62          3HB       ASP  62  -4.328  12.648   3.715
  493    H    GLU  63           H        GLU  63  -3.588  10.531   2.672
  494    HA   GLU  63           HA       GLU  63  -0.722  10.063   3.234
  495   1HB   GLU  63          2HB       GLU  63  -3.199   8.301   3.270
  496   2HB   GLU  63          3HB       GLU  63  -1.583   7.737   3.716
  497   1HG   GLU  63          2HG       GLU  63  -1.501   9.220   5.632
  498   2HG   GLU  63          3HG       GLU  63  -3.016  10.009   5.152
  499    H    LEU  64           H        LEU  64  -3.231   9.039   0.950
  500    HA   LEU  64           HA       LEU  64  -1.938   7.020  -0.444
  501   1HB   LEU  64          2HB       LEU  64  -4.347   7.676  -0.209
  502   2HB   LEU  64          3HB       LEU  64  -4.028   8.949  -1.387
  503    HG   LEU  64           HG       LEU  64  -3.294   6.232  -2.246
  504   1HD1  LEU  64          1HD1      LEU  64  -6.197   7.020  -1.703
  505   2HD1  LEU  64          2HD1      LEU  64  -5.740   5.667  -2.744
  506   3HD1  LEU  64          3HD1      LEU  64  -5.315   5.628  -1.034
  507   1HD2  LEU  64          1HD2      LEU  64  -3.311   8.231  -3.770
  508   2HD2  LEU  64          2HD2      LEU  64  -4.441   6.994  -4.330
  509   3HD2  LEU  64          3HD2      LEU  64  -5.059   8.410  -3.480
  510    H    GLY  65           H        GLY  65  -1.343  10.454  -0.744
  511   1HA   GLY  65          2HA       GLY  65  -0.070  10.358  -3.359
  512   2HA   GLY  65          3HA       GLY  65   0.135  11.602  -2.128
  513    H    PHE  66           H        PHE  66   1.035   9.301  -0.162
  514    HA   PHE  66           HA       PHE  66   3.694   8.624  -1.273
  515   1HB   PHE  66          2HB       PHE  66   4.956   9.846   0.326
  516   2HB   PHE  66          3HB       PHE  66   3.926  10.953  -0.544
  517    HD1  PHE  66           1HD      PHE  66   1.783  11.854   0.622
  518    HD2  PHE  66           2HD      PHE  66   4.879   9.694   2.691
  519    HE1  PHE  66           1HE      PHE  66   0.989  12.776   2.775
  520    HE2  PHE  66           2HE      PHE  66   4.089  10.634   4.856
  521    HZ   PHE  66           HZ       PHE  66   2.131  12.181   4.890
  522    H    ILE  67           H        ILE  67   1.588   7.028  -0.486
  523    HA   ILE  67           HA       ILE  67   1.335   6.086   2.246
  524    HB   ILE  67           HB       ILE  67  -0.496   5.865   1.044
  525   1HG1  ILE  67          2HG       ILE  67   0.052   3.776   2.136
  526   2HG1  ILE  67          3HG       ILE  67  -1.168   3.655   0.882
  527   1HG2  ILE  67          1HG       ILE  67   0.893   4.779  -1.402
  528   2HG2  ILE  67          2HG       ILE  67  -0.853   4.880  -1.160
  529   3HG2  ILE  67          3HG       ILE  67   0.119   6.345  -1.213
  530   1HD1  ILE  67          1HD1      ILE  67   1.694   2.674   0.775
  531   2HD1  ILE  67          2HD1      ILE  67   0.222   1.701   0.713
  532   3HD1  ILE  67          3HD1      ILE  67   0.639   2.714  -0.658
  533    H    LEU  68           H        LEU  68   3.366   5.104  -0.355
  534    HA   LEU  68           HA       LEU  68   4.393   2.760   0.757
  535   1HB   LEU  68          2HB       LEU  68   6.401   3.948  -0.900
  536   2HB   LEU  68          3HB       LEU  68   5.397   2.585  -1.189
  537    HG   LEU  68           HG       LEU  68   5.329   4.268  -2.965
  538   1HD1  LEU  68          1HD1      LEU  68   2.669   3.696  -1.682
  539   2HD1  LEU  68          2HD1      LEU  68   2.953   4.201  -3.365
  540   3HD1  LEU  68          3HD1      LEU  68   3.572   2.676  -2.768
  541   1HD2  LEU  68          1HD2      LEU  68   5.009   6.399  -2.799
  542   2HD2  LEU  68          2HD2      LEU  68   3.453   6.181  -2.007
  543   3HD2  LEU  68          3HD2      LEU  68   4.956   6.278  -1.055
  544    H    LYS  69           H        LYS  69   5.086   6.029   1.777
  545    HA   LYS  69           HA       LYS  69   7.635   5.481   3.040
  546   1HB   LYS  69          2HB       LYS  69   5.475   7.560   3.535
  547   2HB   LYS  69          3HB       LYS  69   6.791   7.335   4.668
  548   1HG   LYS  69          2HG       LYS  69   8.347   7.523   2.533
  549   2HG   LYS  69          3HG       LYS  69   6.934   8.315   1.825
  550   1HD   LYS  69          2HD       LYS  69   8.327  10.046   2.731
  551   2HD   LYS  69          3HD       LYS  69   6.953   9.897   3.821
  552   1HE   LYS  69          2HE       LYS  69   8.933  10.130   5.168
  553   2HE   LYS  69          3HE       LYS  69   8.352   8.472   5.349
  554   1HZ   LYS  69          1HZ       LYS  69  10.579   9.334   3.605
  555   2HZ   LYS  69          2HZ       LYS  69  10.729   8.517   5.024
  556   3HZ   LYS  69          3HZ       LYS  69  10.021   7.788   3.732
  557    H    GLY  70           H        GLY  70   4.431   4.412   3.854
  558   1HA   GLY  70          2HA       GLY  70   5.123   3.629   6.590
  559   2HA   GLY  70          3HA       GLY  70   3.758   3.035   5.610
  560    H    PHE  71           H        PHE  71   5.182   2.014   3.383
  561    HA   PHE  71           HA       PHE  71   6.061  -0.517   4.446
  562   1HB   PHE  71          2HB       PHE  71   6.381   0.641   1.655
  563   2HB   PHE  71          3HB       PHE  71   6.687  -1.018   2.129
  564    HD1  PHE  71           1HD      PHE  71   4.449  -1.977   3.641
  565    HD2  PHE  71           2HD      PHE  71   4.461   0.751   0.303
  566    HE1  PHE  71           1HE      PHE  71   2.141  -2.651   3.050
  567    HE2  PHE  71           2HE      PHE  71   2.105   0.161  -0.183
  568    HZ   PHE  71           HZ       PHE  71   0.966  -1.600   1.144
  569    H    SER  72           H        SER  72   7.950   2.341   3.089
  570    HA   SER  72           HA       SER  72  10.139   1.863   4.846
  571   1HB   SER  72          2HB       SER  72  10.028   0.168   2.541
  572   2HB   SER  72          3HB       SER  72  11.313   1.347   2.247
  573    HG   SER  72           HG       SER  72  11.704  -0.723   3.544
  574    HA   PRO  73           HA       PRO  73  11.278   5.806   2.927
  575   1HB   PRO  73          2HB       PRO  73  14.015   5.894   2.903
  576   2HB   PRO  73          3HB       PRO  73  13.045   6.022   4.402
  577   1HG   PRO  73          2HG       PRO  73  14.370   3.551   3.247
  578   2HG   PRO  73          3HG       PRO  73  14.458   4.170   4.929
  579   1HD   PRO  73          2HD       PRO  73  12.742   2.217   4.180
  580   2HD   PRO  73          3HD       PRO  73  12.271   3.421   5.410
  581    H    ASP  74           H        ASP  74  12.514   6.695   1.154
  582    HA   ASP  74           HA       ASP  74  12.790   7.059  -1.044
  583   1HB   ASP  74          2HB       ASP  74  14.662   5.378  -0.695
  584   2HB   ASP  74          3HB       ASP  74  13.620   4.192  -1.491
  585    H    ALA  75           H        ALA  75  10.339   5.749   0.076
  586    HA   ALA  75           HA       ALA  75   8.591   4.626  -1.726
  587   1HB   ALA  75          1HB       ALA  75   8.345   6.796   0.404
  588   2HB   ALA  75          2HB       ALA  75   6.958   5.979  -0.286
  589   3HB   ALA  75          3HB       ALA  75   8.175   5.039   0.620
  590    H    ARG  76           H        ARG  76   9.247   8.056  -1.339
  591    HA   ARG  76           HA       ARG  76   8.904   9.966  -2.491
  592   1HB   ARG  76          2HB       ARG  76   8.452   8.408  -5.050
  593   2HB   ARG  76          3HB       ARG  76   9.124  10.032  -4.826
  594   1HG   ARG  76          2HG       ARG  76  10.938   8.798  -3.394
  595   2HG   ARG  76          3HG       ARG  76  10.364   7.354  -4.257
  596   1HD   ARG  76          2HD       ARG  76  11.087   8.212  -6.360
  597   2HD   ARG  76          3HD       ARG  76  11.334   9.838  -5.676
  598    HE   ARG  76           HE       ARG  76  12.929   7.691  -4.389
  599   1HH1  ARG  76          1HH2      ARG  76  13.081  10.242  -6.785
  600   2HH1  ARG  76          2HH2      ARG  76  14.816  10.396  -6.606
  601   1HH2  ARG  76          1HH1      ARG  76  14.886   7.869  -4.194
  602   2HH2  ARG  76          2HH1      ARG  76  15.926   8.974  -5.125
  603    H    ASP  77           H        ASP  77   7.473  11.184  -4.106
  604    HA   ASP  77           HA       ASP  77   4.696  10.998  -3.282
  605   1HB   ASP  77          2HB       ASP  77   4.591  13.153  -4.540
  606   2HB   ASP  77          3HB       ASP  77   5.679  13.140  -3.162
  607    H    LEU  78           H        LEU  78   3.422   9.735  -4.334
  608    HA   LEU  78           HA       LEU  78   3.734   8.737  -7.036
  609   1HB   LEU  78          2HB       LEU  78   1.161   8.911  -5.423
  610   2HB   LEU  78          3HB       LEU  78   1.493   7.845  -6.770
  611    HG   LEU  78           HG       LEU  78   2.791   7.787  -3.994
  612   1HD1  LEU  78          1HD1      LEU  78   1.226   5.496  -5.101
  613   2HD1  LEU  78          2HD1      LEU  78   1.535   5.978  -3.427
  614   3HD1  LEU  78          3HD1      LEU  78   0.384   6.880  -4.418
  615   1HD2  LEU  78          1HD2      LEU  78   4.530   7.093  -5.505
  616   2HD2  LEU  78          2HD2      LEU  78   3.881   5.633  -4.769
  617   3HD2  LEU  78          3HD2      LEU  78   3.418   6.057  -6.415
  618    H    SER  79           H        SER  79   2.405   9.180  -8.863
  619    HA   SER  79           HA       SER  79   2.080  12.041  -9.288
  620   1HB   SER  79          2HB       SER  79   1.739  11.595 -11.541
  621   2HB   SER  79          3HB       SER  79   2.848  10.315 -11.036
  622    HG   SER  79           HG       SER  79   1.167   8.868 -11.096
  623    H    ALA  80           H        ALA  80   0.173  13.206  -9.883
  624    HA   ALA  80           HA       ALA  80  -2.139  12.695  -8.383
  625   1HB   ALA  80          1HB       ALA  80  -1.831  14.387 -10.902
  626   2HB   ALA  80          2HB       ALA  80  -3.138  14.519  -9.703
  627   3HB   ALA  80          3HB       ALA  80  -1.471  14.903  -9.236
  628    H    LYS  81           H        LYS  81  -1.425  11.647 -11.698
  629    HA   LYS  81           HA       LYS  81  -4.102  10.676 -12.316
  630   1HB   LYS  81          2HB       LYS  81  -1.784   9.231 -13.536
  631   2HB   LYS  81          3HB       LYS  81  -3.296   9.740 -14.216
  632   1HG   LYS  81          2HG       LYS  81  -1.835  10.981 -15.403
  633   2HG   LYS  81          3HG       LYS  81  -2.271  12.165 -14.164
  634   1HD   LYS  81          2HD       LYS  81  -0.130  11.970 -13.113
  635   2HD   LYS  81          3HD       LYS  81   0.116  10.342 -13.743
  636   1HE   LYS  81          2HE       LYS  81   1.635  11.723 -14.895
  637   2HE   LYS  81          3HE       LYS  81   0.387  11.185 -16.017
  638   1HZ   LYS  81          1HZ       LYS  81   0.507  13.847 -14.709
  639   2HZ   LYS  81          2HZ       LYS  81   0.838  13.537 -16.289
  640   3HZ   LYS  81          3HZ       LYS  81  -0.694  13.351 -15.721
  641    H    GLU  82           H        GLU  82  -1.191   9.310 -10.724
  642    HA   GLU  82           HA       GLU  82  -2.174   6.623 -10.685
  643   1HB   GLU  82          2HB       GLU  82   0.234   7.446 -10.579
  644   2HB   GLU  82          3HB       GLU  82  -0.052   7.926  -8.919
  645   1HG   GLU  82          2HG       GLU  82  -0.996   5.174  -9.521
  646   2HG   GLU  82          3HG       GLU  82   0.713   5.401  -9.847
  647    H    THR  83           H        THR  83  -1.877   9.184  -8.168
  648    HA   THR  83           HA       THR  83  -3.320   8.158  -6.085
  649    HB   THR  83           HB       THR  83  -3.158  10.933  -7.259
  650    HG1  THR  83           1HG      THR  83  -1.969  11.140  -5.264
  651   1HG2  THR  83          1HG       THR  83  -4.551  10.277  -4.636
  652   2HG2  THR  83          2HG       THR  83  -4.056  11.888  -5.176
  653   3HG2  THR  83          3HG       THR  83  -5.303  11.013  -6.068
  654    H    LYS  84           H        LYS  84  -4.825   9.736  -8.941
  655    HA   LYS  84           HA       LYS  84  -7.541   9.278  -8.214
  656   1HB   LYS  84          2HB       LYS  84  -6.069  10.139 -10.611
  657   2HB   LYS  84          3HB       LYS  84  -7.412   9.085 -11.042
  658   1HG   LYS  84          2HG       LYS  84  -8.964  10.485  -9.714
  659   2HG   LYS  84          3HG       LYS  84  -7.620  11.576  -9.308
  660   1HD   LYS  84          2HD       LYS  84  -7.311  12.096 -11.717
  661   2HD   LYS  84          3HD       LYS  84  -8.572  10.930 -12.138
  662   1HE   LYS  84          2HE       LYS  84  -9.553  13.113 -12.240
  663   2HE   LYS  84          3HE       LYS  84 -10.240  12.253 -10.858
  664   1HZ   LYS  84          1HZ       LYS  84  -8.081  14.277 -10.719
  665   2HZ   LYS  84          2HZ       LYS  84  -9.646  14.522 -10.280
  666   3HZ   LYS  84          3HZ       LYS  84  -8.706  13.477  -9.427
  667    H    MET  85           H        MET  85  -5.541   7.228 -10.397
  668    HA   MET  85           HA       MET  85  -7.652   5.271 -10.644
  669   1HB   MET  85          2HB       MET  85  -5.817   5.668 -12.295
  670   2HB   MET  85          3HB       MET  85  -4.684   4.867 -11.195
