*HEADER    TRANSCRIPTION                           22-FEB-08   2K17              
*TITLE     SOLUTION STRUCTURE OF THE TAF3 PHD DOMAIN IN COMPLEX WITH A           
*TITLE    2 H3K4ME3 PEPTIDE                                                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: H3K4ME3 PEPTIDE;                                           
*COMPND   3 CHAIN: P;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MOL_ID: 2;                                                           
*COMPND   6 MOLECULE: TRANSCRIPTION INITIATION FACTOR TFIID SUBUNIT 3;           
*COMPND   7 CHAIN: A;                                                            
*COMPND   8 FRAGMENT: PLANTHOMEODOMAIN FINGER;                                   
*COMPND   9 SYNONYM: TBP-ASSOCIATED FACTOR 3, TRANSCRIPTION INITIATION           
*COMPND  10 FACTOR TFIID 140 KDA SUBUNIT, 140 KDA TATA BOX-BINDING               
*COMPND  11 PROTEIN-ASSOCIATED FACTOR, TAF140, TAFII140;                         
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 MOL_ID: 2;                                                           
*SOURCE   4 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   5 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   6 GENE: TAF3;                                                          
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID                               
*KEYWDS    PROTEIN, ALTERNATIVE SPLICING, METAL-BINDING, NUCLEUS,                
*KEYWDS   2 PHOSPHOPROTEIN, TRANSCRIPTION, TRANSCRIPTION REGULATION,             
*KEYWDS   3 ZINC, ZINC-FINGER                                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.VAN INGEN, F.M.A.VAN SCHAIK, H.WIENK, M.TIMMERS, R.BOELENS          
*REVDAT   1   15-JUL-08 2K17    0                                                


assign (resid 875 and name  HB+ ) (resid 893 and name  HE1 ) 3.68 3.68 0.00 
  peak 1044
assign (resid 861 and name  HB+ ) (resid 862 and name   HN ) 3.04 3.04 0.00 
  peak 341
assign (resid 859 and name   HN ) (resid 867 and name HG2+ ) 4.66 4.66 0.00 
  peak 630
assign (resid 863 and name   HN ) (resid 865 and name   HN ) 3.79 3.79 0.00 
  peak 64
assign (resid 875 and name  HG+ ) (resid 876 and name  HD2 ) 4.08 4.08 0.00 
  peak 1917
assign (resid 861 and name  HB+ ) (resid 863 and name   HN ) 3.96 3.96 0.00 
  peak 1337
assign (resid 897 and name   HB ) (resid 898 and name   HN ) 4.53 4.53 0.00 
  peak 74
assign (resid 875 and name  HG+ ) (resid 876 and name  HD1 ) 4.40 4.40 0.00 
  peak 2122
assign (resid 861 and name  HB+ ) (resid 865 and name   HN ) 3.95 3.95 0.00 
  peak 34
assign (resid 918 and name   HN ) (resid 919 and name   HN ) 3.49 3.49 0.00 
  peak 83
assign (resid 875 and name  HG+ ) (resid 893 and name  HE1 ) 5.34 5.34 0.00 
  peak 1386
assign (resid 917 and name   HN ) (resid 918 and name   HN ) 3.29 3.29 0.00 
  peak 85
assign (resid 876 and name   HA ) (resid 877 and name  HB+ ) 4.77 4.77 0.00 
  peak 1498
assign (resid 899 and name   HN ) (resid 899 and name HG11 ) 4.07 4.07 0.00 
  peak 88
assign (resid 876 and name  HB+ ) (resid 877 and name   HN ) 3.32 3.32 0.00 
  peak 479
assign (resid 897 and name   HN ) (resid 899 and name   HB ) 4.85 4.85 0.00 
  peak 92
assign (resid 877 and name   HN ) (resid 877 and name  HB+ ) 3.05 3.05 0.00 
  peak 372
assign (resid 914 and name   HA ) (resid 917 and name   HN ) 3.90 3.90 0.00 
  peak 94
assign (resid 877 and name  HB+ ) (resid 879 and name   HN ) 3.84 3.84 0.00 
  peak 1201
assign (resid 915 and name   HA ) (resid 917 and name   HN ) 4.52 4.52 0.00 
  peak 95
assign (resid 877 and name  HB+ ) (resid 882 and name  HE+ ) 3.12 3.12 0.00 
  peak 1858
assign (resid 918 and name   HN ) (resid 918 and name HD1+ ) 4.05 4.05 0.00 
  peak 661
assign (resid 920 and name   HN ) (resid 920 and name  HB2 ) 4.09 4.09 0.00 
  peak 665
assign (resid 921 and name   HN ) (resid 921 and name  HB2 ) 4.00 4.00 0.00 
  peak 669
assign (resid 872 and name  HA1 ) (resid 874 and name   HN ) 4.58 4.58 0.00 
  peak 683
assign (resid 896 and name   HN ) (resid 898 and name   HN ) 4.18 4.18 0.00 
  peak 687
assign (resid 862 and name  HB2 ) (resid 863 and name   HN ) 4.27 4.27 0.00 
  peak 554
assign (resid 911 and name  HB2 ) (resid 914 and name   HN ) 4.49 4.49 0.00 
  peak 690
assign (resid 871 and name  HG2 ) (resid 892 and name  HE+ ) 4.44 4.44 0.00 
  peak 557
assign (resid 911 and name  HB1 ) (resid 913 and name   HN ) 4.68 4.68 0.00 
  peak 691
assign (resid 883 and name HD1+ ) (resid 903 and name  HG2 ) 4.12 4.12 0.00 
  peak 209
assign (resid 866 and name   HN ) (resid 866 and name  HB2 ) 3.51 3.51 0.00 
  peak 558
assign (resid 855 and name  HB2 ) (resid 856 and name   HN ) 4.70 4.70 0.00 
  peak 693
assign (resid 883 and name HD1+ ) (resid 899 and name HG11 ) 4.15 4.15 0.00 
  peak 210
assign (resid 860 and name   HN ) (resid 860 and name  HG2 ) 3.98 3.98 0.00 
  peak 559
assign (resid 889 and name  HB1 ) (resid 890 and name   HN ) 4.79 4.79 0.00 
  peak 697
assign (resid 883 and name HD1+ ) (resid 884 and name   HN ) 4.33 4.33 0.00 
  peak 212
assign (resid 882 and name  HE+ ) (resid 892 and name   HN ) 4.27 4.27 0.00 
  peak 561
assign (resid 882 and name  HG1 ) (resid 882 and name  HE+ ) 4.43 4.43 0.00 
  peak 5
assign (resid 859 and name   HN ) (resid 859 and name HD1+ ) 4.30 4.30 0.00 
  peak 220
assign (resid 867 and name   HN ) (resid 867 and name HG12 ) 3.83 3.83 0.00 
  peak 562
assign (resid 859 and name   HA ) (resid 859 and name HD1+ ) 4.34 4.34 0.00 
  peak 221
assign (resid 867 and name   HN ) (resid 867 and name HG2+ ) 4.06 4.06 0.00 
  peak 631
assign (resid   9 and name   HN ) (resid   9 and name  HG+ ) 4.13 4.13 0.00 
  peak 563
assign (resid 867 and name   HN ) (resid 867 and name HD1+ ) 4.73 4.73 0.00 
  peak 223
assign (resid 867 and name HG2+ ) (resid 877 and name   HN ) 4.05 4.05 0.00 
  peak 632
assign (resid 868 and name  HE3 ) (resid 882 and name  HE+ ) 5.50 5.50 0.00 
  peak 567
assign (resid 861 and name  HB1 ) (resid 867 and name HD1+ ) 4.23 4.23 0.00 
  peak 225
assign (resid 861 and name  HB+ ) (resid 867 and name HG2+ ) 4.77 4.77 0.00 
  peak 1557
assign (resid   4 and name  HG1 ) (resid 891 and name  HZ3 ) 4.43 4.43 0.00 
  peak 633
assign (resid 882 and name  HE+ ) (resid 893 and name  HD2 ) 4.00 4.00 0.00 
  peak 568
assign (resid 865 and name  HB2 ) (resid 867 and name HD1+ ) 4.26 4.26 0.00 
  peak 226
assign (resid 861 and name  HB+ ) (resid 867 and name HG12 ) 3.45 3.45 0.00 
  peak 2190
assign (resid 859 and name HG2+ ) (resid 860 and name   HN ) 3.79 3.79 0.00 
  peak 638
assign (resid 882 and name  HE+ ) (resid 893 and name  HE1 ) 4.61 4.61 0.00 
  peak 569
assign (resid 883 and name HG2+ ) (resid 884 and name   HN ) 4.14 4.14 0.00 
  peak 229
assign (resid 861 and name  HB+ ) (resid 867 and name HG11 ) 4.48 4.48 0.00 
  peak 1550
assign (resid 858 and name   HN ) (resid 859 and name HG2+ ) 4.54 4.54 0.00 
  peak 639
assign (resid 883 and name HG2+ ) (resid 909 and name  HZ2 ) 4.39 4.39 0.00 
  peak 230
assign (resid 861 and name  HB+ ) (resid 867 and name HD1+ ) 3.47 3.47 0.00 
  peak 1959
assign (resid 857 and name  HD+ ) (resid 859 and name HG2+ ) 5.50 5.50 0.00 
  peak 640
assign (resid 862 and name  HB+ ) (resid 863 and name   HN ) 3.72 3.72 0.00 
  peak 554
assign (resid 897 and name   HN ) (resid 897 and name HG2+ ) 3.06 3.06 0.00 
  peak 646
assign (resid 862 and name  HB+ ) (resid 864 and name   HN ) 5.34 5.34 0.00 
  peak 551
assign (resid 897 and name HG2+ ) (resid 898 and name   HN ) 3.72 3.72 0.00 
  peak 647
assign (resid 916 and name  HB1 ) (resid 917 and name   HN ) 4.06 4.06 0.00 
  peak 99
assign (resid 878 and name   HN ) (resid 879 and name  HA+ ) 4.58 4.58 0.00 
  peak 235
assign (resid 863 and name   HN ) (resid 864 and name  HA+ ) 4.75 4.75 0.00 
  peak 780
assign (resid 896 and name   HN ) (resid 897 and name HG2+ ) 3.75 3.75 0.00 
  peak 648
assign (resid 854 and name   HA ) (resid 855 and name   HN ) 3.14 3.14 0.00 
  peak 101
assign (resid 878 and name  HB+ ) (resid 879 and name   HN ) 4.45 4.45 0.00 
  peak 360
assign (resid 863 and name  HB2 ) (resid 865 and name HD2+ ) 3.73 3.73 0.00 
  peak 354
assign (resid 893 and name   HN ) (resid 897 and name HG2+ ) 5.42 5.42 0.00 
  peak 650
assign (resid 872 and name   HN ) (resid 874 and name   HN ) 4.26 4.26 0.00 
  peak 109
assign (resid 880 and name   HN ) (resid 880 and name  HB+ ) 3.40 3.40 0.00 
  peak 516
assign (resid 863 and name  HB1 ) (resid 865 and name HD2+ ) 4.50 4.50 0.00 
  peak 570
assign (resid 871 and name  HD1 ) (resid 872 and name   HN ) 4.35 4.35 0.00 
  peak 110
assign (resid 880 and name   HN ) (resid 881 and name  HD+ ) 4.88 4.88 0.00 
  peak 322
assign (resid 865 and name   HN ) (resid 865 and name HD2+ ) 4.12 4.12 0.00 
  peak 31
assign (resid 875 and name   HN ) (resid 876 and name  HD2 ) 4.82 4.82 0.00 
  peak 116
assign (resid 880 and name   HA ) (resid 881 and name  HD+ ) 2.91 2.91 0.00 
  peak 1842
assign (resid 870 and name  HB1 ) (resid 875 and name   HN ) 4.03 4.03 0.00 
  peak 117
assign (resid 880 and name  HB+ ) (resid 881 and name  HD+ ) 3.14 3.14 0.00 
  peak 1943
assign (resid 875 and name   HN ) (resid 875 and name  HD+ ) 4.50 4.50 0.00 
  peak 118
assign (resid 881 and name  HG+ ) (resid 894 and name  HE3 ) 4.48 4.48 0.00 
  peak 2106
assign (resid   4 and name HM++ ) (resid 891 and name  HE1 ) 3.93 3.93 0.00 
  peak 122
assign (resid 881 and name  HG+ ) (resid 894 and name  HZ3 ) 3.80 3.80 0.00 
  peak 586
assign (resid 860 and name  HD+ ) (resid 864 and name   HN ) 5.26 5.26 0.00 
  peak 129
assign (resid 888 and name   HN ) (resid 888 and name  HB+ ) 3.42 3.42 0.00 
  peak 399
assign (resid 864 and name   HN ) (resid 865 and name  HB2 ) 5.50 5.50 0.00 
  peak 129
assign (resid 888 and name  HB+ ) (resid 889 and name   HN ) 3.78 3.78 0.00 
  peak 778
assign (resid 917 and name  HB1 ) (resid 918 and name   HN ) 4.30 4.30 0.00 
  peak 32
assign (resid 920 and name  HB2 ) (resid 920 and name  HE+ ) 4.94 4.94 0.00 
  peak 34
assign (resid 913 and name   HN ) (resid 913 and name  HB2 ) 3.81 3.81 0.00 
  peak 37
assign (resid 920 and name   HN ) (resid 920 and name  HB1 ) 4.09 4.09 0.00 
  peak 39
assign (resid 917 and name  HB2 ) (resid 918 and name   HN ) 4.30 4.30 0.00 
  peak 43
assign (resid 854 and name  HB+ ) (resid 855 and name   HN ) 4.00 4.00 0.00 
  peak 572
assign (resid   1 and name   HA ) (resid 909 and name  HB1 ) 4.38 4.38 0.00 
  peak 57
assign (resid 854 and name  HB+ ) (resid 856 and name   HN ) 4.75 4.75 0.00 
  peak 573
assign (resid 910 and name  HB1 ) (resid 914 and name  HB1 ) 4.32 4.32 0.00 
  peak 73
assign (resid 883 and name HG2+ ) (resid 894 and name   HA ) 4.31 4.31 0.00 
  peak 231
assign (resid 862 and name   HN ) (resid 862 and name  HB1 ) 3.60 3.60 0.00 
  peak 574
assign (resid 893 and name  HB1 ) (resid 896 and name   HN ) 3.78 3.78 0.00 
  peak 1
assign (resid 885 and name  HB2 ) (resid 911 and name  HB1 ) 4.37 4.37 0.00 
  peak 77
assign (resid 883 and name HG2+ ) (resid 909 and name  HE3 ) 4.30 4.30 0.00 
  peak 234
assign (resid   7 and name   HN ) (resid   7 and name  HB+ ) 3.40 3.40 0.00 
  peak 577
assign (resid 881 and name  HB2 ) (resid 894 and name  HE1 ) 4.54 4.54 0.00 
  peak 3
assign (resid 914 and name   HA ) (resid 917 and name  HD+ ) 4.01 4.01 0.00 
  peak 79
assign (resid 882 and name   HA ) (resid 883 and name HG2+ ) 4.16 4.16 0.00 
  peak 236
assign (resid 894 and name  HH2 ) (resid 902 and name  HB+ ) 3.39 3.39 0.00 
  peak 581
assign (resid 883 and name HG2+ ) (resid 894 and name  HE1 ) 4.21 4.21 0.00 
  peak 4
assign (resid 906 and name   HN ) (resid 906 and name  HB2 ) 4.06 4.06 0.00 
  peak 86
assign (resid 915 and name  HB+ ) (resid 918 and name HD1+ ) 4.61 4.61 0.00 
  peak 243
assign (resid 894 and name  HZ2 ) (resid 902 and name  HB+ ) 3.53 3.53 0.00 
  peak 582
assign (resid 868 and name  HB1 ) (resid 869 and name   HN ) 4.23 4.23 0.00 
  peak 5
assign (resid 857 and name   HA ) (resid 869 and name HD1+ ) 5.14 5.14 0.00 
  peak 245
assign (resid 869 and name HG2+ ) (resid 875 and name   HN ) 3.76 3.76 0.00 
  peak 653
assign (resid 899 and name   HB ) (resid 900 and name   HN ) 4.32 4.32 0.00 
  peak 583
assign (resid 869 and name   HN ) (resid 876 and name   HA ) 4.83 4.83 0.00 
  peak 7
assign (resid 869 and name HD1+ ) (resid 876 and name  HD1 ) 4.52 4.52 0.00 
  peak 247
assign (resid 869 and name HD1+ ) (resid 877 and name   HN ) 4.01 4.01 0.00 
  peak 654
assign (resid 883 and name HG11 ) (resid 894 and name  HE1 ) 4.93 4.93 0.00 
  peak 584
assign (resid 868 and name   HA ) (resid 869 and name   HN ) 3.21 3.21 0.00 
  peak 8
assign (resid 859 and name HG2+ ) (resid 869 and name HD1+ ) 4.60 4.60 0.00 
  peak 250
assign (resid 869 and name HG2+ ) (resid 870 and name   HN ) 3.29 3.29 0.00 
  peak 655
assign (resid 918 and name   HN ) (resid 918 and name HG12 ) 3.55 3.55 0.00 
  peak 585
assign (resid 915 and name   HN ) (resid 916 and name   HN ) 3.43 3.43 0.00 
  peak 12
assign (resid 859 and name HD1+ ) (resid 869 and name HD1+ ) 4.78 4.78 0.00 
  peak 250
assign (resid 869 and name HG2+ ) (resid 873 and name   HN ) 5.45 5.45 0.00 
  peak 656
assign (resid   4 and name HM++ ) (resid 868 and name   HN ) 4.27 4.27 0.00 
  peak 588
assign (resid 900 and name   HN ) (resid 901 and name   HN ) 3.06 3.06 0.00 
  peak 17
assign (resid 899 and name HD1+ ) (resid 909 and name  HE1 ) 3.70 3.70 0.00 
  peak 251
assign (resid 857 and name  HD+ ) (resid 869 and name HG2+ ) 3.37 3.37 0.00 
  peak 658
assign (resid 901 and name   HN ) (resid 902 and name   HN ) 4.58 4.58 0.00 
  peak 18
assign (resid 899 and name HD1+ ) (resid 900 and name   HN ) 4.30 4.30 0.00 
  peak 252
assign (resid 857 and name  HE+ ) (resid 869 and name HG2+ ) 3.82 3.82 0.00 
  peak 659
assign (resid 910 and name  HD+ ) (resid 918 and name HD1+ ) 5.34 5.34 0.00 
  peak 661
assign (resid 858 and name HG1+ ) (resid 868 and name  HZ2 ) 4.72 4.72 0.00 
  peak 663
assign (resid 862 and name   HA ) (resid 864 and name   HN ) 4.40 4.40 0.00 
  peak 131
assign (resid 888 and name  HB+ ) (resid 890 and name   HN ) 4.49 4.49 0.00 
  peak 340
assign (resid 858 and name   HN ) (resid 858 and name HG1+ ) 4.03 4.03 0.00 
  peak 664
assign (resid 857 and name  HD+ ) (resid 858 and name   HN ) 4.80 4.80 0.00 
  peak 137
assign (resid 889 and name   HN ) (resid 889 and name  HB+ ) 3.53 3.53 0.00 
  peak 1350
assign (resid 858 and name HG1+ ) (resid 866 and name HE22 ) 4.71 4.71 0.00 
  peak 665
assign (resid 856 and name   HA ) (resid 858 and name   HN ) 4.62 4.62 0.00 
  peak 139
assign (resid 889 and name  HB+ ) (resid 890 and name   HN ) 4.06 4.06 0.00 
  peak 697
assign (resid 857 and name  HB2 ) (resid 858 and name   HN ) 4.30 4.30 0.00 
  peak 142
assign (resid 890 and name   HN ) (resid 890 and name  HB+ ) 3.17 3.17 0.00 
  peak 367
assign (resid 856 and name   HN ) (resid 857 and name   HN ) 4.45 4.45 0.00 
  peak 147
assign (resid 890 and name  HB+ ) (resid 891 and name   HN ) 3.43 3.43 0.00 
  peak 428
assign (resid 857 and name   HN ) (resid 858 and name   HN ) 3.43 3.43 0.00 
  peak 148
assign (resid 892 and name  HE+ ) (resid 913 and name  HB+ ) 5.08 5.08 0.00 
  peak 2025
assign (resid 886 and name   HN ) (resid 909 and name   HN ) 4.77 4.77 0.00 
  peak 161
assign (resid 916 and name  HB+ ) (resid 916 and name HD2+ ) 3.17 3.17 0.00 
  peak 406
assign (resid 895 and name   HA ) (resid 898 and name  HA+ ) 4.84 4.84 0.00 
  peak 1410
assign (resid 878 and name   HN ) (resid 880 and name   HN ) 3.68 3.68 0.00 
  peak 163
assign (resid 916 and name  HB+ ) (resid 917 and name   HN ) 3.55 3.55 0.00 
  peak 99
assign (resid 897 and name   HN ) (resid 898 and name  HA+ ) 5.01 5.01 0.00 
  peak 294
assign (resid 893 and name   HN ) (resid 896 and name   HN ) 4.75 4.75 0.00 
  peak 167
assign (resid 917 and name  HE+ ) (resid 918 and name HG1+ ) 4.00 4.00 0.00 
  peak 1861
assign (resid 897 and name HG2+ ) (resid 898 and name  HA+ ) 4.51 4.51 0.00 
  peak 1866
assign (resid 896 and name   HN ) (resid 897 and name   HN ) 3.20 3.20 0.00 
  peak 168
assign (resid 918 and name   HN ) (resid 918 and name HG1+ ) 2.97 2.97 0.00 
  peak 585
assign (resid 898 and name  HA+ ) (resid 899 and name   HA ) 4.43 4.43 0.00 
  peak 853
assign (resid 918 and name   HA ) (resid 918 and name HG1+ ) 3.38 3.38 0.00 
  peak 2418
assign (resid 918 and name HG2+ ) (resid 918 and name HG1+ ) 3.23 3.23 0.00 
  peak 1791
assign (resid 918 and name HG1+ ) (resid 919 and name   HN ) 4.28 4.28 0.00 
  peak 579
assign (resid 875 and name   HA ) (resid 876 and name  HG+ ) 4.11 4.11 0.00 
  peak 99
assign (resid 919 and name   HN ) (resid 919 and name  HB+ ) 3.30 3.30 0.00 
  peak 244
assign (resid 859 and name HG11 ) (resid 867 and name   HB ) 4.13 4.13 0.00 
  peak 109
assign (resid 919 and name   HN ) (resid 920 and name  HB+ ) 4.80 4.80 0.00 
  peak 31
assign (resid 897 and name   HN ) (resid 897 and name HG1+ ) 4.01 4.01 0.00 
  peak 115
assign (resid 919 and name   HN ) (resid 920 and name  HG+ ) 4.30 4.30 0.00 
  peak 1320
assign (resid 896 and name   HN ) (resid 897 and name HG1+ ) 4.65 4.65 0.00 
  peak 116
assign (resid 897 and name HG1+ ) (resid 909 and name  HZ2 ) 3.40 3.40 0.00 
  peak 117
assign (resid 883 and name HG11 ) (resid 884 and name   HN ) 3.82 3.82 0.00 
  peak 589
assign (resid 858 and name   HN ) (resid 858 and name HG2+ ) 4.03 4.03 0.00 
  peak 130
assign (resid 856 and name  HB+ ) (resid 858 and name   HN ) 3.92 3.92 0.00 
  peak 590
assign (resid 858 and name HG1+ ) (resid 859 and name   HN ) 4.19 4.19 0.00 
  peak 131
assign (resid 899 and name HD1+ ) (resid 903 and name  HD1 ) 4.09 4.09 0.00 
  peak 255
assign (resid   4 and name HM++ ) (resid 891 and name  HH2 ) 4.64 4.64 0.00 
  peak 591
assign (resid 856 and name  HB+ ) (resid 857 and name  HD+ ) 5.13 5.13 0.00 
  peak 135
assign (resid 899 and name HD1+ ) (resid 903 and name  HG1 ) 4.25 4.25 0.00 
  peak 256
assign (resid   4 and name HM++ ) (resid 891 and name  HZ3 ) 4.49 4.49 0.00 
  peak 592
assign (resid 912 and name   HA ) (resid 915 and name  HB+ ) 3.49 3.49 0.00 
  peak 139
assign (resid 897 and name HG2+ ) (resid 899 and name HD1+ ) 3.28 3.28 0.00 
  peak 257
assign (resid   4 and name HM++ ) (resid 892 and name   HN ) 5.50 5.50 0.00 
  peak 593
assign (resid 897 and name HG2+ ) (resid 899 and name   HB ) 3.89 3.89 0.00 
  peak 142
assign (resid 899 and name   HN ) (resid 899 and name HD1+ ) 4.15 4.15 0.00 
  peak 260
assign (resid 859 and name   HN ) (resid 859 and name HG12 ) 3.69 3.69 0.00 
  peak 594
assign (resid 855 and name   HA ) (resid 855 and name  HG+ ) 3.95 3.95 0.00 
  peak 270
assign (resid 858 and name HG2+ ) (resid 859 and name   HN ) 4.19 4.19 0.00 
  peak 666
assign (resid 856 and name  HB+ ) (resid 857 and name   HN ) 3.54 3.54 0.00 
  peak 595
assign (resid 865 and name   HN ) (resid 865 and name  HB1 ) 4.21 4.21 0.00 
  peak 283
assign (resid 858 and name HG2+ ) (resid 867 and name   HN ) 5.50 5.50 0.00 
  peak 667
assign (resid 862 and name   HN ) (resid 862 and name  HG+ ) 3.48 3.48 0.00 
  peak 600
assign (resid 905 and name  HB2 ) (resid 906 and name   HN ) 4.43 4.43 0.00 
  peak 284
assign (resid 883 and name HG12 ) (resid 884 and name   HN ) 4.09 4.09 0.00 
  peak 668
assign (resid 862 and name  HG+ ) (resid 863 and name  HE3 ) 4.61 4.61 0.00 
  peak 602
assign (resid 867 and name HG2+ ) (resid 869 and name HD1+ ) 3.56 3.56 0.00 
  peak 291
assign (resid 899 and name HG2+ ) (resid 900 and name   HN ) 3.92 3.92 0.00 
  peak 678
assign (resid 862 and name  HG+ ) (resid 863 and name  HZ2 ) 4.54 4.54 0.00 
  peak 603
assign (resid   5 and name   HA ) (resid 881 and name   HA ) 4.27 4.27 0.00 
  peak 315
assign (resid 899 and name   HN ) (resid 899 and name HG2+ ) 3.91 3.91 0.00 
  peak 679
assign (resid 869 and name   HA ) (resid 876 and name   HA ) 3.44 3.44 0.00 
  peak 332
assign (resid 899 and name HG2+ ) (resid 901 and name   HN ) 3.28 3.28 0.00 
  peak 680
assign (resid 881 and name  HB2 ) (resid 894 and name  HZ2 ) 4.85 4.85 0.00 
  peak 682
assign (resid 881 and name  HB2 ) (resid 894 and name   HN ) 5.50 5.50 0.00 
  peak 684
assign (resid 895 and name  HD1 ) (resid 896 and name   HN ) 4.34 4.34 0.00 
  peak 170
assign (resid 899 and name   HA ) (resid 900 and name  HB+ ) 4.70 4.70 0.00 
  peak 2248
assign (resid 894 and name   HN ) (resid 899 and name HG2+ ) 5.50 5.50 0.00 
  peak 684
assign (resid 895 and name  HG2 ) (resid 896 and name   HN ) 3.73 3.73 0.00 
  peak 173
assign (resid 899 and name   HA ) (resid 900 and name  HG+ ) 4.63 4.63 0.00 
  peak 2119
assign (resid 883 and name HG2+ ) (resid 892 and name   HN ) 4.03 4.03 0.00 
  peak 685
assign (resid 861 and name   HN ) (resid 862 and name   HN ) 4.48 4.48 0.00 
  peak 176
assign (resid 900 and name   HN ) (resid 900 and name  HB+ ) 3.48 3.48 0.00 
  peak 494
assign (resid 862 and name   HN ) (resid 864 and name   HN ) 4.44 4.44 0.00 
  peak 177
assign (resid 900 and name  HB+ ) (resid 901 and name   HN ) 3.68 3.68 0.00 
  peak 495
assign (resid 897 and name   HB ) (resid 909 and name  HE1 ) 4.60 4.60 0.00 
  peak 183
assign (resid 900 and name  HB+ ) (resid 901 and name  HB+ ) 4.46 4.46 0.00 
  peak 795
assign (resid 870 and name  HB1 ) (resid 873 and name   HN ) 4.36 4.36 0.00 
  peak 192
assign (resid 903 and name   HA ) (resid 904 and name  HG+ ) 4.15 4.15 0.00 
  peak 340
assign (resid 868 and name   HN ) (resid 869 and name   HN ) 4.61 4.61 0.00 
  peak 198
assign (resid 919 and name  HB+ ) (resid 920 and name   HN ) 3.93 3.93 0.00 
  peak 368
assign (resid 903 and name  HB+ ) (resid 904 and name  HD2 ) 3.60 3.60 0.00 
  peak 1881
assign (resid 867 and name   HB ) (resid 868 and name   HN ) 4.53 4.53 0.00 
  peak 199
assign (resid 920 and name   HN ) (resid 920 and name  HB+ ) 3.44 3.44 0.00 
  peak 665
assign (resid 904 and name  HG+ ) (resid 906 and name   HN ) 4.32 4.32 0.00 
  peak 213
assign (resid 867 and name HG12 ) (resid 868 and name   HN ) 5.50 5.50 0.00 
  peak 200
assign (resid 920 and name   HN ) (resid 920 and name  HG+ ) 3.88 3.88 0.00 
  peak 1295
assign (resid 905 and name   HN ) (resid 905 and name  HG+ ) 3.37 3.37 0.00 
  peak 587
assign (resid 868 and name   HN ) (resid 882 and name  HE+ ) 5.50 5.50 0.00 
  peak 200
assign (resid 920 and name  HB+ ) (resid 921 and name   HN ) 3.84 3.84 0.00 
  peak 46
assign (resid 905 and name   HN ) (resid 906 and name  HG+ ) 4.65 4.65 0.00 
  peak 456
assign (resid 921 and name   HN ) (resid 921 and name  HB+ ) 3.46 3.46 0.00 
  peak 669
assign (resid 922 and name   HN ) (resid 922 and name  HB+ ) 3.47 3.47 0.00 
  peak 27
assign (resid 922 and name  HB+ ) (resid 923 and name   HN ) 4.39 4.39 0.00 
  peak 2378
assign (resid 892 and name  HB1 ) (resid 897 and name HG2+ ) 4.38 4.38 0.00 
  peak 147
assign (resid 923 and name   HA ) (resid 924 and name  HB+ ) 4.41 4.41 0.00 
  peak 415
assign (resid 859 and name HG2+ ) (resid 867 and name   HB ) 5.07 5.07 0.00 
  peak 156
assign (resid 924 and name   HN ) (resid 924 and name  HB+ ) 3.65 3.65 0.00 
  peak 677
assign (resid 882 and name  HE+ ) (resid 893 and name   HN ) 4.16 4.16 0.00 
  peak 161
assign (resid 870 and name   HN ) (resid 882 and name  HE+ ) 4.26 4.26 0.00 
  peak 163
assign (resid 882 and name  HE+ ) (resid 892 and name   HA ) 3.99 3.99 0.00 
  peak 165
assign (resid 894 and name  HZ3 ) (resid 901 and name  HB+ ) 4.49 4.49 0.00 
  peak 605
assign (resid 882 and name  HE+ ) (resid 893 and name   HA ) 4.02 4.02 0.00 
  peak 167
assign (resid 877 and name   HA ) (resid 882 and name  HE+ ) 3.68 3.68 0.00 
  peak 168
assign (resid 918 and name   HA ) (resid 919 and name   HN ) 3.51 3.51 0.00 
  peak 333
assign (resid  11 and name HG2+ ) (resid  12 and name   HN ) 4.67 4.67 0.00 
  peak 607
assign (resid 882 and name  HE+ ) (resid 891 and name  HB2 ) 3.70 3.70 0.00 
  peak 171
assign (resid 867 and name HG2+ ) (resid 876 and name  HG+ ) 3.91 3.91 0.00 
  peak 334
assign (resid   3 and name HG2+ ) (resid 894 and name  HE1 ) 3.37 3.37 0.00 
  peak 609
assign (resid 882 and name  HB2 ) (resid 882 and name  HE+ ) 3.79 3.79 0.00 
  peak 176
assign (resid 903 and name   HA ) (resid 904 and name  HD2 ) 3.23 3.23 0.00 
  peak 338
assign (resid 862 and name  HG+ ) (resid 863 and name   HN ) 3.62 3.62 0.00 
  peak 609
assign (resid 867 and name HG2+ ) (resid 867 and name HG12 ) 3.36 3.36 0.00 
  peak 177
assign (resid 903 and name   HA ) (resid 904 and name  HD1 ) 3.60 3.60 0.00 
  peak 339
assign (resid   3 and name HG2+ ) (resid 894 and name  HZ2 ) 3.22 3.22 0.00 
  peak 611
assign (resid 903 and name   HA ) (resid 904 and name  HG1 ) 4.74 4.74 0.00 
  peak 340
assign (resid 883 and name HG2+ ) (resid 894 and name   HN ) 4.85 4.85 0.00 
  peak 686
assign (resid   3 and name HG2+ ) (resid 891 and name  HZ3 ) 4.26 4.26 0.00 
  peak 612
assign (resid 894 and name   HA ) (resid 899 and name   HB ) 3.95 3.95 0.00 
  peak 346
assign (resid 883 and name HG2+ ) (resid 909 and name  HZ3 ) 4.30 4.30 0.00 
  peak 689
assign (resid   3 and name HG2+ ) (resid 894 and name  HD1 ) 4.62 4.62 0.00 
  peak 613
assign (resid   3 and name   HA ) (resid 883 and name   HA ) 4.01 4.01 0.00 
  peak 368
assign (resid 883 and name HD1+ ) (resid 894 and name  HE1 ) 4.20 4.20 0.00 
  peak 690
assign (resid 915 and name   HN ) (resid 915 and name  HB+ ) 2.86 2.86 0.00 
  peak 614
assign (resid 883 and name   HA ) (resid 883 and name HD1+ ) 4.15 4.15 0.00 
  peak 372
assign (resid 894 and name  HD1 ) (resid 899 and name HD1+ ) 5.19 5.19 0.00 
  peak 692
assign (resid   6 and name HG2+ ) (resid   7 and name   HN ) 4.26 4.26 0.00 
  peak 616
assign (resid 882 and name  HG2 ) (resid 893 and name   HA ) 4.00 4.00 0.00 
  peak 386
assign (resid 883 and name HG12 ) (resid 909 and name  HZ3 ) 4.98 4.98 0.00 
  peak 693
assign (resid 869 and name   HA ) (resid 877 and name   HN ) 4.24 4.24 0.00 
  peak 387
assign (resid 883 and name HG2+ ) (resid 891 and name  HE3 ) 5.50 5.50 0.00 
  peak 694
assign (resid 883 and name HG2+ ) (resid 892 and name  HD+ ) 5.50 5.50 0.00 
  peak 694
assign (resid 894 and name  HE1 ) (resid 899 and name HD1+ ) 5.29 5.29 0.00 
  peak 695
assign (resid 867 and name   HN ) (resid 868 and name   HN ) 4.59 4.59 0.00 
  peak 201
assign (resid 905 and name   HA ) (resid 905 and name  HG+ ) 3.64 3.64 0.00 
  peak 1573
assign (resid 883 and name HD1+ ) (resid 909 and name  HE1 ) 4.83 4.83 0.00 
  peak 696
assign (resid 867 and name HD1+ ) (resid 868 and name   HN ) 4.34 4.34 0.00 
  peak 206
assign (resid 905 and name  HB+ ) (resid 906 and name   HN ) 3.77 3.77 0.00 
  peak 478
assign (resid 883 and name   HN ) (resid 883 and name HG11 ) 4.76 4.76 0.00 
  peak 697
assign (resid 860 and name   HA ) (resid 867 and name   HN ) 4.10 4.10 0.00 
  peak 220
assign (resid 905 and name  HG+ ) (resid 906 and name   HN ) 4.14 4.14 0.00 
  peak 1995
assign (resid 859 and name   HN ) (resid 867 and name   HN ) 3.64 3.64 0.00 
  peak 222
assign (resid 906 and name   HN ) (resid 906 and name  HB+ ) 3.19 3.19 0.00 
  peak 467
assign (resid 866 and name  HG1 ) (resid 867 and name   HN ) 5.04 5.04 0.00 
  peak 225
assign (resid 906 and name   HA ) (resid 906 and name  HG+ ) 3.47 3.47 0.00 
  peak 1923
assign (resid 877 and name   HN ) (resid 882 and name  HE+ ) 4.76 4.76 0.00 
  peak 226
assign (resid 906 and name  HG+ ) (resid 907 and name   HN ) 4.11 4.11 0.00 
  peak 44
assign (resid 895 and name  HB2 ) (resid 896 and name   HN ) 3.90 3.90 0.00 
  peak 235
assign (resid 908 and name   HN ) (resid 908 and name  HG+ ) 3.38 3.38 0.00 
  peak 443
assign (resid 897 and name   HN ) (resid 898 and name   HN ) 3.23 3.23 0.00 
  peak 236
assign (resid 908 and name  HG+ ) (resid 909 and name   HN ) 4.43 4.43 0.00 
  peak 338
assign (resid 916 and name   HN ) (resid 917 and name   HN ) 3.34 3.34 0.00 
  peak 242
assign (resid 908 and name  HG+ ) (resid 910 and name  HE+ ) 4.80 4.80 0.00 
  peak 2366
assign (resid 921 and name   HN ) (resid 921 and name  HB1 ) 4.00 4.00 0.00 
  peak 243
assign (resid 908 and name  HG+ ) (resid 910 and name   HZ ) 4.80 4.80 0.00 
  peak 459
assign (resid 911 and name   HA ) (resid 912 and name  HD+ ) 3.49 3.49 0.00 
  peak 412
assign (resid 860 and name   HA ) (resid 866 and name   HA ) 3.91 3.91 0.00 
  peak 425
assign (resid 870 and name   HA ) (resid 871 and name  HD1 ) 3.63 3.63 0.00 
  peak 432
assign (resid 877 and name   HA ) (resid 893 and name  HE2 ) 4.15 4.15 0.00 
  peak 435
assign (resid 892 and name   HA ) (resid 897 and name HG1+ ) 4.60 4.60 0.00 
  peak 450
assign (resid   3 and name HG2+ ) (resid 883 and name   HN ) 5.00 5.00 0.00 
  peak 699
assign (resid 910 and name  HB1 ) (resid 915 and name   HA ) 4.89 4.89 0.00 
  peak 453
assign (resid 878 and name   HN ) (resid 882 and name  HE+ ) 5.02 5.02 0.00 
  peak 700
assign (resid 914 and name  HB1 ) (resid 915 and name   HA ) 4.39 4.39 0.00 
  peak 456
assign (resid 893 and name   HA ) (resid 894 and name  HD1 ) 4.45 4.45 0.00 
  peak 714
assign (resid 911 and name   HN ) (resid 915 and name  HB+ ) 5.44 5.44 0.00 
  peak 701
assign (resid 875 and name   HA ) (resid 876 and name  HD1 ) 3.38 3.38 0.00 
  peak 468
assign (resid 909 and name   HA ) (resid 910 and name  HB2 ) 4.64 4.64 0.00 
  peak 721
assign (resid 886 and name  HB1 ) (resid 887 and name   HN ) 4.95 4.95 0.00 
  peak 702
assign (resid 875 and name   HA ) (resid 875 and name  HD+ ) 4.31 4.31 0.00 
  peak 470
assign (resid 885 and name   HA ) (resid 886 and name  HB2 ) 4.47 4.47 0.00 
  peak 724
assign (resid 883 and name   HN ) (resid 891 and name  HB1 ) 5.50 5.50 0.00 
  peak 704
assign (resid 869 and name HG2+ ) (resid 875 and name   HA ) 4.38 4.38 0.00 
  peak 472
assign (resid 903 and name   HA ) (resid 904 and name  HG2 ) 4.74 4.74 0.00 
  peak 725
assign (resid 885 and name  HB2 ) (resid 887 and name   HN ) 5.33 5.33 0.00 
  peak 705
assign (resid 896 and name   HA ) (resid 897 and name HG1+ ) 5.13 5.13 0.00 
  peak 727
assign (resid 887 and name   HN ) (resid 888 and name   HN ) 3.41 3.41 0.00 
  peak 790
assign (resid 887 and name   HN ) (resid 914 and name  HB1 ) 5.50 5.50 0.00 
  peak 705
assign (resid 896 and name   HA ) (resid 897 and name HG2+ ) 5.50 5.50 0.00 
  peak 727
assign (resid 887 and name   HN ) (resid 889 and name   HN ) 4.47 4.47 0.00 
  peak 791
assign (resid 885 and name  HB1 ) (resid 886 and name   HN ) 4.95 4.95 0.00 
  peak 706
assign (resid 919 and name   HN ) (resid 919 and name  HB1 ) 3.84 3.84 0.00 
  peak 244
assign (resid 904 and name   HA ) (resid 905 and name   HA ) 4.41 4.41 0.00 
  peak 730
assign (resid 912 and name  HB+ ) (resid 913 and name   HN ) 3.80 3.80 0.00 
  peak 285
assign (resid 878 and name   HN ) (resid 879 and name   HN ) 3.15 3.15 0.00 
  peak 793
assign (resid 887 and name  HB1 ) (resid 911 and name   HN ) 5.38 5.38 0.00 
  peak 707
assign (resid 917 and name   HN ) (resid 917 and name  HB2 ) 3.70 3.70 0.00 
  peak 245
assign (resid 882 and name   HA ) (resid 894 and name   HA ) 5.21 5.21 0.00 
  peak 731
assign (resid 912 and name  HB+ ) (resid 915 and name  HB+ ) 4.79 4.79 0.00 
  peak 2354
assign (resid 878 and name   HN ) (resid 893 and name  HD2 ) 4.77 4.77 0.00 
  peak 796
assign (resid 883 and name   HN ) (resid 894 and name   HA ) 4.91 4.91 0.00 
  peak 709
assign (resid 855 and name   HN ) (resid 855 and name  HB2 ) 4.12 4.12 0.00 
  peak 247
assign (resid 894 and name   HA ) (resid 899 and name HG2+ ) 4.49 4.49 0.00 
  peak 737
assign (resid 913 and name   HN ) (resid 913 and name  HB+ ) 3.06 3.06 0.00 
  peak 481
assign (resid 910 and name  HD+ ) (resid 911 and name   HN ) 4.41 4.41 0.00 
  peak 798
assign (resid 876 and name  HG+ ) (resid 877 and name   HN ) 4.06 4.06 0.00 
  peak 248
assign (resid 893 and name  HB2 ) (resid 896 and name  HB2 ) 4.51 4.51 0.00 
  peak 749
assign (resid 913 and name   HN ) (resid 913 and name  HG+ ) 3.56 3.56 0.00 
  peak 541
assign (resid 890 and name   HN ) (resid 891 and name   HN ) 4.42 4.42 0.00 
  peak 803
assign (resid 899 and name   HN ) (resid 899 and name HG12 ) 3.71 3.71 0.00 
  peak 252
assign (resid 913 and name   HN ) (resid 913 and name  HD+ ) 5.00 5.00 0.00 
  peak 629
assign (resid 911 and name   HN ) (resid 915 and name   HN ) 5.28 5.28 0.00 
  peak 812
assign (resid 897 and name HG2+ ) (resid 899 and name   HN ) 3.58 3.58 0.00 
  peak 253
assign (resid 913 and name   HN ) (resid 916 and name  HB+ ) 5.26 5.26 0.00 
  peak 2091
assign (resid 914 and name   HN ) (resid 915 and name   HN ) 3.18 3.18 0.00 
  peak 814
assign (resid 905 and name   HN ) (resid 907 and name   HN ) 4.47 4.47 0.00 
  peak 256
assign (resid 913 and name   HA ) (resid 913 and name  HG+ ) 3.57 3.57 0.00 
  peak 1677
assign (resid 913 and name   HN ) (resid 915 and name   HN ) 4.14 4.14 0.00 
  peak 815
assign (resid 858 and name HG2+ ) (resid 866 and name HE22 ) 4.71 4.71 0.00 
  peak 257
assign (resid 913 and name   HA ) (resid 913 and name  HD+ ) 4.40 4.40 0.00 
  peak 376
assign (resid 868 and name   HN ) (resid 877 and name   HN ) 4.74 4.74 0.00 
  peak 819
assign (resid 858 and name HG1+ ) (resid 866 and name HE21 ) 4.34 4.34 0.00 
  peak 258
assign (resid 913 and name   HA ) (resid 916 and name  HB+ ) 4.16 4.16 0.00 
  peak 2080
assign (resid 861 and name   HN ) (resid 861 and name  HB1 ) 4.07 4.07 0.00 
  peak 262
assign (resid 913 and name   HA ) (resid 916 and name HD2+ ) 5.18 5.18 0.00 
  peak 266
assign (resid 895 and name  HD2 ) (resid 896 and name   HN ) 4.31 4.31 0.00 
  peak 479
assign (resid 893 and name  HB1 ) (resid 895 and name  HD2 ) 3.93 3.93 0.00 
  peak 480
assign (resid 894 and name  HB2 ) (resid 895 and name  HD1 ) 3.90 3.90 0.00 
  peak 482
assign (resid 875 and name   HA ) (resid 876 and name  HD2 ) 3.45 3.45 0.00 
  peak 485
assign (resid 875 and name  HB2 ) (resid 876 and name  HD2 ) 4.05 4.05 0.00 
  peak 486
assign (resid 865 and name   HA ) (resid 866 and name   HN ) 2.93 2.93 0.00 
  peak 713
assign (resid 902 and name   HA ) (resid 903 and name  HD1 ) 3.29 3.29 0.00 
  peak 487
assign (resid   3 and name   HB ) (resid   4 and name   HN ) 3.59 3.59 0.00 
  peak 715
assign (resid 903 and name  HB2 ) (resid 904 and name  HD2 ) 4.27 4.27 0.00 
  peak 496
assign (resid 885 and name  HB1 ) (resid 911 and name  HB1 ) 4.99 4.99 0.00 
  peak 750
assign (resid   2 and name   HA ) (resid   3 and name   HN ) 3.19 3.19 0.00 
  peak 716
assign (resid 880 and name  HB2 ) (resid 881 and name  HD2 ) 4.21 4.21 0.00 
  peak 501
assign (resid 914 and name   HA ) (resid 917 and name  HG1 ) 4.75 4.75 0.00 
  peak 777
assign (resid 910 and name   HA ) (resid 911 and name   HN ) 3.18 3.18 0.00 
  peak 719
assign (resid 880 and name  HB2 ) (resid 881 and name  HD1 ) 4.21 4.21 0.00 
  peak 504
assign (resid 914 and name   HA ) (resid 917 and name  HB1 ) 4.57 4.57 0.00 
  peak 789
assign (resid 890 and name   HA ) (resid 891 and name   HN ) 3.11 3.11 0.00 
  peak 720
assign (resid 914 and name   HA ) (resid 917 and name  HE+ ) 3.86 3.86 0.00 
  peak 537
assign (resid 882 and name  HG2 ) (resid 891 and name  HE3 ) 5.50 5.50 0.00 
  peak 792
assign (resid 870 and name   HA ) (resid 872 and name   HN ) 4.62 4.62 0.00 
  peak 723
assign (resid 877 and name  HB1 ) (resid 879 and name   HN ) 4.71 4.71 0.00 
  peak 819
assign (resid 873 and name   HN ) (resid 874 and name   HN ) 3.04 3.04 0.00 
  peak 820
assign (resid 890 and name   HN ) (resid 891 and name   HA ) 5.11 5.11 0.00 
  peak 726
assign (resid 883 and name HG11 ) (resid 884 and name  HA1 ) 5.20 5.20 0.00 
  peak 824
assign (resid 862 and name   HN ) (resid 863 and name   HN ) 3.56 3.56 0.00 
  peak 822
assign (resid 891 and name   HA ) (resid 892 and name   HN ) 3.20 3.20 0.00 
  peak 727
assign (resid 914 and name   HN ) (resid 915 and name  HB+ ) 4.33 4.33 0.00 
  peak 263
assign (resid 860 and name  HB+ ) (resid 864 and name  HA2 ) 4.55 4.55 0.00 
  peak 833
assign (resid 913 and name  HB+ ) (resid 913 and name  HE+ ) 4.26 4.26 0.00 
  peak 38
assign (resid 905 and name   HN ) (resid 906 and name   HN ) 3.54 3.54 0.00 
  peak 824
assign (resid 883 and name   HN ) (resid 893 and name   HA ) 4.92 4.92 0.00 
  peak 730
assign (resid   4 and name HM++ ) (resid 868 and name  HE1 ) 4.71 4.71 0.00 
  peak 269
assign (resid 872 and name  HA2 ) (resid 896 and name  HB1 ) 5.48 5.48 0.00 
  peak 835
assign (resid 913 and name  HB+ ) (resid 914 and name   HN ) 3.26 3.26 0.00 
  peak 480
assign (resid 861 and name   HN ) (resid 865 and name   HN ) 3.70 3.70 0.00 
  peak 826
assign (resid 893 and name   HA ) (resid 894 and name   HN ) 3.31 3.31 0.00 
  peak 731
assign (resid   4 and name   HN ) (resid 882 and name   HN ) 4.13 4.13 0.00 
  peak 271
assign (resid 858 and name HG2+ ) (resid 866 and name  HG2 ) 4.64 4.64 0.00 
  peak 847
assign (resid 913 and name  HB+ ) (resid 915 and name   HN ) 5.34 5.34 0.00 
  peak 1148
assign (resid 864 and name   HN ) (resid 865 and name   HN ) 3.22 3.22 0.00 
  peak 827
assign (resid 896 and name  HB1 ) (resid 897 and name   HN ) 4.47 4.47 0.00 
  peak 278
assign (resid 899 and name HG2+ ) (resid 901 and name   HA ) 4.20 4.20 0.00 
  peak 849
assign (resid 913 and name  HG+ ) (resid 913 and name  HE+ ) 3.37 3.37 0.00 
  peak 29
assign (resid 909 and name   HN ) (resid 910 and name   HZ ) 4.84 4.84 0.00 
  peak 830
assign (resid 893 and name  HB1 ) (resid 894 and name   HN ) 4.14 4.14 0.00 
  peak 279
assign (resid 913 and name  HG+ ) (resid 914 and name   HN ) 5.08 5.08 0.00 
  peak 1257
assign (resid 872 and name   HN ) (resid 873 and name   HN ) 3.40 3.40 0.00 
  peak 832
assign (resid 874 and name  HB1 ) (resid 875 and name   HN ) 4.92 4.92 0.00 
  peak 280
assign (resid 915 and name   HA ) (resid 918 and name HG1+ ) 3.67 3.67 0.00 
  peak 2417
assign (resid 888 and name   HN ) (resid 890 and name   HN ) 4.85 4.85 0.00 
  peak 833
assign (resid 905 and name   HN ) (resid 905 and name  HB2 ) 3.68 3.68 0.00 
  peak 281
assign (resid 915 and name  HB+ ) (resid 916 and name  HB+ ) 4.57 4.57 0.00 
  peak 2356
assign (resid 885 and name   HN ) (resid 911 and name   HN ) 5.50 5.50 0.00 
  peak 837
assign (resid 912 and name  HB2 ) (resid 913 and name   HN ) 4.52 4.52 0.00 
  peak 285
assign (resid 916 and name   HN ) (resid 916 and name  HB+ ) 3.06 3.06 0.00 
  peak 643
assign (resid 879 and name   HN ) (resid 880 and name   HN ) 3.39 3.39 0.00 
  peak 840
assign (resid 908 and name   HN ) (resid 909 and name   HN ) 4.63 4.63 0.00 
  peak 287
assign (resid 916 and name   HN ) (resid 918 and name HG1+ ) 4.27 4.27 0.00 
  peak 2107
assign (resid 916 and name   HA ) (resid 916 and name HD2+ ) 4.51 4.51 0.00 
  peak 200
assign (resid 915 and name   HA ) (resid 917 and name  HE+ ) 4.87 4.87 0.00 
  peak 538
assign (resid 859 and name HG12 ) (resid 867 and name   HB ) 4.13 4.13 0.00 
  peak 547
assign (resid 857 and name   HA ) (resid 869 and name   HB ) 4.15 4.15 0.00 
  peak 552
assign (resid 899 and name   HN ) (resid 899 and name   HB ) 4.02 4.02 0.00 
  peak 574
assign (resid 886 and name  HB1 ) (resid 909 and name   HN ) 5.26 5.26 0.00 
  peak 643
assign (resid 876 and name   HA ) (resid 877 and name   HN ) 3.24 3.24 0.00 
  peak 733
assign (resid 883 and name HG2+ ) (resid 909 and name  HH2 ) 4.45 4.45 0.00 
  peak 657
assign (resid 870 and name   HN ) (resid 876 and name   HA ) 3.81 3.81 0.00 
  peak 737
assign (resid 883 and name HG2+ ) (resid 892 and name  HB1 ) 4.78 4.78 0.00 
  peak 658
assign (resid 918 and name HG2+ ) (resid 919 and name   HN ) 4.09 4.09 0.00 
  peak 854
assign (resid 893 and name   HA ) (resid 893 and name  HD2 ) 4.09 4.09 0.00 
  peak 747
assign (resid 883 and name HG2+ ) (resid 885 and name  HB2 ) 4.70 4.70 0.00 
  peak 659
assign (resid 883 and name HG11 ) (resid 903 and name  HD1 ) 5.50 5.50 0.00 
  peak 863
assign (resid 893 and name  HB2 ) (resid 896 and name   HN ) 3.51 3.51 0.00 
  peak 748
assign (resid 899 and name HD1+ ) (resid 901 and name   HN ) 4.42 4.42 0.00 
  peak 660
assign (resid 883 and name HG2+ ) (resid 899 and name HG12 ) 4.52 4.52 0.00 
  peak 865
assign (resid 910 and name   HA ) (resid 910 and name  HD+ ) 3.84 3.84 0.00 
  peak 749
assign (resid 869 and name HD1+ ) (resid 876 and name  HB1 ) 3.99 3.99 0.00 
  peak 661
assign (resid 868 and name  HB1 ) (resid 882 and name  HE+ ) 3.76 3.76 0.00 
  peak 879
assign (resid 883 and name   HA ) (resid 891 and name  HZ3 ) 4.11 4.11 0.00 
  peak 752
assign (resid 867 and name HG2+ ) (resid 876 and name   HA ) 4.43 4.43 0.00 
  peak 881
assign (resid 889 and name   HN ) (resid 890 and name   HN ) 3.55 3.55 0.00 
  peak 841
assign (resid 892 and name   HA ) (resid 892 and name  HD+ ) 4.63 4.63 0.00 
  peak 753
assign (resid 867 and name HG2+ ) (resid 877 and name  HB2 ) 4.65 4.65 0.00 
  peak 884
assign (resid 869 and name   HN ) (resid 870 and name   HN ) 4.62 4.62 0.00 
  peak 844
assign (resid 882 and name   HA ) (resid 893 and name   HA ) 3.89 3.89 0.00 
  peak 754
assign (resid 914 and name   HA ) (resid 916 and name   HN ) 4.49 4.49 0.00 
  peak 295
assign (resid 867 and name HG2+ ) (resid 868 and name  HB2 ) 5.04 5.04 0.00 
  peak 885
assign (resid 858 and name   HN ) (resid 859 and name   HN ) 4.66 4.66 0.00 
  peak 845
assign (resid 913 and name  HB2 ) (resid 914 and name   HN ) 3.80 3.80 0.00 
  peak 302
assign (resid 858 and name HG2+ ) (resid 868 and name  HZ2 ) 4.72 4.72 0.00 
  peak 887
assign (resid 907 and name   HN ) (resid 908 and name   HN ) 4.60 4.60 0.00 
  peak 849
assign (resid 912 and name   HA ) (resid 914 and name   HN ) 5.24 5.24 0.00 
  peak 755
assign (resid 923 and name   HA ) (resid 924 and name   HN ) 3.28 3.28 0.00 
  peak 303
assign (resid 858 and name HG2+ ) (resid 868 and name   HA ) 4.58 4.58 0.00 
  peak 888
assign (resid 874 and name   HN ) (resid 875 and name   HN ) 3.39 3.39 0.00 
  peak 850
assign (resid 859 and name   HN ) (resid 860 and name   HN ) 4.47 4.47 0.00 
  peak 307
assign (resid 858 and name HG1+ ) (resid 868 and name  HD1 ) 4.96 4.96 0.00 
  peak 894
assign (resid 873 and name   HN ) (resid 875 and name   HN ) 4.05 4.05 0.00 
  peak 851
assign (resid 855 and name   HN ) (resid 856 and name   HN ) 4.17 4.17 0.00 
  peak 312
assign (resid 894 and name  HH2 ) (resid 902 and name   HN ) 3.64 3.64 0.00 
  peak 854
assign (resid 904 and name  HB1 ) (resid 905 and name   HN ) 3.94 3.94 0.00 
  peak 316
assign (resid 894 and name  HZ2 ) (resid 902 and name   HN ) 4.52 4.52 0.00 
  peak 855
assign (resid 905 and name   HN ) (resid 905 and name  HB1 ) 3.68 3.68 0.00 
  peak 318
assign (resid 860 and name   HN ) (resid 861 and name   HN ) 4.61 4.61 0.00 
  peak 858
assign (resid 901 and name   HA ) (resid 902 and name   HN ) 2.97 2.97 0.00 
  peak 321
assign (resid 857 and name   HN ) (resid 857 and name  HD+ ) 3.80 3.80 0.00 
  peak 862
assign (resid 901 and name  HB+ ) (resid 902 and name   HN ) 3.10 3.10 0.00 
  peak 322
assign (resid 883 and name HG2+ ) (resid 883 and name HG11 ) 3.90 3.90 0.00 
  peak 1751
assign (resid 899 and name HG2+ ) (resid 902 and name   HN ) 4.79 4.79 0.00 
  peak 323
assign (resid 883 and name HG2+ ) (resid 899 and name   HB ) 4.40 4.40 0.00 
  peak 1751
assign (resid   3 and name HG2+ ) (resid 883 and name HG2+ ) 4.41 4.41 0.00 
  peak 1753
assign (resid 883 and name HG2+ ) (resid 883 and name HG12 ) 3.75 3.75 0.00 
  peak 1759
assign (resid 859 and name   HB ) (resid 859 and name HD1+ ) 3.26 3.26 0.00 
  peak 1762
assign (resid 918 and name   HB ) (resid 918 and name HD1+ ) 3.31 3.31 0.00 
  peak 1765
assign (resid   1 and name  HB+ ) (resid 883 and name HG12 ) 3.96 3.96 0.00 
  peak 1768
assign (resid 897 and name   HA ) (resid 897 and name HG1+ ) 3.27 3.27 0.00 
  peak 1773
assign (resid   2 and name   HA ) (resid   2 and name  HG+ ) 3.43 3.43 0.00 
  peak 1775
assign (resid 867 and name   HB ) (resid 869 and name HD1+ ) 4.34 4.34 0.00 
  peak 662
assign (resid 859 and name HD1+ ) (resid 860 and name   HN ) 4.44 4.44 0.00 
  peak 663
assign (resid 869 and name HG2+ ) (resid 874 and name   HN ) 4.52 4.52 0.00 
  peak 665
assign (resid 857 and name   HA ) (resid 869 and name HG2+ ) 4.83 4.83 0.00 
  peak 666
assign (resid 892 and name  HB2 ) (resid 897 and name HG2+ ) 3.92 3.92 0.00 
  peak 667
assign (resid 894 and name   HN ) (resid 896 and name  HB2 ) 4.98 4.98 0.00 
  peak 757
assign (resid 883 and name HG2+ ) (resid 897 and name HG1+ ) 4.43 4.43 0.00 
  peak 670
assign (resid 912 and name  HD+ ) (resid 914 and name   HN ) 4.79 4.79 0.00 
  peak 758
assign (resid 867 and name HG2+ ) (resid 877 and name  HB1 ) 4.65 4.65 0.00 
  peak 672
assign (resid 858 and name HG1+ ) (resid 868 and name   HA ) 4.58 4.58 0.00 
  peak 895
assign (resid 900 and name   HN ) (resid 900 and name  HG1 ) 3.99 3.99 0.00 
  peak 760
assign (resid 882 and name  HE+ ) (resid 891 and name   HA ) 4.43 4.43 0.00 
  peak 674
assign (resid 858 and name HG1+ ) (resid 866 and name  HG2 ) 4.64 4.64 0.00 
  peak 897
assign (resid 921 and name  HB2 ) (resid 922 and name   HN ) 4.91 4.91 0.00 
  peak 762
assign (resid 899 and name HD1+ ) (resid 903 and name  HD2 ) 4.58 4.58 0.00 
  peak 681
assign (resid 858 and name HG1+ ) (resid 866 and name  HB1 ) 4.48 4.48 0.00 
  peak 898
assign (resid 921 and name  HB1 ) (resid 922 and name   HN ) 4.91 4.91 0.00 
  peak 763
assign (resid 883 and name HD1+ ) (resid 903 and name  HD1 ) 4.51 4.51 0.00 
  peak 683
assign (resid 858 and name   HA ) (resid 868 and name   HA ) 4.03 4.03 0.00 
  peak 899
assign (resid 861 and name  HB2 ) (resid 864 and name   HN ) 5.01 5.01 0.00 
  peak 764
assign (resid 857 and name  HE+ ) (resid 871 and name  HB2 ) 5.20 5.20 0.00 
  peak 900
assign (resid 911 and name   HN ) (resid 914 and name   HN ) 4.59 4.59 0.00 
  peak 864
assign (resid 855 and name  HG+ ) (resid 856 and name   HN ) 4.92 4.92 0.00 
  peak 765
assign (resid 857 and name  HD+ ) (resid 869 and name HD1+ ) 4.85 4.85 0.00 
  peak 904
assign (resid 913 and name   HN ) (resid 914 and name   HN ) 3.12 3.12 0.00 
  peak 866
assign (resid 905 and name   HN ) (resid 905 and name  HG1 ) 3.90 3.90 0.00 
  peak 767
assign (resid   3 and name HG2+ ) (resid 883 and name HG12 ) 4.65 4.65 0.00 
