NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
11479 1rjv 6049 cing 1-original 1 DYANA/DIANA distance NOE simple



#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


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