  671   1HG   MET  85          2HG       MET  85  -5.916   2.789 -11.336
  672   2HG   MET  85          3HG       MET  85  -7.256   3.559 -12.182
  673   1HE   MET  85          1HE       MET  85  -6.202   5.223 -14.521
  674   2HE   MET  85          2HE       MET  85  -6.050   4.001 -15.800
  675   3HE   MET  85          3HE       MET  85  -7.437   3.952 -14.689
  676    H    LEU  86           H        LEU  86  -4.874   5.503  -8.444
  677    HA   LEU  86           HA       LEU  86  -5.133   3.008  -7.125
  678   1HB   LEU  86          2HB       LEU  86  -3.149   4.308  -6.910
  679   2HB   LEU  86          3HB       LEU  86  -4.022   5.717  -6.328
  680    HG   LEU  86           HG       LEU  86  -4.434   4.755  -4.201
  681   1HD1  LEU  86          1HD1      LEU  86  -3.658   2.149  -5.434
  682   2HD1  LEU  86          2HD1      LEU  86  -3.453   2.418  -3.673
  683   3HD1  LEU  86          3HD1      LEU  86  -5.036   2.537  -4.423
  684   1HD2  LEU  86          1HD2      LEU  86  -2.198   5.698  -4.552
  685   2HD2  LEU  86          2HD2      LEU  86  -2.125   4.348  -3.402
  686   3HD2  LEU  86          3HD2      LEU  86  -1.604   4.135  -5.092
  687    H    MET  87           H        MET  87  -6.492   6.257  -6.055
  688    HA   MET  87           HA       MET  87  -7.892   5.022  -3.901
  689   1HB   MET  87          2HB       MET  87  -9.126   7.008  -3.607
  690   2HB   MET  87          3HB       MET  87  -7.477   7.456  -4.043
  691   1HG   MET  87          2HG       MET  87  -8.204   7.990  -6.324
  692   2HG   MET  87          3HG       MET  87  -9.842   7.437  -5.964
  693   1HE   MET  87          1HE       MET  87 -10.784   9.559  -6.954
  694   2HE   MET  87          2HE       MET  87 -10.494  11.208  -6.350
  695   3HE   MET  87          3HE       MET  87  -9.217  10.354  -7.243
  696    H    ALA  88           H        ALA  88  -8.871   5.333  -7.300
  697    HA   ALA  88           HA       ALA  88 -11.532   4.286  -6.943
  698   1HB   ALA  88          1HB       ALA  88  -9.684   4.252  -9.373
  699   2HB   ALA  88          2HB       ALA  88 -11.431   3.934  -9.380
  700   3HB   ALA  88          3HB       ALA  88 -10.823   5.544  -8.940
  701    H    ALA  89           H        ALA  89  -8.489   2.593  -8.022
  702    HA   ALA  89           HA       ALA  89  -9.791   0.033  -8.128
  703   1HB   ALA  89          1HB       ALA  89  -6.829   0.767  -8.024
  704   2HB   ALA  89          2HB       ALA  89  -7.498  -0.805  -8.512
  705   3HB   ALA  89          3HB       ALA  89  -7.825   0.640  -9.490
  706    H    GLY  90           H        GLY  90  -7.772   1.565  -5.606
  707   1HA   GLY  90          2HA       GLY  90  -7.380  -0.830  -4.052
  708   2HA   GLY  90          3HA       GLY  90  -7.039   0.827  -3.557
  709    H    ASP  91           H        ASP  91  -9.795   1.816  -3.869
  710    HA   ASP  91           HA       ASP  91 -11.159   0.480  -1.589
  711   1HB   ASP  91          2HB       ASP  91 -11.265   2.847  -1.509
  712   2HB   ASP  91          3HB       ASP  91 -11.763   2.958  -3.206
  713    H    LYS  92           H        LYS  92 -11.254  -1.552  -2.867
  714    HA   LYS  92           HA       LYS  92 -12.995  -1.821  -5.155
  715   1HB   LYS  92          2HB       LYS  92 -13.213  -4.177  -4.394
  716   2HB   LYS  92          3HB       LYS  92 -11.563  -3.569  -4.684
  717   1HG   LYS  92          2HG       LYS  92 -11.212  -3.346  -2.274
  718   2HG   LYS  92          3HG       LYS  92 -12.837  -3.955  -1.936
  719   1HD   LYS  92          2HD       LYS  92 -10.996  -5.654  -3.625
  720   2HD   LYS  92          3HD       LYS  92 -10.614  -5.497  -1.911
  721   1HE   LYS  92          2HE       LYS  92 -12.873  -6.343  -1.335
  722   2HE   LYS  92          3HE       LYS  92 -13.234  -6.495  -3.069
  723   1HZ   LYS  92          1HZ       LYS  92 -11.058  -7.952  -1.633
  724   2HZ   LYS  92          2HZ       LYS  92 -12.449  -8.609  -2.240
  725   3HZ   LYS  92          3HZ       LYS  92 -11.307  -7.992  -3.253
  726    H    ASP  93           H        ASP  93 -13.800  -1.021  -2.018
  727    HA   ASP  93           HA       ASP  93 -16.386  -2.443  -1.908
  728   1HB   ASP  93          2HB       ASP  93 -14.583  -2.541  -0.192
  729   2HB   ASP  93          3HB       ASP  93 -14.788  -0.810   0.080
  730    H    GLY  94           H        GLY  94 -15.301   0.776  -2.699
  731   1HA   GLY  94          2HA       GLY  94 -16.671   2.414  -3.587
  732   2HA   GLY  94          3HA       GLY  94 -18.097   1.691  -2.846
  733    H    ASP  95           H        ASP  95 -15.327   2.260  -0.845
  734    HA   ASP  95           HA       ASP  95 -16.837   4.463   0.653
  735   1HB   ASP  95          2HB       ASP  95 -14.183   3.145   1.325
  736   2HB   ASP  95          3HB       ASP  95 -14.925   4.429   2.266
  737    H    GLY  96           H        GLY  96 -14.461   4.226  -1.785
  738   1HA   GLY  96          2HA       GLY  96 -12.798   5.501  -2.640
  739   2HA   GLY  96          3HA       GLY  96 -13.352   6.902  -1.706
  740    H    LYS  97           H        LYS  97 -12.905   4.707   0.672
  741    HA   LYS  97           HA       LYS  97 -10.032   5.327   1.164
  742   1HB   LYS  97          2HB       LYS  97 -12.047   4.097   3.072
  743   2HB   LYS  97          3HB       LYS  97 -10.507   4.850   3.451
  744   1HG   LYS  97          2HG       LYS  97 -13.039   6.273   2.488
  745   2HG   LYS  97          3HG       LYS  97 -12.449   6.169   4.133
  746   1HD   LYS  97          2HD       LYS  97 -11.855   8.278   3.489
  747   2HD   LYS  97          3HD       LYS  97 -10.340   7.365   3.344
  748   1HE   LYS  97          2HE       LYS  97 -10.441   7.381   0.972
  749   2HE   LYS  97          3HE       LYS  97 -12.168   7.763   0.960
  750   1HZ   LYS  97          1HZ       LYS  97 -10.097   9.640   1.918
  751   2HZ   LYS  97          2HZ       LYS  97 -10.755   9.673   0.400
  752   3HZ   LYS  97          3HZ       LYS  97 -11.690   9.958   1.722
  753    H    ILE  98           H        ILE  98  -8.530   3.800   1.321
  754    HA   ILE  98           HA       ILE  98  -9.055   0.953   0.665
  755    HB   ILE  98           HB       ILE  98  -6.517   2.496   1.236
  756   1HG1  ILE  98          2HG       ILE  98  -7.416   0.858  -1.114
  757   2HG1  ILE  98          3HG       ILE  98  -7.580   2.612  -0.991
  758   1HG2  ILE  98          1HG       ILE  98  -6.554  -0.513   0.796
  759   2HG2  ILE  98          2HG       ILE  98  -5.119   0.488   0.990
  760   3HG2  ILE  98          3HG       ILE  98  -6.166   0.226   2.365
  761   1HD1  ILE  98          1HD1      ILE  98  -5.034   0.993  -1.245
  762   2HD1  ILE  98          2HD1      ILE  98  -5.693   2.225  -2.325
  763   3HD1  ILE  98          3HD1      ILE  98  -5.038   2.713  -0.751
  764    H    GLY  99           H        GLY  99  -9.580  -0.452   2.094
  765   1HA   GLY  99          2HA       GLY  99  -8.921  -0.080   5.010
  766   2HA   GLY  99          3HA       GLY  99 -10.345  -0.937   4.434
  767    H    VAL 100           H        VAL 100  -8.224  -1.927   6.147
  768    HA   VAL 100           HA       VAL 100  -6.286  -3.521   5.122
  769    HB   VAL 100           HB       VAL 100  -6.468  -3.283   7.431
  770   1HG1  VAL 100          1HG       VAL 100  -9.018  -4.923   7.589
  771   2HG1  VAL 100          2HG       VAL 100  -8.122  -4.177   8.913
  772   3HG1  VAL 100          3HG       VAL 100  -8.942  -3.150   7.740
  773   1HG2  VAL 100          1HG       VAL 100  -5.382  -5.330   6.761
  774   2HG2  VAL 100          2HG       VAL 100  -6.232  -5.563   8.305
  775   3HG2  VAL 100          3HG       VAL 100  -6.918  -6.226   6.832
  776    H    ASP 101           H        ASP 101  -9.551  -4.903   5.649
  777    HA   ASP 101           HA       ASP 101  -8.891  -7.489   4.705
  778   1HB   ASP 101          2HB       ASP 101 -10.773  -6.661   6.238
  779   2HB   ASP 101          3HB       ASP 101 -11.634  -6.157   4.788
  780    H    GLU 102           H        GLU 102 -10.208  -4.690   3.090
  781    HA   GLU 102           HA       GLU 102 -10.642  -5.812   0.460
  782   1HB   GLU 102          2HB       GLU 102  -9.971  -2.980   1.351
  783   2HB   GLU 102          3HB       GLU 102 -10.508  -3.418  -0.244
  784   1HG   GLU 102          2HG       GLU 102 -12.694  -3.629   0.394
  785   2HG   GLU 102          3HG       GLU 102 -12.321  -4.333   1.960
  786    H    PHE 103           H        PHE 103  -7.957  -3.811   1.826
  787    HA   PHE 103           HA       PHE 103  -6.354  -3.902  -0.436
  788   1HB   PHE 103          2HB       PHE 103  -6.264  -2.487   1.754
  789   2HB   PHE 103          3HB       PHE 103  -5.204  -3.734   2.353
  790    HD1  PHE 103           1HD      PHE 103  -3.517  -2.035   2.744
  791    HD2  PHE 103           2HD      PHE 103  -5.019  -2.626  -1.271
  792    HE1  PHE 103           1HE      PHE 103  -1.708  -0.626   1.830
  793    HE2  PHE 103           2HE      PHE 103  -3.211  -1.247  -2.152
  794    HZ   PHE 103           HZ       PHE 103  -1.536  -0.226  -0.622
  795    H    SER 104           H        SER 104  -6.438  -6.143   2.247
  796    HA   SER 104           HA       SER 104  -4.343  -7.953   1.743
  797   1HB   SER 104          2HB       SER 104  -6.058  -7.884   3.642
  798   2HB   SER 104          3HB       SER 104  -7.218  -8.609   2.540
  799    HG   SER 104           HG       SER 104  -6.231 -10.228   3.714
  800    H    THR 105           H        THR 105  -7.500  -7.696   0.105
  801    HA   THR 105           HA       THR 105  -6.973 -10.198  -1.408
  802    HB   THR 105           HB       THR 105  -9.437 -10.225  -1.668
  803    HG1  THR 105           1HG      THR 105  -9.605  -8.371   0.462
  804   1HG2  THR 105          1HG       THR 105  -8.449 -10.091   1.216
  805   2HG2  THR 105          2HG       THR 105  -9.828 -11.030   0.607
  806   3HG2  THR 105          3HG       THR 105  -8.165 -11.451   0.126
  807    H    LEU 106           H        LEU 106  -7.610  -6.852  -1.787
  808    HA   LEU 106           HA       LEU 106  -8.014  -6.227  -4.402
  809   1HB   LEU 106          2HB       LEU 106  -6.949  -5.004  -2.130
  810   2HB   LEU 106          3HB       LEU 106  -5.579  -4.959  -3.178
  811    HG   LEU 106           HG       LEU 106  -6.689  -2.896  -3.329
  812   1HD1  LEU 106          1HD1      LEU 106  -7.627  -4.395  -5.806
  813   2HD1  LEU 106          2HD1      LEU 106  -7.226  -2.674  -5.659
  814   3HD1  LEU 106          3HD1      LEU 106  -5.953  -3.891  -5.492
  815   1HD2  LEU 106          1HD2      LEU 106  -8.826  -3.601  -2.380
  816   2HD2  LEU 106          2HD2      LEU 106  -9.080  -2.677  -3.882
  817   3HD2  LEU 106          3HD2      LEU 106  -9.228  -4.430  -3.911
  818    H    VAL 107           H        VAL 107  -5.150  -7.640  -3.119
  819    HA   VAL 107           HA       VAL 107  -3.556  -7.468  -5.612
  820    HB   VAL 107           HB       VAL 107  -1.753  -8.105  -4.035
  821   1HG1  VAL 107          1HG       VAL 107  -3.405  -5.702  -3.089
  822   2HG1  VAL 107          2HG       VAL 107  -1.661  -5.856  -3.059
  823   3HG1  VAL 107          3HG       VAL 107  -2.470  -5.729  -4.599
  824   1HG2  VAL 107          1HG       VAL 107  -3.675  -9.110  -2.358
  825   2HG2  VAL 107          2HG       VAL 107  -2.045  -8.683  -1.892
  826   3HG2  VAL 107          3HG       VAL 107  -3.369  -7.542  -1.614
  827    H    ALA 108           H        ALA 108  -5.541  -9.581  -4.319
  828    HA   ALA 108           HA       ALA 108  -4.305 -12.090  -5.356
  829   1HB   ALA 108          1HB       ALA 108  -6.751 -11.789  -3.564
  830   2HB   ALA 108          2HB       ALA 108  -5.900 -13.285  -3.987
  831   3HB   ALA 108          3HB       ALA 108  -5.114 -12.069  -2.955
  832    H    GLU 109           H        GLU 109  -7.412 -10.213  -5.355
  833    HA   GLU 109           HA       GLU 109  -8.179 -11.215  -7.993
  834   1HB   GLU 109          2HB       GLU 109  -9.804  -9.464  -8.010
  835   2HB   GLU 109          3HB       GLU 109  -9.770 -10.186  -6.402
  836   1HG   GLU 109          2HG       GLU 109  -8.131  -8.203  -5.836
  837   2HG   GLU 109          3HG       GLU 109  -8.762  -7.466  -7.297
  838    H    SER 110           H        SER 110  -5.859  -8.853  -6.807
  839    HA   SER 110           HA       SER 110  -4.166  -7.839  -7.788
  840   1HB   SER 110          2HB       SER 110  -3.095  -8.822  -9.689
  841   2HB   SER 110          3HB       SER 110  -3.829 -10.129  -8.751
  842    HG   SER 110           HG       SER 110  -5.725  -9.693 -10.259
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1   7.163  -1.382  14.307
    2   2H    MET   1           H2       MET   1   8.255  -0.249  13.827
    3   3H    MET   1           H3       MET   1   8.602  -1.260  15.087
    4    HA   MET   1           HA       MET   1   9.674  -1.732  12.865
    5   1HB   MET   1          2HB       MET   1   9.209  -4.265  13.117
    6   2HB   MET   1          3HB       MET   1  10.116  -3.402  14.344