  peak 908
assign (resid 914 and name   HN ) (resid 916 and name   HN ) 4.49 4.49 0.00 
  peak 867
assign (resid 866 and name  HG2 ) (resid 867 and name   HN ) 4.11 4.11 0.00 
  peak 768
assign (resid   3 and name HG2+ ) (resid 883 and name   HB ) 4.05 4.05 0.00 
  peak 910
assign (resid 888 and name   HN ) (resid 889 and name   HN ) 3.50 3.50 0.00 
  peak 877
assign (resid   8 and name   HN ) (resid   8 and name  HG+ ) 4.91 4.91 0.00 
  peak 772
assign (resid   1 and name   HA ) (resid 883 and name HD1+ ) 4.85 4.85 0.00 
  peak 913
assign (resid 877 and name   HN ) (resid 878 and name   HN ) 4.71 4.71 0.00 
  peak 878
assign (resid 859 and name HD1+ ) (resid 867 and name   HB ) 4.39 4.39 0.00 
  peak 914
assign (resid 863 and name   HN ) (resid 864 and name   HN ) 2.90 2.90 0.00 
  peak 888
assign (resid 863 and name   HN ) (resid 863 and name  HE3 ) 4.04 4.04 0.00 
  peak 898
assign (resid 870 and name   HN ) (resid 875 and name   HN ) 4.27 4.27 0.00 
  peak 899
assign (resid 870 and name   HN ) (resid 893 and name  HE1 ) 3.94 3.94 0.00 
  peak 900
assign (resid 866 and name   HA ) (resid 867 and name HG12 ) 4.21 4.21 0.00 
  peak 1782
assign (resid 897 and name   HN ) (resid 899 and name   HN ) 3.90 3.90 0.00 
  peak 911
assign (resid 867 and name   HA ) (resid 867 and name HG2+ ) 3.45 3.45 0.00 
  peak 1787
assign (resid 907 and name   HA ) (resid 907 and name  HG+ ) 3.45 3.45 0.00 
  peak 1788
assign (resid 894 and name   HA ) (resid 897 and name HG2+ ) 3.53 3.53 0.00 
  peak 1791
assign (resid 869 and name HG2+ ) (resid 874 and name   HA ) 3.19 3.19 0.00 
  peak 1793
assign (resid 908 and name   HA ) (resid 908 and name  HG1 ) 3.72 3.72 0.00 
  peak 1797
assign (resid 859 and name   HA ) (resid 859 and name HG2+ ) 3.14 3.14 0.00 
  peak 1802
assign (resid   6 and name   HA ) (resid   6 and name HG2+ ) 3.34 3.34 0.00 
  peak 1814
assign (resid 869 and name   HA ) (resid 869 and name HG2+ ) 3.41 3.41 0.00 
  peak 1821
assign (resid 914 and name   HA ) (resid 917 and name  HG2 ) 3.70 3.70 0.00 
  peak 1824
assign (resid 883 and name HD1+ ) (resid 902 and name   HA ) 4.82 4.82 0.00 
  peak 688
assign (resid 869 and name HG2+ ) (resid 876 and name  HD2 ) 4.94 4.94 0.00 
  peak 691
assign (resid 869 and name HD1+ ) (resid 876 and name  HD2 ) 5.42 5.42 0.00 
  peak 691
assign (resid 885 and name  HB2 ) (resid 911 and name   HA ) 5.19 5.19 0.00 
  peak 699
assign (resid 861 and name   HA ) (resid 862 and name   HA ) 4.53 4.53 0.00 
  peak 701
assign (resid 915 and name  HB+ ) (resid 917 and name   HN ) 5.05 5.05 0.00 
  peak 777
assign (resid 861 and name   HA ) (resid 862 and name  HG+ ) 4.64 4.64 0.00 
  peak 706
assign (resid 888 and name  HB2 ) (resid 889 and name   HN ) 4.40 4.40 0.00 
  peak 778
assign (resid 870 and name   HA ) (resid 871 and name  HG2 ) 4.60 4.60 0.00 
  peak 707
assign (resid 873 and name   HN ) (resid 873 and name  HB2 ) 3.95 3.95 0.00 
  peak 779
assign (resid 891 and name   HA ) (resid 891 and name  HE3 ) 4.78 4.78 0.00 
  peak 709
assign (resid 860 and name   HA ) (resid 860 and name  HD+ ) 4.28 4.28 0.00 
  peak 1000
assign (resid 863 and name  HB1 ) (resid 864 and name   HN ) 4.42 4.42 0.00 
  peak 781
assign (resid 891 and name   HA ) (resid 892 and name  HD+ ) 5.34 5.34 0.00 
  peak 709
assign (resid 862 and name   HA ) (resid 862 and name  HG+ ) 3.73 3.73 0.00 
  peak 1020
assign (resid 915 and name   HA ) (resid 918 and name   HN ) 4.20 4.20 0.00 
  peak 782
assign (resid 887 and name   HA ) (resid 910 and name  HE+ ) 4.49 4.49 0.00 
  peak 711
assign (resid 866 and name   HA ) (resid 866 and name  HG2 ) 4.21 4.21 0.00 
  peak 1073
assign (resid 883 and name   HN ) (resid 892 and name   HN ) 3.79 3.79 0.00 
  peak 785
assign (resid 867 and name   HB ) (resid 867 and name HD1+ ) 3.51 3.51 0.00 
  peak 1086
assign (resid 898 and name   HN ) (resid 899 and name   HN ) 3.41 3.41 0.00 
  peak 912
assign (resid 883 and name   HN ) (resid 894 and name   HN ) 4.94 4.94 0.00 
  peak 786
assign (resid 867 and name HG2+ ) (resid 867 and name HD1+ ) 3.27 3.27 0.00 
  peak 1090
assign (resid 868 and name  HD1 ) (resid 891 and name   HN ) 4.25 4.25 0.00 
  peak 915
assign (resid 887 and name   HN ) (resid 910 and name  HE+ ) 4.52 4.52 0.00 
  peak 787
assign (resid 867 and name HG2+ ) (resid 867 and name HG11 ) 3.39 3.39 0.00 
  peak 1101
assign (resid 868 and name   HN ) (resid 868 and name  HD1 ) 5.23 5.23 0.00 
  peak 916
assign (resid 887 and name   HN ) (resid 910 and name  HD+ ) 4.00 4.00 0.00 
  peak 788
assign (resid 869 and name   HA ) (resid 869 and name HD1+ ) 3.53 3.53 0.00 
  peak 1121
assign (resid 868 and name  HD1 ) (resid 891 and name  HD1 ) 3.64 3.64 0.00 
  peak 919
assign (resid 886 and name   HN ) (resid 887 and name   HN ) 3.95 3.95 0.00 
  peak 789
assign (resid 869 and name   HB ) (resid 869 and name HD1+ ) 3.66 3.66 0.00 
  peak 1122
assign (resid 863 and name  HE3 ) (resid 864 and name   HN ) 5.26 5.26 0.00 
  peak 923
assign (resid 869 and name HG2+ ) (resid 869 and name HG11 ) 3.63 3.63 0.00 
  peak 1131
assign (resid 908 and name HE21 ) (resid 909 and name   HN ) 4.25 4.25 0.00 
  peak 925
assign (resid 884 and name   HN ) (resid 885 and name   HN ) 4.73 4.73 0.00 
  peak 934
assign (resid 875 and name   HN ) (resid 893 and name  HE1 ) 4.09 4.09 0.00 
  peak 937
assign (resid 915 and name   HN ) (resid 917 and name   HN ) 4.69 4.69 0.00 
  peak 946
assign (resid 918 and name   HA ) (resid 918 and name HG2+ ) 3.29 3.29 0.00 
  peak 1826
assign (resid 891 and name   HN ) (resid 891 and name  HD1 ) 3.89 3.89 0.00 
  peak 949
assign (resid 875 and name  HB1 ) (resid 876 and name  HD2 ) 4.05 4.05 0.00 
  peak 1832
assign (resid 880 and name   HA ) (resid 881 and name  HD2 ) 3.40 3.40 0.00 
  peak 1842
assign (resid 880 and name   HA ) (resid 881 and name  HD1 ) 3.40 3.40 0.00 
  peak 1843
assign (resid   2 and name  HB1 ) (resid   2 and name  HD+ ) 3.10 3.10 0.00 
  peak 1850
assign (resid 894 and name  HB1 ) (resid 899 and name   HB ) 3.06 3.06 0.00 
  peak 1853
assign (resid 875 and name  HG1 ) (resid 875 and name  HE+ ) 3.40 3.40 0.00 
  peak 1855
assign (resid 860 and name  HB+ ) (resid 860 and name  HD+ ) 3.15 3.15 0.00 
  peak 1857
assign (resid 892 and name  HB1 ) (resid 897 and name HG1+ ) 3.43 3.43 0.00 
  peak 1863
assign (resid 892 and name  HB2 ) (resid 897 and name HG1+ ) 3.49 3.49 0.00 
  peak 1865
assign (resid 875 and name  HB1 ) (resid 875 and name  HD+ ) 3.83 3.83 0.00 
  peak 1187
assign (resid 870 and name  HB2 ) (resid 882 and name  HE+ ) 3.49 3.49 0.00 
  peak 1286
assign (resid 882 and name  HG2 ) (resid 882 and name  HE+ ) 3.65 3.65 0.00 
  peak 1286
assign (resid 884 and name  HA2 ) (resid 891 and name   HA ) 3.93 3.93 0.00 
  peak 1351
assign (resid 891 and name  HB1 ) (resid 892 and name   HN ) 4.24 4.24 0.00 
  peak 1359
assign (resid 894 and name   HN ) (resid 896 and name   HN ) 4.50 4.50 0.00 
  peak 955
assign (resid 897 and name   HA ) (resid 897 and name HG2+ ) 4.20 4.20 0.00 
  peak 1447
assign (resid 896 and name   HN ) (resid 899 and name   HN ) 4.72 4.72 0.00 
  peak 956
assign (resid 899 and name   HA ) (resid 899 and name HD1+ ) 3.49 3.49 0.00 
  peak 1463
assign (resid 894 and name  HH2 ) (resid 902 and name   HA ) 3.87 3.87 0.00 
  peak 50
assign (resid 883 and name   HN ) (resid 891 and name  HE3 ) 4.25 4.25 0.00 
  peak 974
assign (resid 866 and name  HB2 ) (resid 868 and name  HZ3 ) 4.10 4.10 0.00 
  peak 52
assign (resid 899 and name   HA ) (resid 899 and name HG2+ ) 3.54 3.54 0.00 
  peak 1480
assign (resid 892 and name   HN ) (resid 892 and name  HD+ ) 4.12 4.12 0.00 
  peak 976
assign (resid   1 and name  HB+ ) (resid 909 and name   HN ) 3.94 3.94 0.00 
  peak 54
assign (resid 899 and name HG2+ ) (resid 899 and name HG11 ) 3.63 3.63 0.00 
  peak 1483
assign (resid 894 and name  HZ3 ) (resid 902 and name   HN ) 4.46 4.46 0.00 
  peak 980
assign (resid   2 and name  HG+ ) (resid 891 and name  HZ3 ) 4.92 4.92 0.00 
  peak 58
assign (resid 905 and name   HA ) (resid 905 and name  HG1 ) 4.18 4.18 0.00 
  peak 1573
assign (resid 910 and name   HN ) (resid 910 and name  HD+ ) 3.58 3.58 0.00 
  peak 982
assign (resid   2 and name  HG+ ) (resid 891 and name  HH2 ) 3.58 3.58 0.00 
  peak 59
assign (resid 866 and name  HB1 ) (resid 867 and name   HN ) 4.13 4.13 0.00 
  peak 1230
assign (resid   4 and name   HN ) (resid 891 and name  HH2 ) 4.62 4.62 0.00 
  peak 988
assign (resid   1 and name  HB+ ) (resid 909 and name  HB2 ) 3.39 3.39 0.00 
  peak 61
assign (resid 859 and name   HB ) (resid 867 and name   HN ) 5.50 5.50 0.00 
  peak 1232
assign (resid 892 and name   HN ) (resid 909 and name  HZ3 ) 4.98 4.98 0.00 
  peak 994
assign (resid   1 and name  HB+ ) (resid 909 and name  HB1 ) 3.42 3.42 0.00 
  peak 62
assign (resid 861 and name   HN ) (resid 867 and name HG11 ) 4.88 4.88 0.00 
  peak 1239
assign (resid   4 and name   HN ) (resid 891 and name  HZ3 ) 4.04 4.04 0.00 
  peak 996
assign (resid   3 and name HG2+ ) (resid 902 and name   HA ) 4.02 4.02 0.00 
  peak 63
assign (resid 869 and name HG2+ ) (resid 876 and name  HD1 ) 4.38 4.38 0.00 
  peak 1867
assign (resid 859 and name HG2+ ) (resid 867 and name   HN ) 5.50 5.50 0.00 
  peak 1241
assign (resid 884 and name   HN ) (resid 891 and name  HZ3 ) 4.38 4.38 0.00 
  peak 997
assign (resid   5 and name   HA ) (resid 882 and name   HN ) 4.58 4.58 0.00 
  peak 64
assign (resid 893 and name  HB1 ) (resid 897 and name HG2+ ) 5.47 5.47 0.00 
  peak 1868
assign (resid 859 and name HD1+ ) (resid 867 and name   HN ) 5.50 5.50 0.00 
  peak 1241
assign (resid   8 and name   HA ) (resid   8 and name  HG+ ) 3.77 3.77 0.00 
  peak 65
assign (resid 897 and name HG1+ ) (resid 911 and name   HA ) 4.21 4.21 0.00 
  peak 1870
assign (resid 861 and name   HN ) (resid 865 and name  HB2 ) 4.43 4.43 0.00 
  peak 1244
assign (resid 857 and name  HB1 ) (resid 869 and name HG2+ ) 4.75 4.75 0.00 
  peak 1871
assign (resid   2 and name  HB1 ) (resid   3 and name   HN ) 4.22 4.22 0.00 
  peak 1262
assign (resid 857 and name  HB1 ) (resid 869 and name HD1+ ) 5.18 5.18 0.00 
  peak 1871
assign (resid 854 and name   HN ) (resid 854 and name  HB+ ) 3.77 3.77 0.00 
  peak 1264
assign (resid 896 and name  HB2 ) (resid 897 and name HG1+ ) 4.49 4.49 0.00 
  peak 1873
assign (resid 896 and name  HB2 ) (resid 897 and name HG2+ ) 4.90 4.90 0.00 
  peak 1873
assign (resid 894 and name   HN ) (resid 897 and name HG2+ ) 4.71 4.71 0.00 
  peak 1282
assign (resid 869 and name HG2+ ) (resid 870 and name  HB1 ) 4.66 4.66 0.00 
  peak 1874
assign (resid 899 and name HD1+ ) (resid 902 and name   HA ) 5.11 5.11 0.00 
  peak 1876
assign (resid 897 and name HG1+ ) (resid 912 and name  HD+ ) 3.72 3.72 0.00 
  peak 1879
assign (resid 906 and name   HA ) (resid 906 and name  HG1 ) 3.98 3.98 0.00 
  peak 1588
assign (resid 913 and name   HA ) (resid 913 and name  HG2 ) 4.20 4.20 0.00 
  peak 1677
assign (resid 913 and name   HA ) (resid 913 and name  HG1 ) 4.20 4.20 0.00 
  peak 1678
assign (resid 913 and name  HG1 ) (resid 913 and name  HE+ ) 4.09 4.09 0.00 
  peak 1695
assign (resid 917 and name   HA ) (resid 917 and name  HG2 ) 4.06 4.06 0.00 
  peak 1734
assign (resid 883 and name   HN ) (resid 894 and name  HD1 ) 4.09 4.09 0.00 
  peak 999
assign (resid 917 and name   HA ) (resid 917 and name  HG1 ) 3.70 3.70 0.00 
  peak 1735
assign (resid 894 and name   HN ) (resid 894 and name  HD1 ) 3.72 3.72 0.00 
  peak 1000
assign (resid   3 and name   HA ) (resid 884 and name   HN ) 4.48 4.48 0.00 
  peak 68
assign (resid 917 and name  HG2 ) (resid 917 and name  HD+ ) 2.93 2.93 0.00 
  peak 1744
assign (resid   3 and name   HA ) (resid   4 and name   HN ) 3.60 3.60 0.00 
  peak 1003
assign (resid   2 and name  HB1 ) (resid 891 and name  HH2 ) 4.05 4.05 0.00 
  peak 69
assign (resid 917 and name  HB1 ) (resid 917 and name  HE+ ) 4.28 4.28 0.00 
  peak 1748
assign (resid 882 and name   HA ) (resid 883 and name   HN ) 3.50 3.50 0.00 
  peak 1004
assign (resid   4 and name HM++ ) (resid 877 and name  HB1 ) 3.86 3.86 0.00 
  peak 80
assign (resid 917 and name  HB2 ) (resid 917 and name  HE+ ) 4.02 4.02 0.00 
  peak 1749
assign (resid 892 and name   HA ) (resid 893 and name   HN ) 3.19 3.19 0.00 
  peak 1005
assign (resid   4 and name HM++ ) (resid 868 and name  HZ3 ) 4.01 4.01 0.00 
  peak 81
assign (resid 918 and name HG2+ ) (resid 918 and name HD1+ ) 3.26 3.26 0.00 
  peak 1777
assign (resid 882 and name   HA ) (resid 894 and name   HN ) 3.85 3.85 0.00 
  peak 1007
assign (resid   4 and name HM++ ) (resid 891 and name  HZ2 ) 3.89 3.89 0.00 
  peak 82
assign (resid 859 and name   HB ) (resid 860 and name   HN ) 3.28 3.28 0.00 
  peak 1300
assign (resid 882 and name   HA ) (resid 894 and name  HE1 ) 4.53 4.53 0.00 
  peak 1008
assign (resid   4 and name HM++ ) (resid 891 and name  HD1 ) 4.00 4.00 0.00 
  peak 83
assign (resid 855 and name  HB1 ) (resid 856 and name   HN ) 4.70 4.70 0.00 
  peak 1310
assign (resid 893 and name  HD2 ) (resid 894 and name   HN ) 4.80 4.80 0.00 
  peak 1011
assign (resid 897 and name   HB ) (resid 909 and name  HZ2 ) 3.41 3.41 0.00 
  peak 99
assign (resid 918 and name   HB ) (resid 919 and name   HN ) 3.38 3.38 0.00 
  peak 1319
assign (resid 886 and name   HN ) (resid 888 and name   HN ) 4.97 4.97 0.00 
  peak 1013
assign (resid 897 and name HG2+ ) (resid 909 and name  HZ2 ) 3.04 3.04 0.00 
  peak 102
assign (resid 869 and name HG2+ ) (resid 874 and name  HB1 ) 5.13 5.13 0.00 
  peak 1880
assign (resid 881 and name  HB1 ) (resid 894 and name  HE1 ) 5.21 5.21 0.00 
  peak 1329
assign (resid 899 and name HD1+ ) (resid 909 and name  HD1 ) 3.94 3.94 0.00 
  peak 103
assign (resid 903 and name  HB1 ) (resid 904 and name  HD2 ) 4.27 4.27 0.00 
  peak 1881
assign (resid 894 and name  HE1 ) (resid 899 and name   HB ) 5.32 5.32 0.00 
  peak 1333
assign (resid 883 and name HD1+ ) (resid 909 and name  HD1 ) 4.05 4.05 0.00 
  peak 105
assign (resid 900 and name   HA ) (resid 900 and name  HG2 ) 4.16 4.16 0.00 
  peak 1883
assign (resid 861 and name  HB1 ) (resid 863 and name   HN ) 4.61 4.61 0.00 
  peak 1337
assign (resid 900 and name   HA ) (resid 900 and name  HG1 ) 4.16 4.16 0.00 
  peak 1884
assign (resid 912 and name  HG1 ) (resid 913 and name   HN ) 4.69 4.69 0.00 
  peak 1344
assign (resid 867 and name   HA ) (resid 867 and name HG11 ) 3.92 3.92 0.00 
  peak 1885
assign (resid 889 and name   HN ) (resid 889 and name  HB1 ) 4.07 4.07 0.00 
  peak 1350
assign (resid 899 and name   HA ) (resid 899 and name HG12 ) 4.02 4.02 0.00 
  peak 1887
assign (resid 917 and name  HG2 ) (resid 918 and name   HN ) 4.67 4.67 0.00 
  peak 1359
assign (resid 899 and name   HA ) (resid 899 and name HG11 ) 4.22 4.22 0.00 
  peak 1888
assign (resid 915 and name  HB+ ) (resid 916 and name   HN ) 3.51 3.51 0.00 
  peak 1383
assign (resid 897 and name HG2+ ) (resid 899 and name   HA ) 4.58 4.58 0.00 
  peak 1889
assign (resid 918 and name HG2+ ) (resid 919 and name   HA ) 4.27 4.27 0.00 
  peak 1891
assign (resid 869 and name HG2+ ) (resid 871 and name   HA ) 4.28 4.28 0.00 
  peak 1892
assign (resid 918 and name HG2+ ) (resid 918 and name HG12 ) 3.99 3.99 0.00 
  peak 1788
assign (resid 918 and name HG2+ ) (resid 918 and name HG11 ) 3.99 3.99 0.00 
  peak 1791
assign (resid 919 and name   HA ) (resid 919 and name  HD+ ) 4.75 4.75 0.00 
  peak 1797
assign (resid 919 and name   HA ) (resid 919 and name  HG+ ) 3.76 3.76 0.00 
  peak 1798
assign (resid 923 and name   HA ) (resid 923 and name  HG+ ) 3.93 3.93 0.00 
  peak 1801
assign (resid 885 and name   HN ) (resid 886 and name   HN ) 4.65 4.65 0.00 
  peak 1016
assign (resid 920 and name   HA ) (resid 920 and name  HD+ ) 4.29 4.29 0.00 
  peak 1803
assign (resid 861 and name   HN ) (resid 864 and name   HN ) 4.06 4.06 0.00 
  peak 1017
assign (resid 863 and name  HB1 ) (resid 863 and name  HD1 ) 3.69 3.69 0.00 
  peak 108
assign (resid 922 and name   HA ) (resid 922 and name  HG+ ) 4.08 4.08 0.00 
  peak 1816
assign (resid 867 and name   HN ) (resid 868 and name  HE3 ) 5.35 5.35 0.00 
  peak 1019
assign (resid 890 and name   HA ) (resid 891 and name  HD1 ) 4.18 4.18 0.00 
  peak 110
assign (resid 857 and name   HA ) (resid 859 and name HG2+ ) 4.54 4.54 0.00 
  peak 1829
assign (resid 916 and name  HB2 ) (resid 917 and name   HN ) 4.06 4.06 0.00 
  peak 1052
assign (resid 868 and name  HE1 ) (resid 891 and name  HD1 ) 3.66 3.66 0.00 
  peak 111
assign (resid 862 and name  HG+ ) (resid 864 and name   HN ) 4.40 4.40 0.00 
  peak 1830
assign (resid 909 and name  HZ2 ) (resid 911 and name  HB2 ) 4.89 4.89 0.00 
  peak 1080
assign (resid 868 and name  HE1 ) (resid 891 and name  HE1 ) 5.07 5.07 0.00 
  peak 112
assign (resid 872 and name  HA1 ) (resid 896 and name  HB1 ) 4.50 4.50 0.00 
  peak 1835
assign (resid 909 and name  HZ2 ) (resid 911 and name   HA ) 4.16 4.16 0.00 
  peak 1081
assign (resid 868 and name  HD1 ) (resid 890 and name   HA ) 5.07 5.07 0.00 
  peak 119
assign (resid 916 and name   HN ) (resid 917 and name  HG2 ) 4.46 4.46 0.00 
  peak 1387
assign (resid 884 and name  HA2 ) (resid 891 and name  HZ3 ) 4.89 4.89 0.00 
  peak 1091
assign (resid 868 and name  HD1 ) (resid 891 and name  HB2 ) 4.38 4.38 0.00 
  peak 120
assign (resid 869 and name HG2+ ) (resid 893 and name  HE1 ) 5.50 5.50 0.00 
  peak 1389
assign (resid 909 and name  HH2 ) (resid 911 and name   HA ) 3.90 3.90 0.00 
  peak 1094
assign (resid 863 and name   HN ) (resid 863 and name  HD1 ) 3.93 3.93 0.00 
  peak 123
assign (resid 917 and name   HN ) (resid 917 and name  HD+ ) 4.15 4.15 0.00 
  peak 1393
assign (resid 909 and name  HH2 ) (resid 912 and name  HD+ ) 4.23 4.23 0.00 
  peak 1095
assign (resid 882 and name   HA ) (resid 894 and name  HD1 ) 3.86 3.86 0.00 
  peak 124
assign (resid 918 and name   HA ) (resid 918 and name HD1+ ) 4.02 4.02 0.00 
  peak 1893
assign (resid   2 and name  HB1 ) (resid 891 and name  HZ2 ) 4.46 4.46 0.00 
  peak 1403
assign (resid 892 and name  HB2 ) (resid 909 and name  HH2 ) 4.46 4.46 0.00 
  peak 1096
assign (resid 894 and name   HA ) (resid 894 and name  HD1 ) 3.68 3.68 0.00 
  peak 125
assign (resid 915 and name   HA ) (resid 918 and name HD1+ ) 4.14 4.14 0.00 
  peak 1894
assign (resid 901 and name   HN ) (resid 901 and name  HB+ ) 3.16 3.16 0.00 
  peak 1406
assign (resid 883 and name   HB ) (resid 894 and name  HD1 ) 3.91 3.91 0.00 
  peak 126
assign (resid   3 and name   HA ) (resid   3 and name HG2+ ) 3.45 3.45 0.00 
  peak 1895
assign (resid   1 and name  HB+ ) (resid 909 and name  HE3 ) 4.55 4.55 0.00 
  peak 1410
assign (resid 917 and name   HA ) (resid 917 and name  HD+ ) 4.38 4.38 0.00 
  peak 1904
assign (resid 881 and name  HB1 ) (resid 894 and name  HZ2 ) 4.67 4.67 0.00 
  peak 1414
assign (resid 918 and name   HA ) (resid 918 and name HG11 ) 3.89 3.89 0.00 
  peak 1908
assign (resid 866 and name  HG1 ) (resid 868 and name  HH2 ) 5.25 5.25 0.00 
  peak 1420
assign (resid 894 and name  HB2 ) (resid 899 and name   HB ) 4.22 4.22 0.00 
  peak 1909
assign (resid 908 and name  HB2 ) (resid 910 and name  HD+ ) 5.01 5.01 0.00 
  peak 1430
assign (resid 884 and name  HA1 ) (resid 891 and name  HZ3 ) 4.68 4.68 0.00 
  peak 2022
assign (resid 915 and name   HA ) (resid 918 and name   HB ) 4.18 4.18 0.00 
  peak 1911
assign (resid 882 and name  HE+ ) (resid 891 and name  HE3 ) 4.09 4.09 0.00 
  peak 1431
assign (resid   2 and name  HB2 ) (resid 891 and name  HH2 ) 3.75 3.75 0.00 
  peak 2023
assign (resid 875 and name  HG1 ) (resid 876 and name  HD2 ) 4.67 4.67 0.00 
  peak 1912
assign (resid 908 and name  HB1 ) (resid 910 and name  HE+ ) 3.89 3.89 0.00 
  peak 2024
assign (resid 903 and name  HG2 ) (resid 904 and name  HD2 ) 4.64 4.64 0.00 
  peak 1913
assign (resid 866 and name  HG2 ) (resid 868 and name  HH2 ) 5.50 5.50 0.00 
  peak 2026
assign (resid 857 and name  HB1 ) (resid 869 and name   HB ) 4.06 4.06 0.00 
  peak 1915
assign (resid 910 and name   HN ) (resid 915 and name  HB+ ) 4.92 4.92 0.00 
  peak 2028
assign (resid   2 and name  HG+ ) (resid 884 and name   HN ) 5.13 5.13 0.00 
  peak 2030
assign (resid 873 and name   HN ) (resid 875 and name  HD+ ) 5.50 5.50 0.00 
  peak 2031
assign (resid 882 and name  HG1 ) (resid 891 and name  HZ3 ) 5.50 5.50 0.00 
  peak 2033
assign (resid 899 and name HG11 ) (resid 909 and name  HD1 ) 5.50 5.50 0.00 
  peak 2035
assign (resid 867 and name HG2+ ) (resid 868 and name  HE3 ) 5.37 5.37 0.00 
  peak 2036
assign (resid 872 and name  HA1 ) (resid 896 and name  HB2 ) 5.22 5.22 0.00 
  peak 1836
assign (resid 899 and name HG2+ ) (resid 903 and name  HG2 ) 5.21 5.21 0.00 
  peak 1839
assign (resid 904 and name  HB2 ) (resid 905 and name   HN ) 3.93 3.93 0.00 
  peak 1
assign (resid 899 and name HG2+ ) (resid 903 and name  HG1 ) 4.80 4.80 0.00 
  peak 3
assign (resid 882 and name  HE+ ) (resid 883 and name HG2+ ) 5.48 5.48 0.00 
  peak 5
assign (resid 909 and name  HH2 ) (resid 911 and name  HB1 ) 4.58 4.58 0.00 
  peak 1097
assign (resid   1 and name  HB+ ) (resid 899 and name HG2+ ) 5.01 5.01 0.00 
  peak 6
assign (resid 909 and name  HH2 ) (resid 911 and name  HB2 ) 4.54 4.54 0.00 
  peak 1098
assign (resid 883 and name HG2+ ) (resid 894 and name  HD1 ) 3.55 3.55 0.00 
  peak 127
assign (resid 899 and name HG2+ ) (resid 899 and name HD1+ ) 2.95 2.95 0.00 
  peak 11
assign (resid 882 and name  HB1 ) (resid 883 and name   HN ) 3.87 3.87 0.00 
  peak 1101
assign (resid 883 and name HD1+ ) (resid 894 and name  HD1 ) 4.78 4.78 0.00 
  peak 128
assign (resid 883 and name HD1+ ) (resid 899 and name HG2+ ) 3.82 3.82 0.00 
  peak 13
assign (resid 882 and name  HE+ ) (resid 883 and name   HN ) 4.51 4.51 0.00 
  peak 1103
assign (resid 894 and name  HD1 ) (resid 899 and name HG2+ ) 4.56 4.56 0.00 
  peak 129
assign (resid 883 and name HG2+ ) (resid 899 and name HG2+ ) 3.81 3.81 0.00 
  peak 14
assign (resid 877 and name  HB1 ) (resid 878 and name   HN ) 4.60 4.60 0.00 
  peak 1108
assign (resid 870 and name   HA ) (resid 892 and name   HA ) 4.14 4.14 0.00 
  peak 131
assign (resid 899 and name HD1+ ) (resid 909 and name  HZ2 ) 5.02 5.02 0.00 
  peak 20
assign (resid 904 and name  HB1 ) (resid 906 and name   HN ) 4.39 4.39 0.00 
  peak 1129
assign (resid 882 and name   HA ) (resid 882 and name  HG1 ) 4.21 4.21 0.00 
  peak 133
assign (resid 866 and name  HB2 ) (resid 866 and name HE21 ) 4.44 4.44 0.00 
  peak 1440
assign (resid 905 and name  HG2 ) (resid 906 and name   HN ) 5.01 5.01 0.00 
  peak 1130
assign (resid 885 and name   HA ) (resid 909 and name  HE3 ) 3.39 3.39 0.00 
  peak 156
assign (resid 892 and name   HN ) (resid 897 and name HG1+ ) 4.54 4.54 0.00 
  peak 1143
assign (resid 885 and name   HA ) (resid 909 and name  HZ3 ) 4.20 4.20 0.00 
  peak 157
assign (resid 874 and name   HN ) (resid 874 and name  HB1 ) 4.17 4.17 0.00 
  peak 1154
assign (resid 885 and name   HN ) (resid 909 and name  HZ3 ) 4.48 4.48 0.00 
  peak 158
assign (resid 903 and name  HB2 ) (resid 904 and name  HD1 ) 3.85 3.85 0.00 
  peak 1916
assign (resid 858 and name HG2+ ) (resid 866 and name HE21 ) 4.34 4.34 0.00 
  peak 1444
assign (resid 868 and name   HN ) (resid 868 and name  HB1 ) 3.66 3.66 0.00 
  peak 1155
assign (resid 909 and name  HZ3 ) (resid 911 and name   HN ) 4.61 4.61 0.00 
  peak 159
assign (resid 875 and name  HG2 ) (resid 876 and name  HD2 ) 4.67 4.67 0.00 
  peak 1917
assign (resid 882 and name  HB2 ) (resid 891 and name  HZ3 ) 4.51 4.51 0.00 
  peak 1448
assign (resid 910 and name   HN ) (resid 911 and name   HN ) 4.69 4.69 0.00 
  peak 160
assign (resid 893 and name  HB1 ) (resid 895 and name  HG1 ) 4.02 4.02 0.00 
  peak 1920
assign (resid 897 and name HG1+ ) (resid 909 and name  HZ3 ) 4.52 4.52 0.00 
  peak 1449
assign (resid 906 and name   HA ) (resid 906 and name  HG2 ) 3.98 3.98 0.00 
  peak 1923
assign (resid 897 and name HG2+ ) (resid 909 and name  HZ3 ) 5.11 5.11 0.00 
  peak 1449
assign (resid 905 and name   HA ) (resid 905 and name  HG2 ) 4.18 4.18 0.00 
  peak 1925
assign (resid 894 and name  HD1 ) (resid 897 and name HG2+ ) 4.46 4.46 0.00 
  peak 1452
assign (resid 903 and name  HB1 ) (resid 904 and name  HD1 ) 3.85 3.85 0.00 
  peak 1927
assign (resid 897 and name HG1+ ) (resid 909 and name  HH2 ) 3.48 3.48 0.00 
  peak 1454
assign (resid 910 and name  HE+ ) (resid 918 and name HD1+ ) 5.50 5.50 0.00 
  peak 2037
assign (resid 911 and name  HB1 ) (resid 912 and name  HD+ ) 3.90 3.90 0.00 
  peak 1929
assign (resid 858 and name HG1+ ) (resid 868 and name  HE1 ) 4.95 4.95 0.00 
  peak 1456
assign (resid 897 and name   HB ) (resid 912 and name  HD+ ) 3.34 3.34 0.00 
  peak 1933
assign (resid 863 and name   HA ) (resid 863 and name  HD1 ) 4.90 4.90 0.00 
  peak 2039
assign (resid 902 and name   HA ) (resid 903 and name  HD2 ) 3.19 3.19 0.00 
  peak 1936
assign (resid 883 and name HG2+ ) (resid 909 and name  HB1 ) 5.18 5.18 0.00 
  peak 2041
assign (resid 894 and name  HB1 ) (resid 895 and name  HD1 ) 3.87 3.87 0.00 
  peak 1940
assign (resid 894 and name  HB1 ) (resid 899 and name HG11 ) 5.50 5.50 0.00 
  peak 2044
assign (resid 899 and name HG11 ) (resid 903 and name  HD1 ) 5.50 5.50 0.00 
  peak 2044
assign (resid 898 and name   HN ) (resid 899 and name   HA ) 4.82 4.82 0.00 
  peak 2055
assign (resid 884 and name  HA2 ) (resid 891 and name  HE1 ) 5.35 5.35 0.00 
  peak 2057
assign (resid 875 and name  HG2 ) (resid 875 and name  HE+ ) 3.40 3.40 0.00 
  peak 2061
assign (resid 902 and name  HB+ ) (resid 903 and name  HD2 ) 3.49 3.49 0.00 
  peak 2063
assign (resid 894 and name  HZ2 ) (resid 899 and name HG2+ ) 5.01 5.01 0.00 
  peak 21
assign (resid 883 and name HD1+ ) (resid 903 and name  HG1 ) 3.68 3.68 0.00 
  peak 24
assign (resid 913 and name  HG2 ) (resid 913 and name  HE+ ) 4.09 4.09 0.00 
  peak 29
assign (resid 910 and name  HB1 ) (resid 911 and name   HN ) 3.63 3.63 0.00 
  peak 31
assign (resid 868 and name   HN ) (resid 869 and name HD1+ ) 4.94 4.94 0.00 
  peak 1160
assign (resid 860 and name  HB+ ) (resid 864 and name  HA1 ) 4.55 4.55 0.00 
  peak 33
assign (resid 909 and name   HN ) (resid 909 and name  HB2 ) 3.95 3.95 0.00 
  peak 1175
assign (resid 886 and name   HN ) (resid 909 and name  HE3 ) 4.19 4.19 0.00 
  peak 163
assign (resid 875 and name  HB2 ) (resid 875 and name  HD+ ) 3.83 3.83 0.00 
  peak 36
assign (resid 860 and name  HB+ ) (resid 865 and name   HN ) 4.48 4.48 0.00 
  peak 1183
assign (resid 909 and name  HE3 ) (resid 910 and name   HA ) 4.99 4.99 0.00 
  peak 164
assign (resid   7 and name   HA ) (resid   8 and name   HN ) 3.44 3.44 0.00 
  peak 39
assign (resid 900 and name   HN ) (resid 901 and name  HB+ ) 4.48 4.48 0.00 
  peak 1191
assign (resid 909 and name  HZ3 ) (resid 910 and name   HA ) 4.85 4.85 0.00 
  peak 165
assign (resid 877 and name  HB2 ) (resid 879 and name   HN ) 4.71 4.71 0.00 
  peak 1201
assign (resid 884 and name  HA2 ) (resid 909 and name  HZ3 ) 4.97 4.97 0.00 
  peak 166
assign (resid   4 and name  HG2 ) (resid 891 and name  HZ3 ) 4.43 4.43 0.00 
  peak 48
assign (resid 869 and name   HN ) (resid 869 and name HD1+ ) 3.82 3.82 0.00 
  peak 1204
assign (resid 909 and name  HZ3 ) (resid 911 and name   HA ) 4.92 4.92 0.00 
  peak 166
assign (resid 858 and name HG2+ ) (resid 868 and name  HE1 ) 4.95 4.95 0.00 
  peak 1457
assign (resid 859 and name   HN ) (resid 859 and name HG2+ ) 3.66 3.66 0.00 
  peak 1210
assign (resid 885 and name  HB1 ) (resid 909 and name  HZ3 ) 4.67 4.67 0.00 
  peak 167
assign (resid 882 and name  HE+ ) (resid 893 and name  HE2 ) 4.15 4.15 0.00 
  peak 1458
assign (resid 882 and name   HN ) (resid 882 and name  HB2 ) 3.29 3.29 0.00 
  peak 1215
assign (resid 909 and name  HZ3 ) (resid 911 and name  HB1 ) 4.37 4.37 0.00 
  peak 169
assign (resid 897 and name HG2+ ) (resid 909 and name  HE1 ) 4.11 4.11 0.00 
  peak 1461
assign (resid 881 and name  HB1 ) (resid 882 and name   HN ) 4.22 4.22 0.00 
  peak 1223
assign (resid 885 and name  HB2 ) (resid 909 and name  HZ3 ) 4.10 4.10 0.00 
  peak 170
assign (resid 880 and name  HB1 ) (resid 881 and name  HD1 ) 4.21 4.21 0.00 
  peak 1943
assign (resid   1 and name  HT+ ) (resid   2 and name  HB2 ) 4.63 4.63 0.00 
  peak 1463
assign (resid 875 and name   HN ) (resid 875 and name  HB1 ) 3.94 3.94 0.00 
  peak 1229
assign (resid 883 and name HG12 ) (resid 909 and name  HE3 ) 4.18 4.18 0.00 
  peak 172
assign (resid 861 and name  HB2 ) (resid 867 and name HD1+ ) 4.23 4.23 0.00 
  peak 1959
assign (resid 883 and name HD1+ ) (resid 909 and name  HE3 ) 4.30 4.30 0.00 
  peak 174
assign (resid 867 and name HG2+ ) (resid 876 and name  HB2 ) 3.73 3.73 0.00 
  peak 1961
assign (resid 870 and name  HB2 ) (resid 893 and name  HE2 ) 5.13 5.13 0.00 
  peak 1465
assign (resid 869 and name HD1+ ) (resid 876 and name  HB2 ) 3.99 3.99 0.00 
  peak 1962
assign (resid 882 and name  HG2 ) (resid 893 and name  HE2 ) 5.50 5.50 0.00 
  peak 1465
assign (resid 869 and name HD1+ ) (resid 876 and name  HG+ ) 3.46 3.46 0.00 
  peak 1963
assign (resid 883 and name   HN ) (resid 897 and name HG2+ ) 4.78 4.78 0.00 
  peak 1466
assign (resid 910 and name  HB2 ) (resid 915 and name  HB+ ) 3.47 3.47 0.00 
  peak 1964
assign (resid 894 and name  HE1 ) (resid 899 and name HG2+ ) 4.86 4.86 0.00 
  peak 1467
assign (resid 886 and name  HB2 ) (resid 908 and name  HB1 ) 4.44 4.44 0.00 
  peak 2067
assign (resid 899 and name   HB ) (resid 899 and name HD1+ ) 3.55 3.55 0.00 
  peak 1967
assign (resid 884 and name  HA1 ) (resid 891 and name   HA ) 4.22 4.22 0.00 
  peak 1478
assign (resid 913 and name   HA ) (resid 916 and name  HB2 ) 4.77 4.77 0.00 
  peak 2080
assign (resid 869 and name HG2+ ) (resid 869 and name HG12 ) 3.63 3.63 0.00 
  peak 1972
assign (resid 913 and name   HA ) (resid 916 and name  HB1 ) 4.77 4.77 0.00 
  peak 2081
assign (resid 897 and name HG2+ ) (resid 899 and name HG2+ ) 3.94 3.94 0.00 
  peak 1974
assign (resid 909 and name  HB1 ) (resid 909 and name  HZ3 ) 5.39 5.39 0.00 
  peak 2084
assign (resid 883 and name HG2+ ) (resid 899 and name HD1+ ) 3.57 3.57 0.00 
  peak 1978
assign (resid 909 and name  HZ3 ) (resid 911 and name  HB2 ) 5.50 5.50 0.00 
  peak 2084
assign (resid 885 and name  HB2 ) (resid 909 and name  HE3 ) 4.76 4.76 0.00 
  peak 2086
assign (resid 888 and name  HB1 ) (resid 889 and name   HN ) 4.40 4.40 0.00 
  peak 2090
assign (resid 889 and name   HN ) (resid 889 and name  HB2 ) 4.07 4.07 0.00 
  peak 2092
assign (resid 861 and name  HB1 ) (resid 864 and name   HN ) 5.01 5.01 0.00 
  peak 2093
assign (resid 888 and name   HN ) (resid 914 and name  HB1 ) 4.26 4.26 0.00 
  peak 2095
assign (resid 909 and name  HB2 ) (resid 910 and name   HN ) 4.08 4.08 0.00 
  peak 179
assign (resid 894 and name  HZ3 ) (resid 901 and name   HA ) 3.51 3.51 0.00 
  peak 181
assign (resid 909 and name   HA ) (resid 910 and name  HD+ ) 3.94 3.94 0.00 
  peak 181
assign (resid 881 and name  HB2 ) (resid 894 and name  HZ3 ) 4.89 4.89 0.00 
  peak 182
assign (resid 863 and name   HA ) (resid 863 and name  HE3 ) 5.00 5.00 0.00 
  peak 184
assign (resid 885 and name  HB2 ) (resid 910 and name   HA ) 4.41 4.41 0.00 
  peak 1480
assign (resid 868 and name   HN ) (resid 868 and name  HE3 ) 3.40 3.40 0.00 
  peak 185
assign (resid 870 and name   HA ) (resid 871 and name  HD2 ) 3.63 3.63 0.00 
  peak 1484
assign (resid 871 and name   HA ) (resid 873 and name   HN ) 4.71 4.71 0.00 
  peak 266
assign (resid 867 and name   HA ) (resid 868 and name  HE3 ) 3.69 3.69 0.00 
  peak 186
assign (resid 870 and name   HA ) (resid 882 and name  HE+ ) 4.41 4.41 0.00 
  peak 1485
assign (resid 913 and name   HA ) (resid 916 and name   HN ) 4.46 4.46 0.00 
  peak 267
assign (resid   4 and name HM++ ) (resid 868 and name  HE3 ) 3.70 3.70 0.00 
  peak 187
assign (resid 883 and name HD1+ ) (resid 899 and name HD1+ ) 3.26 3.26 0.00 
  peak 1979
assign (resid 883 and name   HA ) (resid 883 and name HG11 ) 3.70 3.70 0.00 
  peak 1488
assign (resid 912 and name   HA ) (resid 915 and name   HN ) 4.13 4.13 0.00 
  peak 269
assign (resid 882 and name   HA ) (resid 882 and name  HG2 ) 3.98 3.98 0.00 
  peak 190
assign (resid 883 and name HG2+ ) (resid 883 and name HD1+ ) 3.14 3.14 0.00 
  peak 1981
assign (resid   3 and name HG2+ ) (resid 883 and name   HA ) 3.66 3.66 0.00 
  peak 1489
assign (resid 917 and name   HA ) (resid 918 and name   HN ) 3.45 3.45 0.00 
  peak 271
assign (resid 870 and name  HB2 ) (resid 892 and name   HA ) 4.38 4.38 0.00 
  peak 190
assign (resid 883 and name HD1+ ) (resid 899 and name HG12 ) 4.77 4.77 0.00 
  peak 1982
assign (resid 883 and name   HA ) (resid 884 and name  HA1 ) 4.59 4.59 0.00 
  peak 1491
assign (resid 912 and name   HA ) (resid 916 and name   HN ) 4.46 4.46 0.00 
  peak 273
assign (resid 858 and name HG2+ ) (resid 868 and name  HD1 ) 4.96 4.96 0.00 
  peak 1991
assign (resid 860 and name   HA ) (resid 860 and name  HG2 ) 3.86 3.86 0.00 
  peak 1492
assign (resid 899 and name   HA ) (resid 901 and name   HN ) 3.96 3.96 0.00 
  peak 274
assign (resid 883 and name HG12 ) (resid 894 and name  HE1 ) 5.50 5.50 0.00 
  peak 1993
assign (resid 860 and name   HA ) (resid 860 and name  HG1 ) 3.86 3.86 0.00 
  peak 1493
assign (resid 899 and name   HA ) (resid 900 and name   HN ) 3.18 3.18 0.00 
  peak 275
assign (resid 866 and name  HB2 ) (resid 866 and name HE22 ) 4.93 4.93 0.00 
  peak 1994
assign (resid 869 and name HG11 ) (resid 876 and name   HA ) 4.87 4.87 0.00 
  peak 1501
assign (resid 869 and name   HA ) (resid 870 and name   HN ) 3.21 3.21 0.00 
  peak 277
assign (resid 889 and name  HB2 ) (resid 890 and name   HN ) 4.79 4.79 0.00 
  peak 2100
assign (resid 905 and name  HG1 ) (resid 906 and name   HN ) 5.01 5.01 0.00 
  peak 1995
assign (resid 882 and name  HG1 ) (resid 893 and name   HA ) 4.41 4.41 0.00 
  peak 1507
assign (resid 880 and name   HN ) (resid 880 and name  HB1 ) 3.90 3.90 0.00 
  peak 278
assign (resid 870 and name   HA ) (resid 871 and name  HG1 ) 4.47 4.47 0.00 
  peak 2111
assign (resid 914 and name  HB2 ) (resid 915 and name   HN ) 3.90 3.90 0.00 
  peak 1996
assign (resid 894 and name   HN ) (resid 895 and name  HD1 ) 3.96 3.96 0.00 
  peak 279
assign (resid 866 and name   HA ) (resid 866 and name  HG1 ) 3.90 3.90 0.00 
  peak 2114
assign (resid 882 and name   HN ) (resid 883 and name   HN ) 4.92 4.92 0.00 
  peak 1999
assign (resid 908 and name   HA ) (resid 908 and name  HG2 ) 3.72 3.72 0.00 
  peak 2118
assign (resid   8 and name  HB1 ) (resid   8 and name  HD+ ) 3.83 3.83 0.00 
  peak 2126
assign (resid   8 and name  HB2 ) (resid   8 and name  HD+ ) 3.83 3.83 0.00 
  peak 2127
assign (resid 870 and name  HB1 ) (resid 874 and name   HN ) 4.80 4.80 0.00 
  peak 2134
assign (resid 892 and name  HE+ ) (resid 913 and name  HE+ ) 5.15 5.15 0.00 
  peak 2135
assign (resid   3 and name   HA ) (resid 891 and name  HH2 ) 4.75 4.75 0.00 
  peak 2138
assign (resid   3 and name   HA ) (resid 891 and name  HZ3 ) 3.81 3.81 0.00 
  peak 2139
assign (resid 909 and name   HA ) (resid 909 and name  HD1 ) 3.72 3.72 0.00 
  peak 194
assign (resid 886 and name  HB1 ) (resid 910 and name   HZ ) 4.07 4.07 0.00 
  peak 195
assign (resid 861 and name   HA ) (resid 862 and name   HN ) 3.21 3.21 0.00 
  peak 196
assign (resid 916 and name   HA ) (resid 919 and name   HN ) 4.59 4.59 0.00 
  peak 197
assign (resid 861 and name   HA ) (resid 863 and name   HN ) 4.52 4.52 0.00 
  peak 198
assign (resid 875 and name   HA ) (resid 875 and name  HG1 ) 4.13 4.13 0.00 
  peak 1512
assign (resid 916 and name   HA ) (resid 918 and name   HN ) 4.52 4.52 0.00 
  peak 199
assign (resid 875 and name   HA ) (resid 875 and name  HG2 ) 4.13 4.13 0.00 
  peak 1513
assign (resid 894 and name  HE3 ) (resid 895 and name  HD1 ) 4.58 4.58 0.00 
  peak 280
assign (resid 877 and name   HA ) (resid 878 and name   HN ) 3.11 3.11 0.00 
  peak 205
assign (resid 869 and name HG2+ ) (resid 870 and name   HA ) 4.72 4.72 0.00 
  peak 1516
assign (resid 875 and name   HN ) (resid 876 and name  HD1 ) 5.17 5.17 0.00 
  peak 296
assign (resid 877 and name   HA ) (resid 879 and name   HN ) 3.98 3.98 0.00 
  peak 206
assign (resid 883 and name   HA ) (resid 894 and name  HE1 ) 4.42 4.42 0.00 
  peak 2005
assign (resid 883 and name   HA ) (resid 883 and name HG2+ ) 4.15 4.15 0.00 
  peak 1517
assign (resid 894 and name  HB2 ) (resid 894 and name  HE3 ) 3.71 3.71 0.00 
  peak 298
assign (resid 866 and name   HA ) (resid 867 and name   HN ) 2.95 2.95 0.00 
  peak 208
assign (resid 883 and name   HA ) (resid 891 and name  HE3 ) 4.50 4.50 0.00 
  peak 2006
assign (resid 883 and name   HA ) (resid 883 and name HG12 ) 4.18 4.18 0.00 
  peak 1519
assign (resid 887 and name   HN ) (resid 887 and name  HB1 ) 3.85 3.85 0.00 
  peak 299
assign (resid 885 and name   HA ) (resid 911 and name   HN ) 4.24 4.24 0.00 
  peak 210
assign (resid   3 and name   HB ) (resid 894 and name  HZ2 ) 3.80 3.80 0.00 
  peak 2007
assign (resid 869 and name HD1+ ) (resid 876 and name   HA ) 3.36 3.36 0.00 
  peak 1520
assign (resid 914 and name   HN ) (resid 915 and name   HA ) 5.18 5.18 0.00 
  peak 300
assign (resid 894 and name  HZ3 ) (resid 900 and name   HA ) 4.75 4.75 0.00 
  peak 2008
assign (resid 899 and name HG2+ ) (resid 903 and name  HD2 ) 4.52 4.52 0.00 
  peak 1531
assign (resid 887 and name  HB1 ) (resid 888 and name   HN ) 3.29 3.29 0.00 
  peak 301
assign (resid 892 and name  HB2 ) (resid 909 and name  HZ3 ) 4.96 4.96 0.00 
  peak 2011
assign (resid 858 and name   HA ) (resid 858 and name HG1+ ) 3.54 3.54 0.00 
  peak 1534
assign (resid 887 and name  HB1 ) (resid 910 and name  HD+ ) 3.80 3.80 0.00 
  peak 303
assign (resid 870 and name   HN ) (resid 870 and name  HB2 ) 3.31 3.31 0.00 
  peak 2014
assign (resid 858 and name   HA ) (resid 858 and name HG2+ ) 3.54 3.54 0.00 
  peak 1535
assign (resid 878 and name   HN ) (resid 879 and name  HA1 ) 5.31 5.31 0.00 
  peak 304
assign (resid 863 and name  HB1 ) (resid 863 and name  HE3 ) 3.78 3.78 0.00 
  peak 2149
assign (resid 882 and name  HE+ ) (resid 891 and name  HZ3 ) 5.50 5.50 0.00 
  peak 2015
assign (resid 871 and name  HG1 ) (resid 890 and name  HB1 ) 5.50 5.50 0.00 
  peak 1551
assign (resid 887 and name  HB1 ) (resid 910 and name  HE+ ) 4.28 4.28 0.00 
  peak 309
assign (resid 868 and name   HN ) (resid 868 and name  HB2 ) 3.51 3.51 0.00 
  peak 2159
assign (resid 858 and name HG1+ ) (resid 867 and name   HN ) 5.50 5.50 0.00 
  peak 2017
assign (resid 893 and name   HN ) (resid 893 and name  HB1 ) 4.12 4.12 0.00 
  peak 310
assign (resid 868 and name  HB2 ) (resid 868 and name  HE3 ) 3.76 3.76 0.00 
  peak 2161
assign (resid   1 and name  HB+ ) (resid 907 and name   HN ) 5.07 5.07 0.00 
  peak 2020
assign (resid 868 and name  HB1 ) (resid 868 and name  HD1 ) 3.71 3.71 0.00 
  peak 2163
assign (resid 899 and name   HB ) (resid 909 and name  HZ2 ) 5.38 5.38 0.00 
  peak 2021
assign (resid 874 and name   HN ) (resid 874 and name  HB2 ) 4.17 4.17 0.00 
  peak 2172
assign (resid 882 and name  HB1 ) (resid 882 and name  HE+ ) 3.62 3.62 0.00 
  peak 2178
assign (resid 883 and name   HA ) (resid 884 and name   HN ) 3.43 3.43 0.00 
  peak 2180
assign (resid   1 and name  HB+ ) (resid 883 and name HD1+ ) 3.21 3.21 0.00 
  peak 2182
assign (resid 883 and name   HN ) (resid 883 and name HG2+ ) 3.37 3.37 0.00 
  peak 2184
assign (resid 882 and name  HE+ ) (resid 891 and name  HB1 ) 3.52 3.52 0.00 
  peak 2189
assign (resid 885 and name   HA ) (resid 886 and name   HN ) 3.25 3.25 0.00 
  peak 211
assign (resid 885 and name   HA ) (resid 887 and name   HN ) 4.65 4.65 0.00 
  peak 212
assign (resid 895 and name   HA ) (resid 899 and name   HN ) 4.28 4.28 0.00 
  peak 214
assign (resid 895 and name   HA ) (resid 897 and name   HN ) 4.54 4.54 0.00 
  peak 215
assign (resid 895 and name   HA ) (resid 898 and name   HN ) 3.77 3.77 0.00 
  peak 216
assign (resid 871 and name  HG1 ) (resid 890 and name  HB2 ) 5.50 5.50 0.00 
  peak 1552
assign (resid 857 and name   HA ) (resid 857 and name  HD+ ) 3.44 3.44 0.00 
  peak 218
assign (resid 894 and name  HB1 ) (resid 897 and name HG2+ ) 4.83 4.83 0.00 
  peak 1564
assign (resid 884 and name  HA2 ) (resid 892 and name   HN ) 4.26 4.26 0.00 
  peak 315
assign (resid 857 and name   HA ) (resid 857 and name  HE+ ) 4.59 4.59 0.00 
  peak 219
assign (resid 883 and name HG12 ) (resid 909 and name  HB1 ) 4.64 4.64 0.00 
  peak 1577
assign (resid 896 and name  HB2 ) (resid 897 and name   HN ) 4.38 4.38 0.00 
  peak 319
assign (resid 881 and name   HA ) (resid 882 and name   HN ) 2.94 2.94 0.00 
  peak 220
assign (resid   1 and name   HA ) (resid 883 and name HG12 ) 5.48 5.48 0.00 
  peak 1578
assign (resid 893 and name   HN ) (resid 896 and name  HB2 ) 4.19 4.19 0.00 
  peak 320
assign (resid 867 and name   HA ) (resid 868 and name   HN ) 2.99 2.99 0.00 
  peak 221
assign (resid 894 and name  HB1 ) (resid 899 and name HG2+ ) 4.20 4.20 0.00 
  peak 1582
assign (resid 870 and name   HN ) (resid 870 and name  HB1 ) 3.35 3.35 0.00 
  peak 326
assign (resid 907 and name   HA ) (resid 908 and name   HN ) 2.82 2.82 0.00 
  peak 224
assign (resid 899 and name HG2+ ) (resid 903 and name  HD1 ) 4.45 4.45 0.00 
  peak 1582
assign (resid 870 and name  HB1 ) (resid 893 and name  HE1 ) 3.69 3.69 0.00 
  peak 327
assign (resid 910 and name  HB2 ) (resid 915 and name   HA ) 4.43 4.43 0.00 
  peak 1591
assign (resid 863 and name  HB1 ) (resid 865 and name   HN ) 5.16 5.16 0.00 
  peak 328
assign (resid 914 and name   HA ) (resid 917 and name  HB2 ) 5.50 5.50 0.00 
  peak 1617
assign (resid 885 and name  HB1 ) (resid 911 and name   HN ) 4.58 4.58 0.00 
  peak 329
assign (resid 917 and name  HB2 ) (resid 918 and name   HA ) 5.50 5.50 0.00 
  peak 1617
assign (resid 885 and name   HN ) (resid 885 and name  HB1 ) 3.87 3.87 0.00 
  peak 330
assign (resid 893 and name   HN ) (resid 893 and name  HB2 ) 3.60 3.60 0.00 
  peak 2206
assign (resid 920 and name  HB1 ) (resid 920 and name  HE+ ) 4.94 4.94 0.00 
  peak 1619
assign (resid 885 and name  HB1 ) (resid 888 and name   HN ) 4.21 4.21 0.00 
  peak 332
assign (resid 909 and name  HB2 ) (resid 909 and name  HE3 ) 4.16 4.16 0.00 
  peak 2218
assign (resid 885 and name  HB1 ) (resid 889 and name   HN ) 3.92 3.92 0.00 
  peak 333
assign (resid 910 and name   HN ) (resid 910 and name  HB1 ) 3.92 3.92 0.00 
  peak 2228
assign (resid 919 and name   HN ) (resid 919 and name  HB2 ) 3.84 3.84 0.00 
  peak 2236
assign (resid 894 and name  HB1 ) (resid 895 and name  HD2 ) 3.97 3.97 0.00 
  peak 2238
assign (resid   1 and name  HB+ ) (resid 883 and name HG2+ ) 4.77 4.77 0.00 
  peak 2239
assign (resid 897 and name   HB ) (resid 909 and name  HH2 ) 4.93 4.93 0.00 
  peak 2330
assign (resid   1 and name  HB+ ) (resid 899 and name HD1+ ) 4.36 4.36 0.00 
  peak 2241
assign (resid 897 and name HG1+ ) (resid 912 and name  HG2 ) 3.94 3.94 0.00 
  peak 2331
assign (resid 858 and name HG2+ ) (resid 866 and name  HB1 ) 4.48 4.48 0.00 
  peak 2243
assign (resid 897 and name HG1+ ) (resid 912 and name  HG1 ) 3.95 3.95 0.00 
  peak 2332
assign (resid 869 and name HG2+ ) (resid 874 and name  HB2 ) 5.13 5.13 0.00 
  peak 2254
assign (resid 870 and name  HB1 ) (resid 892 and name   HA ) 4.93 4.93 0.00 
  peak 2333
assign (resid 897 and name HG1+ ) (resid 911 and name  HB1 ) 4.58 4.58 0.00 
  peak 2256
assign (resid 869 and name HG12 ) (resid 876 and name   HA ) 4.87 4.87 0.00 
  peak 2337
assign (resid 867 and name HG2+ ) (resid 876 and name  HB1 ) 3.73 3.73 0.00 
  peak 2338
assign (resid 861 and name   HA ) (resid 867 and name HD1+ ) 4.72 4.72 0.00 
  peak 2341
assign (resid 867 and name   HA ) (resid 867 and name HD1+ ) 3.98 3.98 0.00 
  peak 2342
assign (resid 857 and name  HB2 ) (resid 869 and name   HB ) 4.77 4.77 0.00 
  peak 2344
assign (resid 882 and name  HB2 ) (resid 891 and name  HB1 ) 5.11 5.11 0.00 
  peak 2344
assign (resid 855 and name   HA ) (resid 856 and name   HN ) 3.01 3.01 0.00 
  peak 226
assign (resid 894 and name   HA ) (resid 894 and name  HE1 ) 4.66 4.66 0.00 
  peak 228
assign (resid 894 and name   HA ) (resid 899 and name   HN ) 4.19 4.19 0.00 
  peak 229
assign (resid 894 and name   HA ) (resid 897 and name   HN ) 4.06 4.06 0.00 
  peak 230
assign (resid 873 and name   HN ) (resid 874 and name   HA ) 4.21 4.21 0.00 
  peak 232
assign (resid 858 and name   HA ) (resid 867 and name   HB ) 5.10 5.10 0.00 
  peak 1633
assign (resid 908 and name  HB1 ) (resid 909 and name   HA ) 5.46 5.46 0.00 
  peak 1633
assign (resid 894 and name  HZ2 ) (resid 902 and name   HA ) 4.32 4.32 0.00 
  peak 334
assign (resid 904 and name   HA ) (resid 905 and name   HN ) 2.84 2.84 0.00 
  peak 234
assign (resid 902 and name   HA ) (resid 903 and name  HG2 ) 4.59 4.59 0.00 
  peak 1637
assign (resid 885 and name  HB1 ) (resid 910 and name  HD+ ) 5.50 5.50 0.00 
  peak 335
assign (resid 908 and name   HA ) (resid 909 and name   HN ) 3.20 3.20 0.00 
  peak 234
assign (resid 902 and name   HA ) (resid 903 and name  HG1 ) 4.47 4.47 0.00 
  peak 1643
assign (resid 894 and name  HZ3 ) (resid 902 and name   HA ) 5.50 5.50 0.00 
  peak 335
assign (resid 878 and name   HN ) (resid 879 and name  HA2 ) 5.31 5.31 0.00 
  peak 235
assign (resid 917 and name  HG2 ) (resid 917 and name  HE+ ) 3.80 3.80 0.00 
  peak 1646
assign (resid   2 and name  HD+ ) (resid 891 and name  HH2 ) 4.63 4.63 0.00 
  peak 338
assign (resid 909 and name   HA ) (resid 910 and name  HE+ ) 4.61 4.61 0.00 
  peak 240
assign (resid 870 and name  HB1 ) (resid 882 and name  HE+ ) 4.39 4.39 0.00 
  peak 1649
assign (resid 911 and name   HN ) (resid 912 and name  HD+ ) 4.66 4.66 0.00 
  peak 339
assign (resid 917 and name  HG1 ) (resid 917 and name  HE+ ) 3.52 3.52 0.00 
  peak 1658
assign (resid 861 and name  HB1 ) (resid 862 and name   HN ) 3.69 3.69 0.00 
  peak 341
assign (resid 887 and name  HB1 ) (resid 910 and name  HB1 ) 4.36 4.36 0.00 
  peak 1668
assign (resid 912 and name  HD+ ) (resid 913 and name   HN ) 4.05 4.05 0.00 
  peak 343
assign (resid 899 and name HG2+ ) (resid 899 and name HG12 ) 3.66 3.66 0.00 
  peak 1678
assign (resid 888 and name   HN ) (resid 888 and name  HB2 ) 3.97 3.97 0.00 
  peak 345