    7   1HG   MET   1          2HG       MET   1   7.137  -3.902  14.659
    8   2HG   MET   1          3HG       MET   1   8.336  -5.107  15.098
    9   1HE   MET   1          1HE       MET   1  10.661  -3.974  16.577
   10   2HE   MET   1          2HE       MET   1  10.024  -3.868  18.233
   11   3HE   MET   1          3HE       MET   1   9.584  -5.244  17.199
   12    H    SER   2           H        SER   2   6.729  -3.753  12.937
   13    HA   SER   2           HA       SER   2   5.293  -4.347  11.432
   14   1HB   SER   2          2HB       SER   2   5.516  -1.554  10.286
   15   2HB   SER   2          3HB       SER   2   4.152  -2.685  10.108
   16    HG   SER   2           HG       SER   2   3.835  -1.109  11.734
   17    H    MET   3           H        MET   3   5.947  -2.642   8.630
   18    HA   MET   3           HA       MET   3   6.738  -4.925   7.122
   19   1HB   MET   3          2HB       MET   3   7.014  -3.179   5.287
   20   2HB   MET   3          3HB       MET   3   5.441  -3.332   6.014
   21   1HG   MET   3          2HG       MET   3   6.732  -1.303   7.540
   22   2HG   MET   3          3HG       MET   3   7.237  -1.030   5.894
   23   1HE   MET   3          1HE       MET   3   4.358  -1.192   8.441
   24   2HE   MET   3          2HE       MET   3   2.920  -1.211   7.414
   25   3HE   MET   3          3HE       MET   3   4.003  -2.611   7.421
   26    H    THR   4           H        THR   4   8.500  -5.545   8.342
   27    HA   THR   4           HA       THR   4  11.204  -4.868   7.462
   28    HB   THR   4           HB       THR   4  10.077  -3.878  10.127
   29    HG1  THR   4           1HG      THR   4  10.329  -2.614   8.057
   30   1HG2  THR   4          1HG       THR   4  13.031  -4.226   9.392
   31   2HG2  THR   4          2HG       THR   4  12.422  -3.306  10.783
   32   3HG2  THR   4          3HG       THR   4  12.186  -5.054  10.718
   33    H    ASP   5           H        ASP   5   9.353  -5.951  10.275
   34    HA   ASP   5           HA       ASP   5  11.056  -8.367  10.609
   35   1HB   ASP   5          2HB       ASP   5  10.944  -6.367  12.267
   36   2HB   ASP   5          3HB       ASP   5   9.318  -6.919  12.648
   37    H    LEU   6           H        LEU   6   7.713  -7.221  10.378
   38    HA   LEU   6           HA       LEU   6   6.502  -9.842  10.889
   39   1HB   LEU   6          2HB       LEU   6   5.303  -7.290   9.718
   40   2HB   LEU   6          3HB       LEU   6   4.433  -8.690  10.314
   41    HG   LEU   6           HG       LEU   6   6.065  -6.728  11.968
   42   1HD1  LEU   6          1HD1      LEU   6   3.095  -7.379  11.999
   43   2HD1  LEU   6          2HD1      LEU   6   3.937  -6.107  12.919
   44   3HD1  LEU   6          3HD1      LEU   6   3.812  -6.004  11.147
   45   1HD2  LEU   6          1HD2      LEU   6   6.295  -8.949  13.008
   46   2HD2  LEU   6          2HD2      LEU   6   5.188  -7.954  13.959
   47   3HD2  LEU   6          3HD2      LEU   6   4.542  -9.214  12.881
   48    H    LEU   7           H        LEU   7   6.430  -7.713   8.051
   49    HA   LEU   7           HA       LEU   7   6.069  -9.752   6.106
   50   1HB   LEU   7          2HB       LEU   7   7.092  -6.903   5.832
   51   2HB   LEU   7          3HB       LEU   7   6.717  -7.955   4.464
   52    HG   LEU   7           HG       LEU   7   4.744  -6.879   6.518
   53   1HD1  LEU   7          1HD1      LEU   7   5.100  -6.402   3.529
   54   2HD1  LEU   7          2HD1      LEU   7   3.821  -5.713   4.514
   55   3HD1  LEU   7          3HD1      LEU   7   5.484  -5.249   4.822
   56   1HD2  LEU   7          1HD2      LEU   7   4.003  -9.098   5.859
   57   2HD2  LEU   7          2HD2      LEU   7   3.014  -7.929   5.028
   58   3HD2  LEU   7          3HD2      LEU   7   4.330  -8.747   4.138
   59    H    ASN   8           H        ASN   8   8.872  -7.739   5.649
   60    HA   ASN   8           HA       ASN   8  11.077  -9.333   6.204
   61   1HB   ASN   8          2HB       ASN   8   9.680 -10.101   3.640
   62   2HB   ASN   8          3HB       ASN   8  11.435  -9.966   3.584
   63   1HD2  ASN   8          2HD2      ASN   8  10.169 -12.258   2.948
   64   2HD2  ASN   8          1HD2      ASN   8  10.636 -13.456   4.207
   65    H    ALA   9           H        ALA   9  12.322  -7.434   6.362
   66    HA   ALA   9           HA       ALA   9  12.280  -5.160   4.790
   67   1HB   ALA   9          1HB       ALA   9  14.742  -6.536   5.932
   68   2HB   ALA   9          2HB       ALA   9  14.610  -4.823   5.478
   69   3HB   ALA   9          3HB       ALA   9  13.637  -5.460   6.818
   70    H    GLU  10           H        GLU  10  13.889  -8.205   3.842
   71    HA   GLU  10           HA       GLU  10  15.186  -7.274   1.467
   72   1HB   GLU  10          2HB       GLU  10  13.987 -10.010   2.112
   73   2HB   GLU  10          3HB       GLU  10  15.038  -9.639   0.740
   74   1HG   GLU  10          2HG       GLU  10  16.794  -8.871   2.424
   75   2HG   GLU  10          3HG       GLU  10  15.766  -9.568   3.689
   76    H    ASP  11           H        ASP  11  11.951  -8.703   1.920
   77    HA   ASP  11           HA       ASP  11  11.152  -8.573  -0.876
   78   1HB   ASP  11          2HB       ASP  11   9.585  -9.057   1.654
   79   2HB   ASP  11          3HB       ASP  11   9.027  -9.333   0.014
   80    H    ILE  12           H        ILE  12  10.670  -6.502   1.967
   81    HA   ILE  12           HA       ILE  12   9.156  -4.433   0.753
   82    HB   ILE  12           HB       ILE  12  10.965  -4.668   3.102
   83   1HG1  ILE  12          2HG       ILE  12   8.961  -3.179   4.008
   84   2HG1  ILE  12          3HG       ILE  12   8.161  -3.667   2.518
   85   1HG2  ILE  12          1HG       ILE  12  10.327  -1.913   2.037
   86   2HG2  ILE  12          2HG       ILE  12  10.974  -2.321   3.650
   87   3HG2  ILE  12          3HG       ILE  12  11.954  -2.634   2.224
   88   1HD1  ILE  12          1HD1      ILE  12   9.309  -5.444   4.710
   89   2HD1  ILE  12          2HD1      ILE  12   7.600  -5.184   4.331
   90   3HD1  ILE  12          3HD1      ILE  12   8.617  -6.072   3.190
   91    H    LYS  13           H        LYS  13  12.704  -4.876   0.597
   92    HA   LYS  13           HA       LYS  13  13.123  -2.486  -0.935
   93   1HB   LYS  13          2HB       LYS  13  14.734  -5.017  -0.534
   94   2HB   LYS  13          3HB       LYS  13  15.207  -3.832  -1.764
   95   1HG   LYS  13          2HG       LYS  13  15.124  -2.039   0.003
   96   2HG   LYS  13          3HG       LYS  13  14.865  -3.307   1.223
   97   1HD   LYS  13          2HD       LYS  13  16.991  -4.337   0.680
   98   2HD   LYS  13          3HD       LYS  13  17.190  -3.282  -0.740
   99   1HE   LYS  13          2HE       LYS  13  17.180  -1.284   0.777
  100   2HE   LYS  13          3HE       LYS  13  17.144  -2.369   2.174
  101   1HZ   LYS  13          1HZ       LYS  13  19.284  -2.292   0.124
  102   2HZ   LYS  13          2HZ       LYS  13  19.393  -1.635   1.625
  103   3HZ   LYS  13          3HZ       LYS  13  19.271  -3.267   1.449
  104    H    LYS  14           H        LYS  14  12.567  -5.817  -2.166
  105    HA   LYS  14           HA       LYS  14  12.582  -5.013  -4.971
  106   1HB   LYS  14          2HB       LYS  14  10.995  -7.291  -3.687
  107   2HB   LYS  14          3HB       LYS  14  11.147  -6.977  -5.402
  108   1HG   LYS  14          2HG       LYS  14  12.645  -8.656  -5.154
  109   2HG   LYS  14          3HG       LYS  14  13.716  -7.254  -5.089
  110   1HD   LYS  14          2HD       LYS  14  14.024  -7.482  -2.743
  111   2HD   LYS  14          3HD       LYS  14  12.559  -8.475  -2.562
  112   1HE   LYS  14          2HE       LYS  14  13.733 -10.254  -3.952
  113   2HE   LYS  14          3HE       LYS  14  15.219  -9.314  -3.742
  114   1HZ   LYS  14          1HZ       LYS  14  13.529 -10.418  -1.541
  115   2HZ   LYS  14          2HZ       LYS  14  14.992 -11.011  -2.014
  116   3HZ   LYS  14          3HZ       LYS  14  14.891  -9.527  -1.325
  117    H    ALA  15           H        ALA  15  10.078  -5.040  -2.485
  118    HA   ALA  15           HA       ALA  15   7.862  -4.520  -4.199
  119   1HB   ALA  15          1HB       ALA  15   8.084  -3.731  -1.280
  120   2HB   ALA  15          2HB       ALA  15   6.647  -4.174  -2.219
  121   3HB   ALA  15          3HB       ALA  15   7.858  -5.407  -1.850
  122    H    VAL  16           H        VAL  16   9.663  -2.173  -2.087
  123    HA   VAL  16           HA       VAL  16   8.256   0.109  -3.095
  124    HB   VAL  16           HB       VAL  16  11.039  -0.030  -1.874
  125   1HG1  VAL  16          1HG       VAL  16   9.216   2.381  -2.333
  126   2HG1  VAL  16          2HG       VAL  16  10.707   2.387  -1.365
  127   3HG1  VAL  16          3HG       VAL  16  10.794   2.107  -3.102
  128   1HG2  VAL  16          1HG       VAL  16   9.290  -0.796  -0.324
  129   2HG2  VAL  16          2HG       VAL  16   9.804   0.838   0.120
  130   3HG2  VAL  16          3HG       VAL  16   8.273   0.607  -0.726
  131    H    GLY  17           H        GLY  17  11.119  -1.584  -4.343
  132   1HA   GLY  17          2HA       GLY  17  11.791   0.193  -6.471
  133   2HA   GLY  17          3HA       GLY  17  12.091  -1.545  -6.414
  134    H    ALA  18           H        ALA  18   9.029  -1.995  -6.145
  135    HA   ALA  18           HA       ALA  18   8.546  -2.184  -9.012
  136   1HB   ALA  18          1HB       ALA  18   6.846  -3.135  -6.673
  137   2HB   ALA  18          2HB       ALA  18   6.744  -3.655  -8.366
  138   3HB   ALA  18          3HB       ALA  18   8.183  -4.047  -7.398
  139    H    PHE  19           H        PHE  19   6.858  -0.495  -6.273
  140    HA   PHE  19           HA       PHE  19   4.965   0.936  -8.076
  141   1HB   PHE  19          2HB       PHE  19   5.895   1.410  -5.238
  142   2HB   PHE  19          3HB       PHE  19   4.954   2.590  -6.140
  143    HD1  PHE  19           1HD      PHE  19   3.982  -0.984  -6.372
  144    HD2  PHE  19           2HD      PHE  19   3.290   2.862  -4.541
  145    HE1  PHE  19           1HE      PHE  19   1.942  -1.827  -5.242
  146    HE2  PHE  19           2HE      PHE  19   1.271   1.942  -3.358
  147    HZ   PHE  19           HZ       PHE  19   0.644  -0.411  -3.704
  148    H    SER  20           H        SER  20   8.351   1.407  -7.113
  149    HA   SER  20           HA       SER  20   8.579   4.205  -7.426
  150   1HB   SER  20          2HB       SER  20  10.206   2.997  -6.178
  151   2HB   SER  20          3HB       SER  20  10.620   1.971  -7.572
  152    HG   SER  20           HG       SER  20  11.190   3.920  -8.650
  153    H    ALA  21           H        ALA  21   7.126   3.953  -9.456
  154    HA   ALA  21           HA       ALA  21   8.631   4.343 -11.974
  155   1HB   ALA  21          1HB       ALA  21   6.402   2.335 -11.369
  156   2HB   ALA  21          2HB       ALA  21   7.068   2.652 -12.991
  157   3HB   ALA  21          3HB       ALA  21   8.092   1.942 -11.727
  158    H    THR  22           H        THR  22   7.556   6.302 -10.446
  159    HA   THR  22           HA       THR  22   6.317   8.164 -10.353
  160    HB   THR  22           HB       THR  22   5.767   9.269 -12.482
  161    HG1  THR  22           1HG      THR  22   5.258   7.914 -14.083
  162   1HG2  THR  22          1HG       THR  22   8.474   7.877 -12.550
  163   2HG2  THR  22          2HG       THR  22   8.038   9.414 -13.310
  164   3HG2  THR  22          3HG       THR  22   8.086   9.292 -11.539
  165    H    ASP  23           H        ASP  23   4.362   6.726 -12.858
  166    HA   ASP  23           HA       ASP  23   1.850   7.033 -11.314
  167   1HB   ASP  23          2HB       ASP  23   1.406   7.427 -14.097
  168   2HB   ASP  23          3HB       ASP  23   1.254   8.557 -12.760
  169    H    SER  24           H        SER  24   3.813   4.739 -12.576
  170    HA   SER  24           HA       SER  24   2.139   3.070 -14.166
  171   1HB   SER  24          2HB       SER  24   4.628   2.895 -13.871
  172   2HB   SER  24          3HB       SER  24   4.347   2.225 -12.252
  173    HG   SER  24           HG       SER  24   3.960   0.376 -13.162
  174    H    PHE  25           H        PHE  25   2.593   3.194 -10.611
  175    HA   PHE  25           HA       PHE  25   1.858   2.052  -8.890
  176   1HB   PHE  25          2HB       PHE  25  -0.371   3.083  -9.906
  177   2HB   PHE  25          3HB       PHE  25  -0.666   1.504 -10.525
  178    HD1  PHE  25           1HD      PHE  25  -2.727   1.194  -9.492
  179    HD2  PHE  25           2HD      PHE  25   0.717   2.170  -7.061
  180    HE1  PHE  25           1HE      PHE  25  -3.976   0.564  -7.452
  181    HE2  PHE  25           2HE      PHE  25  -0.539   1.481  -5.051
  182    HZ   PHE  25           HZ       PHE  25  -2.835   0.641  -5.235
  183    H    ASP  26           H        ASP  26   1.471  -0.058  -7.874
  184    HA   ASP  26           HA       ASP  26   0.478  -2.123  -9.527
  185   1HB   ASP  26          2HB       ASP  26   3.199  -1.882  -9.974
  186   2HB   ASP  26          3HB       ASP  26   3.203  -3.106  -8.762
  187    H    HIS  27           H        HIS  27  -0.442  -1.293  -7.034
  188    HA   HIS  27           HA       HIS  27  -0.024  -2.446  -4.712
  189   1HB   HIS  27          2HB       HIS  27  -2.477  -2.938  -4.447
  190   2HB   HIS  27          3HB       HIS  27  -1.974  -1.322  -4.824
  191    HD1  HIS  27           HD1      HIS  27  -1.889  -2.498  -8.172
  192    HD2  HIS  27           HD2      HIS  27  -4.875  -1.720  -5.335
  193    HE1  HIS  27           HE1      HIS  27  -4.058  -2.143  -9.476
  194    H    LYS  28           H        LYS  28  -1.913  -4.601  -6.877
  195    HA   LYS  28           HA       LYS  28  -1.630  -6.925  -5.329
  196   1HB   LYS  28          2HB       LYS  28  -2.602  -8.030  -7.046
  197   2HB   LYS  28          3HB       LYS  28  -3.255  -6.415  -7.172
  198   1HG   LYS  28          2HG       LYS  28  -1.089  -7.629  -8.937
  199   2HG   LYS  28          3HG       LYS  28  -2.782  -7.420  -9.334
  200   1HD   LYS  28          2HD       LYS  28  -1.832  -4.807  -8.690
  201   2HD   LYS  28          3HD       LYS  28  -0.575  -5.580  -9.635
  202   1HE   LYS  28          2HE       LYS  28  -2.112  -4.294 -11.017
  203   2HE   LYS  28          3HE       LYS  28  -2.142  -6.008 -11.447
  204   1HZ   LYS  28          1HZ       LYS  28  -4.145  -4.734  -9.662
  205   2HZ   LYS  28          2HZ       LYS  28  -4.385  -5.005 -11.269
  206   3HZ   LYS  28          3HZ       LYS  28  -4.183  -6.268 -10.242
  207    H    LYS  29           H        LYS  29   0.721  -5.598  -7.607
  208    HA   LYS  29           HA       LYS  29   2.292  -8.089  -7.818
  209   1HB   LYS  29          2HB       LYS  29   1.865  -6.020  -9.490
  210   2HB   LYS  29          3HB       LYS  29   3.299  -5.404  -8.691
  211   1HG   LYS  29          2HG       LYS  29   4.508  -6.549 -10.156
  212   2HG   LYS  29          3HG       LYS  29   3.986  -8.054  -9.398
  213   1HD   LYS  29          2HD       LYS  29   2.513  -6.596 -11.657
  214   2HD   LYS  29          3HD       LYS  29   3.630  -7.942 -11.890
  215   1HE   LYS  29          2HE       LYS  29   2.166  -9.394 -10.495
  216   2HE   LYS  29          3HE       LYS  29   1.034  -8.043 -10.291
  217   1HZ   LYS  29          1HZ       LYS  29   1.762  -9.276 -12.881
  218   2HZ   LYS  29          2HZ       LYS  29   0.336  -9.511 -12.085
  219   3HZ   LYS  29          3HZ       LYS  29   0.717  -8.028 -12.687
  220    H    PHE  30           H        PHE  30   2.607  -4.842  -6.383
  221    HA   PHE  30           HA       PHE  30   4.983  -5.180  -4.838
  222   1HB   PHE  30          2HB       PHE  30   3.759  -3.095  -5.184
  223   2HB   PHE  30          3HB       PHE  30   2.435  -3.667  -4.165
  224    HD1  PHE  30           1HD      PHE  30   5.285  -1.634  -4.230
  225    HD2  PHE  30           2HD      PHE  30   3.177  -4.369  -1.629
  226    HE1  PHE  30           1HE      PHE  30   6.427  -0.679  -2.266
  227    HE2  PHE  30           2HE      PHE  30   4.396  -3.453   0.304
  228    HZ   PHE  30           HZ       PHE  30   6.070  -1.648  -0.023
  229    H    PHE  31           H        PHE  31   1.539  -5.840  -3.857
  230    HA   PHE  31           HA       PHE  31   2.241  -6.862  -1.320
  231   1HB   PHE  31          2HB       PHE  31  -0.176  -7.141  -3.059
  232   2HB   PHE  31          3HB       PHE  31  -0.017  -8.125  -1.616
  233    HD1  PHE  31           1HD      PHE  31   0.759  -4.461  -2.226
  234    HD2  PHE  31           2HD      PHE  31  -1.516  -7.376  -0.011
  235    HE1  PHE  31           1HE      PHE  31  -0.091  -2.677  -0.739
  236    HE2  PHE  31           2HE      PHE  31  -2.368  -5.591   1.465
  237    HZ   PHE  31           HZ       PHE  31  -1.605  -3.250   1.145
  238    H    GLN  32           H        GLN  32   2.417  -8.461  -4.422
  239    HA   GLN  32           HA       GLN  32   2.847 -11.130  -3.228
  240   1HB   GLN  32          2HB       GLN  32   2.901 -10.029  -6.058
  241   2HB   GLN  32          3HB       GLN  32   3.417 -11.681  -5.669
  242   1HG   GLN  32          2HG       GLN  32   1.293 -12.267  -4.754
  243   2HG   GLN  32          3HG       GLN  32   0.717 -10.601  -4.742
  244   1HE2  GLN  32          2HE       GLN  32   0.783  -9.575  -7.065
  245   2HE2  GLN  32          1HE       GLN  32   0.136 -10.630  -8.352
  246    H    MET  33           H        MET  33   4.862  -8.642  -4.893
  247    HA   MET  33           HA       MET  33   7.368  -9.926  -4.553
  248   1HB   MET  33          2HB       MET  33   6.631  -6.981  -4.790
  249   2HB   MET  33          3HB       MET  33   8.285  -7.582  -4.844
  250   1HG   MET  33          2HG       MET  33   6.603  -9.068  -6.724
  251   2HG   MET  33          3HG       MET  33   6.465  -7.337  -6.986
  252   1HE   MET  33          1HE       MET  33   8.822 -10.464  -7.016
  253   2HE   MET  33          2HE       MET  33  10.415  -9.741  -7.331
  254   3HE   MET  33          3HE       MET  33   9.620  -9.482  -5.762
  255    H    VAL  34           H        VAL  34   5.686  -7.693  -2.323
  256    HA   VAL  34           HA       VAL  34   7.812  -7.684  -0.329
  257    HB   VAL  34           HB       VAL  34   5.976  -5.905  -0.862
  258   1HG1  VAL  34          1HG       VAL  34   4.427  -7.322   1.280
  259   2HG1  VAL  34          2HG       VAL  34   3.987  -5.904   0.306
  260   3HG1  VAL  34          3HG       VAL  34   4.084  -7.502  -0.460
  261   1HG2  VAL  34          1HG       VAL  34   7.658  -5.733   0.881
  262   2HG2  VAL  34          2HG       VAL  34   6.124  -5.016   1.400
  263   3HG2  VAL  34          3HG       VAL  34   6.644  -6.615   2.004
  264    H    GLY  35           H        GLY  35   5.505 -10.020  -1.236
  265   1HA   GLY  35          2HA       GLY  35   4.738 -11.940  -0.319
  266   2HA   GLY  35          3HA       GLY  35   5.778 -11.668   1.082
  267    H    LEU  36           H        LEU  36   3.362  -9.239   0.387
  268    HA   LEU  36           HA       LEU  36   2.420  -9.152   3.057
  269   1HB   LEU  36          2HB       LEU  36   2.109  -7.696   0.617
  270   2HB   LEU  36          3HB       LEU  36   0.500  -8.021   1.145
  271    HG   LEU  36           HG       LEU  36   2.578  -6.893   3.016
  272   1HD1  LEU  36          1HD1      LEU  36   0.782  -4.830   2.160
  273   2HD1  LEU  36          2HD1      LEU  36   2.551  -4.927   2.040
  274   3HD1  LEU  36          3HD1      LEU  36   1.551  -5.534   0.735
  275   1HD2  LEU  36          1HD2      LEU  36   0.657  -7.832   4.123
  276   2HD2  LEU  36          2HD2      LEU  36   0.396  -6.091   4.134
  277   3HD2  LEU  36          3HD2      LEU  36  -0.463  -7.078   2.961
  278    H    LYS  37           H        LYS  37   0.440  -9.877   0.350
  279    HA   LYS  37           HA       LYS  37  -1.655 -11.389   1.572
  280   1HB   LYS  37          2HB       LYS  37  -2.370 -11.000  -0.486
  281   2HB   LYS  37          3HB       LYS  37  -0.753 -10.866  -1.175
  282   1HG   LYS  37          2HG       LYS  37  -0.602 -13.284  -1.452
  283   2HG   LYS  37          3HG       LYS  37  -2.158 -13.499  -0.624
  284   1HD   LYS  37          2HD       LYS  37  -2.731 -13.781  -2.794
  285   2HD   LYS  37          3HD       LYS  37  -3.211 -12.113  -2.467
  286   1HE   LYS  37          2HE       LYS  37  -1.590 -11.231  -3.891
  287   2HE   LYS  37          3HE       LYS  37  -0.456 -12.549  -3.550
  288   1HZ   LYS  37          1HZ       LYS  37  -2.794 -12.693  -5.360
  289   2HZ   LYS  37          2HZ       LYS  37  -1.205 -12.804  -5.782
  290   3HZ   LYS  37          3HZ       LYS  37  -1.897 -14.001  -4.913
  291    H    LYS  38           H        LYS  38   1.569 -12.480   0.899
  292    HA   LYS  38           HA       LYS  38   0.987 -15.359   1.233
  293   1HB   LYS  38          2HB       LYS  38   2.729 -15.385  -0.166
  294   2HB   LYS  38          3HB       LYS  38   3.135 -13.711   0.133
  295   1HG   LYS  38          2HG       LYS  38   4.430 -14.400   2.169
  296   2HG   LYS  38          3HG       LYS  38   4.082 -16.094   1.760
  297   1HD   LYS  38          2HD       LYS  38   5.228 -15.729  -0.460
  298   2HD   LYS  38          3HD       LYS  38   5.581 -14.070   0.034
  299   1HE   LYS  38          2HE       LYS  38   7.563 -15.305   0.452
  300   2HE   LYS  38          3HE       LYS  38   6.831 -14.960   2.023
  301   1HZ   LYS  38          1HZ       LYS  38   6.629 -17.519   0.538
  302   2HZ   LYS  38          2HZ       LYS  38   7.544 -17.260   1.879
  303   3HZ   LYS  38          3HZ       LYS  38   5.899 -17.215   1.979
  304    H    LYS  39           H        LYS  39   2.036 -12.689   3.195
  305    HA   LYS  39           HA       LYS  39   2.672 -14.281   5.577
  306   1HB   LYS  39          2HB       LYS  39   2.264 -11.297   5.078
  307   2HB   LYS  39          3HB       LYS  39   2.757 -11.958   6.613
  308   1HG   LYS  39          2HG       LYS  39   4.440 -12.569   4.149
  309   2HG   LYS  39          3HG       LYS  39   4.500 -10.992   4.889
  310   1HD   LYS  39          2HD       LYS  39   6.213 -12.001   5.981
  311   2HD   LYS  39          3HD       LYS  39   4.918 -12.312   7.129
  312   1HE   LYS  39          2HE       LYS  39   4.655 -14.579   5.851
  313   2HE   LYS  39          3HE       LYS  39   6.191 -14.158   5.075
  314   1HZ   LYS  39          1HZ       LYS  39   5.740 -14.407   7.985
  315   2HZ   LYS  39          2HZ       LYS  39   6.601 -15.466   7.054
  316   3HZ   LYS  39          3HZ       LYS  39   7.145 -13.922   7.309
  317    H    SER  40           H        SER  40   1.454 -13.275   7.640
  318    HA   SER  40           HA       SER  40  -1.160 -14.545   7.468
  319   1HB   SER  40          2HB       SER  40   0.337 -14.758   9.431
  320   2HB   SER  40          3HB       SER  40   0.125 -13.027   9.778
  321    HG   SER  40           HG       SER  40  -1.313 -14.603  10.889
  322    H    ALA  41           H        ALA  41  -3.186 -13.603   8.104
  323    HA   ALA  41           HA       ALA  41  -3.941 -11.096   6.978
  324   1HB   ALA  41          1HB       ALA  41  -5.200 -12.689   9.254
  325   2HB   ALA  41          2HB       ALA  41  -6.006 -11.436   8.291
  326   3HB   ALA  41          3HB       ALA  41  -5.501 -12.957   7.514
  327    H    ASP  42           H        ASP  42  -2.895 -11.978  10.257
  328    HA   ASP  42           HA       ASP  42  -3.446  -9.470  11.494
  329   1HB   ASP  42          2HB       ASP  42  -2.686 -11.953  12.379
  330   2HB   ASP  42          3HB       ASP  42  -1.160 -11.089  12.542
  331    H    ASP  43           H        ASP  43  -0.809 -10.593   9.504
  332    HA   ASP  43           HA       ASP  43   1.142  -8.526  10.078
  333   1HB   ASP  43          2HB       ASP  43   1.359 -10.870   8.828
  334   2HB   ASP  43          3HB       ASP  43   0.944  -9.918   7.400
  335    H    VAL  44           H        VAL  44  -1.181  -9.037   7.290
  336    HA   VAL  44           HA       VAL  44  -0.949  -6.624   6.112
  337    HB   VAL  44           HB       VAL  44  -3.636  -8.014   6.364
  338   1HG1  VAL  44          1HG       VAL  44  -2.179  -6.384   4.269
  339   2HG1  VAL  44          2HG       VAL  44  -3.702  -7.227   3.960
  340   3HG1  VAL  44          3HG       VAL  44  -3.645  -5.923   5.152
  341   1HG2  VAL  44          1HG       VAL  44  -2.152  -9.846   5.826
  342   2HG2  VAL  44          2HG       VAL  44  -2.907  -9.342   4.327
  343   3HG2  VAL  44          3HG       VAL  44  -1.240  -8.864   4.672
  344    H    LYS  45           H        LYS  45  -2.880  -7.348   8.989
  345    HA   LYS  45           HA       LYS  45  -4.137  -4.815   9.395
  346   1HB   LYS  45          2HB       LYS  45  -3.782  -7.248  10.896
  347   2HB   LYS  45          3HB       LYS  45  -3.251  -5.924  11.924
  348   1HG   LYS  45          2HG       LYS  45  -5.511  -4.784  11.232
  349   2HG   LYS  45          3HG       LYS  45  -5.961  -6.411  10.679
  350   1HD   LYS  45          2HD       LYS  45  -5.232  -7.210  13.048
  351   2HD   LYS  45          3HD       LYS  45  -5.209  -5.486  13.481
  352   1HE   LYS  45          2HE       LYS  45  -7.618  -5.363  12.642
  353   2HE   LYS  45          3HE       LYS  45  -7.571  -7.124  12.468
  354   1HZ   LYS  45          1HZ       LYS  45  -7.215  -5.611  14.990
  355   2HZ   LYS  45          2HZ       LYS  45  -8.506  -6.544  14.590
  356   3HZ   LYS  45          3HZ       LYS  45  -7.043  -7.244  14.859
  357    H    LYS  46           H        LYS  46  -0.999  -5.842  10.755
  358    HA   LYS  46           HA       LYS  46  -0.352  -3.176  11.776
  359   1HB   LYS  46          2HB       LYS  46   1.298  -5.677  11.271
  360   2HB   LYS  46          3HB       LYS  46   2.046  -4.149  11.723
  361   1HG   LYS  46          2HG       LYS  46   1.826  -5.402  13.709
  362   2HG   LYS  46          3HG       LYS  46   0.689  -4.060  13.801
  363   1HD   LYS  46          2HD       LYS  46  -1.184  -5.556  13.295
  364   2HD   LYS  46          3HD       LYS  46  -0.059  -6.902  12.994