assign (resid 896 and name  HB1 ) (resid 897 and name HG1+ ) 3.77 3.77 0.00 
  peak 2259
assign (resid   3 and name HG2+ ) (resid 899 and name HG2+ ) 4.13 4.13 0.00 
  peak 1681
assign (resid 893 and name   HN ) (resid 896 and name  HB1 ) 4.64 4.64 0.00 
  peak 347
assign (resid 897 and name HG1+ ) (resid 911 and name  HB2 ) 4.31 4.31 0.00 
  peak 2261
assign (resid 896 and name   HN ) (resid 896 and name  HB1 ) 3.74 3.74 0.00 
  peak 348
assign (resid 892 and name  HB1 ) (resid 909 and name  HH2 ) 5.25 5.25 0.00 
  peak 2263
assign (resid 886 and name  HB2 ) (resid 910 and name  HD+ ) 4.31 4.31 0.00 
  peak 2265
assign (resid 887 and name  HB1 ) (resid 914 and name  HB2 ) 4.06 4.06 0.00 
  peak 2268
assign (resid 887 and name  HB1 ) (resid 914 and name  HB1 ) 4.23 4.23 0.00 
  peak 2269
assign (resid 857 and name  HB1 ) (resid 869 and name   HN ) 4.09 4.09 0.00 
  peak 2345
assign (resid 886 and name   HN ) (resid 910 and name   HA ) 4.12 4.12 0.00 
  peak 2270
assign (resid 857 and name  HD+ ) (resid 869 and name   HN ) 4.77 4.77 0.00 
  peak 2347
assign (resid 886 and name   HN ) (resid 910 and name  HB2 ) 5.50 5.50 0.00 
  peak 2271
assign (resid 857 and name  HE+ ) (resid 874 and name   HA ) 5.43 5.43 0.00 
  peak 2349
assign (resid 886 and name   HN ) (resid 910 and name  HD+ ) 4.40 4.40 0.00 
  peak 2272
assign (resid 888 and name   HN ) (resid 910 and name  HD+ ) 4.72 4.72 0.00 
  peak 2274
assign (resid 859 and name   HN ) (resid 869 and name HD1+ ) 4.53 4.53 0.00 
  peak 2352
assign (resid 910 and name  HB1 ) (resid 915 and name  HB+ ) 3.78 3.78 0.00 
  peak 2353
assign (resid 914 and name  HB1 ) (resid 915 and name  HB+ ) 4.59 4.59 0.00 
  peak 2355
assign (resid 869 and name   HN ) (resid 869 and name HG12 ) 4.37 4.37 0.00 
  peak 2361
assign (resid 866 and name  HB2 ) (resid 868 and name  HH2 ) 4.16 4.16 0.00 
  peak 2362
assign (resid 858 and name   HA ) (resid 859 and name   HN ) 2.86 2.86 0.00 
  peak 241
assign (resid 859 and name   HA ) (resid 860 and name   HN ) 2.96 2.96 0.00 
  peak 242
assign (resid 856 and name   HA ) (resid 857 and name   HN ) 3.08 3.08 0.00 
  peak 247
assign (resid 896 and name   HA ) (resid 898 and name   HN ) 4.80 4.80 0.00 
  peak 248
assign (resid 856 and name   HA ) (resid 857 and name  HD+ ) 4.56 4.56 0.00 
  peak 249
assign (resid 899 and name HG2+ ) (resid 901 and name  HB+ ) 4.72 4.72 0.00 
  peak 1681
assign (resid 920 and name   HA ) (resid 921 and name   HN ) 3.46 3.46 0.00 
  peak 255
assign (resid 883 and name HG2+ ) (resid 892 and name  HB2 ) 4.04 4.04 0.00 
  peak 1684
assign (resid 894 and name   HN ) (resid 894 and name  HB1 ) 3.88 3.88 0.00 
  peak 350
assign (resid 918 and name   HN ) (resid 919 and name   HA ) 5.50 5.50 0.00 
  peak 259
assign (resid 883 and name HG2+ ) (resid 897 and name HG2+ ) 3.15 3.15 0.00 
  peak 1688
assign (resid 863 and name  HB2 ) (resid 864 and name   HN ) 4.36 4.36 0.00 
  peak 351
assign (resid 871 and name   HA ) (resid 874 and name   HN ) 4.14 4.14 0.00 
  peak 261
assign (resid 883 and name HD1+ ) (resid 909 and name  HB1 ) 3.78 3.78 0.00 
  peak 1689
assign (resid 863 and name  HB2 ) (resid 865 and name   HN ) 3.92 3.92 0.00 
  peak 352
assign (resid 857 and name  HD+ ) (resid 871 and name   HA ) 5.03 5.03 0.00 
  peak 263
assign (resid 883 and name HD1+ ) (resid 903 and name  HD2 ) 4.18 4.18 0.00 
  peak 1690
assign (resid 863 and name  HB2 ) (resid 865 and name HD21 ) 4.26 4.26 0.00 
  peak 352
assign (resid 857 and name  HE+ ) (resid 871 and name   HA ) 3.81 3.81 0.00 
  peak 264
assign (resid 883 and name HD1+ ) (resid 909 and name  HB2 ) 3.91 3.91 0.00 
  peak 1691
assign (resid 863 and name   HN ) (resid 863 and name  HB2 ) 3.41 3.41 0.00 
  peak 353
assign (resid   3 and name HG2+ ) (resid 883 and name HD1+ ) 3.36 3.36 0.00 
  peak 1694
assign (resid 863 and name  HB2 ) (resid 863 and name  HD1 ) 3.70 3.70 0.00 
  peak 354
assign (resid 883 and name   HB ) (resid 883 and name HD1+ ) 3.44 3.44 0.00 
  peak 1695
assign (resid 863 and name  HB2 ) (resid 865 and name HD22 ) 4.26 4.26 0.00 
  peak 354
assign (resid 883 and name HD1+ ) (resid 897 and name HG2+ ) 4.17 4.17 0.00 
  peak 1697
assign (resid 911 and name   HN ) (resid 911 and name  HB2 ) 3.95 3.95 0.00 
  peak 359
assign (resid 888 and name   HN ) (resid 910 and name  HE+ ) 5.50 5.50 0.00 
  peak 2275
assign (resid 899 and name HD1+ ) (resid 903 and name  HG2 ) 4.49 4.49 0.00 
  peak 1716
assign (resid 902 and name   HN ) (resid 903 and name  HD1 ) 5.33 5.33 0.00 
  peak 361
assign (resid 857 and name  HD+ ) (resid 870 and name   HN ) 5.50 5.50 0.00 
  peak 2276
assign (resid 863 and name  HD1 ) (resid 864 and name   HN ) 5.50 5.50 0.00 
  peak 2277
assign (resid 892 and name  HD+ ) (resid 897 and name HG1+ ) 4.04 4.04 0.00 
  peak 2278
assign (resid 883 and name HG2+ ) (resid 899 and name HG11 ) 3.99 3.99 0.00 
  peak 2283
assign (resid 883 and name HG12 ) (resid 899 and name HD1+ ) 4.71 4.71 0.00 
  peak 2284
assign (resid 866 and name  HB1 ) (resid 868 and name  HZ3 ) 4.04 4.04 0.00 
  peak 2363
assign (resid 884 and name  HA1 ) (resid 891 and name  HE3 ) 4.58 4.58 0.00 
  peak 2286
assign (resid 908 and name  HB1 ) (resid 910 and name  HD+ ) 4.56 4.56 0.00 
  peak 2364
assign (resid 894 and name  HD1 ) (resid 899 and name   HB ) 4.72 4.72 0.00 
  peak 2288
assign (resid 908 and name  HB1 ) (resid 908 and name HE22 ) 4.48 4.48 0.00 
  peak 2365
assign (resid   4 and name HM++ ) (resid 868 and name  HB2 ) 3.49 3.49 0.00 
  peak 2291
assign (resid 866 and name  HB1 ) (resid 868 and name  HE3 ) 4.64 4.64 0.00 
  peak 2368
assign (resid   4 and name HM++ ) (resid 891 and name  HB1 ) 3.51 3.51 0.00 
  peak 2292
assign (resid 885 and name  HB2 ) (resid 886 and name   HN ) 4.33 4.33 0.00 
  peak 2369
assign (resid 882 and name   HN ) (resid 882 and name  HG1 ) 4.02 4.02 0.00 
  peak 2371
assign (resid 894 and name  HB1 ) (resid 894 and name  HE3 ) 3.71 3.71 0.00 
  peak 2373
assign (resid 891 and name  HB1 ) (resid 891 and name  HE3 ) 3.53 3.53 0.00 
  peak 2376
assign (resid 913 and name   HN ) (resid 914 and name  HB2 ) 4.67 4.67 0.00 
  peak 2382
assign (resid 868 and name  HD1 ) (resid 869 and name   HN ) 4.86 4.86 0.00 
  peak 2388
assign (resid 890 and name  HB1 ) (resid 891 and name   HN ) 3.91 3.91 0.00 
  peak 366
assign (resid 890 and name   HN ) (resid 890 and name  HB1 ) 3.87 3.87 0.00 
  peak 367
assign (resid 917 and name   HA ) (resid 919 and name   HN ) 4.33 4.33 0.00 
  peak 328
assign (resid 865 and name   HN ) (resid 865 and name  HB2 ) 3.22 3.22 0.00 
  peak 369
assign (resid 886 and name  HB2 ) (resid 908 and name HE21 ) 4.44 4.44 0.00 
  peak 331
assign (resid 865 and name  HB2 ) (resid 865 and name HD21 ) 3.60 3.60 0.00 
  peak 369
assign (resid 899 and name   HN ) (resid 900 and name   HN ) 4.84 4.84 0.00 
  peak 333
assign (resid 865 and name  HB2 ) (resid 866 and name   HN ) 4.09 4.09 0.00 
  peak 370
assign (resid 886 and name  HB2 ) (resid 909 and name   HN ) 4.42 4.42 0.00 
  peak 337
assign (resid 914 and name   HN ) (resid 914 and name  HB2 ) 3.71 3.71 0.00 
  peak 371
assign (resid 909 and name  HZ3 ) (resid 910 and name   HN ) 5.50 5.50 0.00 
  peak 342
assign (resid 906 and name   HN ) (resid 906 and name  HG2 ) 3.94 3.94 0.00 
  peak 452
assign (resid 877 and name   HN ) (resid 877 and name  HB1 ) 3.66 3.66 0.00 
  peak 372
assign (resid 909 and name   HN ) (resid 910 and name   HN ) 4.51 4.51 0.00 
  peak 343
assign (resid 910 and name  HB2 ) (resid 911 and name   HN ) 4.40 4.40 0.00 
  peak 453
assign (resid 860 and name   HN ) (resid 860 and name  HD+ ) 4.53 4.53 0.00 
  peak 373
assign (resid 909 and name  HD1 ) (resid 910 and name   HN ) 4.03 4.03 0.00 
  peak 344
assign (resid   4 and name HM++ ) (resid 891 and name  HB2 ) 3.98 3.98 0.00 
  peak 2293
assign (resid 906 and name   HN ) (resid 906 and name  HG1 ) 3.94 3.94 0.00 
  peak 454
assign (resid 865 and name  HB2 ) (resid 865 and name HD22 ) 3.60 3.60 0.00 
  peak 375
assign (resid 909 and name   HA ) (resid 910 and name   HN ) 2.92 2.92 0.00 
  peak 345
assign (resid   4 and name HM++ ) (resid 877 and name  HB2 ) 3.86 3.86 0.00 
  peak 2294
assign (resid 910 and name  HB2 ) (resid 915 and name   HN ) 4.68 4.68 0.00 
  peak 455
assign (resid 911 and name   HN ) (resid 914 and name  HB2 ) 4.19 4.19 0.00 
  peak 376
assign (resid 909 and name  HB1 ) (resid 910 and name   HN ) 4.05 4.05 0.00 
  peak 346
assign (resid 857 and name  HB2 ) (resid 869 and name   HN ) 4.60 4.60 0.00 
  peak 2303
assign (resid 876 and name  HB2 ) (resid 877 and name   HN ) 3.79 3.79 0.00 
  peak 461
assign (resid 866 and name HE21 ) (resid 868 and name  HE1 ) 5.50 5.50 0.00 
  peak 348
assign (resid 868 and name  HB2 ) (resid 869 and name   HN ) 4.59 4.59 0.00 
  peak 2304
assign (resid 895 and name  HG1 ) (resid 896 and name   HN ) 4.51 4.51 0.00 
  peak 462
assign (resid   3 and name   HA ) (resid 883 and name   HB ) 4.96 4.96 0.00 
  peak 2305
assign (resid 900 and name  HB2 ) (resid 901 and name   HN ) 4.23 4.23 0.00 
  peak 463
assign (resid   3 and name HG2+ ) (resid 884 and name   HN ) 4.30 4.30 0.00 
  peak 2306
assign (resid 900 and name   HN ) (resid 900 and name  HB2 ) 4.05 4.05 0.00 
  peak 464
assign (resid 868 and name   HN ) (resid 868 and name  HZ3 ) 4.84 4.84 0.00 
  peak 2389
assign (resid   3 and name HG2+ ) (resid 903 and name  HD2 ) 3.67 3.67 0.00 
  peak 2309
assign (resid 906 and name   HN ) (resid 906 and name  HB1 ) 4.06 4.06 0.00 
  peak 467
assign (resid 909 and name  HE1 ) (resid 910 and name   HN ) 4.91 4.91 0.00 
  peak 2390
assign (resid   3 and name HG2+ ) (resid 903 and name  HD1 ) 3.75 3.75 0.00 
  peak 2310
assign (resid 907 and name  HB1 ) (resid 908 and name   HN ) 3.97 3.97 0.00 
  peak 468
assign (resid 859 and name   HN ) (resid 867 and name HD1+ ) 5.50 5.50 0.00 
  peak 2394
assign (resid   4 and name   HN ) (resid 883 and name   HA ) 4.62 4.62 0.00 
  peak 2311
assign (resid 866 and name   HN ) (resid 867 and name HD1+ ) 5.50 5.50 0.00 
  peak 2394
assign (resid   2 and name   HN ) (resid 891 and name  HH2 ) 5.50 5.50 0.00 
  peak 2312
assign (resid 892 and name  HB2 ) (resid 893 and name   HN ) 4.25 4.25 0.00 
  peak 2401
assign (resid 892 and name   HN ) (resid 892 and name  HB2 ) 3.64 3.64 0.00 
  peak 2402
assign (resid 857 and name  HB1 ) (resid 858 and name   HN ) 4.01 4.01 0.00 
  peak 2405
assign (resid 882 and name  HB2 ) (resid 883 and name   HA ) 4.91 4.91 0.00 
  peak 2407
assign (resid 910 and name   HA ) (resid 914 and name  HB2 ) 4.62 4.62 0.00 
  peak 2410
assign (resid 880 and name  HB1 ) (resid 881 and name  HD2 ) 4.21 4.21 0.00 
  peak 2413
assign (resid 910 and name  HD+ ) (resid 914 and name  HB2 ) 4.29 4.29 0.00 
  peak 377
assign (resid 882 and name  HG1 ) (resid 883 and name   HN ) 5.21 5.21 0.00 
  peak 378
assign (resid 860 and name   HA ) (resid 861 and name   HN ) 2.96 2.96 0.00 
  peak 351
assign (resid 882 and name  HG1 ) (resid 893 and name  HD2 ) 4.25 4.25 0.00 
  peak 380
assign (resid 894 and name   HN ) (resid 895 and name  HD2 ) 4.09 4.09 0.00 
  peak 361
assign (resid 892 and name  HB1 ) (resid 893 and name   HN ) 3.89 3.89 0.00 
  peak 381
assign (resid 894 and name   HN ) (resid 894 and name  HB2 ) 3.91 3.91 0.00 
  peak 363
assign (resid 892 and name   HN ) (resid 892 and name  HB1 ) 4.02 4.02 0.00 
  peak 382
assign (resid 894 and name   HN ) (resid 895 and name   HA ) 5.50 5.50 0.00 
  peak 365
assign (resid 914 and name   HN ) (resid 917 and name  HE+ ) 5.50 5.50 0.00 
  peak 383
assign (resid 919 and name   HN ) (resid 920 and name   HN ) 4.34 4.34 0.00 
  peak 366
assign (resid 909 and name  HZ2 ) (resid 912 and name  HG1 ) 5.40 5.40 0.00 
  peak 470
assign (resid 874 and name  HB2 ) (resid 875 and name   HN ) 4.92 4.92 0.00 
  peak 385
assign (resid   3 and name   HB ) (resid 894 and name  HE1 ) 3.99 3.99 0.00 
  peak 376
assign (resid 891 and name   HN ) (resid 891 and name  HB1 ) 3.82 3.82 0.00 
  peak 389
assign (resid   3 and name   HA ) (resid 894 and name  HE1 ) 4.59 4.59 0.00 
  peak 378
assign (resid   4 and name HM++ ) (resid 868 and name  HZ2 ) 4.43 4.43 0.00 
  peak 2314
assign (resid 905 and name  HB1 ) (resid 906 and name   HN ) 4.43 4.43 0.00 
  peak 478
assign (resid 857 and name   HN ) (resid 857 and name  HB2 ) 3.33 3.33 0.00 
  peak 390
assign (resid   3 and name   HB ) (resid 882 and name   HN ) 5.19 5.19 0.00 
  peak 379
assign (resid   4 and name HM++ ) (resid 868 and name  HH2 ) 4.13 4.13 0.00 
  peak 2315
assign (resid 876 and name  HB1 ) (resid 877 and name   HN ) 3.79 3.79 0.00 
  peak 479
assign (resid 885 and name  HB2 ) (resid 911 and name   HN ) 3.65 3.65 0.00 
  peak 393
assign (resid 858 and name   HA ) (resid 867 and name   HN ) 4.80 4.80 0.00 
  peak 382
assign (resid 871 and name  HG1 ) (resid 892 and name  HE+ ) 4.95 4.95 0.00 
  peak 2316
assign (resid 913 and name  HB1 ) (resid 914 and name   HN ) 3.80 3.80 0.00 
  peak 480
assign (resid 859 and name   HA ) (resid 867 and name   HN ) 5.39 5.39 0.00 
  peak 382
assign (resid   2 and name  HB2 ) (resid 884 and name   HN ) 4.64 4.64 0.00 
  peak 2320
assign (resid 913 and name   HN ) (resid 913 and name  HB1 ) 3.81 3.81 0.00 
  peak 481
assign (resid 882 and name   HN ) (resid 894 and name  HE1 ) 4.61 4.61 0.00 
  peak 2322
assign (resid 907 and name  HB2 ) (resid 908 and name   HN ) 3.97 3.97 0.00 
  peak 485
assign (resid 882 and name  HB2 ) (resid 891 and name  HE3 ) 3.53 3.53 0.00 
  peak 2324
assign (resid 912 and name  HG2 ) (resid 913 and name   HN ) 3.23 3.23 0.00 
  peak 487
assign (resid 911 and name   HA ) (resid 912 and name   HA ) 4.46 4.46 0.00 
  peak 2414
assign (resid 882 and name  HB2 ) (resid 892 and name   HN ) 5.33 5.33 0.00 
  peak 2325
assign (resid 870 and name  HB2 ) (resid 893 and name   HN ) 3.89 3.89 0.00 
  peak 489
assign (resid 917 and name  HG1 ) (resid 918 and name   HA ) 4.04 4.04 0.00 
  peak 2418
assign (resid 894 and name  HE3 ) (resid 899 and name HG2+ ) 3.67 3.67 0.00 
  peak 2326
assign (resid 870 and name  HB2 ) (resid 873 and name   HN ) 5.02 5.02 0.00 
  peak 490
assign (resid 918 and name   HA ) (resid 918 and name HG12 ) 3.89 3.89 0.00 
  peak 2418
assign (resid 894 and name  HE3 ) (resid 900 and name   HA ) 4.08 4.08 0.00 
  peak 2327
assign (resid   1 and name  HB+ ) (resid 908 and name   HA ) 3.72 3.72 0.00 
  peak 2430
assign (resid 894 and name  HE1 ) (resid 902 and name  HB+ ) 4.29 4.29 0.00 
  peak 2328
assign (resid   3 and name   HN ) (resid 891 and name  HH2 ) 4.85 4.85 0.00 
  peak 2432
assign (resid   4 and name  HB+ ) (resid   4 and name  HD+ ) 3.31 3.31 0.00 
  peak 26
assign (resid   4 and name  HB+ ) (resid 891 and name  HZ3 ) 5.35 5.35 0.00 
  peak 2015
assign (resid   4 and name  HG+ ) (resid 891 and name  HZ3 ) 3.88 3.88 0.00 
  peak 48
assign (resid   4 and name  HD+ ) (resid   4 and name HM++ ) 2.81 2.81 0.00 
  peak 1747
assign (resid 914 and name  HB1 ) (resid 915 and name   HN ) 3.77 3.77 0.00 
  peak 394
assign (resid 885 and name   HN ) (resid 885 and name  HB2 ) 3.68 3.68 0.00 
  peak 395
assign (resid 858 and name   HA ) (resid 869 and name   HN ) 4.47 4.47 0.00 
  peak 383
assign (resid 888 and name   HN ) (resid 888 and name  HB1 ) 3.97 3.97 0.00 
  peak 399
assign (resid 859 and name   HN ) (resid 867 and name   HA ) 4.96 4.96 0.00 
  peak 384
assign (resid 886 and name  HB2 ) (resid 887 and name   HN ) 4.66 4.66 0.00 
  peak 400
assign (resid 861 and name   HN ) (resid 867 and name HD1+ ) 4.32 4.32 0.00 
  peak 386
assign (resid 897 and name   HB ) (resid 899 and name   HN ) 4.65 4.65 0.00 
  peak 401
assign (resid 855 and name   HN ) (resid 855 and name  HB1 ) 4.12 4.12 0.00 
  peak 397
assign (resid 886 and name  HB2 ) (resid 910 and name   HZ ) 4.39 4.39 0.00 
  peak 403
assign (resid 855 and name   HN ) (resid 855 and name  HG+ ) 4.23 4.23 0.00 
  peak 398
assign (resid 870 and name  HB2 ) (resid 893 and name  HE1 ) 3.76 3.76 0.00 
  peak 491
assign (resid 886 and name  HB2 ) (resid 910 and name  HE+ ) 4.07 4.07 0.00 
  peak 404
assign (resid 856 and name   HN ) (resid 856 and name  HB+ ) 3.09 3.09 0.00 
  peak 401
assign (resid 882 and name  HG2 ) (resid 883 and name   HN ) 4.58 4.58 0.00 
  peak 492
assign (resid 886 and name   HN ) (resid 886 and name  HB2 ) 3.72 3.72 0.00 
  peak 405
assign (resid 857 and name   HN ) (resid 857 and name  HB1 ) 4.02 4.02 0.00 
  peak 405
assign (resid 882 and name  HG2 ) (resid 893 and name  HD2 ) 3.96 3.96 0.00 
  peak 493
assign (resid 861 and name  HB2 ) (resid 862 and name   HN ) 3.69 3.69 0.00 
  peak 409
assign (resid 857 and name   HN ) (resid 857 and name  HE+ ) 5.40 5.40 0.00 
  peak 407
assign (resid 900 and name   HN ) (resid 900 and name  HB1 ) 4.05 4.05 0.00 
  peak 494
assign (resid 865 and name  HB1 ) (resid 866 and name   HN ) 3.67 3.67 0.00 
  peak 413
assign (resid 858 and name   HN ) (resid 858 and name   HB ) 3.60 3.60 0.00 
  peak 410
assign (resid 900 and name  HB1 ) (resid 901 and name   HN ) 4.23 4.23 0.00 
  peak 495
assign (resid 859 and name   HN ) (resid 859 and name   HB ) 4.01 4.01 0.00 
  peak 415
assign (resid 908 and name   HN ) (resid 908 and name  HB2 ) 3.43 3.43 0.00 
  peak 496
assign (resid 908 and name  HB2 ) (resid 909 and name   HN ) 3.68 3.68 0.00 
  peak 497
assign (resid 886 and name  HB1 ) (resid 910 and name  HE+ ) 3.81 3.81 0.00 
  peak 498
assign (resid   4 and name HM++ ) (resid 877 and name  HB+ ) 3.27 3.27 0.00 
  peak 80
assign (resid 886 and name  HB1 ) (resid 910 and name  HD+ ) 4.36 4.36 0.00 
  peak 499
assign (resid   5 and name  HB+ ) (resid   5 and name HE2+ ) 3.70 3.70 0.00 
  peak 32
assign (resid 886 and name   HN ) (resid 886 and name  HB1 ) 3.53 3.53 0.00 
  peak 500
assign (resid   5 and name  HB+ ) (resid 881 and name   HA ) 4.45 4.45 0.00 
  peak 728
assign (resid   5 and name  HG+ ) (resid   5 and name HE2+ ) 3.37 3.37 0.00 
  peak 472
assign (resid   8 and name  HB+ ) (resid   8 and name  HD+ ) 3.34 3.34 0.00 
  peak 2127
assign (resid 855 and name   HN ) (resid 855 and name  HB+ ) 3.48 3.48 0.00 
  peak 397
assign (resid 865 and name  HB1 ) (resid 865 and name HD2+ ) 3.58 3.58 0.00 
  peak 412
assign (resid 855 and name  HB+ ) (resid 856 and name   HN ) 4.11 4.11 0.00 
  peak 1310
assign (resid 867 and name HG2+ ) (resid 877 and name  HB+ ) 3.92 3.92 0.00 
  peak 672
assign (resid 856 and name  HB+ ) (resid 858 and name HG++ ) 4.22 4.22 0.00 
  peak 1708
assign (resid 868 and name   HN ) (resid 877 and name  HB+ ) 4.98 4.98 0.00 
  peak 2099
assign (resid 857 and name   HN ) (resid 858 and name HG++ ) 4.83 4.83 0.00 
  peak 2018
assign (resid 869 and name   HN ) (resid 869 and name HG1+ ) 3.63 3.63 0.00 
  peak 623
assign (resid 857 and name  HD+ ) (resid 869 and name HG1+ ) 3.89 3.89 0.00 
  peak 1427
assign (resid 869 and name   HA ) (resid 876 and name  HB+ ) 4.12 4.12 0.00 
  peak 1922
assign (resid 869 and name HG2+ ) (resid 869 and name HG1+ ) 2.99 2.99 0.00 
  peak 1972
assign (resid 869 and name HG2+ ) (resid 874 and name  HB+ ) 4.28 4.28 0.00 
  peak 1880
assign (resid 869 and name HG2+ ) (resid 874 and name HD2+ ) 5.34 5.34 0.00 
  peak 1389
assign (resid 869 and name HG2+ ) (resid 875 and name  HB+ ) 4.84 4.84 0.00 
  peak 2335
assign (resid 869 and name HG1+ ) (resid 876 and name   HA ) 4.26 4.26 0.00 
  peak 1501
assign (resid 861 and name  HB2 ) (resid 863 and name   HN ) 4.61 4.61 0.00 
  peak 414
assign (resid 891 and name   HN ) (resid 891 and name  HB2 ) 3.40 3.40 0.00 
  peak 416
assign (resid 860 and name   HN ) (resid 860 and name  HG1 ) 3.98 3.98 0.00 
  peak 421
assign (resid 907 and name  HG+ ) (resid 908 and name   HN ) 3.61 3.61 0.00 
  peak 417
assign (resid 860 and name   HN ) (resid 860 and name  HB+ ) 3.37 3.37 0.00 
  peak 422
assign (resid 907 and name   HN ) (resid 907 and name  HG+ ) 4.09 4.09 0.00 
  peak 419
assign (resid 861 and name   HN ) (resid 861 and name  HB2 ) 4.07 4.07 0.00 
  peak 425
assign (resid 887 and name   HN ) (resid 887 and name  HB2 ) 3.86 3.86 0.00 
  peak 421
assign (resid 862 and name   HN ) (resid 862 and name  HB2 ) 3.60 3.60 0.00 
  peak 428
assign (resid 887 and name  HB2 ) (resid 888 and name   HN ) 3.60 3.60 0.00 
  peak 422
assign (resid 862 and name  HB1 ) (resid 863 and name   HN ) 4.27 4.27 0.00 
  peak 431
assign (resid   2 and name  HG+ ) (resid   3 and name   HN ) 4.22 4.22 0.00 
  peak 503
assign (resid 887 and name  HB2 ) (resid 910 and name  HE+ ) 3.71 3.71 0.00 
  peak 424
assign (resid 863 and name   HN ) (resid 863 and name  HB1 ) 3.71 3.71 0.00 
  peak 436
assign (resid   2 and name  HG+ ) (resid 891 and name  HZ2 ) 4.05 4.05 0.00 
  peak 506
assign (resid 887 and name  HB2 ) (resid 910 and name  HD+ ) 3.51 3.51 0.00 
  peak 425
assign (resid 862 and name  HG+ ) (resid 863 and name  HE1 ) 4.31 4.31 0.00 
  peak 438
assign (resid 904 and name  HB2 ) (resid 906 and name   HN ) 4.20 4.20 0.00 
  peak 508
assign (resid 877 and name  HB2 ) (resid 878 and name   HN ) 4.60 4.60 0.00 
  peak 427
assign (resid 866 and name   HN ) (resid 866 and name  HG2 ) 4.23 4.23 0.00 
  peak 454
assign (resid 869 and name   HN ) (resid 869 and name   HB ) 3.41 3.41 0.00 
  peak 509
assign (resid 890 and name  HB2 ) (resid 891 and name   HN ) 3.91 3.91 0.00 
  peak 428
assign (resid 873 and name   HN ) (resid 873 and name  HB1 ) 3.95 3.95 0.00 
  peak 487
assign (resid 869 and name   HB ) (resid 870 and name   HN ) 4.91 4.91 0.00 
  peak 510
assign (resid 877 and name   HN ) (resid 877 and name  HB2 ) 3.66 3.66 0.00 
  peak 508
assign (resid   2 and name  HB1 ) (resid 884 and name   HN ) 4.43 4.43 0.00 
  peak 512
assign (resid   2 and name  HB2 ) (resid 891 and name  HZ2 ) 4.78 4.78 0.00 
  peak 513
assign (resid 866 and name  HB1 ) (resid 868 and name  HH2 ) 4.15 4.15 0.00 
  peak 514
assign (resid 857 and name  HE+ ) (resid 869 and name HG1+ ) 5.34 5.34 0.00 
  peak 1441
assign (resid 857 and name  HD+ ) (resid 869 and name   HB ) 3.38 3.38 0.00 
  peak 515
assign (resid 857 and name  HE+ ) (resid 871 and name  HB+ ) 4.39 4.39 0.00 
  peak 535
assign (resid 866 and name  HB1 ) (resid 866 and name HE21 ) 4.07 4.07 0.00 
  peak 516
assign (resid 858 and name   HN ) (resid 858 and name HG++ ) 3.39 3.39 0.00 
  peak 664
assign (resid 858 and name   HA ) (resid 859 and name HG1+ ) 4.25 4.25 0.00 
  peak 1886
assign (resid 858 and name HG++ ) (resid 859 and name   HN ) 3.41 3.41 0.00 
  peak 666
assign (resid 858 and name HG++ ) (resid 859 and name HG2+ ) 4.27 4.27 0.00 
  peak 9
assign (resid 869 and name HD1+ ) (resid 876 and name  HB+ ) 3.34 3.34 0.00 
  peak 1962
assign (resid 858 and name HG++ ) (resid 860 and name   HN ) 5.25 5.25 0.00 
  peak 22
assign (resid 870 and name   HA ) (resid 871 and name  HB+ ) 4.86 4.86 0.00 
  peak 2406
assign (resid 858 and name HG++ ) (resid 866 and name   HA ) 4.18 4.18 0.00 
  peak 848
assign (resid 871 and name  HB+ ) (resid 872 and name   HN ) 4.00 4.00 0.00 
  peak 2380
assign (resid 858 and name HG++ ) (resid 866 and name  HB2 ) 3.63 3.63 0.00 
  peak 850
assign (resid 871 and name  HB+ ) (resid 892 and name  HE+ ) 5.34 5.34 0.00 
  peak 1439
assign (resid 858 and name HG++ ) (resid 866 and name  HB1 ) 3.72 3.72 0.00 
  peak 2243
assign (resid 871 and name  HD+ ) (resid 872 and name   HN ) 3.80 3.80 0.00 
  peak 553
assign (resid 871 and name  HD+ ) (resid 874 and name   HN ) 5.27 5.27 0.00 
  peak 1153
assign (resid 871 and name  HD+ ) (resid 892 and name   HA ) 4.46 4.46 0.00 
  peak 731
assign (resid 871 and name  HD+ ) (resid 892 and name  HE+ ) 4.67 4.67 0.00 
  peak 2349
assign (resid 873 and name  HB+ ) (resid 875 and name  HG+ ) 4.68 4.68 0.00 
  peak 756
assign (resid 873 and name  HB+ ) (resid 875 and name  HD+ ) 4.53 4.53 0.00 
  peak 757
assign (resid 910 and name  HB1 ) (resid 915 and name   HN ) 4.31 4.31 0.00 
  peak 434
assign (resid 910 and name  HB1 ) (resid 914 and name   HN ) 4.66 4.66 0.00 
  peak 435
assign (resid 880 and name   HN ) (resid 880 and name  HB2 ) 3.90 3.90 0.00 
  peak 516
assign (resid 911 and name   HN ) (resid 911 and name  HB1 ) 3.56 3.56 0.00 
  peak 436
assign (resid 890 and name   HN ) (resid 890 and name  HB2 ) 3.87 3.87 0.00 
  peak 540
assign (resid 900 and name   HN ) (resid 900 and name  HG2 ) 3.99 3.99 0.00 
  peak 440
assign (resid 896 and name   HN ) (resid 896 and name  HB2 ) 3.51 3.51 0.00 
  peak 565
assign (resid 895 and name  HB1 ) (resid 896 and name   HN ) 4.49 4.49 0.00 
  peak 442
assign (resid 902 and name   HN ) (resid 902 and name  HB+ ) 2.87 2.87 0.00 
  peak 584
assign (resid 908 and name   HN ) (resid 908 and name  HG2 ) 4.24 4.24 0.00 
  peak 443
assign (resid 905 and name   HN ) (resid 905 and name  HG2 ) 3.90 3.90 0.00 
  peak 587
assign (resid 857 and name  HE+ ) (resid 869 and name   HB ) 4.60 4.60 0.00 
  peak 516
assign (resid 875 and name   HN ) (resid 875 and name  HB2 ) 3.94 3.94 0.00 
  peak 445
assign (resid 907 and name   HN ) (resid 907 and name  HB2 ) 3.21 3.21 0.00 
  peak 594
assign (resid 882 and name  HB2 ) (resid 883 and name   HN ) 4.10 4.10 0.00 
  peak 517
assign (resid 912 and name  HB1 ) (resid 913 and name   HN ) 4.52 4.52 0.00 
  peak 448
assign (resid 907 and name   HN ) (resid 907 and name  HB1 ) 3.21 3.21 0.00 
  peak 595
assign (resid 866 and name   HN ) (resid 866 and name  HB1 ) 3.66 3.66 0.00 
  peak 518
assign (resid 882 and name  HB1 ) (resid 892 and name   HN ) 4.44 4.44 0.00 
  peak 450
assign (resid 908 and name   HN ) (resid 908 and name  HG1 ) 4.24 4.24 0.00 
  peak 601
assign (resid   4 and name   HN ) (resid 882 and name  HB2 ) 4.55 4.55 0.00 
  peak 519
assign (resid 882 and name  HB1 ) (resid 891 and name  HE3 ) 3.68 3.68 0.00 
  peak 451
assign (resid 908 and name  HB2 ) (resid 908 and name HE21 ) 4.57 4.57 0.00 
  peak 602
assign (resid 875 and name  HD+ ) (resid 893 and name  HE1 ) 5.32 5.32 0.00 
  peak 523
assign (resid 909 and name   HN ) (resid 909 and name  HB1 ) 3.97 3.97 0.00 
  peak 614
assign (resid 916 and name   HN ) (resid 917 and name  HB1 ) 5.50 5.50 0.00 
  peak 523
assign (resid   2 and name  HB1 ) (resid   2 and name   HE ) 4.53 4.53 0.00 
  peak 524
assign (resid   2 and name  HB1 ) (resid 891 and name  HZ3 ) 4.90 4.90 0.00 
  peak 525
assign (resid 858 and name HG++ ) (resid 866 and name  HG2 ) 3.79 3.79 0.00 
  peak 847
assign (resid 908 and name  HB1 ) (resid 910 and name   HZ ) 4.07 4.07 0.00 
  peak 530
assign (resid 858 and name HG++ ) (resid 866 and name  HG1 ) 3.81 3.81 0.00 
  peak 2351
assign (resid 908 and name  HB1 ) (resid 909 and name   HN ) 3.65 3.65 0.00 
  peak 531
assign (resid 858 and name HG++ ) (resid 866 and name HE21 ) 3.82 3.82 0.00 
  peak 1444
assign (resid 858 and name HG++ ) (resid 866 and name HE22 ) 4.04 4.04 0.00 
  peak 257
assign (resid 858 and name HG++ ) (resid 867 and name   HN ) 4.08 4.08 0.00 
  peak 667
assign (resid 858 and name HG++ ) (resid 868 and name   HA ) 3.89 3.89 0.00 
  peak 888
assign (resid 865 and name   HN ) (resid 866 and name   HN ) 4.63 4.63 0.00 
  peak 23
assign (resid 874 and name   HN ) (resid 874 and name  HB+ ) 3.63 3.63 0.00 
  peak 2172
assign (resid 858 and name HG++ ) (resid 868 and name  HD1 ) 4.14 4.14 0.00 
  peak 894
assign (resid 906 and name   HN ) (resid 907 and name   HN ) 3.27 3.27 0.00 
  peak 40
assign (resid 874 and name   HA ) (resid 874 and name HD2+ ) 4.43 4.43 0.00 
  peak 233
assign (resid 858 and name HG++ ) (resid 868 and name  HE1 ) 3.95 3.95 0.00 
  peak 1456
assign (resid 905 and name   HA ) (resid 907 and name   HN ) 4.27 4.27 0.00 
  peak 42
assign (resid 874 and name  HB+ ) (resid 874 and name HD2+ ) 3.08 3.08 0.00 
  peak 386
assign (resid 858 and name HG++ ) (resid 868 and name  HZ2 ) 3.98 3.98 0.00 
  peak 887
assign (resid 904 and name  HB1 ) (resid 907 and name   HN ) 4.63 4.63 0.00 
  peak 43
assign (resid 874 and name  HB+ ) (resid 875 and name   HN ) 4.27 4.27 0.00 
  peak 280
assign (resid 859 and name HG2+ ) (resid 859 and name HG1+ ) 3.02 3.02 0.00 
  peak 2131
assign (resid 904 and name  HB2 ) (resid 907 and name   HN ) 3.89 3.89 0.00 
  peak 45
assign (resid 875 and name   HN ) (resid 875 and name  HB+ ) 3.34 3.34 0.00 
  peak 445
assign (resid 920 and name  HB1 ) (resid 921 and name   HN ) 4.41 4.41 0.00 
  peak 46
assign (resid 875 and name   HN ) (resid 875 and name  HG+ ) 3.74 3.74 0.00 
  peak 507
assign (resid 920 and name  HB2 ) (resid 921 and name   HN ) 4.41 4.41 0.00 
  peak 48
assign (resid 875 and name   HA ) (resid 875 and name  HG+ ) 3.53 3.53 0.00 
  peak 1513
assign (resid 893 and name   HN ) (resid 897 and name HG1+ ) 4.45 4.45 0.00 
  peak 50
assign (resid 875 and name  HB+ ) (resid 875 and name  HD+ ) 3.35 3.35 0.00 
  peak 36
assign (resid 893 and name   HN ) (resid 894 and name   HN ) 4.81 4.81 0.00 
  peak 51
assign (resid 875 and name  HB+ ) (resid 875 and name  HE+ ) 4.20 4.20 0.00 
  peak 1191
assign (resid 870 and name  HB1 ) (resid 893 and name   HN ) 4.36 4.36 0.00 
  peak 54
assign (resid 875 and name  HB+ ) (resid 876 and name  HD2 ) 3.35 3.35 0.00 
  peak 1832
assign (resid 910 and name   HN ) (resid 910 and name  HB2 ) 3.63 3.63 0.00 
  peak 620
assign (resid 914 and name   HN ) (resid 914 and name  HB1 ) 3.59 3.59 0.00 
  peak 636
assign (resid 916 and name   HN ) (resid 916 and name  HB2 ) 3.58 3.58 0.00 
  peak 643
assign (resid 916 and name   HN ) (resid 916 and name  HB1 ) 3.58 3.58 0.00 
  peak 644
assign (resid 917 and name   HN ) (resid 917 and name  HB1 ) 3.12 3.12 0.00 
  peak 654
assign (resid 908 and name   HN ) (resid 908 and name  HB1 ) 3.91 3.91 0.00 
  peak 532
assign (resid 917 and name   HN ) (resid 917 and name  HG2 ) 3.54 3.54 0.00 
  peak 655
assign (resid 867 and name   HN ) (resid 867 and name   HB ) 3.46 3.46 0.00 
  peak 534
assign (resid 917 and name   HN ) (resid 917 and name  HG1 ) 3.86 3.86 0.00 
  peak 656
assign (resid 867 and name HG2+ ) (resid 869 and name   HN ) 4.50 4.50 0.00 
  peak 179
assign (resid 857 and name  HE+ ) (resid 871 and name  HB1 ) 5.20 5.20 0.00 
  peak 535
assign (resid 917 and name   HN ) (resid 917 and name  HE+ ) 4.49 4.49 0.00 
  peak 657
assign (resid 867 and name HG2+ ) (resid 869 and name   HA ) 4.29 4.29 0.00 
  peak 180
assign (resid 859 and name   HN ) (resid 867 and name   HB ) 3.84 3.84 0.00 
  peak 536
assign (resid 918 and name   HN ) (resid 918 and name   HB ) 2.93 2.93 0.00 
  peak 659
assign (resid 901 and name   HA ) (resid 902 and name  HB+ ) 4.23 4.23 0.00 
  peak 185
assign (resid   8 and name  HG+ ) (resid   9 and name   HN ) 5.16 5.16 0.00 
  peak 540
assign (resid 918 and name   HN ) (resid 918 and name HG11 ) 3.55 3.55 0.00 
  peak 660
assign (resid 902 and name  HB+ ) (resid 903 and name  HD1 ) 4.20 4.20 0.00 
  peak 186
assign (resid 860 and name  HB+ ) (resid 861 and name   HN ) 3.48 3.48 0.00 
  peak 544
assign (resid 918 and name   HN ) (resid 918 and name HG2+ ) 3.94 3.94 0.00 
  peak 188
assign (resid 910 and name  HD+ ) (resid 915 and name  HB+ ) 4.53 4.53 0.00 
  peak 617
assign (resid 860 and name  HB+ ) (resid 864 and name   HN ) 4.42 4.42 0.00 
  peak 545
assign (resid 869 and name   HN ) (resid 869 and name HG2+ ) 4.26 4.26 0.00 
  peak 189
assign (resid 883 and name   HB ) (resid 894 and name  HE1 ) 3.51 3.51 0.00 
  peak 618
assign (resid 866 and name   HN ) (resid 866 and name  HG1 ) 3.97 3.97 0.00 
  peak 547
assign (resid 869 and name HG2+ ) (resid 876 and name   HA ) 3.96 3.96 0.00 
  peak 193
assign (resid 859 and name HG1+ ) (resid 860 and name   HN ) 3.93 3.93 0.00 
  peak 1304
assign (resid 883 and name   HB ) (resid 884 and name   HN ) 4.37 4.37 0.00 
  peak 619
assign (resid 903 and name  HG1 ) (resid 909 and name  HD1 ) 4.78 4.78 0.00 
  peak 549
assign (resid 894 and name  HB2 ) (resid 899 and name HG2+ ) 4.47 4.47 0.00 
  peak 201
assign (resid 859 and name HG1+ ) (resid 867 and name   HN ) 4.61 4.61 0.00 
  peak 2359
assign (resid 867 and name   HN ) (resid 867 and name HG11 ) 4.12 4.12 0.00 
  peak 621
assign (resid 871 and name  HD2 ) (resid 872 and name   HN ) 4.35 4.35 0.00 
  peak 553
assign (resid 899 and name HG2+ ) (resid 902 and name   HA ) 4.27 4.27 0.00 
  peak 202
assign (resid 860 and name  HB+ ) (resid 864 and name  HA+ ) 3.68 3.68 0.00 
  peak 33
assign (resid   4 and name   HN ) (resid   4 and name  HG2 ) 4.44 4.44 0.00 
  peak 622
assign (resid 894 and name  HZ3 ) (resid 899 and name HG2+ ) 4.35 4.35 0.00 
  peak 204
assign (resid 860 and name  HG+ ) (resid 861 and name   HN ) 4.05 4.05 0.00 
  peak 260
assign (resid 869 and name   HN ) (resid 869 and name HG11 ) 4.37 4.37 0.00 
  peak 623
assign (resid 860 and name  HG+ ) (resid 864 and name   HN ) 5.06 5.06 0.00 
  peak 1312
assign (resid 859 and name   HN ) (resid 859 and name HG11 ) 3.69 3.69 0.00 
  peak 626
assign (resid 860 and name  HD+ ) (resid 864 and name  HA+ ) 3.76 3.76 0.00 
  peak 567
assign (resid   4 and name   HN ) (resid   4 and name  HG1 ) 4.44 4.44 0.00 
  peak 628
assign (resid 885 and name  HB1 ) (resid 890 and name   HN ) 3.78 3.78 0.00 
  peak 61
assign (resid 875 and name  HB+ ) (resid 876 and name  HD1 ) 3.82 3.82 0.00 
  peak 592
assign (resid 861 and name   HN ) (resid 861 and name  HB+ ) 3.37 3.37 0.00 
  peak 425
assign (resid 867 and name HG2+ ) (resid 868 and name   HN ) 3.64 3.64 0.00 
  peak 629
assign (resid 885 and name  HB2 ) (resid 890 and name   HN ) 4.17 4.17 0.00 
  peak 62
assign (resid 914 and name   SG ) (resid 940 ) 2.50 0.00 0.00 
  peak 62
assign (resid 911 and name   SG ) (resid 940 ) 2.50 0.00 0.00 
  peak 62
assign (resid 888 and name   SG ) (resid 940 ) 2.50 0.00 0.00 
  peak 62
assign (resid 885 and name   SG ) (resid 940 ) 2.50 0.00 0.00 
  peak 62
assign (resid 870 and name   SG ) (resid 960 ) 2.50 0.00 0.00 
  peak 62
assign (resid 873 and name   SG ) (resid 960 ) 2.50 0.00 0.00 
  peak 62
assign (resid 896 and name   SG ) (resid 960 ) 2.50 0.00 0.00 
  peak 62
assign (resid 893 and name  ND1 ) (resid 960 ) 1.95 0.00 0.00 
  peak 62
assign (resid 885 and name   SG ) (resid 888 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 885 and name   SG ) (resid 911 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 885 and name   SG ) (resid 914 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 888 and name   SG ) (resid 911 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 888 and name   SG ) (resid 914 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 911 and name   SG ) (resid 914 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 870 and name   SG ) (resid 873 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 870 and name   SG ) (resid 893 and name  ND1 ) 3.80 0.00 0.00 
  peak 62
assign (resid 870 and name   SG ) (resid 896 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 873 and name   SG ) (resid 893 and name  ND1 ) 3.80 0.00 0.00 
  peak 62
assign (resid 873 and name   SG ) (resid 896 and name   SG ) 4.00 0.00 0.00 
  peak 62
assign (resid 893 and name  ND1 ) (resid 896 and name   SG ) 3.80 0.00 0.00 
  peak 62
assign (resid   1 and name  HT+ ) (resid   2 and name   HN ) 5.72 5.72 0.00 
  peak 62
assign (resid   1 and name  HT+ ) (resid   2 and name   HA ) 5.17 5.17 0.00 
  peak 62
assign (resid   1 and name  HT+ ) (resid   2 and name  HB1 ) 4.93 4.93 0.00 
  peak 62
assign (resid   1 and name  HT+ ) (resid   2 and name  HD+ ) 5.71 5.71 0.00 
  peak 62
assign (resid   1 and name  HT+ ) (resid   2 and name  HG+ ) 4.56 4.56 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid   2 and name   HN ) 5.00 5.00 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid   2 and name   HA ) 4.94 4.94 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid   3 and name   HA ) 5.78 5.78 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 883 and name   HA ) 5.48 5.48 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 883 and name   HB ) 4.60 4.60 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 883 and name HG11 ) 4.73 4.73 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 885 and name   HA ) 5.50 5.50 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 902 and name   HA ) 5.25 5.25 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 903 and name   HA ) 5.32 5.32 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 903 and name  HB1 ) 4.65 4.65 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 903 and name  HD2 ) 4.31 4.31 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 903 and name  HD1 ) 4.04 4.04 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 904 and name  HD2 ) 5.57 5.57 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 904 and name  HD1 ) 5.63 5.63 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 905 and name   HA ) 5.43 5.43 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 907 and name  HB2 ) 5.05 5.05 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 907 and name  HB1 ) 4.71 4.71 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 907 and name  HG+ ) 4.98 4.98 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 909 and name  HD1 ) 5.03 5.03 0.00 
  peak 62
assign (resid   1 and name  HB+ ) (resid 910 and name   HN ) 5.67 5.67 0.00 
  peak 62
assign (resid   2 and name   HN ) (resid   2 and name  HB2 ) 4.57 4.57 0.00 
  peak 62
assign (resid   2 and name   HN ) (resid   2 and name  HB1 ) 4.51 4.51 0.00 
  peak 62
assign (resid   2 and name   HN ) (resid   2 and name  HG+ ) 4.30 4.30 0.00 
  peak 62
assign (resid   2 and name   HA ) (resid   2 and name  HB2 ) 4.58 4.58 0.00 
  peak 62
assign (resid   2 and name  HB2 ) (resid   2 and name   HE ) 5.27 5.27 0.00 
  peak 62
assign (resid   2 and name  HB2 ) (resid   2 and name  HD+ ) 4.46 4.46 0.00 
  peak 62
assign (resid   2 and name   HA ) (resid   2 and name  HB1 ) 4.57 4.57 0.00 
  peak 62
assign (resid   2 and name   HA ) (resid   2 and name  HD2 ) 5.37 5.37 0.00 
  peak 62
assign (resid   2 and name  HB2 ) (resid   2 and name  HD2 ) 4.46 4.46 0.00 
  peak 62
assign (resid   2 and name  HB1 ) (resid   2 and name  HD2 ) 4.43 4.43 0.00 
  peak 62
assign (resid   2 and name  HG+ ) (resid   2 and name  HD2 ) 4.19 4.19 0.00 
  peak 62
assign (resid   2 and name   HA ) (resid   2 and name  HD1 ) 5.45 5.45 0.00 
  peak 62
assign (resid   2 and name  HB2 ) (resid   2 and name  HD1 ) 4.68 4.68 0.00 
  peak 62
assign (resid   2 and name  HB1 ) (resid   2 and name  HD1 ) 4.70 4.70 0.00 
  peak 62
assign (resid   2 and name  HG+ ) (resid   2 and name  HD1 ) 4.40 4.40 0.00 
  peak 62
assign (resid   2 and name   HA ) (resid   2 and name   HE ) 5.45 5.45 0.00 
  peak 62
assign (resid   2 and name  HD2 ) (resid   2 and name   HE ) 4.56 4.56 0.00 
  peak 62
assign (resid   2 and name  HD1 ) (resid   2 and name   HE ) 4.58 4.58 0.00 
  peak 62
assign (resid   2 and name  HG+ ) (resid   2 and name   HE ) 4.58 4.58 0.00 
  peak 62
assign (resid   2 and name  HG+ ) (resid   2 and name  HD+ ) 4.03 4.03 0.00 
  peak 62
assign (resid   2 and name  HD2 ) (resid 891 and name  HZ2 ) 5.67 5.67 0.00 
  peak 62
assign (resid   2 and name  HD1 ) (resid 891 and name  HZ2 ) 5.81 5.81 0.00 
  peak 62
assign (resid   2 and name  HD+ ) (resid   3 and name   HN ) 5.70 5.70 0.00 
  peak 62
assign (resid   3 and name   HN ) (resid   3 and name   HA ) 4.27 4.27 0.00 
  peak 62
assign (resid   3 and name   HA ) (resid   3 and name   HB ) 4.52 4.52 0.00 
  peak 62
assign (resid   3 and name   HN ) (resid   3 and name HG2+ ) 3.85 3.85 0.00 
  peak 62
assign (resid   3 and name HG2+ ) (resid   3 and name   HB ) 3.48 3.48 0.00 
  peak 62
assign (resid   3 and name HG2+ ) (resid   4 and name   HN ) 3.85 3.85 0.00 
  peak 62
assign (resid   3 and name   HA ) (resid 883 and name HG12 ) 5.52 5.52 0.00 
  peak 62
assign (resid   3 and name HG2+ ) (resid 883 and name HG11 ) 4.40 4.40 0.00 
  peak 62
assign (resid   3 and name   HN ) (resid 891 and name  HZ3 ) 5.24 5.24 0.00 
  peak 62
assign (resid   3 and name   HA ) (resid 891 and name  HE3 ) 6.28 6.28 0.00 
  peak 62
assign (resid   3 and name   HA ) (resid 894 and name  HZ2 ) 6.14 6.14 0.00 
  peak 62
assign (resid   3 and name HG2+ ) (resid 894 and name  HH2 ) 4.72 4.72 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name   HA ) 3.96 3.96 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name  HB2 ) 4.97 4.97 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name  HB1 ) 4.60 4.60 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name  HD2 ) 6.24 6.24 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name  HD1 ) 5.62 5.62 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid   4 and name  HE1 ) 4.68 4.68 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   4 and name  HB2 ) 4.31 4.31 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HB1 ) 3.65 3.65 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HD2 ) 5.03 5.03 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HD1 ) 4.89 4.89 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HE1 ) 4.81 4.81 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HG2 ) 4.66 4.66 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name HM++ ) 4.81 4.81 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   4 and name  HB1 ) 4.30 4.30 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid   4 and name  HD2 ) 4.97 4.97 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid   4 and name  HD1 ) 4.65 4.65 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid   4 and name  HG2 ) 4.39 4.39 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid   4 and name  HG1 ) 4.54 4.54 0.00 
  peak 62
assign (resid   4 and name  HD2 ) (resid   4 and name  HD1 ) 3.90 3.90 0.00 
  peak 62
assign (resid   4 and name  HD2 ) (resid   4 and name  HE1 ) 4.89 4.89 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   4 and name  HD1 ) 5.98 5.98 0.00 
  peak 62
assign (resid   4 and name  HD1 ) (resid   4 and name  HE1 ) 4.46 4.46 0.00 
  peak 62
assign (resid   4 and name  HG2 ) (resid   4 and name  HD1 ) 4.54 4.54 0.00 
  peak 62
assign (resid   4 and name  HD2 ) (resid   4 and name  HE2 ) 5.03 5.03 0.00 
  peak 62
assign (resid   4 and name  HD1 ) (resid   4 and name  HE2 ) 4.82 4.82 0.00 
  peak 62
assign (resid   4 and name  HE2 ) (resid   4 and name  HE1 ) 3.92 3.92 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   4 and name  HG2 ) 5.32 5.32 0.00 
  peak 62
assign (resid   4 and name  HG2 ) (resid   4 and name  HD2 ) 4.88 4.88 0.00 
  peak 62
assign (resid   4 and name  HG2 ) (resid   4 and name  HE2 ) 4.67 4.67 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   4 and name  HG1 ) 5.44 5.44 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   4 and name  HG1 ) 4.79 4.79 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name  HD2 ) 4.70 4.70 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name  HD1 ) 4.45 4.45 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name  HE2 ) 4.98 4.98 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name  HE1 ) 4.11 4.11 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name  HG2 ) 3.96 3.96 0.00 
  peak 62
assign (resid   4 and name  HD2 ) (resid   4 and name HM++ ) 3.41 3.41 0.00 
  peak 62
assign (resid   4 and name  HD1 ) (resid   4 and name HM++ ) 3.30 3.30 0.00 
  peak 62
assign (resid   4 and name  HE2 ) (resid   4 and name HM++ ) 3.39 3.39 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   4 and name HM++ ) 3.74 3.74 0.00 
  peak 62
assign (resid   4 and name HM++ ) (resid 868 and name  HB1 ) 4.04 4.04 0.00 
  peak 62
assign (resid   4 and name HM++ ) (resid 868 and name  HD1 ) 4.65 4.65 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid 881 and name   HA ) 5.24 5.24 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid 891 and name  HE3 ) 5.85 5.85 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid 891 and name  HZ3 ) 5.89 5.89 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid 891 and name  HZ3 ) 6.00 6.00 0.00 
  peak 62
assign (resid   4 and name  HD1 ) (resid 891 and name  HE3 ) 6.09 6.09 0.00 
  peak 62
assign (resid   4 and name  HG2 ) (resid 891 and name  HE3 ) 6.00 6.00 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid 891 and name  HE3 ) 6.14 6.14 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid 891 and name  HH2 ) 6.21 6.21 0.00 
  peak 62
assign (resid   4 and name HM++ ) (resid 891 and name  HE3 ) 4.54 4.54 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid 894 and name  HE1 ) 5.12 5.12 0.00 
  peak 62
assign (resid   4 and name   HN ) (resid 894 and name  HZ2 ) 5.40 5.40 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   5 and name   HN ) 3.80 3.80 0.00 
  peak 62
assign (resid   4 and name  HB2 ) (resid   5 and name   HN ) 4.85 4.85 0.00 
  peak 62
assign (resid   4 and name  HB1 ) (resid   5 and name   HN ) 4.74 4.74 0.00 
  peak 62
assign (resid   4 and name  HD2 ) (resid   5 and name   HN ) 6.32 6.32 0.00 
  peak 62
assign (resid   4 and name  HD1 ) (resid   5 and name   HN ) 6.06 6.06 0.00 
  peak 62
assign (resid   4 and name  HE1 ) (resid   5 and name   HN ) 5.60 5.60 0.00 
  peak 62
assign (resid   4 and name  HG2 ) (resid   5 and name   HN ) 5.83 5.83 0.00 
  peak 62
assign (resid   4 and name  HG1 ) (resid   5 and name   HN ) 5.95 5.95 0.00 
  peak 62
assign (resid   4 and name HM++ ) (resid   5 and name   HN ) 5.77 5.77 0.00 
  peak 62
assign (resid   4 and name   HA ) (resid   5 and name  HB2 ) 5.88 5.88 0.00 
  peak 62
assign (resid   5 and name   HN ) (resid   5 and name   HA ) 4.60 4.60 0.00 
  peak 62
assign (resid   5 and name   HN ) (resid   5 and name  HB2 ) 5.22 5.22 0.00 
  peak 62
assign (resid   5 and name   HN ) (resid   5 and name  HB1 ) 5.08 5.08 0.00 
  peak 62
assign (resid   5 and name   HN ) (resid   5 and name  HG2 ) 5.15 5.15 0.00 
  peak 62
assign (resid   5 and name   HA ) (resid   5 and name  HB2 ) 4.16 4.16 0.00 
  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
assign (resid   7 and name   HN ) (resid   7 and name   HA ) 4.04 4.04 0.00 
  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
assign (resid   9 and name   HN ) (resid   9 and name   HA ) 4.88 4.88 0.00 
  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
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  peak 62