  365   1HE   LYS  46          2HE       LYS  46   0.601  -7.020  15.270
  366   2HE   LYS  46          3HE       LYS  46  -0.196  -5.486  15.669
  367   1HZ   LYS  46          1HZ       LYS  46  -1.661  -7.918  14.758
  368   2HZ   LYS  46          2HZ       LYS  46  -1.489  -7.494  16.327
  369   3HZ   LYS  46          3HZ       LYS  46  -2.323  -6.534  15.278
  370    H    VAL  47           H        VAL  47   0.208  -4.821   8.711
  371    HA   VAL  47           HA       VAL  47   1.909  -2.897   7.569
  372    HB   VAL  47           HB       VAL  47   0.024  -4.771   6.174
  373   1HG1  VAL  47          1HG       VAL  47   2.144  -2.877   5.116
  374   2HG1  VAL  47          2HG       VAL  47   1.667  -4.340   4.245
  375   3HG1  VAL  47          3HG       VAL  47   0.464  -3.083   4.550
  376   1HG2  VAL  47          1HG       VAL  47   1.982  -5.754   7.538
  377   2HG2  VAL  47          2HG       VAL  47   1.984  -6.124   5.823
  378   3HG2  VAL  47          3HG       VAL  47   3.057  -4.855   6.483
  379    H    PHE  48           H        PHE  48  -1.650  -3.181   6.845
  380    HA   PHE  48           HA       PHE  48  -2.141  -0.732   5.693
  381   1HB   PHE  48          2HB       PHE  48  -3.840  -2.395   5.884
  382   2HB   PHE  48          3HB       PHE  48  -3.687  -2.476   7.637
  383    HD1  PHE  48           1HD      PHE  48  -5.039  -0.503   4.818
  384    HD2  PHE  48           2HD      PHE  48  -4.660  -0.791   9.110
  385    HE1  PHE  48           1HE      PHE  48  -6.540   1.446   5.101
  386    HE2  PHE  48           2HE      PHE  48  -6.107   1.208   9.370
  387    HZ   PHE  48           HZ       PHE  48  -6.969   2.366   7.341
  388    H    HIS  49           H        HIS  49  -1.859  -1.393   9.199
  389    HA   HIS  49           HA       HIS  49  -2.610   1.128  10.131
  390   1HB   HIS  49          2HB       HIS  49  -1.543  -1.292  11.208
  391   2HB   HIS  49          3HB       HIS  49  -0.449  -0.062  11.741
  392    HD1  HIS  49           HD1      HIS  49  -1.775  -1.366  13.997
  393    HD2  HIS  49           HD2      HIS  49  -3.766   1.646  11.817
  394    HE1  HIS  49           HE1      HIS  49  -3.615  -0.436  15.514
  395    H    MET  50           H        MET  50   0.570   0.216   8.804
  396    HA   MET  50           HA       MET  50   1.883   2.653   9.835
  397   1HB   MET  50          2HB       MET  50   2.921   0.331   9.301
  398   2HB   MET  50          3HB       MET  50   2.794   0.863   7.606
  399   1HG   MET  50          2HG       MET  50   4.948   1.406   8.087
  400   2HG   MET  50          3HG       MET  50   4.147   2.938   8.383
  401   1HE   MET  50          1HE       MET  50   6.204   3.930   9.797
  402   2HE   MET  50          2HE       MET  50   7.169   2.851  10.829
  403   3HE   MET  50          3HE       MET  50   6.945   2.467   9.107
  404    H    LEU  51           H        LEU  51   0.043   1.764   7.019
  405    HA   LEU  51           HA       LEU  51   0.958   3.907   5.220
  406   1HB   LEU  51          2HB       LEU  51  -1.640   2.365   5.163
  407   2HB   LEU  51          3HB       LEU  51  -0.842   3.151   3.827
  408    HG   LEU  51           HG       LEU  51  -0.105   0.569   5.247
  409   1HD1  LEU  51          1HD1      LEU  51  -0.965   1.194   2.422
  410   2HD1  LEU  51          2HD1      LEU  51  -0.406  -0.403   2.984
  411   3HD1  LEU  51          3HD1      LEU  51  -1.871   0.329   3.661
  412   1HD2  LEU  51          1HD2      LEU  51   2.045   1.522   4.848
  413   2HD2  LEU  51          2HD2      LEU  51   1.772   0.319   3.595
  414   3HD2  LEU  51          3HD2      LEU  51   1.604   2.047   3.220
  415    H    ASP  52           H        ASP  52  -1.706   3.228   7.433
  416    HA   ASP  52           HA       ASP  52  -3.001   5.791   7.353
  417   1HB   ASP  52          2HB       ASP  52  -3.580   3.217   8.244
  418   2HB   ASP  52          3HB       ASP  52  -3.308   4.031   9.764
  419    H    LYS  53           H        LYS  53  -1.494   7.397   7.644
  420    HA   LYS  53           HA       LYS  53   0.582   7.625   9.676
  421   1HB   LYS  53          2HB       LYS  53  -0.715   9.626   7.768
  422   2HB   LYS  53          3HB       LYS  53   0.645  10.004   8.798
  423   1HG   LYS  53          2HG       LYS  53   0.687   7.917   6.579
  424   2HG   LYS  53          3HG       LYS  53   1.274   9.562   6.462
  425   1HD   LYS  53          2HD       LYS  53   3.283   8.807   7.086
  426   2HD   LYS  53          3HD       LYS  53   2.628   8.630   8.726
  427   1HE   LYS  53          2HE       LYS  53   1.955   6.330   8.257
  428   2HE   LYS  53          3HE       LYS  53   2.391   6.492   6.563
  429   1HZ   LYS  53          1HZ       LYS  53   4.327   6.649   8.790
  430   2HZ   LYS  53          2HZ       LYS  53   4.013   5.316   7.867
  431   3HZ   LYS  53          3HZ       LYS  53   4.693   6.653   7.175
  432    H    ASP  54           H        ASP  54  -2.682   7.770   9.905
  433    HA   ASP  54           HA       ASP  54  -2.811   9.596  12.260
  434   1HB   ASP  54          2HB       ASP  54  -5.164   9.898  11.506
  435   2HB   ASP  54          3HB       ASP  54  -3.986  10.387  10.285
  436    H    LYS  55           H        LYS  55  -3.660   6.445  11.050
  437    HA   LYS  55           HA       LYS  55  -4.450   4.509  11.891
  438   1HB   LYS  55          2HB       LYS  55  -4.020   5.468  14.734
  439   2HB   LYS  55          3HB       LYS  55  -4.123   3.817  14.114
  440   1HG   LYS  55          2HG       LYS  55  -2.084   4.830  12.574
  441   2HG   LYS  55          3HG       LYS  55  -1.856   5.781  14.026
  442   1HD   LYS  55          2HD       LYS  55  -0.878   4.040  15.108
  443   2HD   LYS  55          3HD       LYS  55  -2.148   2.889  14.618
  444   1HE   LYS  55          2HE       LYS  55  -1.236   2.726  12.390
  445   2HE   LYS  55          3HE       LYS  55  -0.022   3.955  12.712
  446   1HZ   LYS  55          1HZ       LYS  55  -0.179   1.301  13.995
  447   2HZ   LYS  55          2HZ       LYS  55   0.893   1.757  12.827
  448   3HZ   LYS  55          3HZ       LYS  55   0.973   2.444  14.323
  449    H    SER  56           H        SER  56  -6.194   6.151  10.937
  450    HA   SER  56           HA       SER  56  -8.542   6.417  12.746
  451   1HB   SER  56          2HB       SER  56  -9.611   7.611  10.998
  452   2HB   SER  56          3HB       SER  56  -7.962   8.240  11.126
  453    HG   SER  56           HG       SER  56  -8.684   7.870   8.978
  454    H    GLY  57           H        GLY  57  -7.288   4.178  10.401
  455   1HA   GLY  57          2HA       GLY  57  -8.195   1.944  10.182
  456   2HA   GLY  57          3HA       GLY  57  -9.805   2.546  10.558
  457    H    PHE  58           H        PHE  58  -8.454   4.761   8.456
  458    HA   PHE  58           HA       PHE  58  -9.383   3.408   5.949
  459   1HB   PHE  58          2HB       PHE  58 -10.374   6.149   6.840
  460   2HB   PHE  58          3HB       PHE  58 -10.903   5.206   5.476
  461    HD1  PHE  58           1HD      PHE  58 -12.366   3.206   5.754
  462    HD2  PHE  58           2HD      PHE  58 -11.226   5.680   9.100
  463    HE1  PHE  58           1HE      PHE  58 -14.163   2.183   7.130
  464    HE2  PHE  58           2HE      PHE  58 -12.990   4.633  10.478
  465    HZ   PHE  58           HZ       PHE  58 -14.473   2.888   9.495
  466    H    ILE  59           H        ILE  59  -7.773   3.723   4.439
  467    HA   ILE  59           HA       ILE  59  -6.025   6.141   4.645
  468    HB   ILE  59           HB       ILE  59  -5.922   3.823   2.735
  469   1HG1  ILE  59          2HG       ILE  59  -3.835   4.330   4.876
  470   2HG1  ILE  59          3HG       ILE  59  -5.296   3.452   5.285
  471   1HG2  ILE  59          1HG       ILE  59  -3.852   5.999   3.192
  472   2HG2  ILE  59          2HG       ILE  59  -3.698   4.632   2.074
  473   3HG2  ILE  59          3HG       ILE  59  -4.900   5.876   1.771
  474   1HD1  ILE  59          1HD1      ILE  59  -3.274   2.658   3.151
  475   2HD1  ILE  59          2HD1      ILE  59  -3.670   1.813   4.665
  476   3HD1  ILE  59          3HD1      ILE  59  -4.851   1.873   3.360
  477    H    GLU  60           H        GLU  60  -6.038   7.750   3.225
  478    HA   GLU  60           HA       GLU  60  -7.981   8.029   1.046
  479   1HB   GLU  60          2HB       GLU  60  -8.709  10.186   1.952
  480   2HB   GLU  60          3HB       GLU  60  -9.081   8.863   3.044
  481   1HG   GLU  60          2HG       GLU  60  -6.504   9.860   3.854
  482   2HG   GLU  60          3HG       GLU  60  -7.495  11.267   3.515
  483    H    GLU  61           H        GLU  61  -7.493  10.254  -0.088
  484    HA   GLU  61           HA       GLU  61  -5.127  10.193  -1.431
  485   1HB   GLU  61          2HB       GLU  61  -7.049  12.429  -0.915
  486   2HB   GLU  61          3HB       GLU  61  -5.615  12.698  -1.900
  487   1HG   GLU  61          2HG       GLU  61  -7.292  10.290  -2.584
  488   2HG   GLU  61          3HG       GLU  61  -7.967  11.877  -2.924
  489    H    ASP  62           H        ASP  62  -5.571  12.039   1.560
  490    HA   ASP  62           HA       ASP  62  -3.218  13.593   1.628
  491   1HB   ASP  62          2HB       ASP  62  -5.213  13.728   3.144
  492   2HB   ASP  62          3HB       ASP  62  -4.693  12.233   3.925
  493    H    GLU  63           H        GLU  63  -3.694  10.199   2.427
  494    HA   GLU  63           HA       GLU  63  -0.822   9.816   3.208
  495   1HB   GLU  63          2HB       GLU  63  -3.391   8.219   3.466
  496   2HB   GLU  63          3HB       GLU  63  -1.810   7.442   3.692
  497   1HG   GLU  63          2HG       GLU  63  -1.244   8.747   5.521
  498   2HG   GLU  63          3HG       GLU  63  -2.379  10.034   5.151
  499    H    LEU  64           H        LEU  64  -3.310   8.781   0.902
  500    HA   LEU  64           HA       LEU  64  -1.983   6.883  -0.596
  501   1HB   LEU  64          2HB       LEU  64  -4.397   8.292  -0.662
  502   2HB   LEU  64          3HB       LEU  64  -3.607   8.819  -2.132
  503    HG   LEU  64           HG       LEU  64  -3.232   6.304  -2.541
  504   1HD1  LEU  64          1HD1      LEU  64  -5.448   6.143  -0.472
  505   2HD1  LEU  64          2HD1      LEU  64  -4.878   4.820  -1.510
  506   3HD1  LEU  64          3HD1      LEU  64  -3.791   5.503  -0.290
  507   1HD2  LEU  64          1HD2      LEU  64  -4.826   7.526  -3.877
  508   2HD2  LEU  64          2HD2      LEU  64  -5.654   6.073  -3.314
  509   3HD2  LEU  64          3HD2      LEU  64  -5.977   7.636  -2.533
  510    H    GLY  65           H        GLY  65  -1.740  10.427  -1.001
  511   1HA   GLY  65          2HA       GLY  65  -0.137  10.565  -3.289
  512   2HA   GLY  65          3HA       GLY  65  -0.022  11.693  -1.939
  513    H    PHE  66           H        PHE  66   0.965   9.347  -0.133
  514    HA   PHE  66           HA       PHE  66   3.583   8.704  -1.333
  515   1HB   PHE  66          2HB       PHE  66   4.898   9.804   0.418
  516   2HB   PHE  66          3HB       PHE  66   4.039  10.924  -0.604
  517    HD1  PHE  66           1HD      PHE  66   2.089  12.224   0.237
  518    HD2  PHE  66           2HD      PHE  66   4.400   9.663   2.817
  519    HE1  PHE  66           1HE      PHE  66   1.112  13.339   2.223
  520    HE2  PHE  66           2HE      PHE  66   3.449  10.815   4.808
  521    HZ   PHE  66           HZ       PHE  66   1.791  12.651   4.503
  522    H    ILE  67           H        ILE  67   1.295   7.153  -0.322
  523    HA   ILE  67           HA       ILE  67   1.540   5.890   2.104
  524    HB   ILE  67           HB       ILE  67  -0.317   5.662   0.749
  525   1HG1  ILE  67          2HG       ILE  67   0.473   3.714   2.177
  526   2HG1  ILE  67          3HG       ILE  67  -0.908   3.483   1.111
  527   1HG2  ILE  67          1HG       ILE  67   1.367   4.282  -1.359
  528   2HG2  ILE  67          2HG       ILE  67  -0.412   4.315  -1.318
  529   3HG2  ILE  67          3HG       ILE  67   0.493   5.813  -1.504
  530   1HD1  ILE  67          1HD1      ILE  67   1.918   2.662   0.371
  531   2HD1  ILE  67          2HD1      ILE  67   0.762   1.570   1.137
  532   3HD1  ILE  67          3HD1      ILE  67   0.419   2.225  -0.467
  533    H    LEU  68           H        LEU  68   3.636   5.284  -0.659
  534    HA   LEU  68           HA       LEU  68   4.984   2.966   0.280
  535   1HB   LEU  68          2HB       LEU  68   5.892   5.335  -1.365
  536   2HB   LEU  68          3HB       LEU  68   6.925   3.930  -1.049
  537    HG   LEU  68           HG       LEU  68   4.263   3.830  -2.503
  538   1HD1  LEU  68          1HD1      LEU  68   7.102   3.589  -3.607
  539   2HD1  LEU  68          2HD1      LEU  68   5.572   3.723  -4.505
  540   3HD1  LEU  68          3HD1      LEU  68   6.163   5.094  -3.619
  541   1HD2  LEU  68          1HD2      LEU  68   4.672   1.670  -1.542
  542   2HD2  LEU  68          2HD2      LEU  68   5.191   1.550  -3.192