assign (resid  857 and name C    ) (resid  858 and name N    )
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assign (resid  891 and name N    ) (resid  891 and name CA   )
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assign (resid    2 and name N    ) (resid    2 and name CA   )
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assign (resid    2 and name C    ) (resid    3 and name N    )
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assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name C    ) (resid    4 and name N    )    1.0  120.0   60.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0 -115.0   65.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  120.0   60.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   ALA   1           HA       ALA   1  12.234   6.381   2.662
    2    H1   ALA   1           HT1      ALA   1  12.441   6.196   5.059
    3    H2   ALA   1           HT2      ALA   1  13.847   6.529   4.276
    4    H3   ALA   1           HT3      ALA   1  13.570   4.936   4.872
    5    HB1  ALA   1           HB1      ALA   1  14.194   5.054   1.995
    6    HB2  ALA   1           HB2      ALA   1  12.701   4.340   1.376
    7    HB3  ALA   1           HB3      ALA   1  13.496   3.634   2.777
    8    H    ARG   2           H        ARG   2  10.280   6.536   3.568
    9    HA   ARG   2           HA       ARG   2   9.059   4.201   4.709
   10    HE   ARG   2           HE       ARG   2   7.810   6.066   7.894
   11    HB2  ARG   2           HB2      ARG   2   8.761   6.608   5.574
   12    HB3  ARG   2           HB1      ARG   2   7.767   6.851   4.158
   13    HG2  ARG   2           HG2      ARG   2   6.218   5.174   4.870
   14    HG3  ARG   2           HG1      ARG   2   7.364   4.735   6.151
   15    HD2  ARG   2           HD2      ARG   2   6.136   7.475   5.984
   16    HD3  ARG   2           HD1      ARG   2   5.417   6.159   6.921
   17   HH11  ARG   2          HH11      ARG   2   5.869   8.986   7.277
   18   HH12  ARG   2          HH12      ARG   2   6.677   9.949   8.423
   19   HH21  ARG   2          HH21      ARG   2   8.894   7.395   9.500
   20   HH22  ARG   2          HH22      ARG   2   8.456   9.023   9.725
   21    H    THR   3           H        THR   3   8.319   2.738   3.406
   22    HA   THR   3           HA       THR   3   7.099   3.602   0.921
   23    HB   THR   3           HB       THR   3   7.602   1.131   0.342
   24    HG1  THR   3           HG1      THR   3   9.865   1.221   1.930
   25   HG21  THR   3          HG21      THR   3   9.862   3.110   0.640
   26   HG22  THR   3          HG22      THR   3   8.640   3.175  -0.615
   27   HG23  THR   3          HG23      THR   3   9.754   1.806  -0.555
   28    HA   M3L   4           HA       M3L   4   3.739   0.982   1.916
   29    H    M3L   4           H        M3L   4   5.036   3.189   0.642
   30    HB2  M3L   4           HB2      M3L   4   3.402   2.356   3.776
   31    HB3  M3L   4           HB1      M3L   4   1.935   2.595   2.847
   32    HG2  M3L   4           HG2      M3L   4   3.911   4.523   2.064
   33    HG3  M3L   4           HG1      M3L   4   3.757   4.529   3.818
   34    HD2  M3L   4           HD2      M3L   4   1.136   4.419   2.919
   35    HD3  M3L   4           HD1      M3L   4   1.973   5.831   3.555
   36    HE2  M3L   4           HE2      M3L   4   2.852   6.121   1.138
   37    HE3  M3L   4           HE1      M3L   4   1.594   5.002   0.691
   38   HM11  M3L   4          HM11      M3L   4  -1.189   7.150   2.175
   39   HM12  M3L   4          HM12      M3L   4  -0.990   5.812   1.087
   40   HM13  M3L   4          HM13      M3L   4  -0.431   5.689   2.727
   41   HM21  M3L   4          HM21      M3L   4   0.775   8.920   2.273
   42   HM22  M3L   4          HM22      M3L   4   2.359   8.212   2.322
   43   HM23  M3L   4          HM23      M3L   4   1.143   7.709   3.457
   44   HM31  M3L   4          HM31      M3L   4  -0.172   8.122  -0.037
   45   HM32  M3L   4          HM32      M3L   4   0.604   6.746  -0.712
   46   HM33  M3L   4          HM33      M3L   4   1.554   8.111  -0.228
   47    H    GLN   5           H        GLN   5   1.687   0.622   1.047
   48    HA   GLN   5           HA       GLN   5   1.102   2.052  -1.476
   49    HB2  GLN   5           HB2      GLN   5   1.869  -0.379  -1.487
   50    HB3  GLN   5           HB1      GLN   5   0.338  -0.742  -0.701
   51    HG2  GLN   5           HG2      GLN   5  -0.799   0.367  -2.611
   52    HG3  GLN   5           HG1      GLN   5   0.773   0.501  -3.377
   53   HE21  GLN   5          HE21      GLN   5  -1.499  -0.845  -4.282
   54   HE22  GLN   5          HE22      GLN   5  -1.058  -2.498  -4.492
   55    H    THR   6           H        THR   6  -0.817   3.174  -1.329
   56    HA   THR   6           HA       THR   6  -2.514   2.800   0.951
   57    HB   THR   6           HB       THR   6  -3.420   4.305  -1.459
   58    HG1  THR   6           HG1      THR   6  -1.850   5.609  -1.451
   59   HG21  THR   6          HG21      THR   6  -4.741   4.318   0.614
   60   HG22  THR   6          HG22      THR   6  -4.117   5.926   0.256
   61   HG23  THR   6          HG23      THR   6  -3.350   4.939   1.502
   62    H    ALA   7           H        ALA   7  -3.028   0.507   0.514
   63    HA   ALA   7           HA       ALA   7  -4.878   0.209  -1.737
   64    HB1  ALA   7           HB1      ALA   7  -3.989  -1.986  -2.214
   65    HB2  ALA   7           HB2      ALA   7  -2.801  -1.798  -0.923
   66    HB3  ALA   7           HB3      ALA   7  -2.739  -0.750  -2.341
   67    H    ARG   8           H        ARG   8  -6.617  -0.896  -1.441
   68    HA   ARG   8           HA       ARG   8  -7.117  -2.088   1.181
   69    HE   ARG   8           HE       ARG   8 -10.037   1.032  -0.049
   70    HB2  ARG   8           HB2      ARG   8  -9.509  -2.048   0.502
   71    HB3  ARG   8           HB1      ARG   8  -8.777  -0.452   0.491
   72    HG2  ARG   8           HG2      ARG   8  -8.484  -0.677  -1.964
   73    HG3  ARG   8           HG1      ARG   8  -9.408  -2.180  -1.887
   74    HD2  ARG   8           HD2      ARG   8 -10.876  -0.376  -2.515
   75    HD3  ARG   8           HD1      ARG   8 -11.273  -0.919  -0.885
   76   HH11  ARG   8          HH11      ARG   8 -11.183   1.139  -3.401
   77   HH12  ARG   8          HH12      ARG   8 -11.273   2.829  -3.455
   78   HH21  ARG   8          HH21      ARG   8 -10.173   3.330  -0.139
   79   HH22  ARG   8          HH22      ARG   8 -10.696   4.126  -1.550
   80    H    LYS   9           H        LYS   9  -6.101  -2.827  -1.825
   81    HA   LYS   9           HA       LYS   9  -6.241  -5.647  -1.293
   82    HB2  LYS   9           HB2      LYS   9  -8.251  -5.213  -2.705
   83    HB3  LYS   9           HB1      LYS   9  -7.218  -4.477  -3.921
   84    HG2  LYS   9           HG2      LYS   9  -6.060  -6.617  -4.240
   85    HG3  LYS   9           HG1      LYS   9  -7.095  -7.358  -3.023
   86    HD2  LYS   9           HD2      LYS   9  -8.029  -6.147  -5.634
   87    HD3  LYS   9           HD1      LYS   9  -7.834  -7.867  -5.317
   88    HE2  LYS   9           HE2      LYS   9  -9.757  -5.999  -3.921
   89    HE3  LYS   9           HE1      LYS   9 -10.166  -7.195  -5.141
   90    HZ1  LYS   9           HZ1      LYS   9 -10.637  -7.987  -2.908
   91    HZ2  LYS   9           HZ2      LYS   9  -9.039  -7.797  -2.461
   92    HZ3  LYS   9           HZ3      LYS   9  -9.453  -8.942  -3.626
   93    H    SER  10           H        SER  10  -4.170  -6.221  -1.483
   94    HA   SER  10           HA       SER  10  -2.625  -5.172  -3.704
   95    HG   SER  10           HG       SER  10  -0.044  -3.928  -2.410
   96    HB2  SER  10           HB2      SER  10  -2.017  -3.874  -1.656
   97    HB3  SER  10           HB1      SER  10  -1.649  -5.382  -0.826
   98    H    THR  11           H        THR  11  -1.022  -6.685  -4.386
   99    HA   THR  11           HA       THR  11  -1.654  -9.433  -3.600
  100    HB   THR  11           HB       THR  11  -0.014  -8.461  -5.964
  101    HG1  THR  11           HG1      THR  11  -2.234  -7.735  -5.936
  102   HG21  THR  11          HG21      THR  11  -0.510 -10.700  -6.878
  103   HG22  THR  11          HG22      THR  11  -1.399 -11.104  -5.413
  104   HG23  THR  11          HG23      THR  11   0.341 -10.825  -5.336
  105    H    GLY  12           H        GLY  12  -0.410  -9.981  -1.882
  106    HA2  GLY  12           HA2      GLY  12   1.598 -10.792  -1.027
  107    HA3  GLY  12           HA1      GLY  12   2.474  -9.855  -2.235
  108    H    GLY  13           H        GLY  13   2.076  -7.419  -1.970
  109    HA2  GLY  13           HA2      GLY  13   1.542  -5.679  -0.346
  110    HA3  GLY  13           HA1      GLY  13   2.194  -6.748   0.891
  111    H1   GLY 850           HT1      GLY 850 -11.185  28.733   4.542
  112    H2   GLY 850           HT2      GLY 850 -11.219  30.221   3.746
  113    H3   GLY 850           HT3      GLY 850 -11.503  30.161   5.403
  114    HA2  GLY 850           HA1      GLY 850  -9.285  30.958   4.894
  115    HA3  GLY 850           HA2      GLY 850  -9.247  29.434   5.784
  116    H    SER 851           H        SER 851  -7.380  30.754   3.765
  117    HA   SER 851           HA       SER 851  -7.498  29.085   1.455
  118    HG   SER 851           HG       SER 851  -7.282  31.250   0.442
  119    HB2  SER 851           HB2      SER 851  -5.319  30.921   2.451
  120    HB3  SER 851           HB1      SER 851  -5.361  30.162   0.858
  121    H    HIS 852           H        HIS 852  -6.285  28.679   4.605
  122    HA   HIS 852           HA       HIS 852  -4.172  26.939   3.941
  123    HD2  HIS 852           HD2      HIS 852  -6.227  25.499   7.960
  124    HE1  HIS 852           HE1      HIS 852  -8.043  29.309   8.306
  125    HE2  HIS 852           HE2      HIS 852  -8.249  26.861   8.859
  126    HB2  HIS 852           HB2      HIS 852  -4.186  26.291   6.367
  127    HB3  HIS 852           HB1      HIS 852  -4.051  28.012   6.091
  128    H    MET 853           H        MET 853  -4.583  25.348   2.731
  129    HA   MET 853           HA       MET 853  -6.541  23.337   3.586
  130    HB2  MET 853           HB2      MET 853  -5.824  24.141   0.740
  131    HB3  MET 853           HB1      MET 853  -6.864  22.794   1.177
  132    HG2  MET 853           HG2      MET 853  -8.539  24.266   2.016
  133    HG3  MET 853           HG1      MET 853  -7.461  25.653   1.896
  134    HE1  MET 853           HE1      MET 853  -9.545  22.984  -0.141
  135    HE2  MET 853           HE2      MET 853  -7.907  22.750  -0.761
  136    HE3  MET 853           HE3      MET 853  -9.157  23.436  -1.800
  137    H    ALA 854           H        ALA 854  -4.061  23.602   1.072
  138    HA   ALA 854           HA       ALA 854  -1.971  22.339   2.316
  139    HB1  ALA 854           HB1      ALA 854  -3.421  20.307   2.360
  140    HB2  ALA 854           HB2      ALA 854  -1.958  20.095   1.406
  141    HB3  ALA 854           HB3      ALA 854  -3.500  20.365   0.596
  142    H    MET 855           H        MET 855  -0.975  23.979   1.181
  143    HA   MET 855           HA       MET 855  -0.992  23.783  -1.694
  144    HB2  MET 855           HB2      MET 855  -0.952  26.047  -0.792
  145    HB3  MET 855           HB1      MET 855   0.490  25.691   0.145
  146    HG2  MET 855           HG2      MET 855   0.963  27.040  -1.869
  147    HG3  MET 855           HG1      MET 855   1.811  25.498  -1.851
  148    HE1  MET 855           HE1      MET 855  -1.152  27.551  -3.396
  149    HE2  MET 855           HE2      MET 855  -2.009  26.145  -2.755
  150    HE3  MET 855           HE3      MET 855  -1.880  26.384  -4.497
  151    H    ALA 856           H        ALA 856  -0.309  21.736  -1.727
  152    HA   ALA 856           HA       ALA 856   2.441  21.326  -2.153
  153    HB1  ALA 856           HB1      ALA 856   1.160  19.955   0.243
  154    HB2  ALA 856           HB2      ALA 856   2.494  21.108   0.307
  155    HB3  ALA 856           HB3      ALA 856   2.729  19.533  -0.445
  156    H    TYR 857           H        TYR 857   2.521  18.701  -2.346
  157    HA   TYR 857           HA       TYR 857   0.376  18.175  -4.166
  158    HD1  TYR 857           HD1      TYR 857   1.130  17.256  -6.818
  159    HD2  TYR 857           HD2      TYR 857   4.244  18.844  -4.392
  160    HE1  TYR 857           HE1      TYR 857   1.828  18.685  -8.670
  161    HE2  TYR 857           HE2      TYR 857   4.957  20.282  -6.245
  162    HH   TYR 857           HH       TYR 857   4.769  20.317  -8.716
  163    HB2  TYR 857           HB2      TYR 857   3.006  16.881  -3.667
  164    HB3  TYR 857           HB1      TYR 857   1.788  16.147  -4.692
  165    H    VAL 858           H        VAL 858  -0.903  18.167  -2.319
  166    HA   VAL 858           HA       VAL 858  -1.669  15.431  -1.534
  167    HB   VAL 858           HB       VAL 858  -1.686  17.665   0.528
  168   HG11  VAL 858          HG11      VAL 858  -2.103  15.879   2.163
  169   HG12  VAL 858          HG12      VAL 858  -2.133  14.702   0.858
  170   HG13  VAL 858          HG13      VAL 858  -3.349  15.972   0.922
  171   HG21  VAL 858          HG21      VAL 858   0.330  15.421   0.360
  172   HG22  VAL 858          HG22      VAL 858   0.183  16.560   1.698
  173   HG23  VAL 858          HG23      VAL 858   0.662  17.132   0.098
  174    H    ILE 859           H        ILE 859  -3.877  15.202  -1.641
  175    HA   ILE 859           HA       ILE 859  -5.586  17.571  -1.411
  176    HB   ILE 859           HB       ILE 859  -7.096  16.760  -3.180
  177   HG12  ILE 859          HG12      ILE 859  -4.976  14.671  -3.782
  178   HG13  ILE 859          HG11      ILE 859  -6.557  14.382  -3.062
  179   HG21  ILE 859          HG21      ILE 859  -4.301  17.179  -4.192
  180   HG22  ILE 859          HG22      ILE 859  -5.490  18.425  -3.818
  181   HG23  ILE 859          HG23      ILE 859  -5.770  17.314  -5.160
  182   HD11  ILE 859          HD11      ILE 859  -6.078  15.427  -5.841
  183   HD12  ILE 859          HD12      ILE 859  -7.648  15.088  -5.111
  184   HD13  ILE 859          HD13      ILE 859  -6.514  13.771  -5.421
  185    H    ARG 860           H        ARG 860  -7.929  16.756  -1.074
  186    HA   ARG 860           HA       ARG 860  -7.767  14.257   0.453
  187    HE   ARG 860           HE       ARG 860 -10.684  19.484   1.498
  188    HB2  ARG 860           HB2      ARG 860  -9.620  15.079   1.870
  189    HB3  ARG 860           HB1      ARG 860  -8.192  16.091   1.985
  190    HG2  ARG 860           HG2      ARG 860  -9.232  17.765   0.562
  191    HG3  ARG 860           HG1      ARG 860 -10.636  16.710   0.344
  192    HD2  ARG 860           HD2      ARG 860 -11.167  16.848   2.692
  193    HD3  ARG 860           HD1      ARG 860  -9.689  17.750   3.008
  194   HH11  ARG 860          HH11      ARG 860 -12.845  17.309   3.261
  195   HH12  ARG 860          HH12      ARG 860 -14.032  18.506   3.542
  196   HH21  ARG 860          HH21      ARG 860 -12.337  21.120   1.914
  197   HH22  ARG 860          HH22      ARG 860 -13.730  20.696   2.802
  198    H    ASP 861           H        ASP 861  -9.485  12.807   0.274
  199    HA   ASP 861           HA       ASP 861 -10.901  13.077  -2.258
  200    HB2  ASP 861           HB2      ASP 861 -11.312  10.761  -2.198
  201    HB3  ASP 861           HB1      ASP 861  -9.782  10.868  -1.347
  202    H    GLU 862           H        GLU 862 -13.278  11.909  -1.896
  203    HA   GLU 862           HA       GLU 862 -14.793  13.982  -0.760
  204    HB2  GLU 862           HB2      GLU 862 -16.728  12.616  -1.308
  205    HB3  GLU 862           HB1      GLU 862 -15.578  12.662  -2.637
  206    HG2  GLU 862           HG2      GLU 862 -14.725  10.467  -1.872
  207    HG3  GLU 862           HG1      GLU 862 -16.034  10.418  -0.697
  208    H    TRP 863           H        TRP 863 -13.675  10.920   0.593
  209    HA   TRP 863           HA       TRP 863 -15.408  11.139   2.868
  210    HD1  TRP 863           HD       TRP 863 -13.351   7.218   1.113
  211    HE1  TRP 863           HE1      TRP 863 -15.347   6.069  -0.041
  212    HE3  TRP 863           HE3      TRP 863 -17.090  10.253   2.754
  213    HZ2  TRP 863           HZ2      TRP 863 -18.137   6.434  -0.255
  214    HZ3  TRP 863           HZ3      TRP 863 -19.400   9.799   2.028
  215    HH2  TRP 863           HH       TRP 863 -19.897   7.919   0.545
  216    HB2  TRP 863           HB2      TRP 863 -12.996   9.357   2.461
  217    HB3  TRP 863           HB1      TRP 863 -14.165   9.222   3.765
  218    H    GLY 864           H        GLY 864 -12.148  11.967   2.060
  219    HA2  GLY 864           HA2      GLY 864 -11.416  14.074   3.171
  220    HA3  GLY 864           HA1      GLY 864 -12.027  13.377   4.663
  221    H    ASN 865           H        ASN 865 -10.389  11.329   2.435
  222    HA   ASN 865           HA       ASN 865  -8.215  10.948   4.331
  223    HB2  ASN 865           HB2      ASN 865  -8.732   9.591   1.661
  224    HB3  ASN 865           HB1      ASN 865  -7.554   9.102   2.861
  225   HD21  ASN 865          HD21      ASN 865 -10.880   9.118   1.947
  226   HD22  ASN 865          HD22      ASN 865 -11.410   7.945   3.103
  227    H    GLN 866           H        GLN 866  -6.066  11.361   3.750
  228    HA   GLN 866           HA       GLN 866  -5.694  13.380   1.765
  229    HB2  GLN 866           HB2      GLN 866  -3.816  11.997   3.678
  230    HB3  GLN 866           HB1      GLN 866  -3.227  13.037   2.408
  231    HG2  GLN 866           HG2      GLN 866  -4.382  14.926   3.322
  232    HG3  GLN 866           HG1      GLN 866  -5.196  13.909   4.507
  233   HE21  GLN 866          HE21      GLN 866  -3.300  16.236   4.708
  234   HE22  GLN 866          HE22      GLN 866  -2.086  15.691   5.807
  235    H    ILE 867           H        ILE 867  -5.231  13.090  -0.206
  236    HA   ILE 867           HA       ILE 867  -4.151  10.527  -1.114
  237    HB   ILE 867           HB       ILE 867  -5.568  12.684  -2.703
  238   HG12  ILE 867          HG12      ILE 867  -7.199  11.545  -1.301
  239   HG13  ILE 867          HG11      ILE 867  -7.429  11.056  -2.974
  240   HG21  ILE 867          HG21      ILE 867  -3.918  11.542  -4.035
  241   HG22  ILE 867          HG22      ILE 867  -5.533  11.109  -4.589
  242   HG23  ILE 867          HG23      ILE 867  -4.602   9.974  -3.608
  243   HD11  ILE 867          HD11      ILE 867  -7.678   9.170  -1.487
  244   HD12  ILE 867          HD12      ILE 867  -6.077   9.460  -0.808
  245   HD13  ILE 867          HD13      ILE 867  -6.240   8.954  -2.490
  246    H    TRP 868           H        TRP 868  -2.078  10.695  -1.537
  247    HA   TRP 868           HA       TRP 868  -0.958  13.326  -1.787
  248    HD1  TRP 868           HD       TRP 868   1.687  13.753   0.123
  249    HE1  TRP 868           HE1      TRP 868   1.216  13.722   2.670
  250    HE3  TRP 868           HE3      TRP 868  -1.460   9.755   0.350
  251    HZ2  TRP 868           HZ2      TRP 868  -0.242  12.198   4.498
  252    HZ3  TRP 868           HZ3      TRP 868  -2.354   9.077   2.537
  253    HH2  TRP 868           HH       TRP 868  -1.751  10.273   4.562
  254    HB2  TRP 868           HB2      TRP 868   0.308  10.616  -1.458
  255    HB3  TRP 868           HB1      TRP 868   1.258  12.053  -1.822
  256    H    ILE 869           H        ILE 869   0.120  14.097  -3.463
  257    HA   ILE 869           HA       ILE 869  -0.374  12.751  -6.024
  258    HB   ILE 869           HB       ILE 869   0.325  15.686  -5.640
  259   HG12  ILE 869          HG12      ILE 869  -1.795  15.305  -4.425
  260   HG13  ILE 869          HG11      ILE 869  -2.023  16.309  -5.847
  261   HG21  ILE 869          HG21      ILE 869  -0.626  15.983  -7.855
  262   HG22  ILE 869          HG22      ILE 869  -0.942  14.252  -7.942
  263   HG23  ILE 869          HG23      ILE 869   0.716  14.838  -7.846
  264   HD11  ILE 869          HD11      ILE 869  -3.834  14.748  -5.591
  265   HD12  ILE 869          HD12      ILE 869  -2.702  13.397  -5.570
  266   HD13  ILE 869          HD13      ILE 869  -2.903  14.360  -7.038
  267    H    CYS 870           H        CYS 870   1.427  12.234  -7.214
  268    HA   CYS 870           HA       CYS 870   3.975  12.478  -5.933
  269    HB2  CYS 870           HB2      CYS 870   3.301  10.440  -7.174
  270    HB3  CYS 870           HB1      CYS 870   3.159  11.386  -8.640
  271    HA   PRO 871           HA       PRO 871   4.602  16.421  -8.073
  272    HB2  PRO 871           HB2      PRO 871   7.303  16.283  -6.929
  273    HB3  PRO 871           HB1      PRO 871   6.046  17.489  -6.655
  274    HG2  PRO 871           HG2      PRO 871   6.782  15.709  -4.762
  275    HG3  PRO 871           HG1      PRO 871   5.127  16.316  -4.897
  276    HD2  PRO 871           HD2      PRO 871   6.267  13.697  -5.771
  277    HD3  PRO 871           HD1      PRO 871   4.692  14.070  -5.032
  278    H    GLY 872           H        GLY 872   6.075  13.444  -8.483
  279    HA2  GLY 872           HA2      GLY 872   8.197  14.150 -10.249
  280    HA3  GLY 872           HA1      GLY 872   7.536  12.545  -9.991
  281    H    CYS 873           H        CYS 873   5.000  12.687 -10.743
  282    HA   CYS 873           HA       CYS 873   5.207  13.156 -13.630
  283    HB2  CYS 873           HB2      CYS 873   3.322  11.503 -13.547
  284    HB3  CYS 873           HB1      CYS 873   4.894  10.914 -12.988
  285    H    ASN 874           H        ASN 874   3.589  14.082 -10.733
  286    HA   ASN 874           HA       ASN 874   2.059  15.593 -10.188
  287    HB2  ASN 874           HB2      ASN 874   2.795  16.899 -12.291
  288    HB3  ASN 874           HB1      ASN 874   1.479  16.110 -13.141
  289   HD21  ASN 874          HD21      ASN 874   2.360  18.528 -10.822
  290   HD22  ASN 874          HD22      ASN 874   0.811  19.281 -10.709
  291    H    LYS 875           H        LYS 875   1.725  12.705 -10.907
  292    HA   LYS 875           HA       LYS 875  -1.148  12.561 -11.388
  293    HB2  LYS 875           HB2      LYS 875   1.005  10.456 -11.220
  294    HB3  LYS 875           HB1      LYS 875  -0.701  10.095 -11.383
  295    HG2  LYS 875           HG2      LYS 875  -0.751  11.150 -13.553
  296    HG3  LYS 875           HG1      LYS 875   0.933  11.658 -13.360
  297    HD2  LYS 875           HD2      LYS 875   1.698   9.403 -13.357
  298    HD3  LYS 875           HD1      LYS 875   0.054   8.772 -13.285
  299    HE2  LYS 875           HE2      LYS 875   1.237  10.343 -15.568
  300    HE3  LYS 875           HE1      LYS 875   1.050   8.591 -15.537
  301    HZ1  LYS 875           HZ1      LYS 875  -0.750   9.602 -16.748
  302    HZ2  LYS 875           HZ2      LYS 875  -1.124  10.603 -15.464
  303    HZ3  LYS 875           HZ3      LYS 875  -1.358   8.940 -15.316
  304    HA   PRO 876           HA       PRO 876  -1.771  11.915  -6.994
  305    HB2  PRO 876           HB2      PRO 876  -4.229  10.800  -7.085
  306    HB3  PRO 876           HB1      PRO 876  -3.971  12.526  -7.360
  307    HG2  PRO 876           HG2      PRO 876  -4.306  10.316  -9.315
  308    HG3  PRO 876           HG1      PRO 876  -5.079  11.919  -9.321
  309    HD2  PRO 876           HD2      PRO 876  -2.926  11.357 -10.885
  310    HD3  PRO 876           HD1      PRO 876  -3.164  12.958 -10.150
  311    H    ASP 877           H        ASP 877  -2.212  10.147  -5.536
  312    HA   ASP 877           HA       ASP 877  -1.013   7.704  -6.327
  313    HB2  ASP 877           HB2      ASP 877  -0.699   8.407  -4.070
  314    HB3  ASP 877           HB1      ASP 877  -2.433   8.561  -3.817
  315    H    ASP 878           H        ASP 878  -1.869   5.882  -6.888
  316    HA   ASP 878           HA       ASP 878  -4.803   5.779  -7.349
  317    HB2  ASP 878           HB2      ASP 878  -2.565   4.217  -8.665
  318    HB3  ASP 878           HB1      ASP 878  -4.267   3.880  -8.923
  319    H    GLY 879           H        GLY 879  -2.843   4.976  -5.050
  320    HA2  GLY 879           HA2      GLY 879  -3.216   3.407  -3.345
  321    HA3  GLY 879           HA1      GLY 879  -4.112   2.400  -4.495
  322    H    SER 880           H        SER 880  -1.121   4.031  -4.808
  323    HA   SER 880           HA       SER 880   0.085   1.572  -5.772
  324    HG   SER 880           HG       SER 880   0.008   5.009  -5.594
  325    HB2  SER 880           HB2      SER 880   1.602   3.310  -6.946
  326    HB3  SER 880           HB1      SER 880  -0.037   3.082  -7.552
  327    HA   PRO 881           HA       PRO 881   3.124   1.947  -2.512
  328    HB2  PRO 881           HB2      PRO 881   5.186   1.111  -4.455
  329    HB3  PRO 881           HB1      PRO 881   4.668   0.307  -2.971
  330    HG2  PRO 881           HG2      PRO 881   4.037  -0.721  -5.344
  331    HG3  PRO 881           HG1      PRO 881   2.884  -0.740  -4.003
  332    HD2  PRO 881           HD2      PRO 881   3.024   1.150  -6.328
  333    HD3  PRO 881           HD1      PRO 881   1.615   0.297  -5.648
  334    H    MET 882           H        MET 882   3.854   3.807  -1.902
  335    HA   MET 882           HA       MET 882   5.332   5.472  -3.827
  336    HB2  MET 882           HB2      MET 882   3.626   6.473  -1.539
  337    HB3  MET 882           HB1      MET 882   4.420   7.444  -2.770
  338    HG2  MET 882           HG2      MET 882   2.965   6.400  -4.468
  339    HG3  MET 882           HG1      MET 882   2.124   5.541  -3.182
  340    HE1  MET 882           HE1      MET 882   2.547   8.816  -5.111
  341    HE2  MET 882           HE2      MET 882   3.470   9.207  -3.641
  342    HE3  MET 882           HE3      MET 882   1.954  10.057  -3.996
  343    H    ILE 883           H        ILE 883   6.966   6.814  -2.840
  344    HA   ILE 883           HA       ILE 883   7.881   5.693  -0.301
  345    HB   ILE 883           HB       ILE 883   9.369   4.982  -2.208
  346   HG12  ILE 883          HG12      ILE 883  10.795   6.910  -0.377
  347   HG13  ILE 883          HG11      ILE 883  10.216   5.330   0.153
  348   HG21  ILE 883          HG21      ILE 883   9.108   6.988  -3.633
  349   HG22  ILE 883          HG22      ILE 883  10.809   6.649  -3.299
  350   HG23  ILE 883          HG23      ILE 883   9.992   7.939  -2.435
  351   HD11  ILE 883          HD11      ILE 883  12.210   5.846  -2.031
  352   HD12  ILE 883          HD12      ILE 883  11.680   4.260  -1.467
  353   HD13  ILE 883          HD13      ILE 883  12.592   5.326  -0.395
  354    H    GLY 884           H        GLY 884   8.355   7.058   1.228
  355    HA2  GLY 884           HA2      GLY 884   7.957   9.886   0.669
  356    HA3  GLY 884           HA1      GLY 884   7.867   9.112   2.252
  357    H    CYS 885           H        CYS 885   9.490  11.287   0.943
  358    HA   CYS 885           HA       CYS 885  12.185  10.423   1.140
  359    HB2  CYS 885           HB2      CYS 885  11.661  12.249  -0.220
  360    HB3  CYS 885           HB1      CYS 885  10.882  13.145   1.080
  361    H    ASP 886           H        ASP 886  13.687  10.937   2.764
  362    HA   ASP 886           HA       ASP 886  12.550  10.827   5.414
  363    HB2  ASP 886           HB2      ASP 886  15.291  10.392   4.311
  364    HB3  ASP 886           HB1      ASP 886  15.107  10.743   6.017
  365    H    ASP 887           H        ASP 887  13.352  13.313   3.394
  366    HA   ASP 887           HA       ASP 887  14.015  14.977   5.737
  367    HB2  ASP 887           HB2      ASP 887  15.812  14.996   4.043
  368    HB3  ASP 887           HB1      ASP 887  14.677  15.625   2.862
  369    H    CYS 888           H        CYS 888  12.514  15.441   2.569
  370    HA   CYS 888           HA       CYS 888  10.908  17.581   3.677
  371    HB2  CYS 888           HB2      CYS 888   9.951  17.853   1.426
  372    HB3  CYS 888           HB1      CYS 888  11.708  17.818   1.390
  373    H    ASP 889           H        ASP 889  10.506  14.239   3.349
  374    HA   ASP 889           HA       ASP 889   8.845  12.763   3.691
  375    HB2  ASP 889           HB2      ASP 889   7.533  15.106   5.109
  376    HB3  ASP 889           HB1      ASP 889   6.837  13.494   5.045
  377    H    ASP 890           H        ASP 890   8.923  14.331   1.236
  378    HA   ASP 890           HA       ASP 890   6.171  14.662   0.468
  379    HB2  ASP 890           HB2      ASP 890   8.367  15.853  -0.465
  380    HB3  ASP 890           HB1      ASP 890   8.405  14.445  -1.516
  381    H    TRP 891           H        TRP 891   5.439  13.433  -1.428
  382    HA   TRP 891           HA       TRP 891   6.268  10.645  -1.116
  383    HD1  TRP 891           HD       TRP 891   3.736  12.533   1.426
  384    HE1  TRP 891           HE1      TRP 891   4.157  11.307   3.652
  385    HE3  TRP 891           HE3      TRP 891   4.944   7.966  -0.422
  386    HZ2  TRP 891           HZ2      TRP 891   4.911   8.724   4.501
  387    HZ3  TRP 891           HZ3      TRP 891   5.514   6.167   1.111
  388    HH2  TRP 891           HH       TRP 891   5.506   6.544   3.569
  389    HB2  TRP 891           HB2      TRP 891   3.447  11.690  -1.075
  390    HB3  TRP 891           HB1      TRP 891   3.812   9.997  -1.410
  391    H    TYR 892           H        TYR 892   7.101   9.990  -2.842
  392    HA   TYR 892           HA       TYR 892   5.998  10.792  -5.450
  393    HD1  TYR 892           HD1      TYR 892   9.082  12.107  -3.471
  394    HD2  TYR 892           HD2      TYR 892   8.039  11.791  -7.566
  395    HE1  TYR 892           HE1      TYR 892   9.868  14.409  -3.846
  396    HE2  TYR 892           HE2      TYR 892   8.808  14.082  -7.957
  397    HH   TYR 892           HH       TYR 892   9.236  16.105  -6.779
  398    HB2  TYR 892           HB2      TYR 892   8.732   9.927  -4.578
  399    HB3  TYR 892           HB1      TYR 892   8.229   9.847  -6.250
  400    H    HIS 893           H        HIS 893   5.819   9.178  -7.012
  401    HA   HIS 893           HA       HIS 893   5.278   6.518  -6.002
  402    HD2  HIS 893           HD2      HIS 893   2.572   6.072  -6.480
  403    HE1  HIS 893           HE1      HIS 893   1.026   9.215  -8.846
  404    HE2  HIS 893           HE2      HIS 893   0.462   7.292  -7.301
  405    HB2  HIS 893           HB2      HIS 893   5.356   7.510  -8.866
  406    HB3  HIS 893           HB1      HIS 893   4.897   5.884  -8.395
  407    H    TRP 894           H        TRP 894   6.337   4.625  -6.838
  408    HA   TRP 894           HA       TRP 894   9.093   4.781  -6.539
  409    HD1  TRP 894           HD       TRP 894   8.114   4.515  -4.512
  410    HE1  TRP 894           HE1      TRP 894   7.874   3.118  -2.355
  411    HE3  TRP 894           HE3      TRP 894   7.959  -0.132  -6.572
  412    HZ2  TRP 894           HZ2      TRP 894   7.619   0.402  -1.645
  413    HZ3  TRP 894           HZ3      TRP 894   7.730  -2.070  -5.099
  414    HH2  TRP 894           HH       TRP 894   7.558  -1.811  -2.696
  415    HB2  TRP 894           HB2      TRP 894   7.305   2.546  -7.437
  416    HB3  TRP 894           HB1      TRP 894   9.049   2.357  -7.314
  417    HA   PRO 895           HA       PRO 895   9.616   3.927 -11.263
  418    HB2  PRO 895           HB2      PRO 895   7.554   4.542 -12.941
  419    HB3  PRO 895           HB1      PRO 895   7.788   2.933 -12.252
  420    HG2  PRO 895           HG2      PRO 895   6.005   5.149 -11.299
  421    HG3  PRO 895           HG1      PRO 895   5.614   3.435 -11.515
  422    HD2  PRO 895           HD2      PRO 895   6.178   4.403  -9.098
  423    HD3  PRO 895           HD1      PRO 895   6.764   2.804  -9.598
  424    H    CYS 896           H        CYS 896   8.207   6.580  -9.789
  425    HA   CYS 896           HA       CYS 896   8.898   8.451 -11.866
  426    HB2  CYS 896           HB2      CYS 896   7.694   8.850  -9.146
  427    HB3  CYS 896           HB1      CYS 896   7.754  10.048 -10.453
  428    H    VAL 897           H        VAL 897  10.270   7.157  -8.977
  429    HA   VAL 897           HA       VAL 897  12.341   9.244  -9.142
  430    HB   VAL 897           HB       VAL 897  12.925   8.755  -6.771
  431   HG11  VAL 897          HG11      VAL 897  11.060  10.095  -5.865
  432   HG12  VAL 897          HG12      VAL 897  10.182   9.829  -7.373
  433   HG13  VAL 897          HG13      VAL 897  11.695  10.731  -7.380
  434   HG21  VAL 897          HG21      VAL 897  10.261   7.325  -6.769
  435   HG22  VAL 897          HG22      VAL 897  11.245   7.683  -5.344
  436   HG23  VAL 897          HG23      VAL 897  11.843   6.574  -6.570
  437    H    GLY 898           H        GLY 898  11.818   5.919  -9.391
  438    HA2  GLY 898           HA2      GLY 898  13.576   4.655 -10.446
  439    HA3  GLY 898           HA1      GLY 898  14.743   5.598  -9.526
  440    H    ILE 899           H        ILE 899  11.874   4.389  -8.035
  441    HA   ILE 899           HA       ILE 899  13.482   2.448  -6.541
  442    HB   ILE 899           HB       ILE 899  10.841   3.813  -5.889
  443   HG12  ILE 899          HG12      ILE 899  12.866   5.202  -5.580
  444   HG13  ILE 899          HG11      ILE 899  11.980   4.916  -4.083
  445   HG21  ILE 899          HG21      ILE 899  12.342   1.761  -4.232
  446   HG22  ILE 899          HG22      ILE 899  10.781   1.513  -5.016
  447   HG23  ILE 899          HG23      ILE 899  10.927   2.662  -3.692
  448   HD11  ILE 899          HD11      ILE 899  13.611   3.245  -3.473
  449   HD12  ILE 899          HD12      ILE 899  14.329   4.836  -3.743
  450   HD13  ILE 899          HD13      ILE 899  14.514   3.563  -4.966
  451    H    MET 900           H        MET 900  12.806   0.313  -6.584
  452    HA   MET 900           HA       MET 900  10.420  -0.290  -8.184
  453    HB2  MET 900           HB2      MET 900  11.574  -2.144  -9.317
  454    HB3  MET 900           HB1      MET 900  12.340  -0.605  -9.662
  455    HG2  MET 900           HG2      MET 900  14.095  -1.111  -8.047
  456    HG3  MET 900           HG1      MET 900  13.321  -2.652  -7.683
  457    HE1  MET 900           HE1      MET 900  16.525  -3.739  -9.608
  458    HE2  MET 900           HE2      MET 900  15.576  -3.907  -8.130
  459    HE3  MET 900           HE3      MET 900  16.372  -2.377  -8.499
  460    H    ALA 901           H        ALA 901  12.407  -0.974  -5.491
  461    HA   ALA 901           HA       ALA 901  10.486  -2.953  -4.563
  462    HB1  ALA 901           HB1      ALA 901  13.495  -3.125  -4.298
  463    HB2  ALA 901           HB2      ALA 901  12.490  -4.153  -5.320
  464    HB3  ALA 901           HB3      ALA 901  12.328  -4.229  -3.564
  465    H    ALA 902           H        ALA 902  10.185  -2.821  -2.301
  466    HA   ALA 902           HA       ALA 902  10.522  -0.167  -1.338
  467    HB1  ALA 902           HB1      ALA 902   9.403  -2.584   0.074
  468    HB2  ALA 902           HB2      ALA 902   8.491  -1.420  -0.902
  469    HB3  ALA 902           HB3      ALA 902   9.256  -0.901   0.589
  470    HA   PRO 903           HA       PRO 903  14.122  -1.174   1.146
  471    HB2  PRO 903           HB2      PRO 903  14.592   1.567   1.679
  472    HB3  PRO 903           HB1      PRO 903  15.420   0.592   0.469
  473    HG2  PRO 903           HG2      PRO 903  13.666   2.726   0.044
  474    HG3  PRO 903           HG1      PRO 903  14.321   1.646  -1.197
  475    HD2  PRO 903           HD2      PRO 903  11.666   1.678   0.094
  476    HD3  PRO 903           HD1      PRO 903  12.144   1.028  -1.492
  477    HA   PRO 904           HA       PRO 904  12.068  -0.710   5.040
  478    HB2  PRO 904           HB2      PRO 904  14.124  -0.771   6.771
  479    HB3  PRO 904           HB1      PRO 904  13.682  -2.189   5.808
  480    HG2  PRO 904           HG2      PRO 904  15.868  -0.200   5.340
  481    HG3  PRO 904           HG1      PRO 904  15.912  -1.969   5.212
  482    HD2  PRO 904           HD2      PRO 904  15.601  -0.320   3.045
  483    HD3  PRO 904           HD1      PRO 904  14.943  -1.972   3.123
  484    H    GLU 905           H        GLU 905  11.787   0.729   6.877
  485    HA   GLU 905           HA       GLU 905  12.300   3.460   6.203
  486    HB2  GLU 905           HB2      GLU 905  11.171   2.279   8.741
  487    HB3  GLU 905           HB1      GLU 905  11.254   4.001   8.398
  488    HG2  GLU 905           HG2      GLU 905   9.898   3.541   6.354
  489    HG3  GLU 905           HG1      GLU 905   9.644   1.909   6.985
  490    H    GLU 906           H        GLU 906  13.949   1.114   7.880
  491    HA   GLU 906           HA       GLU 906  15.559   2.649   9.632
  492    HB2  GLU 906           HB2      GLU 906  16.196   0.047   8.241
  493    HB3  GLU 906           HB1      GLU 906  17.057   0.711   9.621
  494    HG2  GLU 906           HG2      GLU 906  15.069   0.505  10.986
  495    HG3  GLU 906           HG1      GLU 906  14.169  -0.105   9.598
  496    H    MET 907           H        MET 907  15.724   1.890   6.224
  497    HA   MET 907           HA       MET 907  18.328   3.154   6.025
  498    HB2  MET 907           HB2      MET 907  18.009   1.103   4.745
  499    HB3  MET 907           HB1      MET 907  16.628   1.813   3.901
  500    HG2  MET 907           HG2      MET 907  18.139   3.489   2.918
  501    HG3  MET 907           HG1      MET 907  19.495   2.743   3.755
  502    HE1  MET 907           HE1      MET 907  20.817   2.567   1.486
  503    HE2  MET 907           HE2      MET 907  19.468   3.328   0.645
  504    HE3  MET 907           HE3      MET 907  20.170   1.837   0.017
  505    H    GLN 908           H        GLN 908  18.563   5.065   5.149
  506    HA   GLN 908           HA       GLN 908  16.129   6.600   4.881
  507    HB2  GLN 908           HB2      GLN 908  18.982   7.522   5.059
  508    HB3  GLN 908           HB1      GLN 908  17.595   8.585   4.898
  509    HG2  GLN 908           HG2      GLN 908  16.692   7.578   6.999
  510    HG3  GLN 908           HG1      GLN 908  18.247   6.766   7.186
  511   HE21  GLN 908          HE21      GLN 908  16.605   9.763   7.110
  512   HE22  GLN 908          HE22      GLN 908  17.811  10.707   7.909
  513    H    TRP 909           H        TRP 909  15.807   8.041   3.248
  514    HA   TRP 909           HA       TRP 909  17.271   7.705   0.782
  515    HD1  TRP 909           HD       TRP 909  16.620   5.800  -1.797
  516    HE1  TRP 909           HE1      TRP 909  15.687   6.665  -4.028
  517    HE3  TRP 909           HE3      TRP 909  13.006   8.897   0.017
  518    HZ2  TRP 909           HZ2      TRP 909  13.615   8.448  -4.904
  519    HZ3  TRP 909           HZ3      TRP 909  11.613  10.147  -1.550
  520    HH2  TRP 909           HH       TRP 909  11.914   9.930  -3.959
  521    HB2  TRP 909           HB2      TRP 909  15.654   5.861   0.688
  522    HB3  TRP 909           HB1      TRP 909  14.340   6.979   1.032
  523    H    PHE 910           H        PHE 910  17.007   9.442  -0.520
  524    HA   PHE 910           HA       PHE 910  15.238  11.555   0.386
  525    HD1  PHE 910           HD2      PHE 910  16.123  13.225   2.457
  526    HD2  PHE 910           HD1      PHE 910  19.324  10.674   1.286
  527    HE1  PHE 910           HE2      PHE 910  16.709  12.879   4.809
  528    HE2  PHE 910           HE1      PHE 910  19.907  10.312   3.647
  529    HZ   PHE 910           HZ       PHE 910  18.597  11.408   5.412
  530    HB2  PHE 910           HB2      PHE 910  18.166  11.901  -0.321
  531    HB3  PHE 910           HB1      PHE 910  17.052  13.201   0.116
  532    H    CYS 911           H        CYS 911  14.362  12.618  -1.246
  533    HA   CYS 911           HA       CYS 911  14.294  11.419  -3.808
  534    HB2  CYS 911           HB2      CYS 911  12.686  13.246  -4.203
  535    HB3  CYS 911           HB1      CYS 911  12.381  12.394  -2.700
  536    HA   PRO 912           HA       PRO 912  17.097  13.910  -6.276
  537    HB2  PRO 912           HB2      PRO 912  15.258  15.078  -8.077
  538    HB3  PRO 912           HB1      PRO 912  16.137  13.565  -8.302
  539    HG2  PRO 912           HG2      PRO 912  13.346  14.000  -7.347
  540    HG3  PRO 912           HG1      PRO 912  14.011  12.671  -8.312
  541    HD2  PRO 912           HD2      PRO 912  13.432  12.350  -5.736
  542    HD3  PRO 912           HD1      PRO 912  14.842  11.570  -6.472
  543    H    LYS 913           H        LYS 913  14.368  15.363  -4.717
  544    HA   LYS 913           HA       LYS 913  15.043  18.138  -5.129
  545    HB2  LYS 913           HB2      LYS 913  13.477  16.853  -2.877
  546    HB3  LYS 913           HB1      LYS 913  13.498  18.551  -3.288
  547    HG2  LYS 913           HG2      LYS 913  12.130  18.238  -5.148
  548    HG3  LYS 913           HG1      LYS 913  12.484  16.508  -5.226
  549    HD2  LYS 913           HD2      LYS 913  10.221  16.894  -4.335
  550    HD3  LYS 913           HD1      LYS 913  11.260  16.136  -3.138
  551    HE2  LYS 913           HE2      LYS 913  11.621  18.382  -2.126
  552    HE3  LYS 913           HE1      LYS 913  10.447  19.037  -3.265
  553    HZ1  LYS 913           HZ1      LYS 913   9.940  17.018  -1.126
  554    HZ2  LYS 913           HZ2      LYS 913   8.787  17.438  -2.284
  555    HZ3  LYS 913           HZ3      LYS 913   9.348  18.588  -1.205
  556    H    CYS 914           H        CYS 914  15.208  15.875  -2.454
  557    HA   CYS 914           HA       CYS 914  16.670  17.740  -0.878
  558    HB2  CYS 914           HB2      CYS 914  15.594  15.020  -0.328
  559    HB3  CYS 914           HB1      CYS 914  16.454  15.941   0.896
  560    H    ALA 915           H        ALA 915  17.436  14.735  -2.494
  561    HA   ALA 915           HA       ALA 915  19.895  14.443  -1.151
  562    HB1  ALA 915           HB1      ALA 915  18.697  12.596  -2.182
  563    HB2  ALA 915           HB2      ALA 915  20.373  12.673  -2.741
  564    HB3  ALA 915           HB3      ALA 915  19.056  13.239  -3.783
  565    H    ASN 916           H        ASN 916  18.915  16.520  -3.509
  566    HA   ASN 916           HA       ASN 916  21.425  16.770  -4.960
  567    HB2  ASN 916           HB2      ASN 916  19.230  17.253  -6.067
  568    HB3  ASN 916           HB1      ASN 916  19.052  18.635  -4.991
  569   HD21  ASN 916          HD21      ASN 916  19.044  20.153  -6.612
  570   HD22  ASN 916          HD22      ASN 916  20.440  20.551  -7.536
  571    H    LYS 917           H        LYS 917  19.608  18.622  -2.530
  572    HA   LYS 917           HA       LYS 917  21.547  20.691  -2.281
  573    HB2  LYS 917           HB2      LYS 917  20.329  21.357  -0.237
  574    HB3  LYS 917           HB1      LYS 917  19.206  21.044  -1.547
  575    HG2  LYS 917           HG2      LYS 917  18.827  18.788  -0.593
  576    HG3  LYS 917           HG1      LYS 917  19.866  19.255   0.747
  577    HD2  LYS 917           HD2      LYS 917  18.300  21.029   1.353
  578    HD3  LYS 917           HD1      LYS 917  17.281  20.614  -0.031
  579    HE2  LYS 917           HE2      LYS 917  17.008  18.325   0.929
  580    HE3  LYS 917           HE1      LYS 917  17.922  18.844   2.324
  581    HZ1  LYS 917           HZ1      LYS 917  15.363  20.076   1.456
  582    HZ2  LYS 917           HZ2      LYS 917  16.245  20.448   2.859
  583    HZ3  LYS 917           HZ3      LYS 917  15.526  18.941   2.693
  584    H    ILE 918           H        ILE 918  21.033  17.621  -0.773
  585    HA   ILE 918           HA       ILE 918  23.045  17.682   1.207
  586    HB   ILE 918           HB       ILE 918  21.955  15.389  -0.431
  587   HG12  ILE 918          HG12      ILE 918  21.148  16.488   2.276
  588   HG13  ILE 918          HG11      ILE 918  20.227  16.404   0.767
  589   HG21  ILE 918          HG21      ILE 918  24.064  14.784   0.409
  590   HG22  ILE 918          HG22      ILE 918  22.820  13.887   1.299
  591   HG23  ILE 918          HG23      ILE 918  23.641  15.267   2.057
  592   HD11  ILE 918          HD11      ILE 918  21.090  14.014   2.376
  593   HD12  ILE 918          HD12      ILE 918  20.087  14.004   0.927
  594   HD13  ILE 918          HD13      ILE 918  19.484  14.742   2.412
  595    H    LYS 919           H        LYS 919  22.933  16.609  -2.133
  596    HA   LYS 919           HA       LYS 919  24.306  16.740  -3.782
  597    HB2  LYS 919           HB2      LYS 919  25.383  18.740  -2.954
  598    HB3  LYS 919           HB1      LYS 919  26.350  17.802  -1.836
  599    HG2  LYS 919           HG2      LYS 919  27.542  16.795  -3.724
  600    HG3  LYS 919           HG1      LYS 919  26.574  17.775  -4.835
  601    HD2  LYS 919           HD2      LYS 919  27.413  19.799  -3.768
  602    HD3  LYS 919           HD1      LYS 919  28.399  18.821  -2.683
  603    HE2  LYS 919           HE2      LYS 919  29.650  17.948  -4.575
  604    HE3  LYS 919           HE1      LYS 919  28.634  18.871  -5.685
  605    HZ1  LYS 919           HZ1      LYS 919  30.741  19.985  -5.246
  606    HZ2  LYS 919           HZ2      LYS 919  30.389  20.032  -3.597
  607    HZ3  LYS 919           HZ3      LYS 919  29.438  20.900  -4.690
  608    H    LYS 920           H        LYS 920  25.481  15.254  -0.902
  609    HA   LYS 920           HA       LYS 920  26.540  13.285  -0.475
  610    HB2  LYS 920           HB2      LYS 920  25.715  12.564  -3.305
  611    HB3  LYS 920           HB1      LYS 920  26.305  11.425  -2.103
  612    HG2  LYS 920           HG2      LYS 920  24.322  11.647  -0.814
  613    HG3  LYS 920           HG1      LYS 920  23.790  13.036  -1.755
  614    HD2  LYS 920           HD2      LYS 920  24.211  10.337  -3.028
  615    HD3  LYS 920           HD1      LYS 920  22.695  10.753  -2.235
  616    HE2  LYS 920           HE2      LYS 920  22.522  11.124  -4.646
  617    HE3  LYS 920           HE1      LYS 920  22.405  12.646  -3.782
  618    HZ1  LYS 920           HZ1      LYS 920  23.715  12.761  -5.788
  619    HZ2  LYS 920           HZ2      LYS 920  24.846  11.679  -5.241
  620    HZ3  LYS 920           HZ3      LYS 920  24.655  13.198  -4.490
  621    H    ASP 921           H        ASP 921  28.202  14.935  -0.618
  622    HA   ASP 921           HA       ASP 921  29.780  15.331  -2.910
  623    HB2  ASP 921           HB2      ASP 921  29.521  16.857  -0.879
  624    HB3  ASP 921           HB1      ASP 921  30.638  15.781  -0.052
  625    H    LYS 922           H        LYS 922  32.087  14.836  -2.988
  626    HA   LYS 922           HA       LYS 922  32.516  12.050  -3.002
  627    HB2  LYS 922           HB2      LYS 922  33.539  13.593  -4.604
  628    HB3  LYS 922           HB1      LYS 922  34.455  14.339  -3.304
  629    HG2  LYS 922           HG2      LYS 922  35.590  12.173  -2.923
  630    HG3  LYS 922           HG1      LYS 922  34.733  11.524  -4.323
  631    HD2  LYS 922           HD2      LYS 922  35.727  13.214  -5.736
  632    HD3  LYS 922           HD1      LYS 922  36.574  13.903  -4.350
  633    HE2  LYS 922           HE2      LYS 922  37.752  11.744  -4.061
  634    HE3  LYS 922           HE1      LYS 922  36.943  11.151  -5.510
  635    HZ1  LYS 922           HZ1      LYS 922  37.987  12.970  -6.759
  636    HZ2  LYS 922           HZ2      LYS 922  39.112  11.931  -6.090
  637    HZ3  LYS 922           HZ3      LYS 922  38.838  13.431  -5.378
  638    H    LYS 923           H        LYS 923  33.472  14.668  -0.863
  639    HA   LYS 923           HA       LYS 923  35.307  13.098   0.615
  640    HB2  LYS 923           HB2      LYS 923  35.276  14.926   2.279
  641    HB3  LYS 923           HB1      LYS 923  35.593  15.488   0.649
  642    HG2  LYS 923           HG2      LYS 923  33.272  16.254   0.476
  643    HG3  LYS 923           HG1      LYS 923  32.970  15.692   2.119
  644    HD2  LYS 923           HD2      LYS 923  34.631  17.233   2.981
  645    HD3  LYS 923           HD1      LYS 923  35.022  17.755   1.341
  646    HE2  LYS 923           HE2      LYS 923  32.770  18.616   1.063
  647    HE3  LYS 923           HE1      LYS 923  32.341  18.067   2.684
  648    HZ1  LYS 923           HZ1      LYS 923  32.906  20.452   2.586
  649    HZ2  LYS 923           HZ2      LYS 923  34.464  20.054   2.086
  650    HZ3  LYS 923           HZ3      LYS 923  33.926  19.587   3.607
  651    H    HIS 924           H        HIS 924  35.027  11.748   2.153
  652    HA   HIS 924           HA       HIS 924  32.594  11.724   3.668
  653    HD1  HIS 924           HD1      HIS 924  33.784   9.967  -0.079
  654    HD2  HIS 924           HD2      HIS 924  34.364   7.394   3.141
  655    HE1  HIS 924           HE1      HIS 924  35.311   8.190  -0.914
  656    HE2  HIS 924           HE2      HIS 924  35.454   6.530   0.969
  657    HB2  HIS 924           HB2      HIS 924  32.317   9.240   3.336
  658    HB3  HIS 924           HB1      HIS 924  31.990  10.186   1.895
  Start of MODEL    2
    1    HA   ALA   1           HA       ALA   1  12.290   7.020   2.741
    2    H1   ALA   1           HT1      ALA   1  12.354   7.008   5.221
    3    H2   ALA   1           HT2      ALA   1  13.778   7.240   4.454
    4    H3   ALA   1           HT3      ALA   1  13.453   5.715   5.139
    5    HB1  ALA   1           HB1      ALA   1  12.745   4.875   1.646
    6    HB2  ALA   1           HB2      ALA   1  13.328   4.209   3.165
    7    HB3  ALA   1           HB3      ALA   1  14.231   5.495   2.383
    8    H    ARG   2           H        ARG   2  10.334   7.356   4.026
    9    HA   ARG   2           HA       ARG   2   8.874   5.242   5.087
   10    HE   ARG   2           HE       ARG   2   8.813   9.271   6.287
   11    HB2  ARG   2           HB2      ARG   2   8.583   8.036   4.594
   12    HB3  ARG   2           HB1      ARG   2   7.103   7.202   4.177
   13    HG2  ARG   2           HG2      ARG   2   6.950   6.269   6.350
   14    HG3  ARG   2           HG1      ARG   2   8.531   6.916   6.809
   15    HD2  ARG   2           HD2      ARG   2   6.079   8.503   6.072
   16    HD3  ARG   2           HD1      ARG   2   6.728   8.298   7.698
   17   HH11  ARG   2          HH11      ARG   2   5.485  10.449   6.672
   18   HH12  ARG   2          HH12      ARG   2   5.933  12.074   6.585
   19   HH21  ARG   2          HH21      ARG   2   9.381  11.476   6.160
   20   HH22  ARG   2          HH22      ARG   2   8.186  12.691   6.359
   21    H    THR   3           H        THR   3   8.050   3.585   4.036
   22    HA   THR   3           HA       THR   3   7.129   4.005   1.309
   23    HB   THR   3           HB       THR   3   7.712   1.514   1.114
   24    HG1  THR   3           HG1      THR   3   9.870   1.686   2.724
   25   HG21  THR   3          HG21      THR   3   8.853   3.338  -0.087
   26   HG22  THR   3          HG22      THR   3   9.952   2.047   0.371
   27   HG23  THR   3          HG23      THR   3   9.939   3.557   1.292
   28    HA   M3L   4           HA       M3L   4   3.940   1.054   2.100
   29    H    M3L   4           H        M3L   4   5.178   3.209   0.797
   30    HB2  M3L   4           HB2      M3L   4   3.171   2.368   3.883
   31    HB3  M3L   4           HB1      M3L   4   1.854   2.503   2.739
   32    HG2  M3L   4           HG2      M3L   4   3.932   4.586   3.410
   33    HG3  M3L   4           HG1      M3L   4   2.215   4.639   3.781
   34    HD2  M3L   4           HD2      M3L   4   2.946   6.128   1.903
   35    HD3  M3L   4           HD1      M3L   4   3.346   4.685   0.986
   36    HE2  M3L   4           HE2      M3L   4   1.311   4.642   0.197
   37    HE3  M3L   4           HE1      M3L   4   0.757   4.192   1.784
   38   HM11  M3L   4          HM11      M3L   4   0.807   8.427   0.914
   39   HM12  M3L   4          HM12      M3L   4   1.888   7.776   2.094
   40   HM13  M3L   4          HM13      M3L   4   2.106   7.397   0.410
   41   HM21  M3L   4          HM21      M3L   4  -1.117   5.420   0.085
   42   HM22  M3L   4          HM22      M3L   4  -0.096   6.533  -0.763
   43   HM23  M3L   4          HM23      M3L   4  -1.293   7.126   0.341
   44   HM31  M3L   4          HM31      M3L   4  -0.909   5.495   2.805
   45   HM32  M3L   4          HM32      M3L   4  -0.860   7.240   2.774
   46   HM33  M3L   4          HM33      M3L   4   0.447   6.334   3.483
   47    H    GLN   5           H        GLN   5   1.758   0.741   1.200
   48    HA   GLN   5           HA       GLN   5   1.101   2.564  -0.886
   49    HB2  GLN   5           HB2      GLN   5   0.319   0.740  -2.384
   50    HB3  GLN   5           HB1      GLN   5   2.039   0.742  -2.186
   51    HG2  GLN   5           HG2      GLN   5   1.598  -1.446  -2.174
   52    HG3  GLN   5           HG1      GLN   5   1.522  -1.138  -0.451
   53   HE21  GLN   5          HE21      GLN   5  -0.199  -1.750  -3.344
   54   HE22  GLN   5          HE22      GLN   5  -1.730  -2.117  -2.672
   55    H    THR   6           H        THR   6  -1.131   2.867  -1.173
   56    HA   THR   6           HA       THR   6  -2.416   3.020   1.237
   57    HB   THR   6           HB       THR   6  -3.980   2.950  -1.304
   58    HG1  THR   6           HG1      THR   6  -2.903   5.040  -1.842
   59   HG21  THR   6          HG21      THR   6  -5.021   3.690   0.804
   60   HG22  THR   6          HG22      THR   6  -4.871   5.051  -0.312
   61   HG23  THR   6          HG23      THR   6  -3.741   4.878   1.025
   62    H    ALA   7           H        ALA   7  -3.474   0.981  -1.498
   63    HA   ALA   7           HA       ALA   7  -3.618  -1.434  -0.224
   64    HB1  ALA   7           HB1      ALA   7  -5.384  -0.521   1.221
   65    HB2  ALA   7           HB2      ALA   7  -6.068  -1.741   0.142
   66    HB3  ALA   7           HB3      ALA   7  -6.304  -0.023  -0.190
   67    H    ARG   8           H        ARG   8  -6.336  -0.222  -2.017
   68    HA   ARG   8           HA       ARG   8  -5.164  -1.250  -4.502
   69    HE   ARG   8           HE       ARG   8  -6.451  -5.757  -2.251
   70    HB2  ARG   8           HB2      ARG   8  -7.945  -1.974  -3.544
   71    HB3  ARG   8           HB1      ARG   8  -7.277  -2.372  -5.115
   72    HG2  ARG   8           HG2      ARG   8  -5.578  -3.773  -4.023
   73    HG3  ARG   8           HG1      ARG   8  -6.289  -3.399  -2.455
   74    HD2  ARG   8           HD2      ARG   8  -8.426  -4.402  -3.257
   75    HD3  ARG   8           HD1      ARG   8  -7.599  -4.861  -4.744
   76   HH11  ARG   8          HH11      ARG   8  -8.456  -6.633  -5.061
   77   HH12  ARG   8          HH12      ARG   8  -8.206  -8.305  -4.850
   78   HH21  ARG   8          HH21      ARG   8  -6.189  -8.011  -1.980
   79   HH22  ARG   8          HH22      ARG   8  -6.913  -9.107  -3.061
   80    H    LYS   9           H        LYS   9  -8.004   0.346  -3.058
   81    HA   LYS   9           HA       LYS   9  -9.241   2.079  -3.595
   82    HB2  LYS   9           HB2      LYS   9  -6.696   2.953  -4.964
   83    HB3  LYS   9           HB1      LYS   9  -8.127   3.983  -4.887
   84    HG2  LYS   9           HG2      LYS   9  -8.075   3.963  -2.479
   85    HG3  LYS   9           HG1      LYS   9  -6.748   2.810  -2.483
   86    HD2  LYS   9           HD2      LYS   9  -6.008   5.110  -1.992
   87    HD3  LYS   9           HD1      LYS   9  -5.277   4.457  -3.454
   88    HE2  LYS   9           HE2      LYS   9  -6.711   5.745  -4.826
   89    HE3  LYS   9           HE1      LYS   9  -7.680   6.271  -3.440
   90    HZ1  LYS   9           HZ1      LYS   9  -5.967   7.862  -4.349
   91    HZ2  LYS   9           HZ2      LYS   9  -4.784   6.857  -3.627
   92    HZ3  LYS   9           HZ3      LYS   9  -5.964   7.600  -2.682
   93    H    SER  10           H        SER  10  -9.075  -0.259  -5.312
   94    HA   SER  10           HA       SER  10 -10.657   0.818  -7.485
   95    HG   SER  10           HG       SER  10 -10.002  -0.671  -9.859
   96    HB2  SER  10           HB2      SER  10  -8.563  -0.085  -8.409
   97    HB3  SER  10           HB1      SER  10  -8.799  -1.588  -7.522
   98    H    THR  11           H        THR  11 -12.626  -0.041  -7.563
   99    HA   THR  11           HA       THR  11 -13.335  -1.988  -5.499
  100    HB   THR  11           HB       THR  11 -15.186  -0.197  -7.098
  101    HG1  THR  11           HG1      THR  11 -13.311   0.344  -5.186
  102   HG21  THR  11          HG21      THR  11 -15.388  -1.407  -4.323
  103   HG22  THR  11          HG22      THR  11 -16.245  -2.001  -5.746
  104   HG23  THR  11          HG23      THR  11 -16.614  -0.402  -5.096
  105    H    GLY  12           H        GLY  12 -12.132  -2.607  -8.173
  106    HA2  GLY  12           HA2      GLY  12 -12.816  -4.810  -9.144
  107    HA3  GLY  12           HA1      GLY  12 -14.385  -4.053  -9.394
  108    H    GLY  13           H        GLY  13 -12.759  -1.516  -9.923
  109    HA2  GLY  13           HA2      GLY  13 -11.435  -2.017 -12.391
  110    HA3  GLY  13           HA1      GLY  13 -13.039  -1.316 -12.606
  111    H1   GLY 850           HT1      GLY 850  -0.279  28.947 -13.720
  112    H2   GLY 850           HT2      GLY 850  -0.471  27.272 -13.632
  113    H3   GLY 850           HT3      GLY 850   0.870  27.922 -14.417
  114    HA2  GLY 850           HA1      GLY 850   1.483  27.083 -12.247
  115    HA3  GLY 850           HA2      GLY 850   1.701  28.822 -12.370
  116    H    SER 851           H        SER 851   0.033  26.276 -10.821
  117    HA   SER 851           HA       SER 851  -1.569  28.215  -9.323
  118    HG   SER 851           HG       SER 851  -2.774  26.172 -11.457
  119    HB2  SER 851           HB2      SER 851  -1.955  25.239  -9.714
  120    HB3  SER 851           HB1      SER 851  -2.961  26.247  -8.670
  121    H    HIS 852           H        HIS 852  -1.989  27.234  -6.963
  122    HA   HIS 852           HA       HIS 852   0.616  27.162  -5.791
  123    HD2  HIS 852           HD2      HIS 852   0.923  29.576  -4.445
  124    HE1  HIS 852           HE1      HIS 852  -2.718  31.687  -4.917
  125    HE2  HIS 852           HE2      HIS 852  -0.212  31.801  -5.114
  126    HB2  HIS 852           HB2      HIS 852  -2.123  27.061  -4.509
  127    HB3  HIS 852           HB1      HIS 852  -0.612  27.146  -3.612
  128    H    MET 853           H        MET 853   1.574  25.379  -6.281
  129    HA   MET 853           HA       MET 853   0.395  22.786  -5.557
  130    HB2  MET 853           HB2      MET 853   2.793  23.482  -7.280
  131    HB3  MET 853           HB1      MET 853   2.198  21.859  -6.976
  132    HG2  MET 853           HG2      MET 853   0.195  22.283  -8.187
  133    HG3  MET 853           HG1      MET 853   0.551  24.000  -8.292
  134    HE1  MET 853           HE1      MET 853   3.175  21.094  -8.807
  135    HE2  MET 853           HE2      MET 853   3.016  20.795 -10.540
  136    HE3  MET 853           HE3      MET 853   1.688  20.400  -9.451
  137    H    ALA 854           H        ALA 854   3.581  24.283  -5.680
  138    HA   ALA 854           HA       ALA 854   5.397  24.320  -4.324
  139    HB1  ALA 854           HB1      ALA 854   3.985  25.834  -3.030
  140    HB2  ALA 854           HB2      ALA 854   4.999  24.787  -1.974
  141    HB3  ALA 854           HB3      ALA 854   3.319  24.415  -2.206
  142    H    MET 855           H        MET 855   3.718  22.896  -1.886
  143    HA   MET 855           HA       MET 855   5.043  20.342  -1.939
  144    HB2  MET 855           HB2      MET 855   5.363  22.353   0.319
  145    HB3  MET 855           HB1      MET 855   5.931  20.699   0.342
  146    HG2  MET 855           HG2      MET 855   7.598  21.184  -1.314
  147    HG3  MET 855           HG1      MET 855   6.940  22.794  -1.571
  148    HE1  MET 855           HE1      MET 855   7.077  24.765   0.223
  149    HE2  MET 855           HE2      MET 855   7.837  24.601   1.801
  150    HE3  MET 855           HE3      MET 855   6.331  23.757   1.465
  151    H    ALA 856           H        ALA 856   4.095  19.160  -0.292
  152    HA   ALA 856           HA       ALA 856   2.409  18.210   0.890
  153    HB1  ALA 856           HB1      ALA 856   1.361  21.010   1.392
  154    HB2  ALA 856           HB2      ALA 856   2.507  20.150   2.423
  155    HB3  ALA 856           HB3      ALA 856   0.859  19.551   2.245
  156    H    TYR 857           H        TYR 857   1.605  17.112  -0.627
  157    HA   TYR 857           HA       TYR 857  -0.367  18.253  -2.495
  158    HD1  TYR 857           HD2      TYR 857   0.168  18.002  -5.366
  159    HD2  TYR 857           HD1      TYR 857   3.476  17.601  -2.729
  160    HE1  TYR 857           HE2      TYR 857   1.442  19.567  -6.752
  161    HE2  TYR 857           HE1      TYR 857   4.769  19.176  -4.107
  162    HH   TYR 857           HH       TYR 857   4.808  20.056  -6.371
  163    HB2  TYR 857           HB2      TYR 857   1.607  16.057  -2.598
  164    HB3  TYR 857           HB1      TYR 857   0.233  16.163  -3.690
  165    H    VAL 858           H        VAL 858  -0.507  16.797   0.267
  166    HA   VAL 858           HA       VAL 858  -2.349  14.704  -0.484
  167    HB   VAL 858           HB       VAL 858  -0.952  14.183   1.419
  168   HG11  VAL 858          HG11      VAL 858  -1.109  15.356   3.561
  169   HG12  VAL 858          HG12      VAL 858  -2.184  16.543   2.819
  170   HG13  VAL 858          HG13      VAL 858  -0.510  16.403   2.269
  171   HG21  VAL 858          HG21      VAL 858  -3.811  14.585   2.315
  172   HG22  VAL 858          HG22      VAL 858  -2.648  13.491   3.059
  173   HG23  VAL 858          HG23      VAL 858  -3.189  13.216   1.406
  174    H    ILE 859           H        ILE 859  -4.316  15.034  -0.990
  175    HA   ILE 859           HA       ILE 859  -5.874  17.082   0.430
  176    HB   ILE 859           HB       ILE 859  -7.282  17.320  -1.619
  177   HG12  ILE 859          HG12      ILE 859  -5.121  15.644  -2.948
  178   HG13  ILE 859          HG11      ILE 859  -6.785  15.155  -2.652
  179   HG21  ILE 859          HG21      ILE 859  -5.713  18.693  -2.918
  180   HG22  ILE 859          HG22      ILE 859  -4.368  17.989  -2.015
  181   HG23  ILE 859          HG23      ILE 859  -5.575  18.970  -1.181
  182   HD11  ILE 859          HD11      ILE 859  -6.447  15.774  -4.976
  183   HD12  ILE 859          HD12      ILE 859  -5.905  17.377  -4.481
  184   HD13  ILE 859          HD13      ILE 859  -7.572  16.879  -4.183
  185    H    ARG 860           H        ARG 860  -8.326  16.482   0.262
  186    HA   ARG 860           HA       ARG 860  -8.507  13.582   0.717
  187    HE   ARG 860           HE       ARG 860  -8.222  15.012   5.513
  188    HB2  ARG 860           HB2      ARG 860 -10.228  15.829   1.729
  189    HB3  ARG 860           HB1      ARG 860 -10.628  14.129   1.914
  190    HG2  ARG 860           HG2      ARG 860  -8.657  13.790   3.216
  191    HG3  ARG 860           HG1      ARG 860  -8.200  15.497   3.049
  192    HD2  ARG 860           HD2      ARG 860 -10.386  16.092   4.109
  193    HD3  ARG 860           HD1      ARG 860 -10.674  14.376   4.370
  194   HH11  ARG 860          HH11      ARG 860 -11.647  15.764   5.996
  195   HH12  ARG 860          HH12      ARG 860 -11.519  16.075   7.648
  196   HH21  ARG 860          HH21      ARG 860  -8.032  15.441   7.850
  197   HH22  ARG 860          HH22      ARG 860  -9.407  15.898   8.726
  198    H    ASP 861           H        ASP 861 -10.232  12.428  -0.119
  199    HA   ASP 861           HA       ASP 861 -11.510  13.693  -2.407
  200    HB2  ASP 861           HB2      ASP 861 -12.131  11.480  -3.221
  201    HB3  ASP 861           HB1      ASP 861 -10.432  11.463  -2.807
  202    H    GLU 862           H        GLU 862 -13.795  12.382  -2.659
  203    HA   GLU 862           HA       GLU 862 -15.608  13.756  -1.076
  204    HB2  GLU 862           HB2      GLU 862 -17.292  12.265  -2.118
  205    HB3  GLU 862           HB1      GLU 862 -16.179  13.001  -3.259
  206    HG2  GLU 862           HG2      GLU 862 -14.861  10.900  -3.253
  207    HG3  GLU 862           HG1      GLU 862 -16.106  10.174  -2.242
  208    H    TRP 863           H        TRP 863 -14.149  10.622  -0.468
  209    HA   TRP 863           HA       TRP 863 -16.074  10.088   1.618
  210    HD1  TRP 863           HD       TRP 863 -17.577   8.729   0.551
  211    HE1  TRP 863           HE1      TRP 863 -18.526   7.777  -1.699
  212    HE3  TRP 863           HE3      TRP 863 -13.236   7.245  -1.446
  213    HZ2  TRP 863           HZ2      TRP 863 -17.444   6.535  -4.017
  214    HZ3  TRP 863           HZ3      TRP 863 -13.214   6.178  -3.686
  215    HH2  TRP 863           HH       TRP 863 -15.284   5.838  -4.929
  216    HB2  TRP 863           HB2      TRP 863 -13.831   8.394   0.539
  217    HB3  TRP 863           HB1      TRP 863 -15.034   7.874   1.721
  218    H    GLY 864           H        GLY 864 -13.141  11.640   1.241
  219    HA2  GLY 864           HA2      GLY 864 -12.113  12.764   3.008
  220    HA3  GLY 864           HA1      GLY 864 -12.737  11.553   4.120
  221    H    ASN 865           H        ASN 865 -11.367  10.329   1.226
  222    HA   ASN 865           HA       ASN 865  -9.222   9.130   2.772
  223    HB2  ASN 865           HB2      ASN 865  -9.783   8.925  -0.196
  224    HB3  ASN 865           HB1      ASN 865  -8.568   8.002   0.669
  225   HD21  ASN 865          HD21      ASN 865 -11.835   8.346  -0.138
  226   HD22  ASN 865          HD22      ASN 865 -12.420   6.883   0.591
  227    H    GLN 866           H        GLN 866  -7.076   9.500   2.453
  228    HA   GLN 866           HA       GLN 866  -6.492  12.143   1.518
  229    HB2  GLN 866           HB2      GLN 866  -4.795  10.027   2.805
  230    HB3  GLN 866           HB1      GLN 866  -4.190  11.602   2.318
  231    HG2  GLN 866           HG2      GLN 866  -5.704  12.685   3.811
  232    HG3  GLN 866           HG1      GLN 866  -6.409  11.139   4.281
  233   HE21  GLN 866          HE21      GLN 866  -3.697  13.245   4.589
  234   HE22  GLN 866          HE22      GLN 866  -2.919  12.383   5.861
  235    H    ILE 867           H        ILE 867  -5.858  12.593  -0.326
  236    HA   ILE 867           HA       ILE 867  -4.867  10.513  -2.135
  237    HB   ILE 867           HB       ILE 867  -6.070  13.187  -2.857
  238   HG12  ILE 867          HG12      ILE 867  -7.851  11.939  -1.781
  239   HG13  ILE 867          HG11      ILE 867  -8.146  11.952  -3.509
  240   HG21  ILE 867          HG21      ILE 867  -5.514  10.748  -4.531
  241   HG22  ILE 867          HG22      ILE 867  -4.628  12.272  -4.556
  242   HG23  ILE 867          HG23      ILE 867  -6.306  12.220  -5.102
  243   HD11  ILE 867          HD11      ILE 867  -7.256   9.656  -3.640
  244   HD12  ILE 867          HD12      ILE 867  -8.664   9.792  -2.587
  245   HD13  ILE 867          HD13      ILE 867  -7.051   9.661  -1.890
  246    H    TRP 868           H        TRP 868  -2.717  10.690  -2.079
  247    HA   TRP 868           HA       TRP 868  -1.450  13.275  -1.801
  248    HD1  TRP 868           HD       TRP 868   1.141  13.103   0.251
  249    HE1  TRP 868           HE1      TRP 868   0.695  12.536   2.709
  250    HE3  TRP 868           HE3      TRP 868  -2.212   9.294  -0.384
  251    HZ2  TRP 868           HZ2      TRP 868  -0.865  10.714   4.202
  252    HZ3  TRP 868           HZ3      TRP 868  -3.133   8.197   1.622
  253    HH2  TRP 868           HH       TRP 868  -2.468   8.898   3.862
  254    HB2  TRP 868           HB2      TRP 868  -0.387  10.458  -1.949
  255    HB3  TRP 868           HB1      TRP 868   0.666  11.865  -1.997
  256    H    ILE 869           H        ILE 869  -0.483  14.319  -3.427
  257    HA   ILE 869           HA       ILE 869  -0.609  13.118  -6.104
  258    HB   ILE 869           HB       ILE 869   0.028  16.026  -5.463
  259   HG12  ILE 869          HG12      ILE 869  -2.212  15.602  -4.537
  260   HG13  ILE 869          HG11      ILE 869  -2.294  16.635  -5.953
  261   HG21  ILE 869          HG21      ILE 869   0.709  15.341  -7.606
  262   HG22  ILE 869          HG22      ILE 869  -0.615  16.502  -7.682
  263   HG23  ILE 869          HG23      ILE 869  -0.929  14.784  -7.990
  264   HD11  ILE 869          HD11      ILE 869  -4.096  15.046  -5.947
  265   HD12  ILE 869          HD12      ILE 869  -2.959  13.708  -5.813
  266   HD13  ILE 869          HD13      ILE 869  -3.004  14.678  -7.287
  267    H    CYS 870           H        CYS 870   1.265  12.552  -7.019
  268    HA   CYS 870           HA       CYS 870   3.718  12.595  -5.584
  269    HB2  CYS 870           HB2      CYS 870   3.153  10.802  -7.130
  270    HB3  CYS 870           HB1      CYS 870   3.057  11.933  -8.462
  271    HA   PRO 871           HA       PRO 871   4.855  16.646  -7.267
  272    HB2  PRO 871           HB2      PRO 871   7.414  16.293  -5.892
  273    HB3  PRO 871           HB1      PRO 871   6.153  17.489  -5.581
  274    HG2  PRO 871           HG2      PRO 871   6.693  15.474  -3.853
  275    HG3  PRO 871           HG1      PRO 871   5.072  16.161  -4.055
  276    HD2  PRO 871           HD2      PRO 871   6.214  13.638  -5.185
  277    HD3  PRO 871           HD1      PRO 871   4.611  13.939  -4.477
  278    H    GLY 872           H        GLY 872   6.101  13.599  -7.865
  279    HA2  GLY 872           HA2      GLY 872   8.374  14.333  -9.419
  280    HA3  GLY 872           HA1      GLY 872   7.586  12.763  -9.375
  281    H    CYS 873           H        CYS 873   5.206  12.978 -10.281
  282    HA   CYS 873           HA       CYS 873   5.554  13.987 -13.022
  283    HB2  CYS 873           HB2      CYS 873   3.644  12.322 -13.422
  284    HB3  CYS 873           HB1      CYS 873   5.223  11.644 -13.005
  285    H    ASN 874           H        ASN 874   3.790  14.404 -10.169
  286    HA   ASN 874           HA       ASN 874   2.043  15.459  -9.457
  287    HB2  ASN 874           HB2      ASN 874   2.912  17.486 -10.597
  288    HB3  ASN 874           HB1      ASN 874   2.050  17.025 -12.060
  289   HD21  ASN 874          HD21      ASN 874   1.690  18.120  -8.763
  290   HD22  ASN 874          HD22      ASN 874   0.092  18.751  -8.930
  291    H    LYS 875           H        LYS 875   1.259  13.426  -9.510
  292    HA   LYS 875           HA       LYS 875  -1.164  13.098 -11.037
  293    HB2  LYS 875           HB2      LYS 875   0.447  11.983 -12.266
  294    HB3  LYS 875           HB1      LYS 875   1.256  11.325 -10.834
  295    HG2  LYS 875           HG2      LYS 875  -0.906  10.090 -10.500
  296    HG3  LYS 875           HG1      LYS 875  -1.277  10.537 -12.180
  297    HD2  LYS 875           HD2      LYS 875   1.209   9.083 -11.303
  298    HD3  LYS 875           HD1      LYS 875  -0.239   8.245 -11.840
  299    HE2  LYS 875           HE2      LYS 875   1.306   8.329 -13.670
  300    HE3  LYS 875           HE1      LYS 875  -0.033   9.419 -14.001
  301    HZ1  LYS 875           HZ1      LYS 875   2.256  10.250 -14.560
  302    HZ2  LYS 875           HZ2      LYS 875   2.558  10.441 -12.901
  303    HZ3  LYS 875           HZ3      LYS 875   1.314  11.285 -13.655
  304    HA   PRO 876           HA       PRO 876  -2.155  11.967  -6.847
  305    HB2  PRO 876           HB2      PRO 876  -4.518  10.722  -7.232
  306    HB3  PRO 876           HB1      PRO 876  -4.329  12.469  -7.392
  307    HG2  PRO 876           HG2      PRO 876  -4.508  10.377  -9.482
  308    HG3  PRO 876           HG1      PRO 876  -5.153  12.037  -9.483
  309    HD2  PRO 876           HD2      PRO 876  -2.798  11.219 -10.767
  310    HD3  PRO 876           HD1      PRO 876  -3.153  12.886 -10.351
  311    H    ASP 877           H        ASP 877  -2.681  10.175  -5.531
  312    HA   ASP 877           HA       ASP 877  -1.155   7.837  -6.093
  313    HB2  ASP 877           HB2      ASP 877  -1.110   8.483  -3.836
  314    HB3  ASP 877           HB1      ASP 877  -2.862   8.679  -3.767
  315    H    ASP 878           H        ASP 878  -1.757   5.959  -6.800
  316    HA   ASP 878           HA       ASP 878  -4.595   5.485  -7.511
  317    HB2  ASP 878           HB2      ASP 878  -2.049   4.150  -8.471
  318    HB3  ASP 878           HB1      ASP 878  -3.658   3.610  -8.908
  319    H    GLY 879           H        GLY 879  -3.191   5.074  -4.837
  320    HA2  GLY 879           HA2      GLY 879  -3.388   3.526  -3.139
  321    HA3  GLY 879           HA1      GLY 879  -4.150   2.392  -4.276
  322    H    SER 880           H        SER 880  -1.239   4.202  -4.491
  323    HA   SER 880           HA       SER 880   0.096   1.779  -5.403
  324    HG   SER 880           HG       SER 880  -0.035   5.199  -5.347
  325    HB2  SER 880           HB2      SER 880   1.489   3.522  -6.660
  326    HB3  SER 880           HB1      SER 880  -0.145   3.163  -7.223
  327    HA   PRO 881           HA       PRO 881   3.417   2.128  -2.390
  328    HB2  PRO 881           HB2      PRO 881   4.927   1.593  -4.914
  329    HB3  PRO 881           HB1      PRO 881   5.125   0.863  -3.317
  330    HG2  PRO 881           HG2      PRO 881   3.874  -0.480  -5.215
  331    HG3  PRO 881           HG1      PRO 881   3.261  -0.493  -3.560
  332    HD2  PRO 881           HD2      PRO 881   2.140   0.886  -5.936
  333    HD3  PRO 881           HD1      PRO 881   1.352   0.267  -4.512
  334    H    MET 882           H        MET 882   4.109   3.969  -1.730
  335    HA   MET 882           HA       MET 882   5.285   5.877  -3.627
  336    HB2  MET 882           HB2      MET 882   3.585   6.644  -1.233
  337    HB3  MET 882           HB1      MET 882   4.281   7.732  -2.427
  338    HG2  MET 882           HG2      MET 882   2.833   6.738  -4.129
  339    HG3  MET 882           HG1      MET 882   2.100   5.716  -2.905
  340    HE1  MET 882           HE1      MET 882   3.174   9.491  -3.150
  341    HE2  MET 882           HE2      MET 882   1.592  10.251  -3.400
  342    HE3  MET 882           HE3      MET 882   2.226   9.126  -4.602
  343    H    ILE 883           H        ILE 883   6.843   7.276  -2.560
  344    HA   ILE 883           HA       ILE 883   7.769   6.189  -0.033
  345    HB   ILE 883           HB       ILE 883   9.203   5.220  -1.808
  346   HG12  ILE 883          HG12      ILE 883  10.794   7.318  -0.340
  347   HG13  ILE 883          HG11      ILE 883  10.155   5.873   0.446
  348   HG21  ILE 883          HG21      ILE 883   8.955   6.950  -3.510
  349   HG22  ILE 883          HG22      ILE 883  10.666   6.667  -3.163
  350   HG23  ILE 883          HG23      ILE 883   9.860   8.081  -2.500
  351   HD11  ILE 883          HD11      ILE 883  11.476   4.484  -1.049
  352   HD12  ILE 883          HD12      ILE 883  12.511   5.654  -0.214
  353   HD13  ILE 883          HD13      ILE 883  12.052   5.923  -1.885
  354    H    GLY 884           H        GLY 884   8.304   7.606   1.394
  355    HA2  GLY 884           HA2      GLY 884   7.850  10.417   0.805
  356    HA3  GLY 884           HA1      GLY 884   8.039   9.679   2.382
  357    H    CYS 885           H        CYS 885   9.491  11.705   0.370
  358    HA   CYS 885           HA       CYS 885  12.263  10.998   0.611
  359    HB2  CYS 885           HB2      CYS 885  11.395  12.665  -1.023
  360    HB3  CYS 885           HB1      CYS 885  10.891  13.660   0.320
  361    H    ASP 886           H        ASP 886  13.597  11.271   2.335
  362    HA   ASP 886           HA       ASP 886  12.332  11.946   4.782
  363    HB2  ASP 886           HB2      ASP 886  15.103  11.079   4.087
  364    HB3  ASP 886           HB1      ASP 886  14.674  11.555   5.733
  365    H    ASP 887           H        ASP 887  13.669  13.798   2.438
  366    HA   ASP 887           HA       ASP 887  14.353  15.867   4.400
  367    HB2  ASP 887           HB2      ASP 887  16.032  15.512   2.625
  368    HB3  ASP 887           HB1      ASP 887  14.825  15.950   1.411
  369    H    CYS 888           H        CYS 888  12.668  15.562   1.315
  370    HA   CYS 888           HA       CYS 888  11.136  17.942   1.543
  371    HB2  CYS 888           HB2      CYS 888  10.379  15.420   0.053
  372    HB3  CYS 888           HB1      CYS 888   9.523  16.930  -0.059
  373    H    ASP 889           H        ASP 889  10.533  14.707   2.773
  374    HA   ASP 889           HA       ASP 889   9.045  13.811   4.177
  375    HB2  ASP 889           HB2      ASP 889   9.499  15.850   5.599
  376    HB3  ASP 889           HB1      ASP 889   8.167  16.666   4.790
  377    H    ASP 890           H        ASP 890   8.521  14.600   1.382
  378    HA   ASP 890           HA       ASP 890   5.586  14.676   1.424
  379    HB2  ASP 890           HB2      ASP 890   7.178  16.490   0.219
  380    HB3  ASP 890           HB1      ASP 890   7.037  15.310  -1.082
  381    H    TRP 891           H        TRP 891   4.742  13.600  -0.686
  382    HA   TRP 891           HA       TRP 891   6.031  10.965  -0.644
  383    HD1  TRP 891           HD       TRP 891   3.234  12.459   1.835
  384    HE1  TRP 891           HE1      TRP 891   3.588  11.125   4.029
  385    HE3  TRP 891           HE3      TRP 891   4.971   8.126  -0.132
  386    HZ2  TRP 891           HZ2      TRP 891   4.445   8.587   4.789
  387    HZ3  TRP 891           HZ3      TRP 891   5.536   6.295   1.359
  388    HH2  TRP 891           HH       TRP 891   5.281   6.506   3.785
  389    HB2  TRP 891           HB2      TRP 891   3.127  11.678  -0.720
  390    HB3  TRP 891           HB1      TRP 891   3.719  10.060  -1.091
  391    H    TYR 892           H        TYR 892   6.977  10.427  -2.379
  392    HA   TYR 892           HA       TYR 892   6.023  11.374  -4.998
  393    HD1  TYR 892           HD2      TYR 892   8.403  12.220  -2.249
  394    HD2  TYR 892           HD1      TYR 892   8.954  12.885  -6.414
  395    HE1  TYR 892           HE2      TYR 892   9.222  14.486  -1.769
  396    HE2  TYR 892           HE1      TYR 892   9.783  15.152  -5.940
  397    HH   TYR 892           HH       TYR 892  10.441  16.322  -2.713
  398    HB2  TYR 892           HB2      TYR 892   8.708  10.291  -4.081
  399    HB3  TYR 892           HB1      TYR 892   8.328  10.764  -5.725
  400    H    HIS 893           H        HIS 893   5.867   9.742  -6.670
  401    HA   HIS 893           HA       HIS 893   5.292   7.074  -5.671
  402    HD2  HIS 893           HD2      HIS 893   2.616   6.654  -6.105
  403    HE1  HIS 893           HE1      HIS 893   0.968   9.514  -8.744
  404    HE2  HIS 893           HE2      HIS 893   0.458   7.749  -7.057
  405    HB2  HIS 893           HB2      HIS 893   5.386   8.070  -8.529
  406    HB3  HIS 893           HB1      HIS 893   4.973   6.431  -8.085
  407    H    TRP 894           H        TRP 894   6.274   5.172  -6.717
  408    HA   TRP 894           HA       TRP 894   9.054   5.234  -6.314
  409    HD1  TRP 894           HD       TRP 894   8.027   4.991  -4.321
  410    HE1  TRP 894           HE1      TRP 894   7.801   3.633  -2.158
  411    HE3  TRP 894           HE3      TRP 894   7.906   0.323  -6.349
  412    HZ2  TRP 894           HZ2      TRP 894   7.577   0.912  -1.420
  413    HZ3  TRP 894           HZ3      TRP 894   7.687  -1.618  -4.856
  414    HH2  TRP 894           HH       TRP 894   7.524  -1.333  -2.453
  415    HB2  TRP 894           HB2      TRP 894   7.201   3.058  -7.211
  416    HB3  TRP 894           HB1      TRP 894   8.938   2.811  -7.124
  417    HA   PRO 895           HA       PRO 895   9.584   4.197 -11.036
  418    HB2  PRO 895           HB2      PRO 895   7.610   5.124 -12.718
  419    HB3  PRO 895           HB1      PRO 895   7.685   3.468 -12.107
  420    HG2  PRO 895           HG2      PRO 895   6.102   5.794 -11.067
  421    HG3  PRO 895           HG1      PRO 895   5.570   4.124 -11.334
  422    HD2  PRO 895           HD2      PRO 895   6.191   4.964  -8.893
  423    HD3  PRO 895           HD1      PRO 895   6.669   3.345  -9.433
  424    H    CYS 896           H        CYS 896   8.069   7.050  -9.856
  425    HA   CYS 896           HA       CYS 896   9.010   8.900 -11.764
  426    HB2  CYS 896           HB2      CYS 896   8.095   9.281  -8.941
  427    HB3  CYS 896           HB1      CYS 896   7.972  10.440 -10.289
  428    H    VAL 897           H        VAL 897  10.091   7.807  -8.584
  429    HA   VAL 897           HA       VAL 897  12.343   9.650  -8.766
  430    HB   VAL 897           HB       VAL 897  12.813   9.066  -6.430
  431   HG11  VAL 897          HG11      VAL 897  10.834  10.305  -5.514
  432   HG12  VAL 897          HG12      VAL 897  10.037  10.074  -7.067
  433   HG13  VAL 897          HG13      VAL 897  11.505  11.043  -6.966
  434   HG21  VAL 897          HG21      VAL 897  10.204   7.561  -6.584
  435   HG22  VAL 897          HG22      VAL 897  11.150   7.858  -5.113
  436   HG23  VAL 897          HG23      VAL 897  11.807   6.857  -6.404
  437    H    GLY 898           H        GLY 898  11.723   6.396  -9.300
  438    HA2  GLY 898           HA2      GLY 898  13.384   5.072 -10.382
  439    HA3  GLY 898           HA1      GLY 898  14.615   5.968  -9.503
  440    H    ILE 899           H        ILE 899  11.759   4.747  -7.985
  441    HA   ILE 899           HA       ILE 899  13.419   2.808  -6.544
  442    HB   ILE 899           HB       ILE 899  10.736   4.037  -5.813
  443   HG12  ILE 899          HG12      ILE 899  12.779   5.465  -5.494
  444   HG13  ILE 899          HG11      ILE 899  11.871   5.161  -4.018
  445   HG21  ILE 899          HG21      ILE 899  10.891   2.835  -3.677
  446   HG22  ILE 899          HG22      ILE 899  12.327   1.997  -4.265
  447   HG23  ILE 899          HG23      ILE 899  10.771   1.738  -5.053
  448   HD11  ILE 899          HD11      ILE 899  14.238   5.066  -3.649
  449   HD12  ILE 899          HD12      ILE 899  14.414   3.797  -4.874
  450   HD13  ILE 899          HD13      ILE 899  13.498   3.488  -3.387
  451    H    MET 900           H        MET 900  13.025   0.686  -6.833
  452    HA   MET 900           HA       MET 900  10.516  -0.051  -8.189
  453    HB2  MET 900           HB2      MET 900  11.654  -2.029  -9.145
  454    HB3  MET 900           HB1      MET 900  12.368  -0.516  -9.671
  455    HG2  MET 900           HG2      MET 900  14.198  -0.833  -8.093
  456    HG3  MET 900           HG1      MET 900  13.483  -2.355  -7.563
  457    HE1  MET 900           HE1      MET 900  16.501  -1.952  -8.639
  458    HE2  MET 900           HE2      MET 900  16.677  -3.408  -9.621
  459    HE3  MET 900           HE3      MET 900  15.870  -3.491  -8.056
  460    H    ALA 901           H        ALA 901  12.488  -0.526  -5.454
  461    HA   ALA 901           HA       ALA 901  10.537  -2.379  -4.383
  462    HB1  ALA 901           HB1      ALA 901  12.320  -3.692  -3.333
  463    HB2  ALA 901           HB2      ALA 901  13.530  -2.736  -4.197
  464    HB3  ALA 901           HB3      ALA 901  12.404  -3.764  -5.092
  465    H    ALA 902           H        ALA 902  10.237  -2.126  -2.226
  466    HA   ALA 902           HA       ALA 902  10.657   0.488  -1.224
  467    HB1  ALA 902           HB1      ALA 902   9.442  -0.286   0.728
  468    HB2  ALA 902           HB2      ALA 902   9.587  -1.953   0.164
  469    HB3  ALA 902           HB3      ALA 902   8.633  -0.795  -0.755
  470    HA   PRO 903           HA       PRO 903  14.200  -0.683   1.255
  471    HB2  PRO 903           HB2      PRO 903  14.828   1.988   1.826
  472    HB3  PRO 903           HB1      PRO 903  15.575   1.012   0.567
  473    HG2  PRO 903           HG2      PRO 903  13.907   3.262   0.237
  474    HG3  PRO 903           HG1      PRO 903  14.531   2.206  -1.042
  475    HD2  PRO 903           HD2      PRO 903  11.881   2.292   0.227
  476    HD3  PRO 903           HD1      PRO 903  12.343   1.663  -1.368
  477    HA   PRO 904           HA       PRO 904  12.169  -0.242   5.141
  478    HB2  PRO 904           HB2      PRO 904  14.342   0.288   6.801
  479    HB3  PRO 904           HB1      PRO 904  13.782  -1.317   6.329
  480    HG2  PRO 904           HG2      PRO 904  16.074   0.253   5.324
  481    HG3  PRO 904           HG1      PRO 904  15.851  -1.501   5.407
  482    HD2  PRO 904           HD2      PRO 904  15.653   0.002   3.104
  483    HD3  PRO 904           HD1      PRO 904  14.885  -1.580   3.332
  484    H    GLU 905           H        GLU 905  11.265   1.339   6.378
  485    HA   GLU 905           HA       GLU 905  11.679   4.014   5.500
  486    HB2  GLU 905           HB2      GLU 905   9.835   4.569   7.094
  487    HB3  GLU 905           HB1      GLU 905   9.440   3.348   5.896
  488    HG2  GLU 905           HG2      GLU 905   9.785   1.606   7.590
  489    HG3  GLU 905           HG1      GLU 905  10.107   2.864   8.788
  490    H    GLU 906           H        GLU 906  12.903   2.159   7.993
  491    HA   GLU 906           HA       GLU 906  13.649   4.399   9.644
  492    HB2  GLU 906           HB2      GLU 906  14.508   1.515   9.807
  493    HB3  GLU 906           HB1      GLU 906  14.686   2.734  11.068
  494    HG2  GLU 906           HG2      GLU 906  12.279   2.945  11.233
  495    HG3  GLU 906           HG1      GLU 906  12.066   1.754   9.961
  496    H    MET 907           H        MET 907  14.793   2.951   6.866
  497    HA   MET 907           HA       MET 907  17.509   3.951   7.263
  498    HB2  MET 907           HB2      MET 907  17.274   1.715   6.228
  499    HB3  MET 907           HB1      MET 907  16.298   2.407   4.940
  500    HG2  MET 907           HG2      MET 907  18.606   1.982   4.237
  501    HG3  MET 907           HG1      MET 907  18.200   3.694   4.162
  502    HE1  MET 907           HE1      MET 907  21.993   3.770   5.115
  503    HE2  MET 907           HE2      MET 907  20.754   4.379   4.023
  504    HE3  MET 907           HE3      MET 907  21.168   2.665   4.012
  505    H    GLN 908           H        GLN 908  18.260   5.565   5.744
  506    HA   GLN 908           HA       GLN 908  15.988   7.299   5.215
  507    HB2  GLN 908           HB2      GLN 908  18.863   8.151   5.142
  508    HB3  GLN 908           HB1      GLN 908  17.434   9.158   5.287
  509    HG2  GLN 908           HG2      GLN 908  18.650   7.349   7.353
  510    HG3  GLN 908           HG1      GLN 908  18.448   9.095   7.395
  511   HE21  GLN 908          HE21      GLN 908  15.604   8.924   6.481
  512   HE22  GLN 908          HE22      GLN 908  14.756   8.336   7.856
  513    H    TRP 909           H        TRP 909  15.683   8.427   3.366
  514    HA   TRP 909           HA       TRP 909  17.265   7.936   1.000
  515    HD1  TRP 909           HD       TRP 909  16.666   5.898  -1.598
  516    HE1  TRP 909           HE1      TRP 909  15.680   6.721  -3.858
  517    HE3  TRP 909           HE3      TRP 909  12.974   8.971   0.151
  518    HZ2  TRP 909           HZ2      TRP 909  13.664   8.426  -4.736
  519    HZ3  TRP 909           HZ3      TRP 909  11.564  10.162  -1.467
  520    HH2  TRP 909           HH       TRP 909  11.901   9.894  -3.853
  521    HB2  TRP 909           HB2      TRP 909  15.734   6.018   0.903
  522    HB3  TRP 909           HB1      TRP 909  14.365   7.086   1.204
  523    H    PHE 910           H        PHE 910  16.923   9.543  -0.526
  524    HA   PHE 910           HA       PHE 910  15.065  11.669   0.174
  525    HD1  PHE 910           HD1      PHE 910  16.098  13.680   2.091
  526    HD2  PHE 910           HD2      PHE 910  18.997  10.715   1.224
  527    HE1  PHE 910           HE1      PHE 910  16.676  13.558   4.480
  528    HE2  PHE 910           HE2      PHE 910  19.579  10.571   3.598
  529    HZ   PHE 910           HZ       PHE 910  18.416  11.990   5.237
  530    HB2  PHE 910           HB2      PHE 910  17.997  12.031  -0.538
  531    HB3  PHE 910           HB1      PHE 910  16.846  13.314  -0.178
  532    H    CYS 911           H        CYS 911  14.296  12.706  -1.685
  533    HA   CYS 911           HA       CYS 911  14.264  11.258  -4.091
  534    HB2  CYS 911           HB2      CYS 911  13.120  13.217  -5.076
  535    HB3  CYS 911           HB1      CYS 911  12.529  12.930  -3.449
  536    HA   PRO 912           HA       PRO 912  17.934  12.205  -6.443
  537    HB2  PRO 912           HB2      PRO 912  16.785  13.572  -8.654
  538    HB3  PRO 912           HB1      PRO 912  17.191  11.858  -8.560
  539    HG2  PRO 912           HG2      PRO 912  14.577  13.212  -8.132
  540    HG3  PRO 912           HG1      PRO 912  14.911  11.601  -8.789
  541    HD2  PRO 912           HD2      PRO 912  13.941  11.894  -6.325
  542    HD3  PRO 912           HD1      PRO 912  15.171  10.662  -6.670
  543    H    LYS 913           H        LYS 913  15.636  14.823  -5.996
  544    HA   LYS 913           HA       LYS 913  17.427  16.975  -6.581
  545    HB2  LYS 913           HB2      LYS 913  14.935  16.985  -4.864
  546    HB3  LYS 913           HB1      LYS 913  15.740  18.411  -5.507
  547    HG2  LYS 913           HG2      LYS 913  15.189  17.587  -7.784
  548    HG3  LYS 913           HG1      LYS 913  14.283  16.270  -7.036
  549    HD2  LYS 913           HD2      LYS 913  13.738  19.229  -6.731
  550    HD3  LYS 913           HD1      LYS 913  12.784  18.086  -7.669
  551    HE2  LYS 913           HE2      LYS 913  13.139  18.091  -4.659
  552    HE3  LYS 913           HE1      LYS 913  11.697  18.577  -5.532
  553    HZ1  LYS 913           HZ1      LYS 913  11.291  16.440  -4.798
  554    HZ2  LYS 913           HZ2      LYS 913  12.808  15.869  -5.164
  555    HZ3  LYS 913           HZ3      LYS 913  11.703  16.205  -6.423
  556    H    CYS 914           H        CYS 914  16.155  15.587  -3.602
  557    HA   CYS 914           HA       CYS 914  17.768  17.187  -1.940
  558    HB2  CYS 914           HB2      CYS 914  15.929  14.903  -1.473
  559    HB3  CYS 914           HB1      CYS 914  16.803  15.555  -0.107
  560    H    ALA 915           H        ALA 915  18.125  13.938  -3.151
  561    HA   ALA 915           HA       ALA 915  20.275  13.323  -1.420
  562    HB1  ALA 915           HB1      ALA 915  19.585  12.078  -4.078
  563    HB2  ALA 915           HB2      ALA 915  18.899  11.639  -2.518
  564    HB3  ALA 915           HB3      ALA 915  20.620  11.366  -2.826
  565    H    ASN 916           H        ASN 916  20.024  15.163  -4.231
  566    HA   ASN 916           HA       ASN 916  22.721  14.929  -5.206
  567    HB2  ASN 916           HB2      ASN 916  20.902  15.700  -6.716
  568    HB3  ASN 916           HB1      ASN 916  20.659  17.115  -5.710
  569   HD21  ASN 916          HD21      ASN 916  21.328  16.818  -8.581
  570   HD22  ASN 916          HD22      ASN 916  22.746  17.763  -8.834
  571    H    LYS 917           H        LYS 917  20.981  17.162  -3.138
  572    HA   LYS 917           HA       LYS 917  23.198  18.932  -2.811
  573    HB2  LYS 917           HB2      LYS 917  21.804  20.121  -1.232
  574    HB3  LYS 917           HB1      LYS 917  20.834  19.666  -2.629
  575    HG2  LYS 917           HG2      LYS 917  20.058  17.686  -1.299
  576    HG3  LYS 917           HG1      LYS 917  20.871  18.424   0.081
  577    HD2  LYS 917           HD2      LYS 917  19.439  20.386  -0.125
  578    HD3  LYS 917           HD1      LYS 917  18.652  19.679  -1.537
  579    HE2  LYS 917           HE2      LYS 917  18.001  17.730  -0.058
  580    HE3  LYS 917           HE1      LYS 917  18.601  18.668   1.295
  581    HZ1  LYS 917           HZ1      LYS 917  16.971  20.387   0.822
  582    HZ2  LYS 917           HZ2      LYS 917  16.182  18.909   1.013
  583    HZ3  LYS 917           HZ3      LYS 917  16.424  19.535  -0.521
  584    H    ILE 918           H        ILE 918  22.531  15.947  -1.508
  585    HA   ILE 918           HA       ILE 918  23.955  16.483   0.964
  586    HB   ILE 918           HB       ILE 918  22.951  13.822  -0.071
  587   HG12  ILE 918          HG12      ILE 918  21.597  15.872   1.706
  588   HG13  ILE 918          HG11      ILE 918  21.114  15.355   0.092
  589   HG21  ILE 918          HG21      ILE 918  23.090  13.155   2.296
  590   HG22  ILE 918          HG22      ILE 918  23.733  14.743   2.707
  591   HG23  ILE 918          HG23      ILE 918  24.664  13.653   1.677