  543   3HD2  LEU  68          3HD2      LEU  68   6.416   1.743  -1.934
  544    H    LYS  69           H        LYS  69   5.238   6.263   1.467
  545    HA   LYS  69           HA       LYS  69   7.737   5.883   2.896
  546   1HB   LYS  69          2HB       LYS  69   6.290   8.045   2.028
  547   2HB   LYS  69          3HB       LYS  69   5.863   8.050   3.733
  548   1HG   LYS  69          2HG       LYS  69   8.679   8.121   2.533
  549   2HG   LYS  69          3HG       LYS  69   7.755   9.514   3.098
  550   1HD   LYS  69          2HD       LYS  69   7.721   8.439   5.406
  551   2HD   LYS  69          3HD       LYS  69   8.903   7.260   4.780
  552   1HE   LYS  69          2HE       LYS  69  10.430   9.108   4.172
  553   2HE   LYS  69          3HE       LYS  69   9.240  10.293   4.731
  554   1HZ   LYS  69          1HZ       LYS  69  10.555   8.265   6.440
  555   2HZ   LYS  69          2HZ       LYS  69  10.914   9.873   6.417
  556   3HZ   LYS  69          3HZ       LYS  69   9.446   9.363   6.954
  557    H    GLY  70           H        GLY  70   4.783   4.489   3.447
  558   1HA   GLY  70          2HA       GLY  70   5.392   4.003   6.328
  559   2HA   GLY  70          3HA       GLY  70   4.062   3.282   5.388
  560    H    PHE  71           H        PHE  71   5.338   2.257   3.197
  561    HA   PHE  71           HA       PHE  71   6.382  -0.186   4.146
  562   1HB   PHE  71          2HB       PHE  71   6.418   1.053   1.399
  563   2HB   PHE  71          3HB       PHE  71   6.978  -0.567   1.763
  564    HD1  PHE  71           1HD      PHE  71   5.170  -1.956   3.359
  565    HD2  PHE  71           2HD      PHE  71   4.256   1.051   0.426
  566    HE1  PHE  71           1HE      PHE  71   2.968  -2.968   2.980
  567    HE2  PHE  71           2HE      PHE  71   2.078  -0.019  -0.013
  568    HZ   PHE  71           HZ       PHE  71   1.396  -2.020   1.299
  569    H    SER  72           H        SER  72   8.257   2.705   2.994
  570    HA   SER  72           HA       SER  72  10.509   1.989   4.603
  571   1HB   SER  72          2HB       SER  72  10.268   0.612   2.103
  572   2HB   SER  72          3HB       SER  72  11.579   1.780   1.920
  573    HG   SER  72           HG       SER  72  11.213  -0.285   3.815
  574    HA   PRO  73           HA       PRO  73  11.595   6.097   2.861
  575   1HB   PRO  73          2HB       PRO  73  14.314   6.144   2.734
  576   2HB   PRO  73          3HB       PRO  73  13.429   6.228   4.287
  577   1HG   PRO  73          2HG       PRO  73  14.696   3.803   2.986
  578   2HG   PRO  73          3HG       PRO  73  14.829   4.348   4.690
  579   1HD   PRO  73          2HD       PRO  73  13.069   2.424   3.830
  580   2HD   PRO  73          3HD       PRO  73  12.716   3.484   5.223
  581    H    ASP  74           H        ASP  74  12.928   6.870   0.948
  582    HA   ASP  74           HA       ASP  74  13.347   6.996  -1.284
  583   1HB   ASP  74          2HB       ASP  74  13.814   4.002  -1.216
  584   2HB   ASP  74          3HB       ASP  74  14.291   5.124  -2.489
  585    H    ALA  75           H        ALA  75  10.764   5.555  -0.092
  586    HA   ALA  75           HA       ALA  75   8.838   4.800  -1.752
  587   1HB   ALA  75          1HB       ALA  75   8.954   6.991   0.378
  588   2HB   ALA  75          2HB       ALA  75   7.434   6.396  -0.266
  589   3HB   ALA  75          3HB       ALA  75   8.546   5.281   0.585
  590    H    ARG  76           H        ARG  76   9.541   8.224  -1.340
  591    HA   ARG  76           HA       ARG  76   9.194  10.131  -2.513
  592   1HB   ARG  76          2HB       ARG  76   8.608   8.802  -5.131
  593   2HB   ARG  76          3HB       ARG  76   9.545  10.250  -4.767
  594   1HG   ARG  76          2HG       ARG  76  11.235   8.523  -3.673
  595   2HG   ARG  76          3HG       ARG  76  10.340   7.345  -4.626
  596   1HD   ARG  76          2HD       ARG  76  11.989   7.812  -6.117
  597   2HD   ARG  76          3HD       ARG  76  10.831   9.059  -6.612
  598    HE   ARG  76           HE       ARG  76  12.586   9.932  -4.470
  599   1HH1  ARG  76          1HH2      ARG  76  12.586   9.577  -7.926
  600   2HH1  ARG  76          2HH2      ARG  76  13.916  10.682  -8.175
  601   1HH2  ARG  76          1HH1      ARG  76  14.299  11.311  -4.772
  602   2HH2  ARG  76          2HH1      ARG  76  14.869  11.656  -6.376
  603    H    ASP  77           H        ASP  77   7.658  11.468  -3.667
  604    HA   ASP  77           HA       ASP  77   4.920  11.070  -3.044
  605   1HB   ASP  77          2HB       ASP  77   6.101  12.958  -5.118
  606   2HB   ASP  77          3HB       ASP  77   4.638  13.169  -4.154
  607    H    LEU  78           H        LEU  78   3.555   9.749  -4.055
  608    HA   LEU  78           HA       LEU  78   4.021   8.520  -6.658
  609   1HB   LEU  78          2HB       LEU  78   1.347   8.787  -5.233
  610   2HB   LEU  78          3HB       LEU  78   1.832   7.614  -6.454
  611    HG   LEU  78           HG       LEU  78   2.650   7.704  -3.539
  612   1HD1  LEU  78          1HD1      LEU  78   1.323   5.562  -5.258
  613   2HD1  LEU  78          2HD1      LEU  78   1.621   5.482  -3.517
  614   3HD1  LEU  78          3HD1      LEU  78   0.470   6.664  -4.176
  615   1HD2  LEU  78          1HD2      LEU  78   4.685   7.071  -4.755
  616   2HD2  LEU  78          2HD2      LEU  78   3.957   5.663  -3.974
  617   3HD2  LEU  78          3HD2      LEU  78   3.763   5.892  -5.724
  618    H    SER  79           H        SER  79   3.180   9.110  -8.717
  619    HA   SER  79           HA       SER  79   2.523  11.840  -9.195
  620   1HB   SER  79          2HB       SER  79   2.086   9.290 -10.763
  621   2HB   SER  79          3HB       SER  79   1.508  10.840 -11.367
  622    HG   SER  79           HG       SER  79   3.425  10.415 -12.260
  623    H    ALA  80           H        ALA  80   0.634  12.853  -9.801
  624    HA   ALA  80           HA       ALA  80  -1.799  12.476  -8.556
  625   1HB   ALA  80          1HB       ALA  80  -1.274  13.667 -11.306
  626   2HB   ALA  80          2HB       ALA  80  -2.728  13.926 -10.314
  627   3HB   ALA  80          3HB       ALA  80  -1.155  14.509  -9.743
  628    H    LYS  81           H        LYS  81  -0.757  11.023 -11.653
  629    HA   LYS  81           HA       LYS  81  -3.329   9.752 -12.189
  630   1HB   LYS  81          2HB       LYS  81  -0.738   8.796 -13.398
  631   2HB   LYS  81          3HB       LYS  81  -2.348   8.731 -14.059
  632   1HG   LYS  81          2HG       LYS  81  -0.566  11.184 -13.783
  633   2HG   LYS  81          3HG       LYS  81  -1.001  10.330 -15.257
  634   1HD   LYS  81          2HD       LYS  81  -3.460  10.868 -14.747
  635   2HD   LYS  81          3HD       LYS  81  -2.901  11.944 -13.469
  636   1HE   LYS  81          2HE       LYS  81  -2.244  12.173 -16.437
  637   2HE   LYS  81          3HE       LYS  81  -3.453  13.125 -15.570
  638   1HZ   LYS  81          1HZ       LYS  81  -0.548  13.163 -15.015
  639   2HZ   LYS  81          2HZ       LYS  81  -1.386  14.338 -15.803
  640   3HZ   LYS  81          3HZ       LYS  81  -1.680  14.050 -14.212
  641    H    GLU  82           H        GLU  82  -0.460   8.804 -10.352
  642    HA   GLU  82           HA       GLU  82  -1.170   6.007 -10.258
  643   1HB   GLU  82          2HB       GLU  82   1.146   7.323  -9.454
  644   2HB   GLU  82          3HB       GLU  82   0.342   7.061  -7.911
  645   1HG   GLU  82          2HG       GLU  82  -0.033   4.712  -8.420
  646   2HG   GLU  82          3HG       GLU  82   0.647   4.938 -10.041
  647    H    THR  83           H        THR  83  -1.350   8.675  -7.889
  648    HA   THR  83           HA       THR  83  -2.947   7.345  -5.988
  649    HB   THR  83           HB       THR  83  -1.586   9.368  -5.653
  650    HG1  THR  83           1HG      THR  83  -4.136   9.902  -4.499
  651   1HG2  THR  83          1HG       THR  83  -4.016  10.897  -6.648
  652   2HG2  THR  83          2HG       THR  83  -2.618  11.568  -5.782
  653   3HG2  THR  83          3HG       THR  83  -2.390  10.837  -7.377
  654    H    LYS  84           H        LYS  84  -4.067   9.288  -8.791
  655    HA   LYS  84           HA       LYS  84  -6.835   9.155  -8.409
  656   1HB   LYS  84          2HB       LYS  84  -5.750  10.391 -10.220
  657   2HB   LYS  84          3HB       LYS  84  -5.240   8.882 -10.993
  658   1HG   LYS  84          2HG       LYS  84  -7.630   8.281 -11.372
  659   2HG   LYS  84          3HG       LYS  84  -8.117   9.788 -10.566
  660   1HD   LYS  84          2HD       LYS  84  -6.858  11.074 -12.336
  661   2HD   LYS  84          3HD       LYS  84  -6.442   9.539 -13.110
  662   1HE   LYS  84          2HE       LYS  84  -8.312  10.492 -14.293
  663   2HE   LYS  84          3HE       LYS  84  -8.857   9.044 -13.438
  664   1HZ   LYS  84          1HZ       LYS  84  -9.240  11.829 -12.494
  665   2HZ   LYS  84          2HZ       LYS  84 -10.408  10.889 -13.172
  666   3HZ   LYS  84          3HZ       LYS  84  -9.764  10.481 -11.715
  667    H    MET  85           H        MET  85  -4.931   6.627 -10.193
  668    HA   MET  85           HA       MET  85  -7.305   4.933 -10.354
  669   1HB   MET  85          2HB       MET  85  -5.467   4.850 -12.049
  670   2HB   MET  85          3HB       MET  85  -4.407   4.116 -10.827
  671   1HG   MET  85          2HG       MET  85  -6.045   2.254 -10.560
  672   2HG   MET  85          3HG       MET  85  -7.092   3.005 -11.764
  673   1HE   MET  85          1HE       MET  85  -7.233   0.599 -12.838
  674   2HE   MET  85          2HE       MET  85  -5.818  -0.328 -13.387
  675   3HE   MET  85          3HE       MET  85  -6.073  -0.041 -11.650
  676    H    LEU  86           H        LEU  86  -4.421   4.994  -8.259
  677    HA   LEU  86           HA       LEU  86  -4.869   2.652  -6.755
  678   1HB   LEU  86          2HB       LEU  86  -2.767   3.677  -6.640
  679   2HB   LEU  86          3HB       LEU  86  -3.456   5.260  -6.360
  680    HG   LEU  86           HG       LEU  86  -3.919   4.907  -4.149
  681   1HD1  LEU  86          1HD1      LEU  86  -4.219   2.213  -4.443
  682   2HD1  LEU  86          2HD1      LEU  86  -2.625   2.309  -3.654
  683   3HD1  LEU  86          3HD1      LEU  86  -4.027   3.077  -2.920
  684   1HD2  LEU  86          1HD2      LEU  86  -1.635   5.562  -4.784
  685   2HD2  LEU  86          2HD2      LEU  86  -1.635   4.645  -3.270
  686   3HD2  LEU  86          3HD2      LEU  86  -1.134   3.866  -4.785
  687    H    MET  87           H        MET  87  -6.184   5.973  -6.131
  688    HA   MET  87           HA       MET  87  -7.638   5.333  -3.791
  689   1HB   MET  87          2HB       MET  87  -7.289   7.631  -4.817
  690   2HB   MET  87          3HB       MET  87  -8.497   7.216  -6.026
  691   1HG   MET  87          2HG       MET  87 -10.031   6.709  -3.936
  692   2HG   MET  87          3HG       MET  87  -8.802   7.598  -3.037
  693   1HE   MET  87          1HE       MET  87 -11.758   7.648  -5.491
  694   2HE   MET  87          2HE       MET  87 -11.727   9.279  -6.199
  695   3HE   MET  87          3HE       MET  87 -10.485   8.093  -6.651
  696    H    ALA  88           H        ALA  88  -8.839   5.254  -7.169
  697    HA   ALA  88           HA       ALA  88 -11.391   4.169  -6.527
  698   1HB   ALA  88          1HB       ALA  88  -9.811   4.109  -9.139
  699   2HB   ALA  88          2HB       ALA  88 -11.560   3.831  -8.967
  700   3HB   ALA  88          3HB       ALA  88 -10.875   5.424  -8.587
  701    H    ALA  89           H        ALA  89  -8.396   2.481  -7.656
  702    HA   ALA  89           HA       ALA  89  -9.760  -0.099  -7.713
  703   1HB   ALA  89          1HB       ALA  89  -6.805   0.612  -7.969
  704   2HB   ALA  89          2HB       ALA  89  -7.562  -0.938  -8.398
  705   3HB   ALA  89          3HB       ALA  89  -7.975   0.530  -9.308
  706    H    GLY  90           H        GLY  90  -7.650   1.567  -5.343
  707   1HA   GLY  90          2HA       GLY  90  -7.125  -0.722  -3.687
  708   2HA   GLY  90          3HA       GLY  90  -7.002   0.987  -3.242
  709    H    ASP  91           H        ASP  91  -9.623   1.899  -3.538
  710    HA   ASP  91           HA       ASP  91 -11.120   0.654  -1.356
  711   1HB   ASP  91          2HB       ASP  91 -11.232   3.009  -1.615
  712   2HB   ASP  91          3HB       ASP  91 -11.782   2.856  -3.296
  713    H    LYS  92           H        LYS  92 -10.801  -1.461  -2.729
  714    HA   LYS  92           HA       LYS  92 -12.466  -2.102  -4.931
  715   1HB   LYS  92          2HB       LYS  92 -12.024  -4.337  -4.372
  716   2HB   LYS  92          3HB       LYS  92 -10.599  -3.341  -3.985
  717   1HG   LYS  92          2HG       LYS  92 -10.538  -4.143  -1.892
  718   2HG   LYS  92          3HG       LYS  92 -12.152  -3.532  -1.593
  719   1HD   LYS  92          2HD       LYS  92 -12.311  -5.837  -1.103
  720   2HD   LYS  92          3HD       LYS  92 -13.074  -5.646  -2.685
  721   1HE   LYS  92          2HE       LYS  92 -10.488  -6.116  -3.442