  592   HD11  ILE 918          HD11      ILE 918  21.134  13.607   2.530
  593   HD12  ILE 918          HD12      ILE 918  20.603  13.149   0.912
  594   HD13  ILE 918          HD13      ILE 918  19.716  14.371   1.818
  595    H    LYS 919           H        LYS 919  24.363  14.763  -2.077
  596    HA   LYS 919           HA       LYS 919  26.938  13.843  -1.178
  597    HB2  LYS 919           HB2      LYS 919  27.137  12.638  -3.344
  598    HB3  LYS 919           HB1      LYS 919  25.713  12.200  -2.436
  599    HG2  LYS 919           HG2      LYS 919  24.375  13.682  -3.938
  600    HG3  LYS 919           HG1      LYS 919  25.843  13.938  -4.890
  601    HD2  LYS 919           HD2      LYS 919  26.016  11.534  -5.311
  602    HD3  LYS 919           HD1      LYS 919  24.585  11.246  -4.327
  603    HE2  LYS 919           HE2      LYS 919  23.970  11.155  -6.660
  604    HE3  LYS 919           HE1      LYS 919  23.260  12.593  -5.932
  605    HZ1  LYS 919           HZ1      LYS 919  25.013  13.921  -6.938
  606    HZ2  LYS 919           HZ2      LYS 919  24.251  13.027  -8.134
  607    HZ3  LYS 919           HZ3      LYS 919  25.739  12.552  -7.564
  608    H    LYS 920           H        LYS 920  25.647  16.274  -3.305
  609    HA   LYS 920           HA       LYS 920  26.547  18.156  -4.204
  610    HB2  LYS 920           HB2      LYS 920  28.580  17.632  -2.057
  611    HB3  LYS 920           HB1      LYS 920  28.488  19.143  -2.958
  612    HG2  LYS 920           HG2      LYS 920  26.249  19.516  -2.001
  613    HG3  LYS 920           HG1      LYS 920  26.406  18.006  -1.097
  614    HD2  LYS 920           HD2      LYS 920  28.423  18.908   0.014
  615    HD3  LYS 920           HD1      LYS 920  28.204  20.421  -0.860
  616    HE2  LYS 920           HE2      LYS 920  27.367  20.553   1.434
  617    HE3  LYS 920           HE1      LYS 920  26.089  20.803   0.247
  618    HZ1  LYS 920           HZ1      LYS 920  25.428  19.365   2.094
  619    HZ2  LYS 920           HZ2      LYS 920  26.589  18.218   1.647
  620    HZ3  LYS 920           HZ3      LYS 920  25.307  18.600   0.612
  621    H    ASP 921           H        ASP 921  27.333  15.621  -5.353
  622    HA   ASP 921           HA       ASP 921  28.760  14.548  -6.650
  623    HB2  ASP 921           HB2      ASP 921  29.325  17.382  -7.332
  624    HB3  ASP 921           HB1      ASP 921  30.482  16.172  -7.872
  625    H    LYS 922           H        LYS 922  30.034  13.213  -5.761
  626    HA   LYS 922           HA       LYS 922  31.949  13.805  -3.769
  627    HB2  LYS 922           HB2      LYS 922  31.634  11.385  -5.549
  628    HB3  LYS 922           HB1      LYS 922  32.692  11.455  -4.154
  629    HG2  LYS 922           HG2      LYS 922  30.850  11.633  -2.654
  630    HG3  LYS 922           HG1      LYS 922  29.716  11.875  -3.983
  631    HD2  LYS 922           HD2      LYS 922  31.341   9.356  -3.603
  632    HD3  LYS 922           HD1      LYS 922  29.701   9.561  -2.986
  633    HE2  LYS 922           HE2      LYS 922  28.869   9.916  -5.246
  634    HE3  LYS 922           HE1      LYS 922  30.496   9.809  -5.894
  635    HZ1  LYS 922           HZ1      LYS 922  30.596   7.513  -5.240
  636    HZ2  LYS 922           HZ2      LYS 922  29.231   7.781  -6.185
  637    HZ3  LYS 922           HZ3      LYS 922  29.068   7.598  -4.516
  638    H    LYS 923           H        LYS 923  31.982  13.700  -7.182
  639    HA   LYS 923           HA       LYS 923  33.299  14.613  -8.708
  640    HB2  LYS 923           HB2      LYS 923  35.001  15.494  -6.391
  641    HB3  LYS 923           HB1      LYS 923  35.336  15.925  -8.060
  642    HG2  LYS 923           HG2      LYS 923  33.231  17.084  -8.227
  643    HG3  LYS 923           HG1      LYS 923  32.780  16.558  -6.607
  644    HD2  LYS 923           HD2      LYS 923  34.647  17.823  -5.674
  645    HD3  LYS 923           HD1      LYS 923  35.114  18.330  -7.297
  646    HE2  LYS 923           HE2      LYS 923  33.843  20.084  -6.186
  647    HE3  LYS 923           HE1      LYS 923  32.967  19.446  -7.573
  648    HZ1  LYS 923           HZ1      LYS 923  31.597  18.122  -6.013
  649    HZ2  LYS 923           HZ2      LYS 923  31.501  19.767  -5.735
  650    HZ3  LYS 923           HZ3      LYS 923  32.438  18.820  -4.716
  651    H    HIS 924           H        HIS 924  34.232  13.497 -10.087
  652    HA   HIS 924           HA       HIS 924  36.586  11.960  -9.388
  653    HD1  HIS 924           HD1      HIS 924  35.455   9.643 -12.841
  654    HD2  HIS 924           HD2      HIS 924  36.995   8.929  -9.051
  655    HE1  HIS 924           HE1      HIS 924  37.044   7.739 -13.119
  656    HE2  HIS 924           HE2      HIS 924  38.221   7.624 -10.914
  657    HB2  HIS 924           HB2      HIS 924  34.567  10.450  -9.394
  658    HB3  HIS 924           HB1      HIS 924  34.271  10.940 -11.055
  Start of MODEL    3
    1    HA   ALA   1           HA       ALA   1  12.660   6.270   2.804
    2    H1   ALA   1           HT1      ALA   1  14.424   6.140   4.305
    3    H2   ALA   1           HT2      ALA   1  13.952   4.619   4.857
    4    H3   ALA   1           HT3      ALA   1  13.001   5.985   5.208
    5    HB1  ALA   1           HB1      ALA   1  13.726   3.440   2.812
    6    HB2  ALA   1           HB2      ALA   1  14.480   4.816   2.012
    7    HB3  ALA   1           HB3      ALA   1  12.918   4.212   1.455
    8    H    ARG   2           H        ARG   2  10.645   6.516   3.574
    9    HA   ARG   2           HA       ARG   2   9.327   4.317   4.926
   10    HE   ARG   2           HE       ARG   2   8.561   8.178   6.567
   11    HB2  ARG   2           HB2      ARG   2   9.111   7.052   5.119
   12    HB3  ARG   2           HB1      ARG   2   7.775   6.640   4.091
   13    HG2  ARG   2           HG2      ARG   2   6.950   5.056   5.756
   14    HG3  ARG   2           HG1      ARG   2   8.277   5.500   6.827
   15    HD2  ARG   2           HD2      ARG   2   5.974   7.175   5.888
   16    HD3  ARG   2           HD1      ARG   2   6.440   6.761   7.543
   17   HH11  ARG   2          HH11      ARG   2   5.149   8.862   7.169
   18   HH12  ARG   2          HH12      ARG   2   5.336  10.549   7.080
   19   HH21  ARG   2          HH21      ARG   2   8.794  10.510   6.412
   20   HH22  ARG   2          HH22      ARG   2   7.416  11.501   6.600
   21    H    THR   3           H        THR   3   8.443   2.770   3.685
   22    HA   THR   3           HA       THR   3   7.183   3.613   1.187
   23    HB   THR   3           HB       THR   3   7.515   1.201   0.510
   24    HG1  THR   3           HG1      THR   3   8.114   0.781   2.885
   25   HG21  THR   3          HG21      THR   3   8.907   3.047  -0.347
   26   HG22  THR   3          HG22      THR   3   9.813   1.547  -0.196
   27   HG23  THR   3          HG23      THR   3  10.020   2.827   1.009
   28    HA   M3L   4           HA       M3L   4   3.854   1.150   2.628
   29    H    M3L   4           H        M3L   4   5.101   3.109   0.914
   30    HB2  M3L   4           HB2      M3L   4   3.464   3.088   3.970
   31    HB3  M3L   4           HB1      M3L   4   1.966   2.794   3.104
   32    HG2  M3L   4           HG2      M3L   4   3.785   4.593   1.729
   33    HG3  M3L   4           HG1      M3L   4   3.292   5.177   3.316
   34    HD2  M3L   4           HD2      M3L   4   1.263   4.099   1.404
   35    HD3  M3L   4           HD1      M3L   4   1.056   5.231   2.743
   36    HE2  M3L   4           HE2      M3L   4   2.692   6.704   1.343
   37    HE3  M3L   4           HE1      M3L   4   2.206   5.652   0.039
   38   HM11  M3L   4          HM11      M3L   4   0.013   5.456  -0.694
   39   HM12  M3L   4          HM12      M3L   4  -1.034   5.441   0.712
   40   HM13  M3L   4          HM13      M3L   4  -1.135   6.713  -0.483
   41   HM21  M3L   4          HM21      M3L   4   0.843   7.489   2.906
   42   HM22  M3L   4          HM22      M3L   4  -0.550   6.499   2.654
   43   HM23  M3L   4          HM23      M3L   4  -0.569   8.169   2.174
   44   HM31  M3L   4          HM31      M3L   4   1.303   7.936  -0.929
   45   HM32  M3L   4          HM32      M3L   4   1.523   8.839   0.559
   46   HM33  M3L   4          HM33      M3L   4  -0.050   8.678  -0.181
   47    H    GLN   5           H        GLN   5   1.710   0.620   1.854
   48    HA   GLN   5           HA       GLN   5   0.772   1.496  -0.723
   49    HB2  GLN   5           HB2      GLN   5   2.709  -0.020  -1.270
   50    HB3  GLN   5           HB1      GLN   5   1.831  -1.301  -0.437
   51    HG2  GLN   5           HG2      GLN   5  -0.082  -0.830  -1.976
   52    HG3  GLN   5           HG1      GLN   5   1.002   0.206  -2.871
   53   HE21  GLN   5          HE21      GLN   5  -0.339  -2.298  -3.592
   54   HE22  GLN   5          HE22      GLN   5   0.927  -3.319  -4.121
   55    H    THR   6           H        THR   6  -1.376   1.013  -0.798
   56    HA   THR   6           HA       THR   6  -2.332  -1.258   0.650
   57    HB   THR   6           HB       THR   6  -2.370   0.274   2.523
   58    HG1  THR   6           HG1      THR   6  -4.890  -0.448   1.439
   59   HG21  THR   6          HG21      THR   6  -3.719   2.351   2.522
   60   HG22  THR   6          HG22      THR   6  -4.080   2.105   0.814
   61   HG23  THR   6          HG23      THR   6  -2.421   2.418   1.328
   62    H    ALA   7           H        ALA   7  -3.121   1.534  -1.358
   63    HA   ALA   7           HA       ALA   7  -4.761   1.947  -2.861
   64    HB1  ALA   7           HB1      ALA   7  -3.660   0.071  -4.034
   65    HB2  ALA   7           HB2      ALA   7  -5.402   0.007  -4.308
   66    HB3  ALA   7           HB3      ALA   7  -4.653  -1.079  -3.142
   67    H    ARG   8           H        ARG   8  -7.087   0.314  -3.468
   68    HA   ARG   8           HA       ARG   8  -8.288   0.164  -0.827
   69    HE   ARG   8           HE       ARG   8 -11.954   1.010  -3.877
   70    HB2  ARG   8           HB2      ARG   8  -9.243   2.025  -2.215
   71    HB3  ARG   8           HB1      ARG   8  -9.751   0.833  -3.402
   72    HG2  ARG   8           HG2      ARG   8 -11.243  -0.187  -1.826
   73    HG3  ARG   8           HG1      ARG   8 -10.650   0.855  -0.533
   74    HD2  ARG   8           HD2      ARG   8 -12.774   1.677  -1.347
   75    HD3  ARG   8           HD1      ARG   8 -11.486   2.808  -1.739
   76   HH11  ARG   8          HH11      ARG   8 -13.219   3.944  -2.350
   77   HH12  ARG   8          HH12      ARG   8 -14.066   4.449  -3.742
   78   HH21  ARG   8          HH21      ARG   8 -13.117   1.751  -5.796
   79   HH22  ARG   8          HH22      ARG   8 -13.990   3.207  -5.731
   80    H    LYS   9           H        LYS   9  -7.675  -1.855  -0.574
   81    HA   LYS   9           HA       LYS   9  -7.924  -3.901  -2.517
   82    HB2  LYS   9           HB2      LYS   9  -7.446  -4.040   0.445
   83    HB3  LYS   9           HB1      LYS   9  -7.350  -5.410  -0.648
   84    HG2  LYS   9           HG2      LYS   9  -5.530  -4.412  -1.824
   85    HG3  LYS   9           HG1      LYS   9  -5.661  -2.934  -0.869
   86    HD2  LYS   9           HD2      LYS   9  -5.086  -4.190   1.136
   87    HD3  LYS   9           HD1      LYS   9  -4.986  -5.676   0.203
   88    HE2  LYS   9           HE2      LYS   9  -3.269  -3.222  -0.186
   89    HE3  LYS   9           HE1      LYS   9  -2.764  -4.708   0.610
   90    HZ1  LYS   9           HZ1      LYS   9  -3.558  -4.461  -2.257
   91    HZ2  LYS   9           HZ2      LYS   9  -3.097  -5.882  -1.493
   92    HZ3  LYS   9           HZ3      LYS   9  -1.987  -4.619  -1.670
   93    H    SER  10           H        SER  10  -9.463  -5.242  -2.948
   94    HA   SER  10           HA       SER  10 -12.032  -5.124  -1.823
   95    HG   SER  10           HG       SER  10 -11.838  -5.071  -4.318
   96    HB2  SER  10           HB2      SER  10 -10.766  -7.470  -3.248
   97    HB3  SER  10           HB1      SER  10 -12.463  -6.993  -3.225
   98    H    THR  11           H        THR  11  -9.224  -7.226  -1.434
   99    HA   THR  11           HA       THR  11  -9.880  -7.727   1.285
  100    HB   THR  11           HB       THR  11 -11.085  -9.587   0.237
  101    HG1  THR  11           HG1      THR  11 -10.216 -10.256   2.087
  102   HG21  THR  11          HG21      THR  11  -9.929 -11.289  -1.125
  103   HG22  THR  11          HG22      THR  11  -8.460 -10.315  -1.083
  104   HG23  THR  11          HG23      THR  11  -9.898  -9.707  -1.903
  105    H    GLY  12           H        GLY  12  -8.057  -7.779   2.437
  106    HA2  GLY  12           HA2      GLY  12  -5.525  -7.618   0.993
  107    HA3  GLY  12           HA1      GLY  12  -5.791  -7.179   2.674
  108    H    GLY  13           H        GLY  13  -7.067  -9.489   3.523
  109    HA2  GLY  13           HA2      GLY  13  -6.372 -11.939   3.190
  110    HA3  GLY  13           HA1      GLY  13  -4.784 -11.296   3.608
  111    H1   GLY 850           HT1      GLY 850   8.007  19.578   1.269
  112    H2   GLY 850           HT2      GLY 850   8.783  20.941   0.612
  113    H3   GLY 850           HT3      GLY 850   8.455  19.578  -0.339
  114    HA2  GLY 850           HA1      GLY 850   6.177  19.889  -0.293
  115    HA3  GLY 850           HA2      GLY 850   6.329  21.169   0.910
  116    H    SER 851           H        SER 851   4.941  21.679  -1.435
  117    HA   SER 851           HA       SER 851   6.762  23.096  -3.186
  118    HG   SER 851           HG       SER 851   3.225  21.405  -3.612
  119    HB2  SER 851           HB2      SER 851   4.511  23.430  -4.411
  120    HB3  SER 851           HB1      SER 851   5.166  21.788  -4.350
  121    H    HIS 852           H        HIS 852   5.654  25.371  -3.894
  122    HA   HIS 852           HA       HIS 852   5.748  27.001  -1.568
  123    HD2  HIS 852           HD2      HIS 852   8.014  28.392  -2.174
  124    HE1  HIS 852           HE1      HIS 852   9.004  28.112  -6.283
  125    HE2  HIS 852           HE2      HIS 852   9.837  28.758  -3.982
  126    HB2  HIS 852           HB2      HIS 852   4.787  27.722  -4.353
  127    HB3  HIS 852           HB1      HIS 852   5.105  28.866  -3.072
  128    H    MET 853           H        MET 853   3.129  26.405  -3.882
  129    HA   MET 853           HA       MET 853   1.294  26.352  -1.663
  130    HB2  MET 853           HB2      MET 853   1.329  28.747  -2.314
  131    HB3  MET 853           HB1      MET 853   0.805  28.281  -3.933
  132    HG2  MET 853           HG2      MET 853  -1.234  27.315  -2.985
  133    HG3  MET 853           HG1      MET 853  -0.727  27.810  -1.380
  134    HE1  MET 853           HE1      MET 853  -3.551  28.549  -2.314
  135    HE2  MET 853           HE2      MET 853  -3.628  30.259  -1.876
  136    HE3  MET 853           HE3      MET 853  -2.827  29.108  -0.809
  137    H    ALA 854           H        ALA 854   0.803  24.360  -2.056
  138    HA   ALA 854           HA       ALA 854  -1.032  23.953  -4.295
  139    HB1  ALA 854           HB1      ALA 854  -0.172  21.660  -4.615
  140    HB2  ALA 854           HB2      ALA 854   1.085  21.968  -3.422
  141    HB3  ALA 854           HB3      ALA 854   1.077  22.859  -4.942
  142    H    MET 855           H        MET 855  -0.735  24.380  -1.195
  143    HA   MET 855           HA       MET 855  -1.724  23.794   0.738
  144    HB2  MET 855           HB2      MET 855  -3.573  22.175  -1.046
  145    HB3  MET 855           HB1      MET 855  -3.859  22.497   0.660
  146    HG2  MET 855           HG2      MET 855  -4.086  24.855   0.204
  147    HG3  MET 855           HG1      MET 855  -3.688  24.596  -1.492
  148    HE1  MET 855           HE1      MET 855  -7.579  23.108   0.521
  149    HE2  MET 855           HE2      MET 855  -6.342  24.051   1.352
  150    HE3  MET 855           HE3      MET 855  -6.009  22.386   0.867
  151    H    ALA 856           H        ALA 856   0.503  22.553  -0.150
  152    HA   ALA 856           HA       ALA 856   1.957  20.933   0.223
  153    HB1  ALA 856           HB1      ALA 856   1.039  20.741   2.516
  154    HB2  ALA 856           HB2      ALA 856   1.524  19.162   1.894
  155    HB3  ALA 856           HB3      ALA 856  -0.181  19.613   1.923
  156    H    TYR 857           H        TYR 857   2.200  18.428  -0.109
  157    HA   TYR 857           HA       TYR 857   0.866  17.949  -2.624
  158    HD1  TYR 857           HD2      TYR 857   2.248  17.508  -4.693
  159    HD2  TYR 857           HD1      TYR 857   4.938  17.823  -1.416
  160    HE1  TYR 857           HE2      TYR 857   3.787  18.814  -6.093
  161    HE2  TYR 857           HE1      TYR 857   6.480  19.128  -2.798
  162    HH   TYR 857           HH       TYR 857   6.994  19.450  -5.173
  163    HB2  TYR 857           HB2      TYR 857   3.038  16.429  -1.214
  164    HB3  TYR 857           HB1      TYR 857   2.194  15.905  -2.677
  165    H    VAL 858           H        VAL 858  -0.941  17.924  -0.871
  166    HA   VAL 858           HA       VAL 858  -2.020  15.276  -1.021
  167    HB   VAL 858           HB       VAL 858  -0.902  15.069   1.137
  168   HG11  VAL 858          HG11      VAL 858  -2.456  17.495   2.001
  169   HG12  VAL 858          HG12      VAL 858  -0.706  17.378   1.789
  170   HG13  VAL 858          HG13      VAL 858  -1.505  16.464   3.070
  171   HG21  VAL 858          HG21      VAL 858  -3.037  13.918   0.912
  172   HG22  VAL 858          HG22      VAL 858  -3.897  15.346   1.470
  173   HG23  VAL 858          HG23      VAL 858  -2.843  14.475   2.571
  174    H    ILE 859           H        ILE 859  -3.955  15.408  -1.707
  175    HA   ILE 859           HA       ILE 859  -5.570  17.772  -1.063
  176    HB   ILE 859           HB       ILE 859  -6.767  17.458  -3.193
  177   HG12  ILE 859          HG12      ILE 859  -4.764  15.255  -3.796
  178   HG13  ILE 859          HG11      ILE 859  -6.453  15.009  -3.375
  179   HG21  ILE 859          HG21      ILE 859  -4.876  18.968  -3.224
  180   HG22  ILE 859          HG22      ILE 859  -4.998  18.125  -4.769
  181   HG23  ILE 859          HG23      ILE 859  -3.781  17.635  -3.593
  182   HD11  ILE 859          HD11      ILE 859  -6.069  14.798  -5.778
  183   HD12  ILE 859          HD12      ILE 859  -5.467  16.457  -5.827
  184   HD13  ILE 859          HD13      ILE 859  -7.149  16.142  -5.405
  185    H    ARG 860           H        ARG 860  -8.011  17.121  -1.256
  186    HA   ARG 860           HA       ARG 860  -8.122  14.525   0.059
  187    HE   ARG 860           HE       ARG 860  -9.075  17.966   2.593
  188    HB2  ARG 860           HB2      ARG 860 -10.129  15.214   1.231
  189    HB3  ARG 860           HB1      ARG 860  -8.750  16.224   1.614
  190    HG2  ARG 860           HG2      ARG 860  -9.628  17.947   0.112
  191    HG3  ARG 860           HG1      ARG 860 -11.008  16.886  -0.222
  192    HD2  ARG 860           HD2      ARG 860 -11.613  18.497   1.475
  193    HD3  ARG 860           HD1      ARG 860 -11.540  16.837   2.109
  194   HH11  ARG 860          HH11      ARG 860 -12.406  18.648   3.573
  195   HH12  ARG 860          HH12      ARG 860 -11.980  19.267   5.106
  196   HH21  ARG 860          HH21      ARG 860  -8.488  18.778   4.711
  197   HH22  ARG 860          HH22      ARG 860  -9.709  19.320   5.772
  198    H    ASP 861           H        ASP 861  -9.246  13.030  -0.568
  199    HA   ASP 861           HA       ASP 861 -10.450  12.947  -3.139
  200    HB2  ASP 861           HB2      ASP 861  -9.378  11.007  -2.540
  201    HB3  ASP 861           HB1      ASP 861  -9.967  11.087  -0.872
  202    H    GLU 862           H        GLU 862 -12.558  12.001  -3.370
  203    HA   GLU 862           HA       GLU 862 -14.541  13.761  -2.418
  204    HB2  GLU 862           HB2      GLU 862 -16.149  12.315  -3.587
  205    HB3  GLU 862           HB1      GLU 862 -14.754  12.714  -4.574
  206    HG2  GLU 862           HG2      GLU 862 -13.784  10.519  -4.054
  207    HG3  GLU 862           HG1      GLU 862 -15.227  10.120  -3.128
  208    H    TRP 863           H        TRP 863 -13.647  10.496  -1.307
  209    HA   TRP 863           HA       TRP 863 -15.827  10.400   0.545
  210    HD1  TRP 863           HD       TRP 863 -13.440   7.149  -1.904
  211    HE1  TRP 863           HE1      TRP 863 -15.210   6.457  -3.711
  212    HE3  TRP 863           HE3      TRP 863 -17.465   9.424   0.034
  213    HZ2  TRP 863           HZ2      TRP 863 -17.942   6.847  -4.192
  214    HZ3  TRP 863           HZ3      TRP 863 -19.673   9.253  -1.122
  215    HH2  TRP 863           HH       TRP 863 -19.880   7.985  -3.206
  216    HB2  TRP 863           HB2      TRP 863 -13.460   8.548   0.216
  217    HB3  TRP 863           HB1      TRP 863 -14.937   8.219   1.111
  218    H    GLY 864           H        GLY 864 -13.054  12.099   0.511
  219    HA2  GLY 864           HA2      GLY 864 -12.306  13.392   2.328
  220    HA3  GLY 864           HA1      GLY 864 -13.029  12.231   3.428
  221    H    ASN 865           H        ASN 865 -11.251  10.742   1.003
  222    HA   ASN 865           HA       ASN 865  -9.214   9.917   2.869
  223    HB2  ASN 865           HB2      ASN 865  -9.407   9.374  -0.126
  224    HB3  ASN 865           HB1      ASN 865  -8.211   8.685   0.950
  225   HD21  ASN 865          HD21      ASN 865 -11.475   8.526  -0.220
  226   HD22  ASN 865          HD22      ASN 865 -11.872   7.070   0.598
  227    H    GLN 866           H        GLN 866  -6.998  10.391   2.702
  228    HA   GLN 866           HA       GLN 866  -6.430  12.934   1.449
  229    HB2  GLN 866           HB2      GLN 866  -4.763  11.086   3.135
  230    HB3  GLN 866           HB1      GLN 866  -4.146  12.556   2.410
  231    HG2  GLN 866           HG2      GLN 866  -5.650  13.873   3.648
  232    HG3  GLN 866           HG1      GLN 866  -6.441  12.447   4.321
  233   HE21  GLN 866          HE21      GLN 866  -3.670  14.499   4.471
  234   HE22  GLN 866          HE22      GLN 866  -2.961  13.778   5.861
  235    H    ILE 867           H        ILE 867  -5.598  13.104  -0.429
  236    HA   ILE 867           HA       ILE 867  -4.406  10.740  -1.696
  237    HB   ILE 867           HB       ILE 867  -5.804  13.113  -2.943
  238   HG12  ILE 867          HG12      ILE 867  -7.377  11.533  -1.978
  239   HG13  ILE 867          HG11      ILE 867  -7.462  11.478  -3.736
  240   HG21  ILE 867          HG21      ILE 867  -5.463  12.022  -5.104
  241   HG22  ILE 867          HG22      ILE 867  -4.529  10.751  -4.306
  242   HG23  ILE 867          HG23      ILE 867  -3.930  12.406  -4.310
  243   HD11  ILE 867          HD11      ILE 867  -6.106   9.428  -3.706
  244   HD12  ILE 867          HD12      ILE 867  -7.607   9.254  -2.790
  245   HD13  ILE 867          HD13      ILE 867  -6.078   9.494  -1.941
  246    H    TRP 868           H        TRP 868  -2.316  10.942  -1.709
  247    HA   TRP 868           HA       TRP 868  -1.122  13.536  -1.558
  248    HD1  TRP 868           HD       TRP 868   1.647  13.496   0.365
  249    HE1  TRP 868           HE1      TRP 868   1.171  13.229   2.871
  250    HE3  TRP 868           HE3      TRP 868  -2.024   9.928   0.119
  251    HZ2  TRP 868           HZ2      TRP 868  -0.558  11.722   4.529
  252    HZ3  TRP 868           HZ3      TRP 868  -3.034   9.151   2.203
  253    HH2  TRP 868           HH       TRP 868  -2.316  10.036   4.368
  254    HB2  TRP 868           HB2      TRP 868  -0.006  10.751  -1.567
  255    HB3  TRP 868           HB1      TRP 868   1.040  12.155  -1.753
  256    H    ILE 869           H        ILE 869   0.301  14.335  -3.041
  257    HA   ILE 869           HA       ILE 869  -0.163  13.394  -5.791
  258    HB   ILE 869           HB       ILE 869   0.672  16.169  -4.878
  259   HG12  ILE 869          HG12      ILE 869  -1.669  15.757  -4.230
  260   HG13  ILE 869          HG11      ILE 869  -1.575  16.952  -5.517
  261   HG21  ILE 869          HG21      ILE 869   1.509  15.643  -7.087
  262   HG22  ILE 869          HG22      ILE 869   0.223  16.845  -7.213
  263   HG23  ILE 869          HG23      ILE 869  -0.102  15.160  -7.615
  264   HD11  ILE 869          HD11      ILE 869  -2.368  14.059  -5.793
  265   HD12  ILE 869          HD12      ILE 869  -2.210  15.180  -7.135
  266   HD13  ILE 869          HD13      ILE 869  -3.431  15.457  -5.898
  267    H    CYS 870           H        CYS 870   1.603  12.565  -6.737
  268    HA   CYS 870           HA       CYS 870   4.082  12.489  -5.360
  269    HB2  CYS 870           HB2      CYS 870   3.360  10.643  -6.800
  270    HB3  CYS 870           HB1      CYS 870   3.330  11.712  -8.188
  271    HA   PRO 871           HA       PRO 871   5.361  16.480  -7.007
  272    HB2  PRO 871           HB2      PRO 871   7.961  15.760  -5.822
  273    HB3  PRO 871           HB1      PRO 871   6.915  17.144  -5.477
  274    HG2  PRO 871           HG2      PRO 871   7.219  15.138  -3.728
  275    HG3  PRO 871           HG1      PRO 871   5.676  15.986  -3.923
  276    HD2  PRO 871           HD2      PRO 871   6.524  13.328  -4.985
  277    HD3  PRO 871           HD1      PRO 871   4.972  13.839  -4.275
  278    H    GLY 872           H        GLY 872   6.567  13.361  -7.645
  279    HA2  GLY 872           HA2      GLY 872   8.691  14.124  -9.403
  280    HA3  GLY 872           HA1      GLY 872   8.018  12.512  -9.216
  281    H    CYS 873           H        CYS 873   5.398  12.830  -9.923
  282    HA   CYS 873           HA       CYS 873   5.734  13.396 -12.784
  283    HB2  CYS 873           HB2      CYS 873   3.847  11.807 -12.994
  284    HB3  CYS 873           HB1      CYS 873   5.298  11.120 -12.257
  285    H    ASN 874           H        ASN 874   3.966  14.274  -9.948
  286    HA   ASN 874           HA       ASN 874   2.443  15.800  -9.468
  287    HB2  ASN 874           HB2      ASN 874   2.381  16.429 -12.431
  288    HB3  ASN 874           HB1      ASN 874   1.267  17.172 -11.298
  289   HD21  ASN 874          HD21      ASN 874   4.614  16.472 -10.544
  290   HD22  ASN 874          HD22      ASN 874   5.145  18.109 -10.467
  291    H    LYS 875           H        LYS 875   2.032  12.939 -10.528
  292    HA   LYS 875           HA       LYS 875  -0.820  13.017 -11.013
  293    HB2  LYS 875           HB2      LYS 875   1.105  10.698 -10.761
  294    HB3  LYS 875           HB1      LYS 875  -0.602  10.545 -11.134
  295    HG2  LYS 875           HG2      LYS 875  -0.241  11.742 -13.238
  296    HG3  LYS 875           HG1      LYS 875   1.473  11.910 -12.841
  297    HD2  LYS 875           HD2      LYS 875   1.733   9.507 -12.808
  298    HD3  LYS 875           HD1      LYS 875   0.010   9.289 -13.126
  299    HE2  LYS 875           HE2      LYS 875   0.296  10.438 -15.283
  300    HE3  LYS 875           HE1      LYS 875   2.019  10.598 -14.951
  301    HZ1  LYS 875           HZ1      LYS 875   0.527   8.051 -15.247
  302    HZ2  LYS 875           HZ2      LYS 875   2.162   8.158 -14.893
  303    HZ3  LYS 875           HZ3      LYS 875   1.576   8.719 -16.381
  304    HA   PRO 876           HA       PRO 876  -1.709  12.379  -6.733
  305    HB2  PRO 876           HB2      PRO 876  -4.205  11.415  -6.932
  306    HB3  PRO 876           HB1      PRO 876  -3.823  13.110  -7.263
  307    HG2  PRO 876           HG2      PRO 876  -4.231  10.850  -9.151
  308    HG3  PRO 876           HG1      PRO 876  -4.830  12.530  -9.236
  309    HD2  PRO 876           HD2      PRO 876  -2.637  11.662 -10.635
  310    HD3  PRO 876           HD1      PRO 876  -2.835  13.328 -10.060
  311    H    ASP 877           H        ASP 877  -2.244  10.811  -5.276
  312    HA   ASP 877           HA       ASP 877  -1.184   8.195  -5.801
  313    HB2  ASP 877           HB2      ASP 877  -0.416   9.245  -3.838
  314    HB3  ASP 877           HB1      ASP 877  -2.037   9.706  -3.346
  315    H    ASP 878           H        ASP 878  -2.263   6.302  -5.424
  316    HA   ASP 878           HA       ASP 878  -5.241   6.363  -5.286
  317    HB2  ASP 878           HB2      ASP 878  -3.412   4.417  -6.712
  318    HB3  ASP 878           HB1      ASP 878  -5.078   4.039  -6.334
  319    H    GLY 879           H        GLY 879  -2.687   5.896  -3.433
  320    HA2  GLY 879           HA2      GLY 879  -2.597   4.830  -1.360
  321    HA3  GLY 879           HA1      GLY 879  -3.774   3.634  -1.930
  322    H    SER 880           H        SER 880  -1.167   4.816  -3.799
  323    HA   SER 880           HA       SER 880  -0.457   2.157  -4.608
  324    HG   SER 880           HG       SER 880  -1.472   3.172  -6.512
  325    HB2  SER 880           HB2      SER 880   0.507   4.894  -5.457
  326    HB3  SER 880           HB1      SER 880   0.781   3.380  -6.326
  327    HA   PRO 881           HA       PRO 881   3.393   1.883  -2.365
  328    HB2  PRO 881           HB2      PRO 881   5.082   1.318  -4.649
  329    HB3  PRO 881           HB1      PRO 881   4.547   0.215  -3.388
  330    HG2  PRO 881           HG2      PRO 881   3.763   0.107  -5.986
  331    HG3  PRO 881           HG1      PRO 881   2.855  -0.574  -4.640
  332    HD2  PRO 881           HD2      PRO 881   2.347   1.928  -6.169
  333    HD3  PRO 881           HD1      PRO 881   1.193   0.856  -5.352
  334    H    MET 882           H        MET 882   4.004   3.729  -1.710
  335    HA   MET 882           HA       MET 882   5.496   5.469  -3.572
  336    HB2  MET 882           HB2      MET 882   3.743   6.473  -1.331
  337    HB3  MET 882           HB1      MET 882   4.600   7.442  -2.519
  338    HG2  MET 882           HG2      MET 882   3.200   6.401  -4.283
  339    HG3  MET 882           HG1      MET 882   2.301   5.586  -3.003
  340    HE1  MET 882           HE1      MET 882   3.721   9.235  -3.465
  341    HE2  MET 882           HE2      MET 882   2.208  10.062  -3.917
  342    HE3  MET 882           HE3      MET 882   2.876   8.816  -4.969
  343    H    ILE 883           H        ILE 883   7.023   6.873  -2.567
  344    HA   ILE 883           HA       ILE 883   7.973   5.910   0.007
  345    HB   ILE 883           HB       ILE 883   9.364   4.928  -1.811
  346   HG12  ILE 883          HG12      ILE 883  11.034   7.032  -0.460
  347   HG13  ILE 883          HG11      ILE 883  10.382   5.647   0.434
  348   HG21  ILE 883          HG21      ILE 883   9.075   6.620  -3.523
  349   HG22  ILE 883          HG22      ILE 883  10.793   6.344  -3.216
  350   HG23  ILE 883          HG23      ILE 883  10.001   7.773  -2.557
  351   HD11  ILE 883          HD11      ILE 883  12.693   5.331  -0.264
  352   HD12  ILE 883          HD12      ILE 883  12.225   5.562  -1.946
  353   HD13  ILE 883          HD13      ILE 883  11.628   4.165  -1.047
  354    H    GLY 884           H        GLY 884   8.441   7.505   1.407
  355    HA2  GLY 884           HA2      GLY 884   7.714  10.195   0.449
  356    HA3  GLY 884           HA1      GLY 884   7.519   9.616   2.092
  357    H    CYS 885           H        CYS 885  10.380   9.204   0.180
  358    HA   CYS 885           HA       CYS 885  12.561   9.830   0.507
  359    HB2  CYS 885           HB2      CYS 885  11.551  11.966  -0.278
  360    HB3  CYS 885           HB1      CYS 885  11.205  12.425   1.375
  361    H    ASP 886           H        ASP 886  13.840  11.231   2.395
  362    HA   ASP 886           HA       ASP 886  12.777  10.335   4.960
  363    HB2  ASP 886           HB2      ASP 886  15.521  10.071   3.863
  364    HB3  ASP 886           HB1      ASP 886  15.350  10.415   5.576
  365    H    ASP 887           H        ASP 887  13.521  12.879   3.024
  366    HA   ASP 887           HA       ASP 887  14.250  14.507   5.364
  367    HB2  ASP 887           HB2      ASP 887  15.952  14.354   3.539
  368    HB3  ASP 887           HB1      ASP 887  14.823  15.212   2.496
  369    H    CYS 888           H        CYS 888  12.657  14.991   2.213
  370    HA   CYS 888           HA       CYS 888  11.361  17.360   3.133
  371    HB2  CYS 888           HB2      CYS 888  10.175  17.338   0.963
  372    HB3  CYS 888           HB1      CYS 888  11.924  17.185   0.824
  373    H    ASP 889           H        ASP 889  10.416  14.040   3.008
  374    HA   ASP 889           HA       ASP 889   8.700  12.903   3.948
  375    HB2  ASP 889           HB2      ASP 889   8.687  14.445   5.869
  376    HB3  ASP 889           HB1      ASP 889   7.794  15.639   4.947
  377    H    ASP 890           H        ASP 890   8.704  14.536   1.298
  378    HA   ASP 890           HA       ASP 890   5.869  14.531   0.734
  379    HB2  ASP 890           HB2      ASP 890   8.208  15.240  -1.052
  380    HB3  ASP 890           HB1      ASP 890   6.535  15.263  -1.572
  381    H    TRP 891           H        TRP 891   4.883  13.188  -0.549
  382    HA   TRP 891           HA       TRP 891   6.145  10.590  -0.724
  383    HD1  TRP 891           HD       TRP 891   3.257  12.142   1.716
  384    HE1  TRP 891           HE1      TRP 891   3.687  10.863   3.910
  385    HE3  TRP 891           HE3      TRP 891   5.125   7.870  -0.234
  386    HZ2  TRP 891           HZ2      TRP 891   4.692   8.362   4.697
  387    HZ3  TRP 891           HZ3      TRP 891   5.808   6.081   1.228
  388    HH2  TRP 891           HH       TRP 891   5.621   6.307   3.706
  389    HB2  TRP 891           HB2      TRP 891   3.262  11.422  -0.832
  390    HB3  TRP 891           HB1      TRP 891   3.786   9.779  -1.200
  391    H    TYR 892           H        TYR 892   7.156  10.065  -2.444
  392    HA   TYR 892           HA       TYR 892   6.186  10.911  -5.076
  393    HD1  TYR 892           HD1      TYR 892   8.902  11.739  -2.525
  394    HD2  TYR 892           HD2      TYR 892   8.896  12.106  -6.760
  395    HE1  TYR 892           HE1      TYR 892   9.949  13.929  -2.324
  396    HE2  TYR 892           HE2      TYR 892   9.942  14.301  -6.588
  397    HH   TYR 892           HH       TYR 892  11.407  15.340  -3.782
  398    HB2  TYR 892           HB2      TYR 892   8.799   9.736  -4.140
  399    HB3  TYR 892           HB1      TYR 892   8.401  10.047  -5.813
  400    H    HIS 893           H        HIS 893   5.871   9.344  -6.621
  401    HA   HIS 893           HA       HIS 893   5.223   6.659  -5.692
  402    HD2  HIS 893           HD2      HIS 893   2.436   6.230  -6.284
  403    HE1  HIS 893           HE1      HIS 893   1.008   9.464  -8.608
  404    HE2  HIS 893           HE2      HIS 893   0.373   7.451  -7.244
  405    HB2  HIS 893           HB2      HIS 893   5.322   7.723  -8.530
  406    HB3  HIS 893           HB1      HIS 893   4.838   6.098  -8.102
  407    H    TRP 894           H        TRP 894   6.207   4.761  -6.555
  408    HA   TRP 894           HA       TRP 894   8.987   4.842  -6.345
  409    HD1  TRP 894           HD       TRP 894   8.168   4.604  -4.276
  410    HE1  TRP 894           HE1      TRP 894   7.903   3.248  -2.107
  411    HE3  TRP 894           HE3      TRP 894   7.577  -0.002  -6.324
  412    HZ2  TRP 894           HZ2      TRP 894   7.491   0.534  -1.383
  413    HZ3  TRP 894           HZ3      TRP 894   7.259  -1.912  -4.886
  414    HH2  TRP 894           HH       TRP 894   7.227  -1.661  -2.420
  415    HB2  TRP 894           HB2      TRP 894   7.103   2.661  -7.151
  416    HB3  TRP 894           HB1      TRP 894   8.842   2.416  -7.096
  417    HA   PRO 895           HA       PRO 895   9.299   3.861 -11.064
  418    HB2  PRO 895           HB2      PRO 895   7.204   4.568 -12.666
  419    HB3  PRO 895           HB1      PRO 895   7.397   2.950 -11.988
  420    HG2  PRO 895           HG2      PRO 895   5.745   5.238 -10.983
  421    HG3  PRO 895           HG1      PRO 895   5.288   3.533 -11.165
  422    HD2  PRO 895           HD2      PRO 895   5.980   4.515  -8.786
  423    HD3  PRO 895           HD1      PRO 895   6.480   2.886  -9.280
  424    H    CYS 896           H        CYS 896   7.996   6.613  -9.628
  425    HA   CYS 896           HA       CYS 896   8.704   8.445 -11.737
  426    HB2  CYS 896           HB2      CYS 896   7.694   8.903  -8.942
  427    HB3  CYS 896           HB1      CYS 896   7.740  10.105 -10.246
  428    H    VAL 897           H        VAL 897  10.153   7.059  -8.918
  429    HA   VAL 897           HA       VAL 897  12.292   9.074  -9.066
  430    HB   VAL 897           HB       VAL 897  12.805   8.657  -6.694
  431   HG11  VAL 897          HG11      VAL 897  10.862   9.883  -5.782
  432   HG12  VAL 897          HG12      VAL 897  10.010   9.578  -7.296
  433   HG13  VAL 897          HG13      VAL 897  11.468  10.567  -7.293
  434   HG21  VAL 897          HG21      VAL 897  10.224   7.087  -6.696
  435   HG22  VAL 897          HG22      VAL 897  11.194   7.494  -5.272
  436   HG23  VAL 897          HG23      VAL 897  11.846   6.426  -6.507
  437    H    GLY 898           H        GLY 898  11.657   5.856  -9.617
  438    HA2  GLY 898           HA2      GLY 898  13.361   4.554 -10.665
  439    HA3  GLY 898           HA1      GLY 898  14.550   5.368  -9.664
  440    H    ILE 899           H        ILE 899  11.732   4.393  -8.038
  441    HA   ILE 899           HA       ILE 899  13.267   2.274  -6.762
  442    HB   ILE 899           HB       ILE 899  10.682   3.631  -5.908
  443   HG12  ILE 899          HG12      ILE 899  12.791   4.977  -5.654
  444   HG13  ILE 899          HG11      ILE 899  11.915   4.696  -4.150
  445   HG21  ILE 899          HG21      ILE 899  10.661   1.310  -5.156
  446   HG22  ILE 899          HG22      ILE 899  10.884   2.390  -3.782
  447   HG23  ILE 899          HG23      ILE 899  12.261   1.511  -4.441
  448   HD11  ILE 899          HD11      ILE 899  13.513   2.930  -3.620
  449   HD12  ILE 899          HD12      ILE 899  14.243   4.524  -3.810
  450   HD13  ILE 899          HD13      ILE 899  14.412   3.314  -5.101
  451    H    MET 900           H        MET 900  12.667   0.179  -7.046
  452    HA   MET 900           HA       MET 900  10.094  -0.319  -8.396
  453    HB2  MET 900           HB2      MET 900  12.657  -1.911  -8.650
  454    HB3  MET 900           HB1      MET 900  11.106  -2.381  -9.337
  455    HG2  MET 900           HG2      MET 900  11.126  -0.327 -10.701
  456    HG3  MET 900           HG1      MET 900  12.716   0.061 -10.052
  457    HE1  MET 900           HE1      MET 900  11.338  -3.528 -11.069
  458    HE2  MET 900           HE2      MET 900  11.835  -3.585 -12.762
  459    HE3  MET 900           HE3      MET 900  10.621  -2.420 -12.237
  460    H    ALA 901           H        ALA 901  12.330  -1.332  -5.934
  461    HA   ALA 901           HA       ALA 901  10.122  -2.806  -4.725
  462    HB1  ALA 901           HB1      ALA 901  13.044  -3.596  -4.706
  463    HB2  ALA 901           HB2      ALA 901  11.751  -4.427  -5.575
  464    HB3  ALA 901           HB3      ALA 901  11.758  -4.411  -3.813
  465    H    ALA 902           H        ALA 902   9.959  -2.527  -2.539
  466    HA   ALA 902           HA       ALA 902  10.690  -0.006  -1.609
  467    HB1  ALA 902           HB1      ALA 902   8.707  -1.197  -0.828
  468    HB2  ALA 902           HB2      ALA 902   9.728  -0.687   0.517
  469    HB3  ALA 902           HB3      ALA 902   9.739  -2.368  -0.010
  470    HA   PRO 903           HA       PRO 903  14.632  -1.278   0.189
  471    HB2  PRO 903           HB2      PRO 903  15.536   1.189   0.845
  472    HB3  PRO 903           HB1      PRO 903  15.581   0.615  -0.820
  473    HG2  PRO 903           HG2      PRO 903  13.743   2.533   0.478
  474    HG3  PRO 903           HG1      PRO 903  14.315   2.492  -1.198
  475    HD2  PRO 903           HD2      PRO 903  11.830   1.602  -0.257
  476    HD3  PRO 903           HD1      PRO 903  12.531   1.257  -1.847
  477    HA   PRO 904           HA       PRO 904  13.489  -1.445   4.483
  478    HB2  PRO 904           HB2      PRO 904  16.180  -0.443   5.188
  479    HB3  PRO 904           HB1      PRO 904  15.345  -1.900   5.728
  480    HG2  PRO 904           HG2      PRO 904  17.321  -1.961   3.995
  481    HG3  PRO 904           HG1      PRO 904  15.949  -3.095   3.893
  482    HD2  PRO 904           HD2      PRO 904  16.595  -0.726   2.185
  483    HD3  PRO 904           HD1      PRO 904  15.748  -2.225   1.761
  484    H    GLU 905           H        GLU 905  12.750  -0.147   6.067
  485    HA   GLU 905           HA       GLU 905  12.704   2.653   5.536
  486    HB2  GLU 905           HB2      GLU 905  11.262   2.795   7.564
  487    HB3  GLU 905           HB1      GLU 905  10.658   1.710   6.335
  488    HG2  GLU 905           HG2      GLU 905  12.152   0.789   8.785
  489    HG3  GLU 905           HG1      GLU 905  10.403   0.968   8.684
  490    H    GLU 906           H        GLU 906  14.690   0.569   7.200
  491    HA   GLU 906           HA       GLU 906  15.665   2.569   9.062
  492    HB2  GLU 906           HB2      GLU 906  17.231   0.766   9.783
  493    HB3  GLU 906           HB1      GLU 906  15.538   0.314   9.902
  494    HG2  GLU 906           HG2      GLU 906  15.783  -0.896   7.749
  495    HG3  GLU 906           HG1      GLU 906  17.507  -0.536   7.797
  496    H    MET 907           H        MET 907  16.030   1.837   5.923
  497    HA   MET 907           HA       MET 907  18.794   2.721   5.657
  498    HB2  MET 907           HB2      MET 907  18.202   0.811   4.291
  499    HB3  MET 907           HB1      MET 907  16.751   1.627   3.719
  500    HG2  MET 907           HG2      MET 907  18.192   3.265   2.542
  501    HG3  MET 907           HG1      MET 907  19.601   2.345   3.061
  502    HE1  MET 907           HE1      MET 907  18.741  -0.654   2.794
  503    HE2  MET 907           HE2      MET 907  20.257   0.008   2.198
  504    HE3  MET 907           HE3      MET 907  19.257  -0.991   1.139
  505    H    GLN 908           H        GLN 908  19.185   4.661   4.675
  506    HA   GLN 908           HA       GLN 908  16.902   6.464   4.632
  507    HB2  GLN 908           HB2      GLN 908  19.823   7.122   4.361
  508    HB3  GLN 908           HB1      GLN 908  18.517   8.277   4.450
  509    HG2  GLN 908           HG2      GLN 908  19.419   6.423   6.634
  510    HG3  GLN 908           HG1      GLN 908  19.566   8.179   6.592
  511   HE21  GLN 908          HE21      GLN 908  17.639   9.402   6.720
  512   HE22  GLN 908          HE22      GLN 908  16.245   8.753   7.517
  513    H    TRP 909           H        TRP 909  16.414   7.686   2.939
  514    HA   TRP 909           HA       TRP 909  17.749   7.351   0.389
  515    HD1  TRP 909           HD       TRP 909  16.952   5.333  -2.175
  516    HE1  TRP 909           HE1      TRP 909  15.857   6.224  -4.354
  517    HE3  TRP 909           HE3      TRP 909  13.506   8.391  -0.135
  518    HZ2  TRP 909           HZ2      TRP 909  13.781   8.008  -5.073
  519    HZ3  TRP 909           HZ3      TRP 909  11.970   9.685  -1.620
  520    HH2  TRP 909           HH       TRP 909  12.131   9.476  -4.031
  521    HB2  TRP 909           HB2      TRP 909  16.196   5.423   0.377
  522    HB3  TRP 909           HB1      TRP 909  14.861   6.490   0.795
  523    H    PHE 910           H        PHE 910  17.394   9.113  -0.903
  524    HA   PHE 910           HA       PHE 910  15.505  11.101   0.083
  525    HD1  PHE 910           HD2      PHE 910  16.389  12.874   2.091
  526    HD2  PHE 910           HD1      PHE 910  19.655  10.486   0.785
  527    HE1  PHE 910           HE2      PHE 910  17.102  12.567   4.432
  528    HE2  PHE 910           HE1      PHE 910  20.367  10.167   3.109
  529    HZ   PHE 910           HZ       PHE 910  19.087  11.208   4.942
  530    HB2  PHE 910           HB2      PHE 910  18.356  11.667  -0.783
  531    HB3  PHE 910           HB1      PHE 910  17.179  12.876  -0.281
  532    H    CYS 911           H        CYS 911  14.558  12.269  -1.511
  533    HA   CYS 911           HA       CYS 911  14.441  11.030  -4.058
  534    HB2  CYS 911           HB2      CYS 911  12.788  12.805  -4.538
  535    HB3  CYS 911           HB1      CYS 911  12.481  11.990  -3.019
  536    HA   PRO 912           HA       PRO 912  17.280  13.321  -6.629
  537    HB2  PRO 912           HB2      PRO 912  15.466  14.471  -8.467
  538    HB3  PRO 912           HB1      PRO 912  16.323  12.941  -8.647
  539    HG2  PRO 912           HG2      PRO 912  13.541  13.443  -7.703
  540    HG3  PRO 912           HG1      PRO 912  14.186  12.075  -8.626
  541    HD2  PRO 912           HD2      PRO 912  13.604  11.830  -6.042
  542    HD3  PRO 912           HD1      PRO 912  15.032  11.035  -6.738
  543    H    LYS 913           H        LYS 913  14.473  15.013  -5.371
  544    HA   LYS 913           HA       LYS 913  15.528  17.650  -5.858
  545    HB2  LYS 913           HB2      LYS 913  13.244  16.644  -4.179
  546    HB3  LYS 913           HB1      LYS 913  13.733  18.326  -4.167
  547    HG2  LYS 913           HG2      LYS 913  12.794  16.803  -6.588
  548    HG3  LYS 913           HG1      LYS 913  11.812  17.896  -5.606
  549    HD2  LYS 913           HD2      LYS 913  13.480  19.704  -6.127
  550    HD3  LYS 913           HD1      LYS 913  14.228  18.593  -7.269
  551    HE2  LYS 913           HE2      LYS 913  11.370  19.567  -7.365
  552    HE3  LYS 913           HE1      LYS 913  12.688  20.132  -8.384
  553    HZ1  LYS 913           HZ1      LYS 913  11.581  17.374  -8.341
  554    HZ2  LYS 913           HZ2      LYS 913  12.860  17.870  -9.291
  555    HZ3  LYS 913           HZ3      LYS 913  11.321  18.519  -9.539
  556    H    CYS 914           H        CYS 914  15.116  15.611  -2.972
  557    HA   CYS 914           HA       CYS 914  16.473  17.467  -1.343
  558    HB2  CYS 914           HB2      CYS 914  15.536  14.667  -0.881
  559    HB3  CYS 914           HB1      CYS 914  16.482  15.508   0.336
  560    H    ALA 915           H        ALA 915  17.540  14.589  -3.015
  561    HA   ALA 915           HA       ALA 915  20.053  14.564  -1.741
  562    HB1  ALA 915           HB1      ALA 915  19.314  13.446  -4.443