  722   2HE   LYS  92          3HE       LYS  92 -10.485  -6.966  -1.891
  723   1HZ   LYS  92          1HZ       LYS  92 -12.343  -7.453  -4.149
  724   2HZ   LYS  92          2HZ       LYS  92 -11.105  -8.435  -3.697
  725   3HZ   LYS  92          3HZ       LYS  92 -12.400  -8.238  -2.701
  726    H    ASP  93           H        ASP  93 -13.501  -1.263  -1.992
  727    HA   ASP  93           HA       ASP  93 -15.889  -2.971  -1.681
  728   1HB   ASP  93          2HB       ASP  93 -13.925  -2.036  -0.002
  729   2HB   ASP  93          3HB       ASP  93 -15.092  -0.745   0.181
  730    H    GLY  94           H        GLY  94 -15.019   0.215  -2.864
  731   1HA   GLY  94          2HA       GLY  94 -16.328   1.860  -3.758
  732   2HA   GLY  94          3HA       GLY  94 -17.782   0.955  -3.338
  733    H    ASP  95           H        ASP  95 -15.388   1.869  -0.915
  734    HA   ASP  95           HA       ASP  95 -17.492   3.655   0.432
  735   1HB   ASP  95          2HB       ASP  95 -14.706   2.910   1.404
  736   2HB   ASP  95          3HB       ASP  95 -15.809   3.986   2.248
  737    H    GLY  96           H        GLY  96 -14.593   3.893  -1.383
  738   1HA   GLY  96          2HA       GLY  96 -13.333   5.574  -2.181
  739   2HA   GLY  96          3HA       GLY  96 -14.182   6.788  -1.187
  740    H    LYS  97           H        LYS  97 -12.981   4.145   0.674
  741    HA   LYS  97           HA       LYS  97 -10.192   5.186   0.917
  742   1HB   LYS  97          2HB       LYS  97 -12.015   4.565   3.271
  743   2HB   LYS  97          3HB       LYS  97 -10.270   4.738   3.341
  744   1HG   LYS  97          2HG       LYS  97 -10.689   6.865   3.866
  745   2HG   LYS  97          3HG       LYS  97 -10.781   7.089   2.136
  746   1HD   LYS  97          2HD       LYS  97 -12.633   8.214   3.141
  747   2HD   LYS  97          3HD       LYS  97 -13.292   6.789   2.315
  748   1HE   LYS  97          2HE       LYS  97 -13.187   5.576   4.568
  749   2HE   LYS  97          3HE       LYS  97 -12.738   7.117   5.305
  750   1HZ   LYS  97          1HZ       LYS  97 -15.243   6.597   3.804
  751   2HZ   LYS  97          2HZ       LYS  97 -15.120   6.676   5.443
  752   3HZ   LYS  97          3HZ       LYS  97 -14.846   8.019   4.529
  753    H    ILE  98           H        ILE  98  -8.729   3.672   1.370
  754    HA   ILE  98           HA       ILE  98  -9.295   0.810   0.886
  755    HB   ILE  98           HB       ILE  98  -6.824   2.413   1.554
  756   1HG1  ILE  98          2HG       ILE  98  -7.304   0.671  -0.860
  757   2HG1  ILE  98          3HG       ILE  98  -7.948   2.316  -0.798
  758   1HG2  ILE  98          1HG       ILE  98  -6.831  -0.600   1.122
  759   2HG2  ILE  98          2HG       ILE  98  -5.396   0.430   1.248
  760   3HG2  ILE  98          3HG       ILE  98  -6.429   0.206   2.653
  761   1HD1  ILE  98          1HD1      ILE  98  -5.041   1.490  -0.735
  762   2HD1  ILE  98          2HD1      ILE  98  -5.909   2.480  -1.924
  763   3HD1  ILE  98          3HD1      ILE  98  -5.602   3.116  -0.291
  764    H    GLY  99           H        GLY  99  -9.949  -0.507   2.396
  765   1HA   GLY  99          2HA       GLY  99  -9.047  -0.115   5.247
  766   2HA   GLY  99          3HA       GLY  99 -10.435  -1.088   4.776
  767    H    VAL 100           H        VAL 100  -8.138  -1.875   6.283
  768    HA   VAL 100           HA       VAL 100  -6.169  -3.346   5.122
  769    HB   VAL 100           HB       VAL 100  -6.142  -3.017   7.399
  770   1HG1  VAL 100          1HG       VAL 100  -8.635  -4.705   7.854
  771   2HG1  VAL 100          2HG       VAL 100  -7.638  -3.908   9.079
  772   3HG1  VAL 100          3HG       VAL 100  -8.566  -2.929   7.954
  773   1HG2  VAL 100          1HG       VAL 100  -5.015  -5.055   6.842
  774   2HG2  VAL 100          2HG       VAL 100  -5.852  -5.294   8.392
  775   3HG2  VAL 100          3HG       VAL 100  -6.512  -6.010   6.944
  776    H    ASP 101           H        ASP 101  -9.293  -4.955   5.959
  777    HA   ASP 101           HA       ASP 101  -8.519  -7.502   4.947
  778   1HB   ASP 101          2HB       ASP 101 -10.317  -7.032   6.602
  779   2HB   ASP 101          3HB       ASP 101 -11.292  -6.291   5.331
  780    H    GLU 102           H        GLU 102 -10.294  -4.852   3.496
  781    HA   GLU 102           HA       GLU 102 -10.901  -5.914   0.923
  782   1HB   GLU 102          2HB       GLU 102 -10.126  -3.092   1.737
  783   2HB   GLU 102          3HB       GLU 102 -10.905  -3.503   0.250
  784   1HG   GLU 102          2HG       GLU 102 -12.967  -3.796   1.227
  785   2HG   GLU 102          3HG       GLU 102 -12.316  -4.362   2.767
  786    H    PHE 103           H        PHE 103  -8.052  -3.962   2.024
  787    HA   PHE 103           HA       PHE 103  -6.674  -4.206  -0.431
  788   1HB   PHE 103          2HB       PHE 103  -6.344  -2.790   1.911
  789   2HB   PHE 103          3HB       PHE 103  -5.064  -3.954   2.079
  790    HD1  PHE 103           1HD      PHE 103  -5.921  -2.586  -1.360
  791    HD2  PHE 103           2HD      PHE 103  -3.589  -2.058   2.244
  792    HE1  PHE 103           1HE      PHE 103  -4.517  -0.952  -2.505
  793    HE2  PHE 103           2HE      PHE 103  -2.229  -0.381   1.107
  794    HZ   PHE 103           HZ       PHE 103  -2.645   0.166  -1.314
  795    H    SER 104           H        SER 104  -6.456  -6.218   2.475
  796    HA   SER 104           HA       SER 104  -4.433  -8.043   1.804
  797   1HB   SER 104          2HB       SER 104  -5.819  -7.888   3.948
  798   2HB   SER 104          3HB       SER 104  -7.093  -8.770   3.098
  799    HG   SER 104           HG       SER 104  -5.774 -10.204   4.213
  800    H    THR 105           H        THR 105  -7.783  -7.968   0.665
  801    HA   THR 105           HA       THR 105  -7.452 -10.508  -0.835
  802    HB   THR 105           HB       THR 105  -9.933 -10.352  -1.011
  803    HG1  THR 105           1HG      THR 105  -9.819  -8.357   0.992
  804   1HG2  THR 105          1HG       THR 105  -8.795 -10.168   1.813
  805   2HG2  THR 105          2HG       THR 105 -10.342 -10.911   1.352
  806   3HG2  THR 105          3HG       THR 105  -8.805 -11.621   0.798
  807    H    LEU 106           H        LEU 106  -8.048  -7.111  -1.417
  808    HA   LEU 106           HA       LEU 106  -8.693  -7.115  -4.178
  809   1HB   LEU 106          2HB       LEU 106  -8.702  -5.180  -2.625
  810   2HB   LEU 106          3HB       LEU 106  -6.959  -5.174  -2.569
  811    HG   LEU 106           HG       LEU 106  -8.257  -3.447  -3.948
  812   1HD1  LEU 106          1HD1      LEU 106  -5.950  -4.874  -5.301
  813   2HD1  LEU 106          2HD1      LEU 106  -6.553  -3.239  -5.613
  814   3HD1  LEU 106          3HD1      LEU 106  -5.842  -3.628  -4.030
  815   1HD2  LEU 106          1HD2      LEU 106  -9.682  -5.124  -5.215
  816   2HD2  LEU 106          2HD2      LEU 106  -8.852  -3.917  -6.205
  817   3HD2  LEU 106          3HD2      LEU 106  -8.225  -5.569  -6.126
  818    H    VAL 107           H        VAL 107  -5.529  -7.443  -2.613
  819    HA   VAL 107           HA       VAL 107  -4.103  -7.527  -5.165
  820    HB   VAL 107           HB       VAL 107  -2.187  -8.134  -3.824
  821   1HG1  VAL 107          1HG       VAL 107  -3.660  -5.894  -2.359
  822   2HG1  VAL 107          2HG       VAL 107  -2.002  -5.900  -2.957
  823   3HG1  VAL 107          3HG       VAL 107  -3.315  -5.734  -4.083
  824   1HG2  VAL 107          1HG       VAL 107  -3.516  -9.532  -2.101
  825   2HG2  VAL 107          2HG       VAL 107  -2.148  -8.615  -1.568
  826   3HG2  VAL 107          3HG       VAL 107  -3.783  -8.001  -1.270
  827    H    ALA 108           H        ALA 108  -5.816  -9.870  -3.390
  828    HA   ALA 108           HA       ALA 108  -4.351 -12.196  -4.311
  829   1HB   ALA 108          1HB       ALA 108  -7.153 -12.039  -3.209
  830   2HB   ALA 108          2HB       ALA 108  -6.053 -13.437  -3.224
  831   3HB   ALA 108          3HB       ALA 108  -5.673 -12.016  -2.217
  832    H    GLU 109           H        GLU 109  -6.880 -10.197  -5.650
  833    HA   GLU 109           HA       GLU 109  -7.592 -11.711  -7.952
  834   1HB   GLU 109          2HB       GLU 109  -7.111  -8.723  -7.638
  835   2HB   GLU 109          3HB       GLU 109  -7.956  -9.458  -8.979
  836   1HG   GLU 109          2HG       GLU 109  -8.950  -9.701  -6.103
  837   2HG   GLU 109          3HG       GLU 109  -9.386  -8.381  -7.176
  838    H    SER 110           H        SER 110  -4.470 -10.293  -7.092
  839    HA   SER 110           HA       SER 110  -2.671  -9.647  -8.382
  840   1HB   SER 110          2HB       SER 110  -1.439 -11.571  -8.971
  841   2HB   SER 110          3HB       SER 110  -2.405 -11.926  -7.524
  842    HG   SER 110           HG       SER 110  -2.505 -13.617  -9.078
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1   4.185   0.330  12.406
    2   2H    MET   1           H2       MET   1   3.225   0.448  13.725
    3   3H    MET   1           H3       MET   1   2.685  -0.352  12.392
    4    HA   MET   1           HA       MET   1   3.872  -1.424  14.579
    5   1HB   MET   1          2HB       MET   1   2.274  -2.505  13.016
    6   2HB   MET   1          3HB       MET   1   3.590  -2.766  11.871
    7   1HG   MET   1          2HG       MET   1   3.234  -4.797  13.208
    8   2HG   MET   1          3HG       MET   1   4.784  -4.137  13.610
    9   1HE   MET   1          1HE       MET   1   5.546  -4.558  15.965
   10   2HE   MET   1          2HE       MET   1   4.392  -5.306  17.091
   11   3HE   MET   1          3HE       MET   1   4.601  -5.975  15.457
   12    H    SER   2           H        SER   2   5.582  -3.109  12.251
   13    HA   SER   2           HA       SER   2   8.204  -1.803  12.562
   14   1HB   SER   2          2HB       SER   2   7.333  -4.348  13.980
   15   2HB   SER   2          3HB       SER   2   9.036  -4.007  13.597
   16    HG   SER   2           HG       SER   2   8.643  -3.184  15.614
   17    H    MET   3           H        MET   3   7.680  -1.781  10.250
   18    HA   MET   3           HA       MET   3   7.043  -4.174   8.775
   19   1HB   MET   3          2HB       MET   3   7.662  -1.261   8.044
   20   2HB   MET   3          3HB       MET   3   7.229  -2.464   6.827
   21   1HG   MET   3          2HG       MET   3   5.587  -1.887   9.296
   22   2HG   MET   3          3HG       MET   3   5.312  -1.099   7.734
   23   1HE   MET   3          1HE       MET   3   5.651  -3.153   5.569
   24   2HE   MET   3          2HE       MET   3   4.069  -3.914   5.439
   25   3HE   MET   3          3HE       MET   3   4.178  -2.160   5.702
   26    H    THR   4           H        THR   4   8.945  -5.268   9.498
   27    HA   THR   4           HA       THR   4  11.242  -5.596   7.769
   28    HB   THR   4           HB       THR   4  11.245  -3.437   9.867
   29    HG1  THR   4           1HG      THR   4  11.272  -3.116   7.628
   30   1HG2  THR   4          1HG       THR   4  13.727  -5.056   9.323
   31   2HG2  THR   4          2HG       THR   4  13.658  -3.435  10.074
   32   3HG2  THR   4          3HG       THR   4  12.893  -4.807  10.891
   33    H    ASP   5           H        ASP   5   9.818  -5.783  11.038
   34    HA   ASP   5           HA       ASP   5  11.481  -8.131  11.728
   35   1HB   ASP   5          2HB       ASP   5  11.061  -6.199  13.290
   36   2HB   ASP   5          3HB       ASP   5   9.346  -6.609  13.287
   37    H    LEU   6           H        LEU   6   8.050  -7.230  11.277
   38    HA   LEU   6           HA       LEU   6   7.043  -9.966  11.522
   39   1HB   LEU   6          2HB       LEU   6   5.780  -7.370  10.498
   40   2HB   LEU   6          3HB       LEU   6   4.941  -8.865  10.738
   41    HG   LEU   6           HG       LEU   6   5.912  -6.864  12.744
   42   1HD1  LEU   6          1HD1      LEU   6   3.439  -8.639  12.614
   43   2HD1  LEU   6          2HD1      LEU   6   3.693  -7.262  13.709
   44   3HD1  LEU   6          3HD1      LEU   6   3.542  -6.999  11.953
   45   1HD2  LEU   6          1HD2      LEU   6   7.011  -8.833  13.677
   46   2HD2  LEU   6          2HD2      LEU   6   5.588  -8.447  14.637
   47   3HD2  LEU   6          3HD2      LEU   6   5.528  -9.798  13.480
   48    H    LEU   7           H        LEU   7   7.381  -7.658   8.910
   49    HA   LEU   7           HA       LEU   7   7.059  -9.625   6.747
   50   1HB   LEU   7          2HB       LEU   7   7.037  -6.660   7.096
   51   2HB   LEU   7          3HB       LEU   7   7.904  -7.199   5.686
   52    HG   LEU   7           HG       LEU   7   5.553  -6.609   5.264
   53   1HD1  LEU   7          1HD1      LEU   7   6.271  -9.508   4.648
   54   2HD1  LEU   7          2HD1      LEU   7   5.069  -8.531   3.800
   55   3HD1  LEU   7          3HD1      LEU   7   6.775  -8.089   3.724
   56   1HD2  LEU   7          1HD2      LEU   7   4.522  -7.413   7.313
   57   2HD2  LEU   7          2HD2      LEU   7   3.750  -8.157   5.913
   58   3HD2  LEU   7          3HD2      LEU   7   4.885  -9.090   6.888