  563    HB2  ALA 915           HB2      ALA 915  19.114  12.637  -2.890
  564    HB3  ALA 915           HB3      ALA 915  20.738  13.005  -3.487
  565    H    ASN 916           H        ASN 916  18.768  16.416  -4.265
  566    HA   ASN 916           HA       ASN 916  21.272  17.174  -5.494
  567    HB2  ASN 916           HB2      ASN 916  19.252  17.164  -6.875
  568    HB3  ASN 916           HB1      ASN 916  18.504  18.357  -5.826
  569   HD21  ASN 916          HD21      ASN 916  18.965  20.508  -6.139
  570   HD22  ASN 916          HD22      ASN 916  19.959  21.081  -7.426
  571    H    LYS 917           H        LYS 917  19.161  18.477  -3.052
  572    HA   LYS 917           HA       LYS 917  20.484  21.030  -2.947
  573    HB2  LYS 917           HB2      LYS 917  19.064  21.535  -1.077
  574    HB3  LYS 917           HB1      LYS 917  18.082  20.639  -2.223
  575    HG2  LYS 917           HG2      LYS 917  18.639  18.587  -0.846
  576    HG3  LYS 917           HG1      LYS 917  19.273  19.720   0.346
  577    HD2  LYS 917           HD2      LYS 917  17.057  20.789   0.481
  578    HD3  LYS 917           HD1      LYS 917  16.434  19.636  -0.705
  579    HE2  LYS 917           HE2      LYS 917  17.175  17.809   0.882
  580    HE3  LYS 917           HE1      LYS 917  17.437  19.066   2.081
  581    HZ1  LYS 917           HZ1      LYS 917  15.307  18.228   2.470
  582    HZ2  LYS 917           HZ2      LYS 917  14.921  18.140   0.880
  583    HZ3  LYS 917           HZ3      LYS 917  14.982  19.673   1.638
  584    H    ILE 918           H        ILE 918  21.120  17.940  -1.765
  585    HA   ILE 918           HA       ILE 918  22.839  18.757   0.423
  586    HB   ILE 918           HB       ILE 918  22.583  16.032  -0.871
  587   HG12  ILE 918          HG12      ILE 918  21.026  17.170   1.475
  588   HG13  ILE 918          HG11      ILE 918  20.410  16.768  -0.131
  589   HG21  ILE 918          HG21      ILE 918  23.441  15.204   1.271
  590   HG22  ILE 918          HG22      ILE 918  23.588  16.863   1.850
  591   HG23  ILE 918          HG23      ILE 918  24.578  16.312   0.499
  592   HD11  ILE 918          HD11      ILE 918  21.551  14.784   1.814
  593   HD12  ILE 918          HD12      ILE 918  20.845  14.424   0.240
  594   HD13  ILE 918          HD13      ILE 918  19.832  15.069   1.534
  595    H    LYS 919           H        LYS 919  23.033  17.501  -2.829
  596    HA   LYS 919           HA       LYS 919  25.861  17.131  -2.814
  597    HB2  LYS 919           HB2      LYS 919  24.437  15.652  -4.117
  598    HB3  LYS 919           HB1      LYS 919  23.809  17.009  -5.033
  599    HG2  LYS 919           HG2      LYS 919  25.410  15.744  -6.334
  600    HG3  LYS 919           HG1      LYS 919  26.015  17.369  -6.019
  601    HD2  LYS 919           HD2      LYS 919  27.390  16.473  -4.180
  602    HD3  LYS 919           HD1      LYS 919  26.806  14.847  -4.557
  603    HE2  LYS 919           HE2      LYS 919  29.010  15.266  -5.528
  604    HE3  LYS 919           HE1      LYS 919  27.791  14.999  -6.772
  605    HZ1  LYS 919           HZ1      LYS 919  29.312  16.869  -7.238
  606    HZ2  LYS 919           HZ2      LYS 919  28.739  17.689  -5.909
  607    HZ3  LYS 919           HZ3      LYS 919  27.704  17.353  -7.209
  608    H    LYS 920           H        LYS 920  23.650  19.232  -4.644
  609    HA   LYS 920           HA       LYS 920  23.846  21.239  -5.605
  610    HB2  LYS 920           HB2      LYS 920  26.057  21.548  -3.602
  611    HB3  LYS 920           HB1      LYS 920  25.432  22.890  -4.568
  612    HG2  LYS 920           HG2      LYS 920  23.258  22.600  -3.436
  613    HG3  LYS 920           HG1      LYS 920  23.952  21.281  -2.484
  614    HD2  LYS 920           HD2      LYS 920  25.667  22.857  -1.635
  615    HD3  LYS 920           HD1      LYS 920  24.858  24.160  -2.498
  616    HE2  LYS 920           HE2      LYS 920  23.655  22.470  -0.306
  617    HE3  LYS 920           HE1      LYS 920  24.271  24.107  -0.119
  618    HZ1  LYS 920           HZ1      LYS 920  21.899  24.130  -0.322
  619    HZ2  LYS 920           HZ2      LYS 920  21.932  23.282  -1.762
  620    HZ3  LYS 920           HZ3      LYS 920  22.538  24.845  -1.706
  621    H    ASP 921           H        ASP 921  25.674  22.818  -6.529
  622    HA   ASP 921           HA       ASP 921  27.958  21.436  -7.621
  623    HB2  ASP 921           HB2      ASP 921  26.262  21.104  -9.380
  624    HB3  ASP 921           HB1      ASP 921  25.858  22.816  -9.328
  625    H    LYS 922           H        LYS 922  29.598  22.756  -7.376
  626    HA   LYS 922           HA       LYS 922  30.864  24.572  -7.131
  627    HB2  LYS 922           HB2      LYS 922  28.507  25.998  -8.363
  628    HB3  LYS 922           HB1      LYS 922  30.020  26.810  -7.983
  629    HG2  LYS 922           HG2      LYS 922  31.218  25.463  -9.522
  630    HG3  LYS 922           HG1      LYS 922  29.833  24.390  -9.731
  631    HD2  LYS 922           HD2      LYS 922  28.592  26.252 -10.747
  632    HD3  LYS 922           HD1      LYS 922  30.038  27.262 -10.609
  633    HE2  LYS 922           HE2      LYS 922  29.729  26.193 -12.850
  634    HE3  LYS 922           HE1      LYS 922  31.269  25.839 -12.070
  635    HZ1  LYS 922           HZ1      LYS 922  28.928  24.010 -11.888
  636    HZ2  LYS 922           HZ2      LYS 922  30.524  23.674 -11.493
  637    HZ3  LYS 922           HZ3      LYS 922  30.092  23.872 -13.098
  638    H    LYS 923           H        LYS 923  30.819  26.843  -6.053
  639    HA   LYS 923           HA       LYS 923  29.657  26.285  -3.458
  640    HB2  LYS 923           HB2      LYS 923  31.792  28.253  -4.286
  641    HB3  LYS 923           HB1      LYS 923  31.256  27.977  -2.631
  642    HG2  LYS 923           HG2      LYS 923  31.995  25.676  -2.737
  643    HG3  LYS 923           HG1      LYS 923  32.468  25.886  -4.418
  644    HD2  LYS 923           HD2      LYS 923  34.144  27.512  -3.755
  645    HD3  LYS 923           HD1      LYS 923  33.642  27.361  -2.073
  646    HE2  LYS 923           HE2      LYS 923  35.642  26.017  -2.514
  647    HE3  LYS 923           HE1      LYS 923  34.279  25.002  -2.078
  648    HZ1  LYS 923           HZ1      LYS 923  33.972  24.424  -4.393
  649    HZ2  LYS 923           HZ2      LYS 923  35.586  24.147  -3.951
  650    HZ3  LYS 923           HZ3      LYS 923  35.198  25.508  -4.850
  651    H    HIS 924           H        HIS 924  27.636  26.910  -3.572
  652    HA   HIS 924           HA       HIS 924  27.145  29.738  -4.062
  653    HD1  HIS 924           HD1      HIS 924  23.016  28.025  -5.450
  654    HD2  HIS 924           HD2      HIS 924  25.448  31.378  -5.124
  655    HE1  HIS 924           HE1      HIS 924  21.480  30.000  -5.735
  656    HE2  HIS 924           HE2      HIS 924  23.008  32.015  -5.666
  657    HB2  HIS 924           HB2      HIS 924  26.314  28.385  -5.973
  658    HB3  HIS 924           HB1      HIS 924  25.354  27.421  -4.860
  Start of MODEL    4
    1    HA   ALA   1           HA       ALA   1  11.757   6.659   3.164
    2    H1   ALA   1           HT1      ALA   1  13.112   5.190   5.337
    3    H2   ALA   1           HT2      ALA   1  11.929   6.337   5.561
    4    H3   ALA   1           HT3      ALA   1  13.361   6.816   4.828
    5    HB1  ALA   1           HB1      ALA   1  13.124   3.957   3.169
    6    HB2  ALA   1           HB2      ALA   1  13.803   5.434   2.496
    7    HB3  ALA   1           HB3      ALA   1  12.353   4.727   1.786
    8    H    ARG   2           H        ARG   2   9.801   6.703   4.149
    9    HA   ARG   2           HA       ARG   2   8.622   4.297   5.131
   10    HE   ARG   2           HE       ARG   2   7.464   6.786   7.826
   11    HB2  ARG   2           HB2      ARG   2   8.216   6.704   5.951
   12    HB3  ARG   2           HB1      ARG   2   7.274   6.909   4.492
   13    HG2  ARG   2           HG2      ARG   2   5.767   5.159   5.165
   14    HG3  ARG   2           HG1      ARG   2   6.835   4.841   6.548
   15    HD2  ARG   2           HD2      ARG   2   5.442   7.487   6.115
   16    HD3  ARG   2           HD1      ARG   2   4.788   6.209   7.142
   17   HH11  ARG   2          HH11      ARG   2   4.274   8.320   8.124
   18   HH12  ARG   2          HH12      ARG   2   4.593   8.970   9.662
   19   HH21  ARG   2          HH21      ARG   2   7.886   7.691   9.934
   20   HH22  ARG   2          HH22      ARG   2   6.679   8.597  10.711
   21    H    THR   3           H        THR   3   7.616   2.868   3.857
   22    HA   THR   3           HA       THR   3   6.821   3.760   1.202
   23    HB   THR   3           HB       THR   3   7.325   1.283   0.613
   24    HG1  THR   3           HG1      THR   3   9.296   1.506   2.634
   25   HG21  THR   3          HG21      THR   3   9.582   3.223   1.146
   26   HG22  THR   3          HG22      THR   3   8.528   3.242  -0.263
   27   HG23  THR   3          HG23      THR   3   9.614   1.872   0.001
   28    HA   M3L   4           HA       M3L   4   3.312   1.262   1.972
   29    H    M3L   4           H        M3L   4   4.785   3.407   0.676
   30    HB2  M3L   4           HB2      M3L   4   2.410   2.817   3.401
   31    HB3  M3L   4           HB1      M3L   4   1.349   3.068   2.029
   32    HG2  M3L   4           HG2      M3L   4   3.804   4.736   2.521
   33    HG3  M3L   4           HG1      M3L   4   2.227   5.136   3.193
   34    HD2  M3L   4           HD2      M3L   4   2.818   6.329   1.042
   35    HD3  M3L   4           HD1      M3L   4   2.763   4.770   0.247
   36    HE2  M3L   4           HE2      M3L   4   0.635   5.213  -0.183
   37    HE3  M3L   4           HE1      M3L   4   0.353   4.704   1.457
   38   HM11  M3L   4          HM11      M3L   4  -1.622   7.860   0.738
   39   HM12  M3L   4          HM12      M3L   4  -0.801   7.242  -0.678
   40   HM13  M3L   4          HM13      M3L   4  -1.621   6.166   0.379
   41   HM21  M3L   4          HM21      M3L   4  -0.357   7.941   2.982
   42   HM22  M3L   4          HM22      M3L   4   0.785   6.670   3.290
   43   HM23  M3L   4          HM23      M3L   4  -0.875   6.285   2.947
   44   HM31  M3L   4          HM31      M3L   4   0.809   8.962   0.826
   45   HM32  M3L   4          HM32      M3L   4   1.679   7.843  -0.174
   46   HM33  M3L   4          HM33      M3L   4   2.098   8.054   1.512
   47    H    GLN   5           H        GLN   5   1.223   0.894   0.877
   48    HA   GLN   5           HA       GLN   5   1.023   1.969  -1.831
   49    HB2  GLN   5           HB2      GLN   5   2.310  -0.207  -1.866
   50    HB3  GLN   5           HB1      GLN   5   0.853  -0.972  -1.231
   51    HG2  GLN   5           HG2      GLN   5  -0.404  -0.134  -3.165
   52    HG3  GLN   5           HG1      GLN   5   1.079   0.561  -3.794
   53   HE21  GLN   5          HE21      GLN   5  -0.628  -1.337  -4.992
   54   HE22  GLN   5          HE22      GLN   5   0.335  -2.733  -5.265
   55    H    THR   6           H        THR   6  -0.959   2.793  -1.834
   56    HA   THR   6           HA       THR   6  -2.918   2.053   0.032
   57    HB   THR   6           HB       THR   6  -3.101   3.657  -2.522
   58    HG1  THR   6           HG1      THR   6  -2.363   5.191  -1.443
   59   HG21  THR   6          HG21      THR   6  -5.137   4.636  -1.577
   60   HG22  THR   6          HG22      THR   6  -4.992   3.591  -0.164
   61   HG23  THR   6          HG23      THR   6  -5.325   2.887  -1.753
   62    H    ALA   7           H        ALA   7  -2.209   1.003  -3.195
   63    HA   ALA   7           HA       ALA   7  -2.872  -0.670  -4.491
   64    HB1  ALA   7           HB1      ALA   7  -4.255  -1.795  -2.055
   65    HB2  ALA   7           HB2      ALA   7  -2.567  -2.063  -2.482
   66    HB3  ALA   7           HB3      ALA   7  -3.849  -2.683  -3.523
   67    H    ARG   8           H        ARG   8  -4.558  -1.363  -5.847
   68    HA   ARG   8           HA       ARG   8  -6.966   0.235  -5.659
   69    HE   ARG   8           HE       ARG   8  -5.441   2.279  -9.965
   70    HB2  ARG   8           HB2      ARG   8  -5.931  -1.601  -7.818
   71    HB3  ARG   8           HB1      ARG   8  -7.577  -0.996  -7.845
   72    HG2  ARG   8           HG2      ARG   8  -6.654   1.319  -7.861
   73    HG3  ARG   8           HG1      ARG   8  -5.039   0.622  -8.005
   74    HD2  ARG   8           HD2      ARG   8  -5.625  -0.425 -10.114
   75    HD3  ARG   8           HD1      ARG   8  -7.298   0.074  -9.939
   76   HH11  ARG   8          HH11      ARG   8  -7.167   0.067 -12.141
   77   HH12  ARG   8          HH12      ARG   8  -7.296   1.187 -13.400
   78   HH21  ARG   8          HH21      ARG   8  -5.675   3.815 -11.631
   79   HH22  ARG   8          HH22      ARG   8  -6.406   3.410 -13.126
   80    H    LYS   9           H        LYS   9  -5.985  -2.612  -4.413
   81    HA   LYS   9           HA       LYS   9  -6.988  -4.326  -3.317
   82    HB2  LYS   9           HB2      LYS   9  -9.446  -2.586  -3.634
   83    HB3  LYS   9           HB1      LYS   9  -9.500  -4.145  -2.843
   84    HG2  LYS   9           HG2      LYS   9  -9.428  -2.496  -1.143
   85    HG3  LYS   9           HG1      LYS   9  -7.845  -3.250  -1.182
   86    HD2  LYS   9           HD2      LYS   9  -6.916  -1.355  -2.333
   87    HD3  LYS   9           HD1      LYS   9  -8.514  -0.628  -2.511
   88    HE2  LYS   9           HE2      LYS   9  -8.692  -0.534  -0.034
   89    HE3  LYS   9           HE1      LYS   9  -7.052  -1.171   0.061
   90    HZ1  LYS   9           HZ1      LYS   9  -6.221   0.765  -1.011
   91    HZ2  LYS   9           HZ2      LYS   9  -7.147   1.236   0.314
   92    HZ3  LYS   9           HZ3      LYS   9  -7.780   1.386  -1.248
   93    H    SER  10           H        SER  10  -6.706  -4.363  -6.191
   94    HA   SER  10           HA       SER  10  -8.760  -6.374  -6.741
   95    HG   SER  10           HG       SER  10  -9.994  -6.178  -8.705
   96    HB2  SER  10           HB2      SER  10  -9.351  -4.154  -7.778
   97    HB3  SER  10           HB1      SER  10  -7.890  -4.286  -8.751
   98    H    THR  11           H        THR  11  -5.746  -6.122  -6.116
   99    HA   THR  11           HA       THR  11  -3.850  -7.229  -6.549
  100    HB   THR  11           HB       THR  11  -5.477  -8.902  -8.494
  101    HG1  THR  11           HG1      THR  11  -5.340 -10.344  -6.520
  102   HG21  THR  11          HG21      THR  11  -2.884  -9.497  -7.031
  103   HG22  THR  11          HG22      THR  11  -3.036  -9.149  -8.750
  104   HG23  THR  11          HG23      THR  11  -3.746 -10.616  -8.087
  105    H    GLY  12           H        GLY  12  -2.711  -5.594  -7.414
  106    HA2  GLY  12           HA2      GLY  12  -3.113  -4.742 -10.113
  107    HA3  GLY  12           HA1      GLY  12  -1.876  -4.165  -9.000
  108    H    GLY  13           H        GLY  13  -1.858  -5.044 -11.844
  109    HA2  GLY  13           HA2      GLY  13   0.691  -6.054 -11.884
  110    HA3  GLY  13           HA1      GLY  13  -0.408  -7.421 -12.047
  111    H1   GLY 850           HT1      GLY 850  -9.087  30.804  -7.187
  112    H2   GLY 850           HT2      GLY 850  -8.655  30.384  -8.759
  113    H3   GLY 850           HT3      GLY 850  -7.463  30.824  -7.617
  114    HA2  GLY 850           HA1      GLY 850  -9.189  28.435  -7.492
  115    HA3  GLY 850           HA2      GLY 850  -7.476  28.467  -7.923
  116    H    SER 851           H        SER 851  -9.288  27.488  -5.590
  117    HA   SER 851           HA       SER 851  -8.025  28.750  -3.360
  118    HG   SER 851           HG       SER 851  -8.802  26.540  -1.472
  119    HB2  SER 851           HB2      SER 851 -10.413  27.974  -3.326
  120    HB3  SER 851           HB1      SER 851  -9.839  26.319  -3.490
  121    H    HIS 852           H        HIS 852  -5.884  28.319  -3.533
  122    HA   HIS 852           HA       HIS 852  -5.049  25.494  -3.496
  123    HD2  HIS 852           HD2      HIS 852  -4.715  28.837  -6.373
  124    HE1  HIS 852           HE1      HIS 852  -4.359  25.241  -8.585
  125    HE2  HIS 852           HE2      HIS 852  -5.134  27.644  -8.654
  126    HB2  HIS 852           HB2      HIS 852  -3.383  27.949  -4.165
  127    HB3  HIS 852           HB1      HIS 852  -2.807  26.292  -4.194
  128    H    MET 853           H        MET 853  -5.095  25.025  -1.369
  129    HA   MET 853           HA       MET 853  -4.086  26.993   0.524
  130    HB2  MET 853           HB2      MET 853  -5.317  24.276   1.078
  131    HB3  MET 853           HB1      MET 853  -4.819  25.430   2.295
  132    HG2  MET 853           HG2      MET 853  -7.160  25.646   2.139
  133    HG3  MET 853           HG1      MET 853  -6.499  27.030   1.290
  134    HE1  MET 853           HE1      MET 853  -6.809  23.266   0.021
  135    HE2  MET 853           HE2      MET 853  -8.367  23.346  -0.797
  136    HE3  MET 853           HE3      MET 853  -8.279  23.555   0.949
  137    H    ALA 854           H        ALA 854  -2.495  26.455   2.090
  138    HA   ALA 854           HA       ALA 854  -0.353  24.932   0.977
  139    HB1  ALA 854           HB1      ALA 854   0.891  25.689   2.943
  140    HB2  ALA 854           HB2      ALA 854  -0.601  26.338   3.628
  141    HB3  ALA 854           HB3      ALA 854   0.063  27.034   2.155
  142    H    MET 855           H        MET 855  -0.886  22.863   0.988
  143    HA   MET 855           HA       MET 855  -1.086  21.547   3.570
  144    HB2  MET 855           HB2      MET 855  -3.016  20.189   2.844
  145    HB3  MET 855           HB1      MET 855  -3.420  21.894   2.926
  146    HG2  MET 855           HG2      MET 855  -3.131  22.028   0.462
  147    HG3  MET 855           HG1      MET 855  -2.866  20.287   0.438
  148    HE1  MET 855           HE1      MET 855  -5.055  21.725  -1.339
  149    HE2  MET 855           HE2      MET 855  -6.466  20.697  -1.111
  150    HE3  MET 855           HE3      MET 855  -4.880  19.965  -1.340
  151    H    ALA 856           H        ALA 856   0.742  21.912   1.183
  152    HA   ALA 856           HA       ALA 856   2.285  20.798   0.079
  153    HB1  ALA 856           HB1      ALA 856   2.893  18.517   0.744
  154    HB2  ALA 856           HB2      ALA 856   1.360  18.339   1.592
  155    HB3  ALA 856           HB3      ALA 856   2.557  19.484   2.183
  156    H    TYR 857           H        TYR 857   2.146  18.153  -0.941
  157    HA   TYR 857           HA       TYR 857   0.341  18.654  -3.145
  158    HD1  TYR 857           HD1      TYR 857   1.276  17.922  -5.845
  159    HD2  TYR 857           HD2      TYR 857   4.164  18.404  -2.790
  160    HE1  TYR 857           HE1      TYR 857   2.583  19.353  -7.340
  161    HE2  TYR 857           HE2      TYR 857   5.498  19.855  -4.271
  162    HH   TYR 857           HH       TYR 857   5.733  20.065  -6.867
  163    HB2  TYR 857           HB2      TYR 857   2.494  16.671  -2.643
  164    HB3  TYR 857           HB1      TYR 857   1.323  16.426  -3.931
  165    H    VAL 858           H        VAL 858  -0.325  17.451  -0.345
  166    HA   VAL 858           HA       VAL 858  -1.839  15.168  -1.317
  167    HB   VAL 858           HB       VAL 858  -0.688  14.774   0.805
  168   HG11  VAL 858          HG11      VAL 858  -0.644  17.002   1.732
  169   HG12  VAL 858          HG12      VAL 858  -1.360  15.867   2.877
  170   HG13  VAL 858          HG13      VAL 858  -2.391  16.961   1.955
  171   HG21  VAL 858          HG21      VAL 858  -2.551  13.953   2.148
  172   HG22  VAL 858          HG22      VAL 858  -2.721  13.546   0.438
  173   HG23  VAL 858          HG23      VAL 858  -3.675  14.858   1.135
  174    H    ILE 859           H        ILE 859  -3.907  15.103  -1.668
  175    HA   ILE 859           HA       ILE 859  -5.484  17.455  -0.909
  176    HB   ILE 859           HB       ILE 859  -6.943  17.041  -2.832
  177   HG12  ILE 859          HG12      ILE 859  -4.990  14.863  -3.652
  178   HG13  ILE 859          HG11      ILE 859  -6.593  14.581  -2.983
  179   HG21  ILE 859          HG21      ILE 859  -5.145  18.585  -3.175
  180   HG22  ILE 859          HG22      ILE 859  -5.394  17.665  -4.663
  181   HG23  ILE 859          HG23      ILE 859  -4.045  17.274  -3.589
  182   HD11  ILE 859          HD11      ILE 859  -7.589  15.669  -4.935
  183   HD12  ILE 859          HD12      ILE 859  -6.571  14.305  -5.403
  184   HD13  ILE 859          HD13      ILE 859  -5.978  15.956  -5.594
  185    H    ARG 860           H        ARG 860  -7.820  16.831  -0.667
  186    HA   ARG 860           HA       ARG 860  -7.854  14.253   0.689
  187    HE   ARG 860           HE       ARG 860 -12.202  18.457   1.251
  188    HB2  ARG 860           HB2      ARG 860  -9.752  15.049   1.971
  189    HB3  ARG 860           HB1      ARG 860  -8.383  16.136   2.153
  190    HG2  ARG 860           HG2      ARG 860  -9.409  17.635   0.476
  191    HG3  ARG 860           HG1      ARG 860 -10.814  16.564   0.437
  192    HD2  ARG 860           HD2      ARG 860 -11.139  16.945   2.831
  193    HD3  ARG 860           HD1      ARG 860  -9.759  18.051   2.819
  194   HH11  ARG 860          HH11      ARG 860  -9.618  19.778   3.325
  195   HH12  ARG 860          HH12      ARG 860 -10.154  21.378   3.185
  196   HH21  ARG 860          HH21      ARG 860 -12.913  20.654   1.081
  197   HH22  ARG 860          HH22      ARG 860 -12.097  21.891   1.911
  198    H    ASP 861           H        ASP 861  -9.135  12.768   0.117
  199    HA   ASP 861           HA       ASP 861 -10.639  12.871  -2.311
  200    HB2  ASP 861           HB2      ASP 861  -9.509  10.868  -1.942
  201    HB3  ASP 861           HB1      ASP 861  -9.962  10.829  -0.231
  202    H    GLU 862           H        GLU 862 -12.869  11.802  -2.152
  203    HA   GLU 862           HA       GLU 862 -14.543  13.699  -0.837
  204    HB2  GLU 862           HB2      GLU 862 -16.420  12.409  -1.803
  205    HB3  GLU 862           HB1      GLU 862 -15.209  12.861  -2.992
  206    HG2  GLU 862           HG2      GLU 862 -14.284  10.599  -2.900
  207    HG3  GLU 862           HG1      GLU 862 -15.510  10.152  -1.715
  208    H    TRP 863           H        TRP 863 -13.548  10.408  -0.057
  209    HA   TRP 863           HA       TRP 863 -15.413  10.335   2.159
  210    HD1  TRP 863           HD       TRP 863 -17.096   8.971   1.149
  211    HE1  TRP 863           HE1      TRP 863 -18.037   8.005  -1.100
  212    HE3  TRP 863           HE3      TRP 863 -12.817   7.100  -0.638
  213    HZ2  TRP 863           HZ2      TRP 863 -16.974   6.614  -3.316
  214    HZ3  TRP 863           HZ3      TRP 863 -12.791   5.948  -2.826
  215    HH2  TRP 863           HH       TRP 863 -14.834   5.717  -4.134
  216    HB2  TRP 863           HB2      TRP 863 -13.390   8.287   1.279
  217    HB3  TRP 863           HB1      TRP 863 -14.700   8.039   2.435
  218    H    GLY 864           H        GLY 864 -12.734  11.862   1.690
  219    HA2  GLY 864           HA2      GLY 864 -11.593  13.072   3.346
  220    HA3  GLY 864           HA1      GLY 864 -12.130  11.908   4.540
  221    H    ASN 865           H        ASN 865 -10.790  10.525   1.769
  222    HA   ASN 865           HA       ASN 865  -8.550   9.563   3.316
  223    HB2  ASN 865           HB2      ASN 865  -9.150   9.078   0.369
  224    HB3  ASN 865           HB1      ASN 865  -7.914   8.272   1.314
  225   HD21  ASN 865          HD21      ASN 865 -11.290   8.410   0.503
  226   HD22  ASN 865          HD22      ASN 865 -11.713   7.009   1.407
  227    H    GLN 866           H        GLN 866  -6.412  10.078   2.990
  228    HA   GLN 866           HA       GLN 866  -6.001  12.557   1.581
  229    HB2  GLN 866           HB2      GLN 866  -4.238  10.914   3.356
  230    HB3  GLN 866           HB1      GLN 866  -3.635  12.293   2.460
  231    HG2  GLN 866           HG2      GLN 866  -5.327  13.703   3.611
  232    HG3  GLN 866           HG1      GLN 866  -5.758  12.290   4.584
  233   HE21  GLN 866          HE21      GLN 866  -3.308  14.658   3.915
  234   HE22  GLN 866          HE22      GLN 866  -2.340  14.311   5.298
  235    H    ILE 867           H        ILE 867  -5.317  12.720  -0.379
  236    HA   ILE 867           HA       ILE 867  -4.046  10.388  -1.643
  237    HB   ILE 867           HB       ILE 867  -5.676  12.585  -2.958
  238   HG12  ILE 867          HG12      ILE 867  -7.149  11.186  -1.598
  239   HG13  ILE 867          HG11      ILE 867  -7.437  10.886  -3.307
  240   HG21  ILE 867          HG21      ILE 867  -4.595  10.006  -4.078
  241   HG22  ILE 867          HG22      ILE 867  -4.000  11.629  -4.423
  242   HG23  ILE 867          HG23      ILE 867  -5.620  11.154  -4.942
  243   HD11  ILE 867          HD11      ILE 867  -5.856   9.163  -1.426
  244   HD12  ILE 867          HD12      ILE 867  -6.096   8.842  -3.145
  245   HD13  ILE 867          HD13      ILE 867  -7.480   8.824  -2.039
  246    H    TRP 868           H        TRP 868  -1.948  10.784  -1.933
  247    HA   TRP 868           HA       TRP 868  -0.993  13.526  -2.015
  248    HD1  TRP 868           HD       TRP 868   1.774  14.023  -0.192
  249    HE1  TRP 868           HE1      TRP 868   1.425  13.994   2.360
  250    HE3  TRP 868           HE3      TRP 868  -1.376  10.020   0.180
  251    HZ2  TRP 868           HZ2      TRP 868   0.031  12.499   4.269
  252    HZ3  TRP 868           HZ3      TRP 868  -2.173   9.364   2.423
  253    HH2  TRP 868           HH       TRP 868  -1.477  10.581   4.412
  254    HB2  TRP 868           HB2      TRP 868   0.369  10.878  -1.679
  255    HB3  TRP 868           HB1      TRP 868   1.285  12.320  -2.091
  256    H    ILE 869           H        ILE 869  -0.319  14.540  -3.748
  257    HA   ILE 869           HA       ILE 869  -0.173  13.105  -6.263
  258    HB   ILE 869           HB       ILE 869  -0.225  16.064  -5.567
  259   HG12  ILE 869          HG12      ILE 869  -2.112  16.127  -7.203
  260   HG13  ILE 869          HG11      ILE 869  -1.955  14.389  -7.397
  261   HG21  ILE 869          HG21      ILE 869   0.428  14.941  -8.280
  262   HG22  ILE 869          HG22      ILE 869   1.511  15.856  -7.232
  263   HG23  ILE 869          HG23      ILE 869   0.090  16.636  -7.923
  264   HD11  ILE 869          HD11      ILE 869  -2.565  14.108  -5.033
  265   HD12  ILE 869          HD12      ILE 869  -3.805  14.907  -5.985
  266   HD13  ILE 869          HD13      ILE 869  -2.779  15.857  -4.900
  267    H    CYS 870           H        CYS 870   1.581  12.482  -7.127
  268    HA   CYS 870           HA       CYS 870   4.065  12.771  -5.765
  269    HB2  CYS 870           HB2      CYS 870   3.432  10.694  -6.869
  270    HB3  CYS 870           HB1      CYS 870   3.253  11.531  -8.396
  271    HA   PRO 871           HA       PRO 871   4.940  16.525  -8.118
  272    HB2  PRO 871           HB2      PRO 871   7.581  16.585  -6.957
  273    HB3  PRO 871           HB1      PRO 871   6.210  17.634  -6.600
  274    HG2  PRO 871           HG2      PRO 871   7.290  15.708  -4.905
  275    HG3  PRO 871           HG1      PRO 871   5.715  16.459  -4.691
  276    HD2  PRO 871           HD2      PRO 871   6.427  13.774  -5.676
  277    HD3  PRO 871           HD1      PRO 871   4.921  14.359  -4.943
  278    H    GLY 872           H        GLY 872   6.173  13.506  -8.474
  279    HA2  GLY 872           HA2      GLY 872   8.295  14.149 -10.329
  280    HA3  GLY 872           HA1      GLY 872   7.709  12.541  -9.921
  281    H    CYS 873           H        CYS 873   4.913  13.050 -10.475
  282    HA   CYS 873           HA       CYS 873   5.050  13.225 -13.412
  283    HB2  CYS 873           HB2      CYS 873   3.200  11.528 -13.252
  284    HB3  CYS 873           HB1      CYS 873   4.802  10.976 -12.748
  285    H    ASN 874           H        ASN 874   3.636  14.431 -10.534
  286    HA   ASN 874           HA       ASN 874   2.028  15.902 -10.020
  287    HB2  ASN 874           HB2      ASN 874   2.810  17.051 -12.226
  288    HB3  ASN 874           HB1      ASN 874   1.446  16.261 -12.990
  289   HD21  ASN 874          HD21      ASN 874   2.039  19.055 -12.762
  290   HD22  ASN 874          HD22      ASN 874   0.729  19.812 -11.951
  291    H    LYS 875           H        LYS 875   1.682  13.030 -10.537
  292    HA   LYS 875           HA       LYS 875  -1.205  12.997 -10.966
  293    HB2  LYS 875           HB2      LYS 875   0.785  10.735 -11.231
  294    HB3  LYS 875           HB1      LYS 875  -0.951  10.592 -11.465
  295    HG2  LYS 875           HG2      LYS 875  -0.838  12.127 -13.350
  296    HG3  LYS 875           HG1      LYS 875   0.895  12.314 -13.096
  297    HD2  LYS 875           HD2      LYS 875   1.184   9.908 -13.500
  298    HD3  LYS 875           HD1      LYS 875  -0.547   9.762 -13.825
  299    HE2  LYS 875           HE2      LYS 875  -0.273  11.426 -15.652
  300    HE3  LYS 875           HE1      LYS 875   1.460  11.406 -15.360
  301    HZ1  LYS 875           HZ1      LYS 875   0.957   9.970 -17.160
  302    HZ2  LYS 875           HZ2      LYS 875  -0.231   9.169 -16.301
  303    HZ3  LYS 875           HZ3      LYS 875   1.402   8.977 -15.862
  304    HA   PRO 876           HA       PRO 876  -1.587  12.001  -6.663
  305    HB2  PRO 876           HB2      PRO 876  -4.110  11.082  -6.705
  306    HB3  PRO 876           HB1      PRO 876  -3.732  12.800  -6.856
  307    HG2  PRO 876           HG2      PRO 876  -4.434  10.814  -8.962
  308    HG3  PRO 876           HG1      PRO 876  -4.952  12.506  -8.768
  309    HD2  PRO 876           HD2      PRO 876  -2.976  11.751 -10.512
  310    HD3  PRO 876           HD1      PRO 876  -3.041  13.338  -9.712
  311    H    ASP 877           H        ASP 877  -2.195  10.230  -5.290
  312    HA   ASP 877           HA       ASP 877  -1.104   7.768  -6.176
  313    HB2  ASP 877           HB2      ASP 877  -0.837   8.444  -3.846
  314    HB3  ASP 877           HB1      ASP 877  -2.582   8.408  -3.617
  315    H    ASP 878           H        ASP 878  -1.982   6.308  -7.115
  316    HA   ASP 878           HA       ASP 878  -4.858   6.305  -7.714
  317    HB2  ASP 878           HB2      ASP 878  -3.341   6.354  -9.572
  318    HB3  ASP 878           HB1      ASP 878  -2.449   4.980  -8.949
  319    H    GLY 879           H        GLY 879  -2.747   4.865  -5.656
  320    HA2  GLY 879           HA2      GLY 879  -3.561   3.022  -4.221
  321    HA3  GLY 879           HA1      GLY 879  -4.126   2.263  -5.711
  322    H    SER 880           H        SER 880  -1.242   4.057  -5.252
  323    HA   SER 880           HA       SER 880   0.231   1.823  -6.384
  324    HG   SER 880           HG       SER 880  -0.158   5.176  -5.821
  325    HB2  SER 880           HB2      SER 880   1.709   3.805  -7.167
  326    HB3  SER 880           HB1      SER 880   0.169   3.512  -7.983
  327    HA   PRO 881           HA       PRO 881   2.977   2.202  -2.876
  328    HB2  PRO 881           HB2      PRO 881   5.326   1.575  -4.460
  329    HB3  PRO 881           HB1      PRO 881   4.477   0.543  -3.310
  330    HG2  PRO 881           HG2      PRO 881   4.500   0.050  -5.974
  331    HG3  PRO 881           HG1      PRO 881   3.154  -0.387  -4.920
  332    HD2  PRO 881           HD2      PRO 881   3.410   1.992  -6.727
  333    HD3  PRO 881           HD1      PRO 881   2.019   0.916  -6.473
  334    H    MET 882           H        MET 882   3.899   3.862  -1.974
  335    HA   MET 882           HA       MET 882   5.249   5.858  -3.667
  336    HB2  MET 882           HB2      MET 882   3.577   6.538  -1.245
  337    HB3  MET 882           HB1      MET 882   4.251   7.644  -2.430
  338    HG2  MET 882           HG2      MET 882   2.745   6.654  -4.121
  339    HG3  MET 882           HG1      MET 882   1.999   5.693  -2.845
  340    HE1  MET 882           HE1      MET 882   2.167   9.020  -4.673
  341    HE2  MET 882           HE2      MET 882   3.221   9.412  -3.301
  342    HE3  MET 882           HE3      MET 882   1.658  10.224  -3.487
  343    H    ILE 883           H        ILE 883   6.856   7.079  -2.542
  344    HA   ILE 883           HA       ILE 883   7.738   5.868  -0.037
  345    HB   ILE 883           HB       ILE 883   9.158   5.037  -1.940
  346   HG12  ILE 883          HG12      ILE 883  10.736   6.903  -0.172
  347   HG13  ILE 883          HG11      ILE 883  10.059   5.380   0.399
  348   HG21  ILE 883          HG21      ILE 883   9.942   7.941  -2.249
  349   HG22  ILE 883          HG22      ILE 883   8.995   7.010  -3.406
  350   HG23  ILE 883          HG23      ILE 883  10.681   6.584  -3.089
  351   HD11  ILE 883          HD11      ILE 883  12.419   5.175  -0.193
  352   HD12  ILE 883          HD12      ILE 883  12.054   5.703  -1.833
  353   HD13  ILE 883          HD13      ILE 883  11.404   4.178  -1.233
  354    H    GLY 884           H        GLY 884   8.462   7.278   1.454
  355    HA2  GLY 884           HA2      GLY 884   8.005  10.101   0.819
  356    HA3  GLY 884           HA1      GLY 884   7.891   9.385   2.422
  357    H    CYS 885           H        CYS 885   9.571  11.458   0.796
  358    HA   CYS 885           HA       CYS 885  12.273  10.738   1.268
  359    HB2  CYS 885           HB2      CYS 885  11.716  12.364  -0.375
  360    HB3  CYS 885           HB1      CYS 885  10.949  13.421   0.807
  361    H    ASP 886           H        ASP 886  13.510  11.026   2.952
  362    HA   ASP 886           HA       ASP 886  12.208  11.478   5.468
  363    HB2  ASP 886           HB2      ASP 886  14.943  10.590   4.672
  364    HB3  ASP 886           HB1      ASP 886  14.600  10.970   6.343
  365    H    ASP 887           H        ASP 887  13.794  13.471   3.286
  366    HA   ASP 887           HA       ASP 887  14.910  15.168   5.396
  367    HB2  ASP 887           HB2      ASP 887  16.113  14.688   3.188
  368    HB3  ASP 887           HB1      ASP 887  14.953  15.772   2.432
  369    H    CYS 888           H        CYS 888  12.715  15.581   2.623
  370    HA   CYS 888           HA       CYS 888  11.706  18.009   3.882
  371    HB2  CYS 888           HB2      CYS 888  10.428  18.338   1.778
  372    HB3  CYS 888           HB1      CYS 888  12.175  18.283   1.549
  373    H    ASP 889           H        ASP 889  10.768  14.763   3.546
  374    HA   ASP 889           HA       ASP 889   8.967  13.547   3.956
  375    HB2  ASP 889           HB2      ASP 889   8.921  14.688   6.185
  376    HB3  ASP 889           HB1      ASP 889   7.879  15.931   5.504
  377    H    ASP 890           H        ASP 890   8.871  13.789   1.762
  378    HA   ASP 890           HA       ASP 890   6.345  14.914   0.779
  379    HB2  ASP 890           HB2      ASP 890   8.223  16.364   0.149
  380    HB3  ASP 890           HB1      ASP 890   9.072  14.991  -0.533
  381    H    TRP 891           H        TRP 891   5.602  13.713  -1.125
  382    HA   TRP 891           HA       TRP 891   6.480  10.911  -0.902
  383    HD1  TRP 891           HD       TRP 891   3.654  12.767   1.470
  384    HE1  TRP 891           HE1      TRP 891   3.764  11.533   3.715
  385    HE3  TRP 891           HE3      TRP 891   5.133   8.225  -0.238
  386    HZ2  TRP 891           HZ2      TRP 891   4.409   8.925   4.636
  387    HZ3  TRP 891           HZ3      TRP 891   5.481   6.409   1.356
  388    HH2  TRP 891           HH       TRP 891   5.129   6.754   3.763
  389    HB2  TRP 891           HB2      TRP 891   3.659  11.949  -1.039
  390    HB3  TRP 891           HB1      TRP 891   4.072  10.271  -1.353
  391    H    TYR 892           H        TYR 892   7.218  10.115  -2.656
  392    HA   TYR 892           HA       TYR 892   6.121  10.981  -5.249
  393    HD1  TYR 892           HD2      TYR 892   8.842  12.354  -3.360
  394    HD2  TYR 892           HD1      TYR 892   8.593  11.706  -7.543
  395    HE1  TYR 892           HE2      TYR 892   9.630  14.613  -3.747
  396    HE2  TYR 892           HE1      TYR 892   9.405  13.973  -7.964
  397    HH   TYR 892           HH       TYR 892   9.538  16.073  -6.874
  398    HB2  TYR 892           HB2      TYR 892   8.858  10.026  -4.461
  399    HB3  TYR 892           HB1      TYR 892   8.293   9.925  -6.117
  400    H    HIS 893           H        HIS 893   5.936   9.343  -6.786
  401    HA   HIS 893           HA       HIS 893   5.210   6.733  -5.702
  402    HD2  HIS 893           HD2      HIS 893   2.534   6.455  -6.094
  403    HE1  HIS 893           HE1      HIS 893   1.021   9.473  -8.626
  404    HE2  HIS 893           HE2      HIS 893   0.458   7.572  -7.079
  405    HB2  HIS 893           HB2      HIS 893   5.312   7.662  -8.587
  406    HB3  HIS 893           HB1      HIS 893   4.784   6.075  -8.076
  407    H    TRP 894           H        TRP 894   6.149   4.766  -6.536
  408    HA   TRP 894           HA       TRP 894   8.915   4.792  -6.311
  409    HD1  TRP 894           HD       TRP 894   7.851   4.548  -4.279
  410    HE1  TRP 894           HE1      TRP 894   7.722   3.182  -2.121
  411    HE3  TRP 894           HE3      TRP 894   7.854  -0.117  -6.315
  412    HZ2  TRP 894           HZ2      TRP 894   7.608   0.441  -1.376
  413    HZ3  TRP 894           HZ3      TRP 894   7.738  -2.054  -4.839
  414    HH2  TRP 894           HH       TRP 894   7.616  -1.793  -2.414
  415    HB2  TRP 894           HB2      TRP 894   7.007   2.630  -7.149
  416    HB3  TRP 894           HB1      TRP 894   8.743   2.365  -7.120
  417    HA   PRO 895           HA       PRO 895   9.276   3.847 -11.044
  418    HB2  PRO 895           HB2      PRO 895   7.238   4.749 -12.636
  419    HB3  PRO 895           HB1      PRO 895   7.361   3.087 -12.044
  420    HG2  PRO 895           HG2      PRO 895   5.773   5.369 -10.928
  421    HG3  PRO 895           HG1      PRO 895   5.266   3.692 -11.210
  422    HD2  PRO 895           HD2      PRO 895   5.955   4.500  -8.770
  423    HD3  PRO 895           HD1      PRO 895   6.447   2.900  -9.367
  424    H    CYS 896           H        CYS 896   7.803   6.654  -9.735
  425    HA   CYS 896           HA       CYS 896   8.638   8.450 -11.756
  426    HB2  CYS 896           HB2      CYS 896   7.599   8.890  -8.977
  427    HB3  CYS 896           HB1      CYS 896   7.657  10.106 -10.264
  428    H    VAL 897           H        VAL 897   9.985   7.270  -8.757
  429    HA   VAL 897           HA       VAL 897  12.209   9.140  -9.132
  430    HB   VAL 897           HB       VAL 897  12.913   8.559  -6.788
  431   HG11  VAL 897          HG11      VAL 897  11.796  10.634  -7.294
  432   HG12  VAL 897          HG12      VAL 897  11.170  10.001  -5.767
  433   HG13  VAL 897          HG13      VAL 897  10.231   9.834  -7.249
  434   HG21  VAL 897          HG21      VAL 897  11.249   7.582  -5.296
  435   HG22  VAL 897          HG22      VAL 897  11.639   6.458  -6.600
  436   HG23  VAL 897          HG23      VAL 897  10.140   7.381  -6.651
  437    H    GLY 898           H        GLY 898  11.395   5.929  -9.478
  438    HA2  GLY 898           HA2      GLY 898  12.844   4.489 -10.691
  439    HA3  GLY 898           HA1      GLY 898  14.221   5.336 -10.001
  440    H    ILE 899           H        ILE 899  11.625   4.524  -7.932
  441    HA   ILE 899           HA       ILE 899  13.309   2.588  -6.571
  442    HB   ILE 899           HB       ILE 899  10.687   3.930  -5.818
  443   HG12  ILE 899          HG12      ILE 899  12.827   5.232  -5.592
  444   HG13  ILE 899          HG11      ILE 899  11.887   5.078  -4.111
  445   HG21  ILE 899          HG21      ILE 899  12.186   1.856  -4.200
  446   HG22  ILE 899          HG22      ILE 899  10.605   1.644  -4.945
  447   HG23  ILE 899          HG23      ILE 899  10.810   2.797  -3.627
  448   HD11  ILE 899          HD11      ILE 899  14.243   4.864  -3.716
  449   HD12  ILE 899          HD12      ILE 899  14.342   3.493  -4.837
  450   HD13  ILE 899          HD13      ILE 899  13.391   3.370  -3.341
  451    H    MET 900           H        MET 900  12.857   0.442  -6.556
  452    HA   MET 900           HA       MET 900  10.481  -0.425  -8.059
  453    HB2  MET 900           HB2      MET 900  13.230  -1.695  -8.124
  454    HB3  MET 900           HB1      MET 900  11.801  -2.323  -8.931
  455    HG2  MET 900           HG2      MET 900  11.686  -0.296 -10.298
  456    HG3  MET 900           HG1      MET 900  13.130   0.317  -9.496
  457    HE1  MET 900           HE1      MET 900  14.310   0.724 -11.821
  458    HE2  MET 900           HE2      MET 900  12.863   0.142 -12.649
  459    HE3  MET 900           HE3      MET 900  14.447  -0.504 -13.082
  460    H    ALA 901           H        ALA 901  12.627  -0.969  -5.392
  461    HA   ALA 901           HA       ALA 901  10.613  -2.765  -4.298
  462    HB1  ALA 901           HB1      ALA 901  12.554  -4.087  -4.949
  463    HB2  ALA 901           HB2      ALA 901  12.373  -4.038  -3.197
  464    HB3  ALA 901           HB3      ALA 901  13.602  -3.043  -3.987
  465    H    ALA 902           H        ALA 902  10.611  -2.723  -1.939
  466    HA   ALA 902           HA       ALA 902  10.757   0.045  -1.149
  467    HB1  ALA 902           HB1      ALA 902   8.736  -1.232  -0.687
  468    HB2  ALA 902           HB2      ALA 902   9.486  -0.665   0.804
  469    HB3  ALA 902           HB3      ALA 902   9.659  -2.351   0.311
  470    HA   PRO 903           HA       PRO 903  14.286  -0.908   1.418
  471    HB2  PRO 903           HB2      PRO 903  14.743   1.754   2.090
  472    HB3  PRO 903           HB1      PRO 903  15.487   0.918   0.730
  473    HG2  PRO 903           HG2      PRO 903  13.572   3.025   0.700
  474    HG3  PRO 903           HG1      PRO 903  14.320   2.231  -0.694
  475    HD2  PRO 903           HD2      PRO 903  11.653   1.855   0.466
  476    HD3  PRO 903           HD1      PRO 903  12.268   1.360  -1.125
  477    HA   PRO 904           HA       PRO 904  12.167  -0.745   5.256
  478    HB2  PRO 904           HB2      PRO 904  14.245  -0.453   7.019
  479    HB3  PRO 904           HB1      PRO 904  13.801  -1.985   6.273
  480    HG2  PRO 904           HG2      PRO 904  16.013  -0.120   5.599
  481    HG3  PRO 904           HG1      PRO 904  15.966  -1.884   5.500
  482    HD2  PRO 904           HD2      PRO 904  15.704  -0.206   3.333
  483    HD3  PRO 904           HD1      PRO 904  15.050  -1.857   3.390
  484    H    GLU 905           H        GLU 905  11.485   0.668   6.875
  485    HA   GLU 905           HA       GLU 905  11.888   3.421   6.296
  486    HB2  GLU 905           HB2      GLU 905  10.437   3.805   8.328
  487    HB3  GLU 905           HB1      GLU 905   9.702   2.928   7.001
  488    HG2  GLU 905           HG2      GLU 905  10.884   1.542   9.393
  489    HG3  GLU 905           HG1      GLU 905   9.229   2.154   9.347
  490    H    GLU 906           H        GLU 906  13.527   1.220   8.099
  491    HA   GLU 906           HA       GLU 906  14.705   3.067   9.976
  492    HB2  GLU 906           HB2      GLU 906  15.496   0.242   9.253
  493    HB3  GLU 906           HB1      GLU 906  16.066   1.155  10.647
  494    HG2  GLU 906           HG2      GLU 906  13.210   0.428  10.133
  495    HG3  GLU 906           HG1      GLU 906  14.295  -0.488  11.184
  496    H    MET 907           H        MET 907  15.013   2.466   6.773
  497    HA   MET 907           HA       MET 907  17.765   3.483   6.633
  498    HB2  MET 907           HB2      MET 907  17.480   1.417   5.384
  499    HB3  MET 907           HB1      MET 907  16.070   2.069   4.546
  500    HG2  MET 907           HG2      MET 907  17.569   3.748   3.497
  501    HG3  MET 907           HG1      MET 907  18.939   2.964   4.279
  502    HE1  MET 907           HE1      MET 907  19.349   2.023   0.485
  503    HE2  MET 907           HE2      MET 907  20.105   2.783   1.883
  504    HE3  MET 907           HE3      MET 907  18.697   3.528   1.128
  505    H    GLN 908           H        GLN 908  18.048   5.392   5.512
  506    HA   GLN 908           HA       GLN 908  15.545   6.821   5.097
  507    HB2  GLN 908           HB2      GLN 908  18.303   7.996   5.454
  508    HB3  GLN 908           HB1      GLN 908  16.823   8.899   5.205
  509    HG2  GLN 908           HG2      GLN 908  15.888   7.899   7.265
  510    HG3  GLN 908           HG1      GLN 908  17.444   7.138   7.560
  511   HE21  GLN 908          HE21      GLN 908  17.011  10.351   6.249
  512   HE22  GLN 908          HE22      GLN 908  17.640  11.192   7.615
  513    H    TRP 909           H        TRP 909  15.247   8.189   3.401
  514    HA   TRP 909           HA       TRP 909  16.836   7.783   1.006
  515    HD1  TRP 909           HD       TRP 909  16.090   5.913  -1.640
  516    HE1  TRP 909           HE1      TRP 909  15.132   6.866  -3.865
  517    HE3  TRP 909           HE3      TRP 909  12.567   9.061   0.252
  518    HZ2  TRP 909           HZ2      TRP 909  13.131   8.679  -4.670
  519    HZ3  TRP 909           HZ3      TRP 909  11.178  10.367  -1.289
  520    HH2  TRP 909           HH       TRP 909  11.458  10.180  -3.701
  521    HB2  TRP 909           HB2      TRP 909  15.173   5.981   0.866
  522    HB3  TRP 909           HB1      TRP 909  13.883   7.118   1.233
  523    H    PHE 910           H        PHE 910  16.568   9.495  -0.409
  524    HA   PHE 910           HA       PHE 910  14.923  11.690   0.563
  525    HD1  PHE 910           HD1      PHE 910  15.786  12.920   2.551
  526    HD2  PHE 910           HD2      PHE 910  19.243  10.920   1.122
  527    HE1  PHE 910           HE1      PHE 910  16.487  12.517   4.855
  528    HE2  PHE 910           HE2      PHE 910  19.956  10.492   3.426
  529    HZ   PHE 910           HZ       PHE 910  18.555  11.277   5.308
  530    HB2  PHE 910           HB2      PHE 910  17.793  11.920  -0.383
  531    HB3  PHE 910           HB1      PHE 910  16.776  13.247   0.176
  532    H    CYS 911           H        CYS 911  13.989  12.828  -1.009
  533    HA   CYS 911           HA       CYS 911  13.670  11.627  -3.548
  534    HB2  CYS 911           HB2      CYS 911  12.186  13.493  -4.044