   59    H    ASN   8           H        ASN   8   8.655  -9.578   4.953
   60    HA   ASN   8           HA       ASN   8  11.406 -10.022   5.944
   61   1HB   ASN   8          2HB       ASN   8   9.893 -10.618   3.361
   62   2HB   ASN   8          3HB       ASN   8  11.634 -10.835   3.506
   63   1HD2  ASN   8          2HD2      ASN   8   9.725 -11.667   6.363
   64   2HD2  ASN   8          1HD2      ASN   8   9.907 -13.404   6.067
   65    H    ALA   9           H        ALA   9  12.345  -7.976   6.249
   66    HA   ALA   9           HA       ALA   9  12.001  -5.637   4.876
   67   1HB   ALA   9          1HB       ALA   9  14.633  -6.735   5.934
   68   2HB   ALA   9          2HB       ALA   9  14.238  -5.026   5.652
   69   3HB   ALA   9          3HB       ALA   9  13.372  -5.938   6.899
   70    H    GLU  10           H        GLU  10  14.024  -8.320   3.763
   71    HA   GLU  10           HA       GLU  10  15.241  -7.090   1.456
   72   1HB   GLU  10          2HB       GLU  10  14.683  -9.903   2.413
   73   2HB   GLU  10          3HB       GLU  10  15.279  -9.657   0.770
   74   1HG   GLU  10          2HG       GLU  10  17.343  -8.864   1.443
   75   2HG   GLU  10          3HG       GLU  10  16.752  -8.252   2.987
   76    H    ASP  11           H        ASP  11  12.174  -8.873   1.866
   77    HA   ASP  11           HA       ASP  11  11.405  -8.696  -0.953
   78   1HB   ASP  11          2HB       ASP  11   9.914  -9.448   1.579
   79   2HB   ASP  11          3HB       ASP  11   9.181  -9.341   0.009
   80    H    ILE  12           H        ILE  12  10.804  -6.741   2.011
   81    HA   ILE  12           HA       ILE  12   9.179  -4.706   0.779
   82    HB   ILE  12           HB       ILE  12  10.743  -4.921   3.276
   83   1HG1  ILE  12          2HG       ILE  12   8.686  -3.387   3.979
   84   2HG1  ILE  12          3HG       ILE  12   8.035  -3.846   2.407
   85   1HG2  ILE  12          1HG       ILE  12  10.263  -2.160   2.152
   86   2HG2  ILE  12          2HG       ILE  12  10.729  -2.560   3.828
   87   3HG2  ILE  12          3HG       ILE  12  11.857  -2.896   2.515
   88   1HD1  ILE  12          1HD1      ILE  12   8.976  -5.655   4.654
   89   2HD1  ILE  12          2HD1      ILE  12   7.283  -5.360   4.173
   90   3HD1  ILE  12          3HD1      ILE  12   8.378  -6.265   3.094
   91    H    LYS  13           H        LYS  13  12.756  -4.890   0.818
   92    HA   LYS  13           HA       LYS  13  13.208  -2.509  -0.625
   93   1HB   LYS  13          2HB       LYS  13  15.201  -3.324  -0.015
   94   2HB   LYS  13          3HB       LYS  13  14.662  -4.986  -0.035
   95   1HG   LYS  13          2HG       LYS  13  16.422  -4.814  -1.591
   96   2HG   LYS  13          3HG       LYS  13  14.942  -5.074  -2.490
   97   1HD   LYS  13          2HD       LYS  13  15.233  -2.240  -2.354
   98   2HD   LYS  13          3HD       LYS  13  16.872  -2.868  -2.582
   99   1HE   LYS  13          2HE       LYS  13  15.723  -4.368  -4.448
  100   2HE   LYS  13          3HE       LYS  13  14.426  -3.169  -4.352
  101   1HZ   LYS  13          1HZ       LYS  13  17.263  -2.616  -4.988
  102   2HZ   LYS  13          2HZ       LYS  13  16.004  -2.557  -6.045
  103   3HZ   LYS  13          3HZ       LYS  13  16.104  -1.459  -4.826
  104    H    LYS  14           H        LYS  14  12.287  -5.667  -1.963
  105    HA   LYS  14           HA       LYS  14  12.146  -4.668  -4.739
  106   1HB   LYS  14          2HB       LYS  14  11.454  -7.246  -3.316
  107   2HB   LYS  14          3HB       LYS  14  10.846  -6.951  -4.954
  108   1HG   LYS  14          2HG       LYS  14  12.983  -6.836  -5.911
  109   2HG   LYS  14          3HG       LYS  14  13.783  -6.505  -4.373
  110   1HD   LYS  14          2HD       LYS  14  14.264  -8.773  -5.169
  111   2HD   LYS  14          3HD       LYS  14  13.449  -8.761  -3.595
  112   1HE   LYS  14          2HE       LYS  14  11.274  -9.226  -4.755
  113   2HE   LYS  14          3HE       LYS  14  12.143  -9.322  -6.298
  114   1HZ   LYS  14          1HZ       LYS  14  12.575 -11.058  -3.932
  115   2HZ   LYS  14          2HZ       LYS  14  11.823 -11.510  -5.317
  116   3HZ   LYS  14          3HZ       LYS  14  13.432 -11.159  -5.335
  117    H    ALA  15           H        ALA  15   9.831  -4.999  -2.108
  118    HA   ALA  15           HA       ALA  15   7.485  -4.327  -3.537
  119   1HB   ALA  15          1HB       ALA  15   7.930  -3.202  -0.761
  120   2HB   ALA  15          2HB       ALA  15   6.552  -4.061  -1.455
  121   3HB   ALA  15          3HB       ALA  15   8.022  -4.945  -1.001
  122    H    VAL  16           H        VAL  16   9.597  -2.074  -1.661
  123    HA   VAL  16           HA       VAL  16   8.357   0.297  -2.647
  124    HB   VAL  16           HB       VAL  16  11.282   0.099  -1.829
  125   1HG1  VAL  16          1HG       VAL  16   9.199   2.300  -1.598
  126   2HG1  VAL  16          2HG       VAL  16  10.914   2.415  -1.153
  127   3HG1  VAL  16          3HG       VAL  16  10.468   2.256  -2.853
  128   1HG2  VAL  16          1HG       VAL  16   9.990  -0.851   0.042
  129   2HG2  VAL  16          2HG       VAL  16  10.462   0.795   0.435
  130   3HG2  VAL  16          3HG       VAL  16   8.796   0.456  -0.070
  131    H    GLY  17           H        GLY  17  10.966  -1.672  -3.996
  132   1HA   GLY  17          2HA       GLY  17  11.644  -0.063  -6.267
  133   2HA   GLY  17          3HA       GLY  17  11.943  -1.785  -6.054
  134    H    ALA  18           H        ALA  18   8.660  -1.608  -5.708
  135    HA   ALA  18           HA       ALA  18   8.115  -2.073  -8.590
  136   1HB   ALA  18          1HB       ALA  18   6.376  -2.633  -6.158
  137   2HB   ALA  18          2HB       ALA  18   6.164  -3.253  -7.804
  138   3HB   ALA  18          3HB       ALA  18   7.556  -3.778  -6.814
  139    H    PHE  19           H        PHE  19   7.084  -0.004  -5.854
  140    HA   PHE  19           HA       PHE  19   5.287   1.594  -7.642
  141   1HB   PHE  19          2HB       PHE  19   5.903   1.844  -4.686
  142   2HB   PHE  19          3HB       PHE  19   4.741   2.812  -5.598
  143    HD1  PHE  19           1HD      PHE  19   4.390   1.114  -3.024
  144    HD2  PHE  19           2HD      PHE  19   3.393   0.501  -7.157
  145    HE1  PHE  19           1HE      PHE  19   2.436  -0.245  -2.326
  146    HE2  PHE  19           2HE      PHE  19   1.442  -0.886  -6.430
  147    HZ   PHE  19           HZ       PHE  19   1.008  -1.308  -4.059
  148    H    SER  20           H        SER  20   8.629   1.629  -6.866
  149    HA   SER  20           HA       SER  20   9.143   4.386  -6.442
  150   1HB   SER  20          2HB       SER  20  11.480   3.766  -6.895
  151   2HB   SER  20          3HB       SER  20  10.709   2.605  -5.821
  152    HG   SER  20           HG       SER  20  11.072   2.359  -8.626
  153    H    ALA  21           H        ALA  21   7.423   4.652  -8.447
  154    HA   ALA  21           HA       ALA  21   8.885   5.762 -10.750
  155   1HB   ALA  21          1HB       ALA  21   6.827   3.520 -10.928
  156   2HB   ALA  21          2HB       ALA  21   7.500   4.388 -12.335
  157   3HB   ALA  21          3HB       ALA  21   8.549   3.380 -11.328
  158    H    THR  22           H        THR  22   6.664   6.286 -12.373
  159    HA   THR  22           HA       THR  22   4.713   7.724 -10.656
  160    HB   THR  22           HB       THR  22   4.747   9.545 -12.383
  161    HG1  THR  22           1HG      THR  22   6.670   9.704 -13.595
  162   1HG2  THR  22          1HG       THR  22   7.411   9.130 -10.967
  163   2HG2  THR  22          2HG       THR  22   6.705  10.676 -11.482
  164   3HG2  THR  22          3HG       THR  22   5.939   9.738 -10.183
  165    H    ASP  23           H        ASP  23   2.829   6.984 -10.970
  166    HA   ASP  23           HA       ASP  23   0.905   6.210 -11.789
  167   1HB   ASP  23          2HB       ASP  23   1.455   7.846 -13.732
  168   2HB   ASP  23          3HB       ASP  23   1.755   6.357 -14.643
  169    H    SER  24           H        SER  24   3.779   4.640 -12.219
  170    HA   SER  24           HA       SER  24   2.840   2.245 -13.634
  171   1HB   SER  24          2HB       SER  24   5.221   3.331 -13.613
  172   2HB   SER  24          3HB       SER  24   5.427   2.429 -12.100
  173    HG   SER  24           HG       SER  24   5.726   0.735 -13.261
  174    H    PHE  25           H        PHE  25   1.219   2.784 -11.418
  175    HA   PHE  25           HA       PHE  25   2.194   1.589  -9.024
  176   1HB   PHE  25          2HB       PHE  25   0.235   3.240  -9.310
  177   2HB   PHE  25          3HB       PHE  25  -0.780   1.873  -9.657
  178    HD1  PHE  25           1HD      PHE  25   1.537   3.378  -7.142
  179    HD2  PHE  25           2HD      PHE  25  -1.604   0.516  -7.831
  180    HE1  PHE  25           1HE      PHE  25   1.333   3.013  -4.689
  181    HE2  PHE  25           2HE      PHE  25  -1.797   0.162  -5.362
  182    HZ   PHE  25           HZ       PHE  25  -0.342   1.405  -3.807
  183    H    ASP  26           H        ASP  26   2.113  -0.551  -8.335
  184    HA   ASP  26           HA       ASP  26   0.246  -2.372  -9.735
  185   1HB   ASP  26          2HB       ASP  26   2.793  -2.101 -10.650
  186   2HB   ASP  26          3HB       ASP  26   3.053  -3.379  -9.473
  187    H    HIS  27           H        HIS  27  -0.886  -2.159  -7.756
  188    HA   HIS  27           HA       HIS  27  -0.069  -2.851  -5.203
  189   1HB   HIS  27          2HB       HIS  27  -2.491  -3.494  -4.803
  190   2HB   HIS  27          3HB       HIS  27  -2.194  -1.895  -5.411
  191    HD1  HIS  27           HD1      HIS  27  -3.135  -1.316  -7.889
  192    HD2  HIS  27           HD2      HIS  27  -3.884  -5.188  -6.409
  193    HE1  HIS  27           HE1      HIS  27  -4.797  -2.405  -9.481
  194    H    LYS  28           H        LYS  28  -1.501  -5.143  -7.517
  195    HA   LYS  28           HA       LYS  28  -1.064  -7.567  -6.099
  196   1HB   LYS  28          2HB       LYS  28  -0.788  -8.530  -8.496
  197   2HB   LYS  28          3HB       LYS  28  -2.326  -7.931  -7.917
  198   1HG   LYS  28          2HG       LYS  28  -2.447  -6.271  -9.407
  199   2HG   LYS  28          3HG       LYS  28  -0.743  -5.873  -9.334
  200   1HD   LYS  28          2HD       LYS  28  -1.545  -8.429 -10.718
  201   2HD   LYS  28          3HD       LYS  28  -1.835  -6.901 -11.534
  202   1HE   LYS  28          2HE       LYS  28   0.901  -7.176 -10.423
  203   2HE   LYS  28          3HE       LYS  28   0.490  -8.445 -11.586
  204   1HZ   LYS  28          1HZ       LYS  28   0.459  -5.528 -11.971
  205   2HZ   LYS  28          2HZ       LYS  28   1.420  -6.546 -12.752
  206   3HZ   LYS  28          3HZ       LYS  28  -0.207  -6.549 -13.100
  207    H    LYS  29           H        LYS  29   1.153  -6.084  -8.520
  208    HA   LYS  29           HA       LYS  29   3.114  -8.156  -8.288
  209   1HB   LYS  29          2HB       LYS  29   2.715  -5.796  -9.809
  210   2HB   LYS  29          3HB       LYS  29   4.272  -5.567  -9.024
  211   1HG   LYS  29          2HG       LYS  29   5.016  -7.758  -9.959
  212   2HG   LYS  29          3HG       LYS  29   3.427  -7.961 -10.719
  213   1HD   LYS  29          2HD       LYS  29   3.749  -5.910 -12.011
  214   2HD   LYS  29          3HD       LYS  29   5.322  -5.616 -11.271
  215   1HE   LYS  29          2HE       LYS  29   4.591  -8.118 -12.838
  216   2HE   LYS  29          3HE       LYS  29   5.215  -6.653 -13.616
  217   1HZ   LYS  29          1HZ       LYS  29   6.642  -8.183 -11.522
  218   2HZ   LYS  29          2HZ       LYS  29   7.001  -8.210 -13.132
  219   3HZ   LYS  29          3HZ       LYS  29   7.200  -6.826 -12.268
  220    H    PHE  30           H        PHE  30   2.881  -4.961  -6.725
  221    HA   PHE  30           HA       PHE  30   5.127  -5.068  -5.023
  222   1HB   PHE  30          2HB       PHE  30   3.656  -3.116  -5.386
  223   2HB   PHE  30          3HB       PHE  30   2.365  -3.895  -4.497
  224    HD1  PHE  30           1HD      PHE  30   5.226  -1.786  -4.285
  225    HD2  PHE  30           2HD      PHE  30   2.809  -4.489  -1.960
  226    HE1  PHE  30           1HE      PHE  30   6.080  -0.762  -2.200
  227    HE2  PHE  30           2HE      PHE  30   3.699  -3.502   0.103
  228    HZ   PHE  30           HZ       PHE  30   5.347  -1.637  -0.005
  229    H    PHE  31           H        PHE  31   1.748  -6.042  -4.125
  230    HA   PHE  31           HA       PHE  31   2.452  -7.157  -1.617
  231   1HB   PHE  31          2HB       PHE  31   0.068  -7.240  -3.370
  232   2HB   PHE  31          3HB       PHE  31   0.180  -8.430  -2.093
  233    HD1  PHE  31           1HD      PHE  31   0.525  -4.701  -2.550
  234    HD2  PHE  31           2HD      PHE  31  -0.759  -7.942  -0.032
  235    HE1  PHE  31           1HE      PHE  31  -0.266  -3.067  -0.851
  236    HE2  PHE  31           2HE      PHE  31  -1.589  -6.317   1.644
  237    HZ