  535    HB3  CYS 911           HB1      CYS 911  11.950  13.009  -2.389
  536    HA   PRO 912           HA       PRO 912  16.866  13.360  -6.110
  537    HB2  PRO 912           HB2      PRO 912  15.452  14.610  -8.144
  538    HB3  PRO 912           HB1      PRO 912  15.869  12.896  -8.101
  539    HG2  PRO 912           HG2      PRO 912  13.316  14.246  -7.327
  540    HG3  PRO 912           HG1      PRO 912  13.556  12.715  -8.187
  541    HD2  PRO 912           HD2      PRO 912  12.893  12.742  -5.621
  542    HD3  PRO 912           HD1      PRO 912  14.064  11.557  -6.228
  543    H    LYS 913           H        LYS 913  14.538  15.437  -4.716
  544    HA   LYS 913           HA       LYS 913  15.868  17.882  -5.515
  545    HB2  LYS 913           HB2      LYS 913  13.791  17.497  -3.334
  546    HB3  LYS 913           HB1      LYS 913  14.264  19.016  -4.085
  547    HG2  LYS 913           HG2      LYS 913  13.351  18.155  -6.240
  548    HG3  LYS 913           HG1      LYS 913  12.749  16.750  -5.369
  549    HD2  LYS 913           HD2      LYS 913  11.974  19.626  -4.826
  550    HD3  LYS 913           HD1      LYS 913  11.006  18.464  -5.720
  551    HE2  LYS 913           HE2      LYS 913  11.760  18.276  -2.787
  552    HE3  LYS 913           HE1      LYS 913  10.192  18.750  -3.425
  553    HZ1  LYS 913           HZ1      LYS 913  10.259  16.432  -4.541
  554    HZ2  LYS 913           HZ2      LYS 913   9.846  16.543  -2.950
  555    HZ3  LYS 913           HZ3      LYS 913  11.422  16.062  -3.362
  556    H    CYS 914           H        CYS 914  15.320  16.061  -2.555
  557    HA   CYS 914           HA       CYS 914  17.109  17.647  -1.013
  558    HB2  CYS 914           HB2      CYS 914  15.616  15.130  -0.490
  559    HB3  CYS 914           HB1      CYS 914  16.572  15.928   0.747
  560    H    ALA 915           H        ALA 915  17.387  14.655  -2.717
  561    HA   ALA 915           HA       ALA 915  19.839  13.938  -1.433
  562    HB1  ALA 915           HB1      ALA 915  18.626  12.843  -3.962
  563    HB2  ALA 915           HB2      ALA 915  18.267  12.299  -2.330
  564    HB3  ALA 915           HB3      ALA 915  19.897  12.080  -2.988
  565    H    ASN 916           H        ASN 916  18.968  16.083  -3.862
  566    HA   ASN 916           HA       ASN 916  21.357  15.845  -5.479
  567    HB2  ASN 916           HB2      ASN 916  19.198  16.559  -6.461
  568    HB3  ASN 916           HB1      ASN 916  19.274  18.021  -5.489
  569   HD21  ASN 916          HD21      ASN 916  19.372  19.400  -7.160
  570   HD22  ASN 916          HD22      ASN 916  20.682  19.538  -8.271
  571    H    LYS 917           H        LYS 917  20.124  17.964  -2.964
  572    HA   LYS 917           HA       LYS 917  22.104  19.950  -3.163
  573    HB2  LYS 917           HB2      LYS 917  21.440  20.600  -0.830
  574    HB3  LYS 917           HB1      LYS 917  20.078  20.401  -1.922
  575    HG2  LYS 917           HG2      LYS 917  19.655  18.222  -0.953
  576    HG3  LYS 917           HG1      LYS 917  21.058  18.443   0.096
  577    HD2  LYS 917           HD2      LYS 917  20.034  20.296   1.196
  578    HD3  LYS 917           HD1      LYS 917  18.712  20.323   0.027
  579    HE2  LYS 917           HE2      LYS 917  17.898  19.304   2.027
  580    HE3  LYS 917           HE1      LYS 917  18.089  18.076   0.774
  581    HZ1  LYS 917           HZ1      LYS 917  18.811  17.343   2.935
  582    HZ2  LYS 917           HZ2      LYS 917  19.998  18.535   2.996
  583    HZ3  LYS 917           HZ3      LYS 917  20.101  17.296   1.851
  584    H    ILE 918           H        ILE 918  22.216  16.825  -1.889
  585    HA   ILE 918           HA       ILE 918  24.423  17.099  -0.131
  586    HB   ILE 918           HB       ILE 918  23.525  14.627  -1.650
  587   HG12  ILE 918          HG12      ILE 918  22.601  15.642   1.054
  588   HG13  ILE 918          HG11      ILE 918  21.632  15.654  -0.409
  589   HG21  ILE 918          HG21      ILE 918  25.721  14.428  -0.603
  590   HG22  ILE 918          HG22      ILE 918  24.538  13.410   0.218
  591   HG23  ILE 918          HG23      ILE 918  25.042  14.936   0.945
  592   HD11  ILE 918          HD11      ILE 918  20.998  13.818   1.032
  593   HD12  ILE 918          HD12      ILE 918  22.657  13.214   1.029
  594   HD13  ILE 918          HD13      ILE 918  21.712  13.201  -0.461
  595    H    LYS 919           H        LYS 919  24.027  16.597  -3.584
  596    HA   LYS 919           HA       LYS 919  26.795  15.871  -3.999
  597    HB2  LYS 919           HB2      LYS 919  24.594  16.413  -5.988
  598    HB3  LYS 919           HB1      LYS 919  26.185  15.790  -6.394
  599    HG2  LYS 919           HG2      LYS 919  25.709  13.784  -5.010
  600    HG3  LYS 919           HG1      LYS 919  24.088  14.407  -4.718
  601    HD2  LYS 919           HD2      LYS 919  25.249  13.726  -7.428
  602    HD3  LYS 919           HD1      LYS 919  24.123  12.725  -6.517
  603    HE2  LYS 919           HE2      LYS 919  22.446  14.513  -6.641
  604    HE3  LYS 919           HE1      LYS 919  23.570  15.508  -7.568
  605    HZ1  LYS 919           HZ1      LYS 919  22.010  14.387  -9.022
  606    HZ2  LYS 919           HZ2      LYS 919  22.443  12.893  -8.394
  607    HZ3  LYS 919           HZ3      LYS 919  23.552  13.758  -9.288
  608    H    LYS 920           H        LYS 920  24.972  18.721  -3.808
  609    HA   LYS 920           HA       LYS 920  26.412  20.382  -5.604
  610    HB2  LYS 920           HB2      LYS 920  24.780  21.040  -3.157
  611    HB3  LYS 920           HB1      LYS 920  25.510  22.266  -4.176
  612    HG2  LYS 920           HG2      LYS 920  24.158  21.543  -6.056
  613    HG3  LYS 920           HG1      LYS 920  23.473  20.240  -5.080
  614    HD2  LYS 920           HD2      LYS 920  22.466  21.858  -3.564
  615    HD3  LYS 920           HD1      LYS 920  23.255  23.171  -4.412
  616    HE2  LYS 920           HE2      LYS 920  21.285  21.315  -5.724
  617    HE3  LYS 920           HE1      LYS 920  20.826  22.840  -4.973
  618    HZ1  LYS 920           HZ1      LYS 920  21.138  23.130  -7.329
  619    HZ2  LYS 920           HZ2      LYS 920  22.702  22.526  -7.276
  620    HZ3  LYS 920           HZ3      LYS 920  22.331  23.974  -6.508
  621    H    ASP 921           H        ASP 921  26.931  19.395  -2.326
  622    HA   ASP 921           HA       ASP 921  28.852  21.311  -1.565
  623    HB2  ASP 921           HB2      ASP 921  27.798  19.982   0.140
  624    HB3  ASP 921           HB1      ASP 921  28.394  18.492  -0.585
  625    H    LYS 922           H        LYS 922  29.188  18.126  -3.006
  626    HA   LYS 922           HA       LYS 922  30.836  17.038  -4.044
  627    HB2  LYS 922           HB2      LYS 922  31.920  19.802  -4.503
  628    HB3  LYS 922           HB1      LYS 922  32.685  18.360  -5.142
  629    HG2  LYS 922           HG2      LYS 922  30.629  17.849  -6.386
  630    HG3  LYS 922           HG1      LYS 922  29.915  19.345  -5.775
  631    HD2  LYS 922           HD2      LYS 922  31.630  20.654  -6.834
  632    HD3  LYS 922           HD1      LYS 922  32.480  19.197  -7.343
  633    HE2  LYS 922           HE2      LYS 922  30.609  18.579  -8.746
  634    HE3  LYS 922           HE1      LYS 922  29.716  20.017  -8.237
  635    HZ1  LYS 922           HZ1      LYS 922  32.304  20.010  -9.700
  636    HZ2  LYS 922           HZ2      LYS 922  31.423  21.381  -9.245
  637    HZ3  LYS 922           HZ3      LYS 922  30.793  20.315 -10.377
  638    H    LYS 923           H        LYS 923  31.665  15.795  -2.575
  639    HA   LYS 923           HA       LYS 923  33.780  16.772  -0.840
  640    HB2  LYS 923           HB2      LYS 923  33.859  14.477   0.030
  641    HB3  LYS 923           HB1      LYS 923  32.229  15.120   0.100
  642    HG2  LYS 923           HG2      LYS 923  31.601  13.830  -1.862
  643    HG3  LYS 923           HG1      LYS 923  33.255  13.240  -2.025
  644    HD2  LYS 923           HD2      LYS 923  31.471  12.733   0.360
  645    HD3  LYS 923           HD1      LYS 923  31.710  11.605  -0.973
  646    HE2  LYS 923           HE2      LYS 923  34.111  11.499  -0.450
  647    HE3  LYS 923           HE1      LYS 923  33.874  12.643   0.868
  648    HZ1  LYS 923           HZ1      LYS 923  33.989  10.364   1.651
  649    HZ2  LYS 923           HZ2      LYS 923  32.651   9.931   0.723
  650    HZ3  LYS 923           HZ3      LYS 923  32.487  11.041   1.982
  651    H    HIS 924           H        HIS 924  35.806  15.300  -0.800
  652    HA   HIS 924           HA       HIS 924  36.654  15.017  -3.568
  653    HD1  HIS 924           HD1      HIS 924  39.296  16.248  -4.424
  654    HD2  HIS 924           HD2      HIS 924  40.214  13.200  -1.769
  655    HE1  HIS 924           HE1      HIS 924  41.288  15.104  -5.407
  656    HE2  HIS 924           HE2      HIS 924  41.747  13.169  -3.860
  657    HB2  HIS 924           HB2      HIS 924  38.097  16.407  -2.105
  658    HB3  HIS 924           HB1      HIS 924  38.292  15.033  -1.018
  Start of MODEL    5
    1    HA   ALA   1           HA       ALA   1  12.434   6.606   2.953
    2    H1   ALA   1           HT1      ALA   1  12.877   6.353   5.310
    3    H2   ALA   1           HT2      ALA   1  14.224   6.676   4.400
    4    H3   ALA   1           HT3      ALA   1  13.958   5.085   4.986
    5    HB1  ALA   1           HB1      ALA   1  12.864   4.646   1.552
    6    HB2  ALA   1           HB2      ALA   1  13.782   3.892   2.858
    7    HB3  ALA   1           HB3      ALA   1  14.383   5.359   2.097
    8    H    ARG   2           H        ARG   2  10.337   6.416   3.266
    9    HA   ARG   2           HA       ARG   2   9.397   4.065   4.773
   10    HE   ARG   2           HE       ARG   2   7.746   7.967   6.351
   11    HB2  ARG   2           HB2      ARG   2   8.924   6.665   5.312
   12    HB3  ARG   2           HB1      ARG   2   7.636   6.359   4.175
   13    HG2  ARG   2           HG2      ARG   2   6.911   4.454   5.553
   14    HG3  ARG   2           HG1      ARG   2   8.143   4.899   6.737
   15    HD2  ARG   2           HD2      ARG   2   5.786   6.503   5.836
   16    HD3  ARG   2           HD1      ARG   2   6.065   5.793   7.428
   17   HH11  ARG   2          HH11      ARG   2   5.995   6.494   9.061
   18   HH12  ARG   2          HH12      ARG   2   6.070   7.870  10.044
   19   HH21  ARG   2          HH21      ARG   2   7.808   9.953   7.729
   20   HH22  ARG   2          HH22      ARG   2   7.120   9.839   9.277
   21    H    THR   3           H        THR   3   8.253   2.542   3.578
   22    HA   THR   3           HA       THR   3   7.171   3.478   1.030
   23    HB   THR   3           HB       THR   3   7.635   1.135   0.233
   24    HG1  THR   3           HG1      THR   3   8.174  -0.143   1.810
   25   HG21  THR   3          HG21      THR   3  10.029   2.786   1.078
   26   HG22  THR   3          HG22      THR   3   9.084   3.021  -0.388
   27   HG23  THR   3          HG23      THR   3  10.031   1.546  -0.181
   28    HA   M3L   4           HA       M3L   4   3.792   0.740   1.823
   29    H    M3L   4           H        M3L   4   5.078   3.004   0.633
   30    HB2  M3L   4           HB2      M3L   4   3.370   2.111   3.696
   31    HB3  M3L   4           HB1      M3L   4   1.884   2.127   2.770
   32    HG2  M3L   4           HG2      M3L   4   3.661   4.284   2.028
   33    HG3  M3L   4           HG1      M3L   4   3.267   4.316   3.744
   34    HD2  M3L   4           HD2      M3L   4   0.948   3.793   2.048
   35    HD3  M3L   4           HD1      M3L   4   1.152   4.955   3.359
   36    HE2  M3L   4           HE2      M3L   4   2.723   6.070   1.499
   37    HE3  M3L   4           HE1      M3L   4   1.619   5.218   0.448
   38   HM11  M3L   4          HM11      M3L   4   1.795   8.324   0.660
   39   HM12  M3L   4          HM12      M3L   4   0.758   7.425  -0.409
   40   HM13  M3L   4          HM13      M3L   4   0.083   8.602   0.673
   41   HM21  M3L   4          HM21      M3L   4  -0.914   5.735   0.571
   42   HM22  M3L   4          HM22      M3L   4  -1.507   6.886   1.739
   43   HM23  M3L   4          HM23      M3L   4  -0.870   5.360   2.263
   44   HM31  M3L   4          HM31      M3L   4   0.270   6.891   3.799
   45   HM32  M3L   4          HM32      M3L   4   0.570   8.435   3.072
   46   HM33  M3L   4          HM33      M3L   4   1.881   7.333   3.387
   47    H    GLN   5           H        GLN   5   1.754   0.317   0.830
   48    HA   GLN   5           HA       GLN   5   1.463   1.718  -1.738
   49    HB2  GLN   5           HB2      GLN   5   2.298  -0.589  -1.935
   50    HB3  GLN   5           HB1      GLN   5   0.901  -1.171  -1.048
   51    HG2  GLN   5           HG2      GLN   5  -0.558  -0.423  -2.845
   52    HG3  GLN   5           HG1      GLN   5   0.826   0.221  -3.701
   53   HE21  GLN   5          HE21      GLN   5   1.067  -2.816  -2.002
   54   HE22  GLN   5          HE22      GLN   5   1.154  -3.769  -3.429
   55    H    THR   6           H        THR   6  -0.445   2.688  -2.131
   56    HA   THR   6           HA       THR   6  -2.544   2.439  -0.135
   57    HB   THR   6           HB       THR   6  -2.733   4.270  -2.486
   58    HG1  THR   6           HG1      THR   6  -0.861   4.962  -2.132
   59   HG21  THR   6          HG21      THR   6  -3.197   4.625   0.489
   60   HG22  THR   6          HG22      THR   6  -4.440   4.293  -0.716
   61   HG23  THR   6          HG23      THR   6  -3.563   5.822  -0.756
   62    H    ALA   7           H        ALA   7  -2.207   0.238  -1.797
   63    HA   ALA   7           HA       ALA   7  -4.515   0.351  -3.645
   64    HB1  ALA   7           HB1      ALA   7  -3.518  -1.554  -4.772
   65    HB2  ALA   7           HB2      ALA   7  -2.233  -1.581  -3.553
   66    HB3  ALA   7           HB3      ALA   7  -2.371  -0.207  -4.648
   67    H    ARG   8           H        ARG   8  -4.068  -0.269  -0.616
   68    HA   ARG   8           HA       ARG   8  -4.955  -1.527   1.007
   69    HE   ARG   8           HE       ARG   8  -8.726   1.068  -1.246
   70    HB2  ARG   8           HB2      ARG   8  -6.772  -2.700  -1.120
   71    HB3  ARG   8           HB1      ARG   8  -7.070  -2.676   0.614
   72    HG2  ARG   8           HG2      ARG   8  -7.255  -0.261   0.589
   73    HG3  ARG   8           HG1      ARG   8  -6.838  -0.224  -1.117
   74    HD2  ARG   8           HD2      ARG   8  -8.879  -1.647  -1.524
   75    HD3  ARG   8           HD1      ARG   8  -9.316  -1.327   0.156
   76   HH11  ARG   8          HH11      ARG   8 -11.303  -1.302  -0.691
   77   HH12  ARG   8          HH12      ARG   8 -12.548  -0.254  -1.180
   78   HH21  ARG   8          HH21      ARG   8 -10.440   2.490  -1.915
   79   HH22  ARG   8          HH22      ARG   8 -12.057   1.929  -1.893
   80    H    LYS   9           H        LYS   9  -3.083  -2.660  -1.234
   81    HA   LYS   9           HA       LYS   9  -3.030  -5.453  -0.421
   82    HB2  LYS   9           HB2      LYS   9  -1.376  -3.898  -2.430
   83    HB3  LYS   9           HB1      LYS   9  -1.076  -5.573  -2.015
   84    HG2  LYS   9           HG2      LYS   9  -3.627  -4.546  -3.246
   85    HG3  LYS   9           HG1      LYS   9  -2.296  -5.276  -4.138
   86    HD2  LYS   9           HD2      LYS   9  -2.573  -7.323  -2.728
   87    HD3  LYS   9           HD1      LYS   9  -4.013  -6.580  -2.035
   88    HE2  LYS   9           HE2      LYS   9  -3.589  -7.249  -4.958
   89    HE3  LYS   9           HE1      LYS   9  -4.581  -8.153  -3.827
   90    HZ1  LYS   9           HZ1      LYS   9  -5.056  -5.364  -4.737
   91    HZ2  LYS   9           HZ2      LYS   9  -6.003  -6.178  -3.607
   92    HZ3  LYS   9           HZ3      LYS   9  -5.926  -6.730  -5.194
   93    H    SER  10           H        SER  10  -2.441  -5.304   1.671
   94    HA   SER  10           HA       SER  10   0.134  -4.068   2.222
   95    HG   SER  10           HG       SER  10  -2.662  -4.886   4.734
   96    HB2  SER  10           HB2      SER  10  -0.875  -3.814   4.517
   97    HB3  SER  10           HB1      SER  10  -1.614  -2.831   3.249
   98    H    THR  11           H        THR  11   1.395  -5.174   3.826
   99    HA   THR  11           HA       THR  11   0.952  -8.036   3.899
  100    HB   THR  11           HB       THR  11   3.239  -7.898   5.104
  101    HG1  THR  11           HG1      THR  11   4.342  -5.875   4.617
  102   HG21  THR  11          HG21      THR  11   3.005  -8.586   2.750
  103   HG22  THR  11          HG22      THR  11   4.451  -7.603   2.979
  104   HG23  THR  11          HG23      THR  11   3.002  -6.892   2.263
  105    H    GLY  12           H        GLY  12   2.232  -5.830   6.241
  106    HA2  GLY  12           HA2      GLY  12   0.163  -6.625   8.200
  107    HA3  GLY  12           HA1      GLY  12   1.838  -6.248   8.625
  108    H    GLY  13           H        GLY  13   0.815  -4.447   6.078
  109    HA2  GLY  13           HA2      GLY  13  -0.692  -2.452   6.622
  110    HA3  GLY  13           HA1      GLY  13   0.758  -2.021   7.558
  111    H1   GLY 850           HT1      GLY 850  -7.935  26.447 -12.141
  112    H2   GLY 850           HT2      GLY 850  -6.596  25.605 -11.507
  113    H3   GLY 850           HT3      GLY 850  -6.405  26.591 -12.836
  114    HA2  GLY 850           HA1      GLY 850  -6.862  28.530 -11.557
  115    HA3  GLY 850           HA2      GLY 850  -7.114  27.513 -10.138
  116    H    SER 851           H        SER 851  -5.321  29.154  -9.523
  117    HA   SER 851           HA       SER 851  -2.692  28.425 -10.448
  118    HG   SER 851           HG       SER 851  -3.607  30.459 -10.936
  119    HB2  SER 851           HB2      SER 851  -3.570  30.312  -8.241
  120    HB3  SER 851           HB1      SER 851  -1.954  30.212  -8.940
  121    H    HIS 852           H        HIS 852  -1.047  28.084  -8.463
  122    HA   HIS 852           HA       HIS 852  -2.195  25.793  -7.140
  123    HD2  HIS 852           HD2      HIS 852   0.906  26.520 -10.021
  124    HE1  HIS 852           HE1      HIS 852  -0.509  22.550 -10.402
  125    HE2  HIS 852           HE2      HIS 852   0.121  24.660 -11.626
  126    HB2  HIS 852           HB2      HIS 852   0.709  26.641  -7.293
  127    HB3  HIS 852           HB1      HIS 852   0.128  25.187  -6.490
  128    H    MET 853           H        MET 853  -3.511  27.283  -5.955
  129    HA   MET 853           HA       MET 853  -2.473  28.746  -3.750
  130    HB2  MET 853           HB2      MET 853  -5.176  27.428  -4.122
  131    HB3  MET 853           HB1      MET 853  -4.781  28.480  -2.774
  132    HG2  MET 853           HG2      MET 853  -4.763  29.278  -5.677
  133    HG3  MET 853           HG1      MET 853  -6.050  29.631  -4.528
  134    HE1  MET 853           HE1      MET 853  -4.303  32.105  -2.049
  135    HE2  MET 853           HE2      MET 853  -4.408  30.360  -1.868
  136    HE3  MET 853           HE3      MET 853  -5.800  31.268  -2.468
  137    H    ALA 854           H        ALA 854  -3.720  25.513  -4.134
  138    HA   ALA 854           HA       ALA 854  -2.553  24.712  -1.607
  139    HB1  ALA 854           HB1      ALA 854  -3.614  22.523  -2.107
  140    HB2  ALA 854           HB2      ALA 854  -4.183  23.169  -3.647
  141    HB3  ALA 854           HB3      ALA 854  -4.789  23.838  -2.131
  142    H    MET 855           H        MET 855  -0.419  24.630  -1.888
  143    HA   MET 855           HA       MET 855   0.614  23.297  -4.276
  144    HB2  MET 855           HB2      MET 855   2.767  24.402  -3.847
  145    HB3  MET 855           HB1      MET 855   1.463  25.563  -4.012
  146    HG2  MET 855           HG2      MET 855   1.392  25.806  -1.567
  147    HG3  MET 855           HG1      MET 855   2.730  24.664  -1.429
  148    HE1  MET 855           HE1      MET 855   3.049  28.840  -3.392
  149    HE2  MET 855           HE2      MET 855   1.575  28.206  -2.662
  150    HE3  MET 855           HE3      MET 855   2.193  27.505  -4.159
  151    H    ALA 856           H        ALA 856  -0.353  22.468  -1.507
  152    HA   ALA 856           HA       ALA 856   1.819  20.827  -0.590
  153    HB1  ALA 856           HB1      ALA 856   0.153  19.974   1.012
  154    HB2  ALA 856           HB2      ALA 856  -1.099  20.918   0.207
  155    HB3  ALA 856           HB3      ALA 856   0.226  21.736   1.038
  156    H    TYR 857           H        TYR 857   1.809  18.595  -0.793
  157    HA   TYR 857           HA       TYR 857   0.341  17.696  -3.116
  158    HD1  TYR 857           HD2      TYR 857   1.998  16.522  -5.328
  159    HD2  TYR 857           HD1      TYR 857   4.046  18.658  -2.296
  160    HE1  TYR 857           HE2      TYR 857   3.196  17.764  -7.048
  161    HE2  TYR 857           HE1      TYR 857   5.278  19.930  -4.012
  162    HH   TYR 857           HH       TYR 857   4.357  19.911  -7.277
  163    HB2  TYR 857           HB2      TYR 857   2.782  16.601  -1.747
  164    HB3  TYR 857           HB1      TYR 857   1.866  15.769  -3.003
  165    H    VAL 858           H        VAL 858  -0.538  17.933  -0.383
  166    HA   VAL 858           HA       VAL 858  -1.902  15.322  -0.236
  167    HB   VAL 858           HB       VAL 858  -1.541  17.251   2.088
  168   HG11  VAL 858          HG11      VAL 858  -2.807  14.512   1.967
  169   HG12  VAL 858          HG12      VAL 858  -3.636  16.042   2.251
  170   HG13  VAL 858          HG13      VAL 858  -2.497  15.418   3.440
  171   HG21  VAL 858          HG21      VAL 858  -0.153  15.528   3.102
  172   HG22  VAL 858          HG22      VAL 858   0.564  16.108   1.588
  173   HG23  VAL 858          HG23      VAL 858  -0.280  14.552   1.646
  174    H    ILE 859           H        ILE 859  -3.909  15.468  -0.893
  175    HA   ILE 859           HA       ILE 859  -5.421  17.929  -0.370
  176    HB   ILE 859           HB       ILE 859  -6.609  17.692  -2.511
  177   HG12  ILE 859          HG12      ILE 859  -4.624  15.504  -3.199
  178   HG13  ILE 859          HG11      ILE 859  -6.301  15.229  -2.743
  179   HG21  ILE 859          HG21      ILE 859  -3.624  17.849  -2.896
  180   HG22  ILE 859          HG22      ILE 859  -4.713  19.190  -2.521
  181   HG23  ILE 859          HG23      ILE 859  -4.829  18.366  -4.074
  182   HD11  ILE 859          HD11      ILE 859  -5.360  16.743  -5.171
  183   HD12  ILE 859          HD12      ILE 859  -7.040  16.453  -4.717
  184   HD13  ILE 859          HD13      ILE 859  -5.995  15.099  -5.146
  185    H    ARG 860           H        ARG 860  -7.850  17.386  -0.594
  186    HA   ARG 860           HA       ARG 860  -8.205  14.710   0.483
  187    HE   ARG 860           HE       ARG 860  -8.204  17.484   4.663
  188    HB2  ARG 860           HB2      ARG 860  -9.905  17.178   0.758
  189    HB3  ARG 860           HB1      ARG 860 -10.434  15.574   1.253
  190    HG2  ARG 860           HG2      ARG 860  -8.639  15.404   2.781
  191    HG3  ARG 860           HG1      ARG 860  -8.008  17.001   2.317
  192    HD2  ARG 860           HD2      ARG 860 -10.204  17.951   3.043
  193    HD3  ARG 860           HD1      ARG 860 -10.636  16.334   3.607
  194   HH11  ARG 860          HH11      ARG 860 -11.606  16.704   5.148
  195   HH12  ARG 860          HH12      ARG 860 -11.616  16.970   6.826
  196   HH21  ARG 860          HH21      ARG 860  -8.166  17.909   6.949
  197   HH22  ARG 860          HH22      ARG 860  -9.550  17.680   7.919
  198    H    ASP 861           H        ASP 861  -9.675  13.355  -0.367
  199    HA   ASP 861           HA       ASP 861 -10.280  13.816  -3.147
  200    HB2  ASP 861           HB2      ASP 861 -10.936  11.515  -3.261
  201    HB3  ASP 861           HB1      ASP 861  -9.511  11.570  -2.240
  202    H    GLU 862           H        GLU 862 -12.580  12.617  -3.580
  203    HA   GLU 862           HA       GLU 862 -14.508  14.549  -3.028
  204    HB2  GLU 862           HB2      GLU 862 -16.070  12.908  -4.069
  205    HB3  GLU 862           HB1      GLU 862 -14.628  13.262  -5.010
  206    HG2  GLU 862           HG2      GLU 862 -13.649  11.162  -3.896
  207    HG3  GLU 862           HG1      GLU 862 -15.317  10.782  -3.494
  208    H    TRP 863           H        TRP 863 -13.691  11.633  -1.251
  209    HA   TRP 863           HA       TRP 863 -16.080  11.844   0.339
  210    HD1  TRP 863           HD       TRP 863 -13.518   8.031  -0.876
  211    HE1  TRP 863           HE1      TRP 863 -14.990   7.021  -2.743
  212    HE3  TRP 863           HE3      TRP 863 -17.628  10.935  -0.289
  213    HZ2  TRP 863           HZ2      TRP 863 -17.582   7.418  -3.811
  214    HZ3  TRP 863           HZ3      TRP 863 -19.586  10.575  -1.776
  215    HH2  TRP 863           HH       TRP 863 -19.539   8.852  -3.496
  216    HB2  TRP 863           HB2      TRP 863 -13.696  10.023   0.725
  217    HB3  TRP 863           HB1      TRP 863 -15.268   9.869   1.500
  218    H    GLY 864           H        GLY 864 -12.707  12.708   0.556
  219    HA2  GLY 864           HA2      GLY 864 -12.312  14.748   1.848
  220    HA3  GLY 864           HA1      GLY 864 -13.393  14.096   3.067
  221    H    ASN 865           H        ASN 865 -11.064  12.075   1.460
  222    HA   ASN 865           HA       ASN 865  -9.668  11.704   4.025
  223    HB2  ASN 865           HB2      ASN 865  -9.527  10.039   1.494
  224    HB3  ASN 865           HB1      ASN 865  -8.851   9.633   3.063
  225   HD21  ASN 865          HD21      ASN 865 -11.704   9.858   1.151
  226   HD22  ASN 865          HD22      ASN 865 -12.715   8.908   2.180
  227    H    GLN 866           H        GLN 866  -7.304  11.537   3.876
  228    HA   GLN 866           HA       GLN 866  -6.208  13.554   2.184
  229    HB2  GLN 866           HB2      GLN 866  -4.855  11.590   4.028
  230    HB3  GLN 866           HB1      GLN 866  -3.994  12.829   3.141
  231    HG2  GLN 866           HG2      GLN 866  -5.215  14.526   4.259
  232    HG3  GLN 866           HG1      GLN 866  -6.147  13.349   5.207
  233   HE21  GLN 866          HE21      GLN 866  -3.339  15.155   4.880
  234   HE22  GLN 866          HE22      GLN 866  -2.472  14.642   6.262
  235    H    ILE 867           H        ILE 867  -5.469  13.369   0.292
  236    HA   ILE 867           HA       ILE 867  -4.669  10.747  -0.777
  237    HB   ILE 867           HB       ILE 867  -5.679  13.185  -2.283
  238   HG12  ILE 867          HG12      ILE 867  -7.525  12.114  -1.104
  239   HG13  ILE 867          HG11      ILE 867  -7.645  11.850  -2.843
  240   HG21  ILE 867          HG21      ILE 867  -4.981  10.440  -3.318
  241   HG22  ILE 867          HG22      ILE 867  -4.067  11.919  -3.585
  242   HG23  ILE 867          HG23      ILE 867  -5.687  11.749  -4.267
  243   HD11  ILE 867          HD11      ILE 867  -6.652   9.862  -0.817
  244   HD12  ILE 867          HD12      ILE 867  -6.781   9.586  -2.554
  245   HD13  ILE 867          HD13      ILE 867  -8.240   9.843  -1.590
  246    H    TRP 868           H        TRP 868  -2.644  10.648  -1.499
  247    HA   TRP 868           HA       TRP 868  -1.075  13.070  -1.233
  248    HD1  TRP 868           HD       TRP 868   1.527  12.796   0.825
  249    HE1  TRP 868           HE1      TRP 868   0.931  12.611   3.328
  250    HE3  TRP 868           HE3      TRP 868  -2.379   9.502   0.518
  251    HZ2  TRP 868           HZ2      TRP 868  -0.925  11.273   4.943
  252    HZ3  TRP 868           HZ3      TRP 868  -3.508   8.834   2.594
  253    HH2  TRP 868           HH       TRP 868  -2.798   9.701   4.756
  254    HB2  TRP 868           HB2      TRP 868  -0.314  10.165  -1.125
  255    HB3  TRP 868           HB1      TRP 868   0.887  11.441  -1.299
  256    H    ILE 869           H        ILE 869  -0.042  13.928  -2.783
  257    HA   ILE 869           HA       ILE 869  -0.409  12.923  -5.512
  258    HB   ILE 869           HB       ILE 869   0.413  15.673  -4.545
  259   HG12  ILE 869          HG12      ILE 869  -1.866  15.249  -3.760
  260   HG13  ILE 869          HG11      ILE 869  -1.861  16.473  -5.017
  261   HG21  ILE 869          HG21      ILE 869  -0.555  14.768  -7.256
  262   HG22  ILE 869          HG22      ILE 869   1.099  15.199  -6.831
  263   HG23  ILE 869          HG23      ILE 869  -0.165  16.430  -6.811
  264   HD11  ILE 869          HD11      ILE 869  -2.643  13.591  -5.317
  265   HD12  ILE 869          HD12      ILE 869  -2.585  14.769  -6.628
  266   HD13  ILE 869          HD13      ILE 869  -3.726  14.983  -5.297
  267    H    CYS 870           H        CYS 870   1.411  12.323  -6.553
  268    HA   CYS 870           HA       CYS 870   3.921  12.306  -5.160
  269    HB2  CYS 870           HB2      CYS 870   3.293  10.413  -6.533
  270    HB3  CYS 870           HB1      CYS 870   3.075  11.449  -7.928
  271    HA   PRO 871           HA       PRO 871   5.015  16.262  -7.047
  272    HB2  PRO 871           HB2      PRO 871   7.656  15.711  -5.855
  273    HB3  PRO 871           HB1      PRO 871   6.585  17.094  -5.602
  274    HG2  PRO 871           HG2      PRO 871   6.948  15.245  -3.693
  275    HG3  PRO 871           HG1      PRO 871   5.374  16.018  -3.948
  276    HD2  PRO 871           HD2      PRO 871   6.326  13.321  -4.837
  277    HD3  PRO 871           HD1      PRO 871   4.762  13.794  -4.129
  278    H    GLY 872           H        GLY 872   6.173  13.127  -7.605
  279    HA2  GLY 872           HA2      GLY 872   8.274  13.758  -9.421
  280    HA3  GLY 872           HA1      GLY 872   7.483  12.197  -9.217
  281    H    CYS 873           H        CYS 873   4.954  12.507  -9.888
  282    HA   CYS 873           HA       CYS 873   5.118  13.162 -12.726
  283    HB2  CYS 873           HB2      CYS 873   2.993  11.830 -12.700
  284    HB3  CYS 873           HB1      CYS 873   4.447  10.956 -12.209
  285    H    ASN 874           H        ASN 874   3.478  13.929  -9.760
  286    HA   ASN 874           HA       ASN 874   2.204  15.587  -9.049
  287    HB2  ASN 874           HB2      ASN 874   2.136  16.581 -11.920
  288    HB3  ASN 874           HB1      ASN 874   1.177  17.312 -10.646
  289   HD21  ASN 874          HD21      ASN 874   4.388  16.089 -10.067
  290   HD22  ASN 874          HD22      ASN 874   5.168  17.617  -9.877
  291    H    LYS 875           H        LYS 875   1.459  12.940  -9.796
  292    HA   LYS 875           HA       LYS 875  -1.402  13.350 -10.276
  293    HB2  LYS 875           HB2      LYS 875   0.305  10.887 -10.531
  294    HB3  LYS 875           HB1      LYS 875  -1.423  10.952 -10.786
  295    HG2  LYS 875           HG2      LYS 875  -1.083  12.394 -12.723
  296    HG3  LYS 875           HG1      LYS 875   0.670  12.333 -12.451
  297    HD2  LYS 875           HD2      LYS 875   0.621   9.930 -12.635
  298    HD3  LYS 875           HD1      LYS 875  -1.119   9.962 -12.915
  299    HE2  LYS 875           HE2      LYS 875  -0.725  11.257 -14.963
  300    HE3  LYS 875           HE1      LYS 875   1.017  11.131 -14.684
  301    HZ1  LYS 875           HZ1      LYS 875   0.743   8.700 -14.723
  302    HZ2  LYS 875           HZ2      LYS 875   0.339   9.408 -16.197
  303    HZ3  LYS 875           HZ3      LYS 875  -0.872   8.895 -15.141
  304    HA   PRO 876           HA       PRO 876  -1.992  11.809  -6.074
  305    HB2  PRO 876           HB2      PRO 876  -4.440  10.692  -6.350
  306    HB3  PRO 876           HB1      PRO 876  -4.233  12.445  -6.314
  307    HG2  PRO 876           HG2      PRO 876  -4.524  10.625  -8.659
  308    HG3  PRO 876           HG1      PRO 876  -5.355  12.165  -8.348
  309    HD2  PRO 876           HD2      PRO 876  -3.235  12.007  -9.999
  310    HD3  PRO 876           HD1      PRO 876  -3.488  13.418  -8.955
  311    H    ASP 877           H        ASP 877  -2.381   9.663  -5.038
  312    HA   ASP 877           HA       ASP 877  -1.083   7.706  -6.663
  313    HB2  ASP 877           HB2      ASP 877  -0.502   7.821  -4.232
  314    HB3  ASP 877           HB1      ASP 877  -2.111   7.221  -3.860
  315    H    ASP 878           H        ASP 878  -1.801   6.077  -7.599
  316    HA   ASP 878           HA       ASP 878  -4.693   5.785  -8.029
  317    HB2  ASP 878           HB2      ASP 878  -3.208   5.650  -9.992
  318    HB3  ASP 878           HB1      ASP 878  -2.318   4.334  -9.241
  319    H    GLY 879           H        GLY 879  -2.056   4.354  -6.460
  320    HA2  GLY 879           HA2      GLY 879  -2.765   2.968  -4.517
  321    HA3  GLY 879           HA1      GLY 879  -3.608   1.990  -5.723
  322    H    SER 880           H        SER 880  -0.443   3.495  -5.290
  323    HA   SER 880           HA       SER 880   0.741   0.938  -6.082
  324    HG   SER 880           HG       SER 880   0.043   1.786  -8.088
  325    HB2  SER 880           HB2      SER 880   1.660   3.697  -6.907
  326    HB3  SER 880           HB1      SER 880   2.431   2.174  -7.338
  327    HA   PRO 881           HA       PRO 881   3.379   1.627  -2.521
  328    HB2  PRO 881           HB2      PRO 881   5.692   0.862  -4.234
  329    HB3  PRO 881           HB1      PRO 881   5.146   0.147  -2.710
  330    HG2  PRO 881           HG2      PRO 881   4.701  -1.200  -4.938
  331    HG3  PRO 881           HG1      PRO 881   3.413  -1.033  -3.746
  332    HD2  PRO 881           HD2      PRO 881   3.829   0.576  -6.240
  333    HD3  PRO 881           HD1      PRO 881   2.369  -0.272  -5.678
  334    H    MET 882           H        MET 882   4.006   3.463  -1.825
  335    HA   MET 882           HA       MET 882   5.383   5.341  -3.630
  336    HB2  MET 882           HB2      MET 882   3.725   6.039  -1.193
  337    HB3  MET 882           HB1      MET 882   4.371   7.149  -2.391
  338    HG2  MET 882           HG2      MET 882   2.891   6.111  -4.076
  339    HG3  MET 882           HG1      MET 882   2.192   5.110  -2.811
  340    HE1  MET 882           HE1      MET 882   1.670   9.649  -3.345
  341    HE2  MET 882           HE2      MET 882   2.156   8.502  -4.590
  342    HE3  MET 882           HE3      MET 882   3.261   8.853  -3.238
  343    H    ILE 883           H        ILE 883   6.989   6.681  -2.587
  344    HA   ILE 883           HA       ILE 883   8.023   5.481  -0.137
  345    HB   ILE 883           HB       ILE 883   9.454   4.773  -2.040
  346   HG12  ILE 883          HG12      ILE 883  10.930   6.804  -0.363
  347   HG13  ILE 883          HG11      ILE 883  10.427   5.227   0.247
  348   HG21  ILE 883          HG21      ILE 883   9.063   6.691  -3.536
  349   HG22  ILE 883          HG22      ILE 883  10.791   6.430  -3.277
  350   HG23  ILE 883          HG23      ILE 883   9.967   7.727  -2.429
  351   HD11  ILE 883          HD11      ILE 883  11.829   4.160  -1.452
  352   HD12  ILE 883          HD12      ILE 883  12.769   5.250  -0.429
  353   HD13  ILE 883          HD13      ILE 883  12.304   5.747  -2.050
  354    H    GLY 884           H        GLY 884   8.509   6.784   1.393
  355    HA2  GLY 884           HA2      GLY 884   8.096   9.645   1.021
  356    HA3  GLY 884           HA1      GLY 884   8.162   8.781   2.552
  357    H    CYS 885           H        CYS 885   9.710  10.960   0.912
  358    HA   CYS 885           HA       CYS 885  12.449  10.231   1.009
  359    HB2  CYS 885           HB2      CYS 885  11.678  12.044  -0.363
  360    HB3  CYS 885           HB1      CYS 885  11.018  12.911   1.011
  361    H    ASP 886           H        ASP 886  14.020  10.954   2.551
  362    HA   ASP 886           HA       ASP 886  12.912  10.967   5.225
  363    HB2  ASP 886           HB2      ASP 886  15.641  10.477   4.145
  364    HB3  ASP 886           HB1      ASP 886  15.411  10.857   5.843
  365    H    ASP 887           H        ASP 887  13.969  13.239   2.981
  366    HA   ASP 887           HA       ASP 887  14.858  15.014   5.153
  367    HB2  ASP 887           HB2      ASP 887  16.184  14.902   2.988
  368    HB3  ASP 887           HB1      ASP 887  14.831  15.723   2.215
  369    H    CYS 888           H        CYS 888  12.598  15.037   2.447
  370    HA   CYS 888           HA       CYS 888  11.194  17.209   3.788
  371    HB2  CYS 888           HB2      CYS 888   9.742  17.329   1.749
  372    HB3  CYS 888           HB1      CYS 888  11.446  17.579   1.416
  373    H    ASP 889           H        ASP 889  10.987  13.848   3.432
  374    HA   ASP 889           HA       ASP 889   9.597  12.229   4.172
  375    HB2  ASP 889           HB2      ASP 889   9.929  13.418   6.351
  376    HB3  ASP 889           HB1      ASP 889   8.553  14.439   5.988
  377    H    ASP 890           H        ASP 890   8.940  13.777   1.905
  378    HA   ASP 890           HA       ASP 890   6.043  13.876   1.909
  379    HB2  ASP 890           HB2      ASP 890   7.558  15.788   1.095
  380    HB3  ASP 890           HB1      ASP 890   7.913  14.753  -0.277
  381    H    TRP 891           H        TRP 891   5.125  13.056  -0.293
  382    HA   TRP 891           HA       TRP 891   6.205  10.315  -0.493
  383    HD1  TRP 891           HD       TRP 891   3.424  11.822   2.076
  384    HE1  TRP 891           HE1      TRP 891   3.833  10.424   4.194
  385    HE3  TRP 891           HE3      TRP 891   5.092   7.572  -0.112
  386    HZ2  TRP 891           HZ2      TRP 891   4.722   7.850   4.838
  387    HZ3  TRP 891           HZ3      TRP 891   5.706   5.682   1.267
  388    HH2  TRP 891           HH       TRP 891   5.544   5.804   3.741
  389    HB2  TRP 891           HB2      TRP 891   3.346  11.223  -0.486
  390    HB3  TRP 891           HB1      TRP 891   3.839   9.595  -0.960
  391    H    TYR 892           H        TYR 892   7.061   9.771  -2.317
  392    HA   TYR 892           HA       TYR 892   5.948  10.800  -4.844
  393    HD1  TYR 892           HD2      TYR 892   8.625  11.652  -2.406
  394    HD2  TYR 892           HD1      TYR 892   8.637  12.198  -6.619
  395    HE1  TYR 892           HE2      TYR 892   9.543  13.895  -2.102
  396    HE2  TYR 892           HE1      TYR 892   9.578  14.441  -6.338
  397    HH   TYR 892           HH       TYR 892  10.984  15.379  -3.514
  398    HB2  TYR 892           HB2      TYR 892   8.679   9.711  -4.156
  399    HB3  TYR 892           HB1      TYR 892   8.151  10.114  -5.774
  400    H    HIS 893           H        HIS 893   5.899   9.212  -6.554
  401    HA   HIS 893           HA       HIS 893   5.316   6.511  -5.612
  402    HD2  HIS 893           HD2      HIS 893   2.692   5.855  -6.071
  403    HE1  HIS 893           HE1      HIS 893   0.942   9.265  -7.889
  404    HE2  HIS 893           HE2      HIS 893   0.530   7.097  -6.510
  405    HB2  HIS 893           HB2      HIS 893   5.262   7.657  -8.408
  406    HB3  HIS 893           HB1      HIS 893   4.894   5.979  -8.035
  407    H    TRP 894           H        TRP 894   6.340   4.632  -6.409
  408    HA   TRP 894           HA       TRP 894   9.101   4.739  -6.300
  409    HD1  TRP 894           HD       TRP 894   8.127   4.415  -4.227
  410    HE1  TRP 894           HE1      TRP 894   8.254   2.987  -2.099
  411    HE3  TRP 894           HE3      TRP 894   8.330  -0.212  -6.379
  412    HZ2  TRP 894           HZ2      TRP 894   8.403   0.231  -1.426
  413    HZ3  TRP 894           HZ3      TRP 894   8.478  -2.186  -4.925
  414    HH2  TRP 894           HH       TRP 894   8.508  -1.965  -2.509
  415    HB2  TRP 894           HB2      TRP 894   7.190   2.556  -7.051
  416    HB3  TRP 894           HB1      TRP 894   8.926   2.321  -7.188
  417    HA   PRO 895           HA       PRO 895   9.366   3.836 -11.010
  418    HB2  PRO 895           HB2      PRO 895   7.235   4.500 -12.600
  419    HB3  PRO 895           HB1      PRO 895   7.491   2.883 -11.930
  420    HG2  PRO 895           HG2      PRO 895   5.780   5.109 -10.882
  421    HG3  PRO 895           HG1      PRO 895   5.371   3.395 -11.086
  422    HD2  PRO 895           HD2      PRO 895   6.057   4.353  -8.695
  423    HD3  PRO 895           HD1      PRO 895   6.616   2.754  -9.233
  424    H    CYS 896           H        CYS 896   7.832   6.565  -9.640
  425    HA   CYS 896           HA       CYS 896   8.478   8.406 -11.712
  426    HB2  CYS 896           HB2      CYS 896   7.532   8.814  -8.883
  427    HB3  CYS 896           HB1      CYS 896   7.615  10.075 -10.120
  428    H    VAL 897           H        VAL 897   9.914   7.324  -8.720
  429    HA   VAL 897           HA       VAL 897  12.053   9.297  -9.083
  430    HB   VAL 897           HB       VAL 897  12.690   8.869  -6.732
  431   HG11  VAL 897          HG11      VAL 897  11.243  10.739  -7.257
  432   HG12  VAL 897          HG12      VAL 897  10.710  10.007  -5.737
  433   HG13  VAL 897          HG13      VAL 897   9.836   9.684  -7.224
  434   HG21  VAL 897          HG21      VAL 897  11.201   7.624  -5.270
  435   HG22  VAL 897          HG22      VAL 897  11.768   6.585  -6.584
  436   HG23  VAL 897          HG23      VAL 897  10.143   7.259  -6.631
  437    H    GLY 898           H        GLY 898  11.457   6.037  -9.541
  438    HA2  GLY 898           HA2      GLY 898  13.052   4.732 -10.733
  439    HA3  GLY 898           HA1      GLY 898  14.332   5.652  -9.957
  440    H    ILE 899           H        ILE 899  11.756   4.569  -7.985
  441    HA   ILE 899           HA       ILE 899  13.589   2.721  -6.704
  442    HB   ILE 899           HB       ILE 899  10.911   3.825  -5.795
  443   HG12  ILE 899          HG12      ILE 899  12.912   5.339  -5.680
  444   HG13  ILE 899          HG11      ILE 899  12.134   5.044  -4.125
  445   HG21  ILE 899          HG21      ILE 899  11.293   2.681  -3.644
  446   HG22  ILE 899          HG22      ILE 899  12.717   1.897  -4.323
  447   HG23  ILE 899          HG23      ILE 899  11.115   1.540  -4.975
  448   HD11  ILE 899          HD11      ILE 899  14.659   3.776  -5.155
  449   HD12  ILE 899          HD12      ILE 899  13.864   3.446  -3.603
  450   HD13  ILE 899          HD13      ILE 899  14.519   5.050  -3.930
  451    H    MET 900           H        MET 900  13.406   0.614  -7.044
  452    HA   MET 900           HA       MET 900  10.915  -0.377  -8.225
  453    HB2  MET 900           HB2      MET 900  13.739  -1.385  -8.598
  454    HB3  MET 900           HB1      MET 900  12.311  -2.203  -9.213
  455    HG2  MET 900           HG2      MET 900  11.768  -0.272 -10.589
  456    HG3  MET 900           HG1      MET 900  13.168   0.584  -9.954
  457    HE1  MET 900           HE1      MET 900  12.495   0.152 -13.078
  458    HE2  MET 900           HE2      MET 900  14.113  -0.173 -13.703
  459    HE3  MET 900           HE3      MET 900  13.873   1.085 -12.490
  460    H    ALA 901           H        ALA 901  13.105  -0.629  -5.608
  461    HA   ALA 901           HA       ALA 901  11.429  -2.698  -4.439
  462    HB1  ALA 901           HB1      ALA 901  14.449  -2.758  -4.384
  463    HB2  ALA 901           HB2      ALA 901  13.419  -3.796  -5.369
  464    HB3  ALA 901           HB3      ALA 901  13.347  -3.907  -3.611
  465    H    ALA 902           H        ALA 902  11.252  -2.539  -2.225
  466    HA   ALA 902           HA       ALA 902  11.483   0.107  -1.203
  467    HB1  ALA 902           HB1      ALA 902   9.556  -1.347  -0.734
  468    HB2  ALA 902           HB2      ALA 902  10.334  -0.755   0.733
  469    HB3  ALA 902           HB3      ALA 902  10.612  -2.408   0.198
  470    HA   PRO 903           HA       PRO 903  15.284  -0.821   0.971
  471    HB2  PRO 903           HB2      PRO 903  15.713   1.842   1.683
  472    HB3  PRO 903           HB1      PRO 903  16.354   1.075   0.235
  473    HG2  PRO 903           HG2      PRO 903  14.318   3.086   0.467
  474    HG3  PRO 903           HG1      PRO 903  15.044   2.426  -1.006
  475    HD2  PRO 903           HD2      PRO 903  12.448   1.852   0.179
  476    HD3  PRO 903           HD1      PRO 903  13.093   1.363  -1.402
  477    HA   PRO 904           HA       PRO 904  13.609  -0.857   5.051
  478    HB2  PRO 904           HB2      PRO 904  15.842  -0.385   6.598
  479    HB3  PRO 904           HB1      PRO 904  15.427  -1.960   5.911
  480    HG2  PRO 904           HG2      PRO 904  17.414   0.050   5.013
  481    HG3  PRO 904           HG1      PRO 904  17.475  -1.712   4.896
  482    HD2  PRO 904           HD2      PRO 904  16.877  -0.046   2.788
  483    HD3  PRO 904           HD1      PRO 904  16.332  -1.727   2.888
  484    H    GLU 905           H        GLU 905  12.792   0.487   6.511
  485    HA   GLU 905           HA       GLU 905  12.412   3.171   6.092
  486    HB2  GLU 905           HB2      GLU 905  12.464   2.030   8.886
  487    HB3  GLU 905           HB1      GLU 905  11.499   3.363   8.289
  488    HG2  GLU 905           HG2      GLU 905  10.036   1.559   8.607
  489    HG3  GLU 905           HG1      GLU 905  10.282   1.679   6.861
  490    H    GLU 906           H        GLU 906  14.726   1.633   8.163
  491    HA   GLU 906           HA       GLU 906  15.836   3.983   9.293
  492    HB2  GLU 906           HB2      GLU 906  17.569   2.410  10.169
  493    HB3  GLU 906           HB1      GLU 906  15.902   1.996  10.549
  494    HG2  GLU 906           HG2      GLU 906  16.011   0.445   8.530
  495    HG3  GLU 906           HG1      GLU 906  17.758   0.686   8.599
  496    H    MET 907           H        MET 907  16.314   2.585   6.258
  497    HA   MET 907           HA       MET 907  18.931   3.813   5.929
  498    HB2  MET 907           HB2      MET 907  18.581   1.719   4.752
  499    HB3  MET 907           HB1      MET 907  17.110   2.356   4.011
  500    HG2  MET 907           HG2      MET 907  18.956   2.287   2.421
  501    HG3  MET 907           HG1      MET 907  18.441   3.942   2.736
  502    HE1  MET 907           HE1      MET 907  20.647   4.874   1.635
  503    HE2  MET 907           HE2      MET 907  21.182   3.229   1.287
  504    HE3  MET 907           HE3      MET 907  22.268   4.357   2.098
  505    H    GLN 908           H        GLN 908  19.145   5.688   4.964
  506    HA   GLN 908           HA       GLN 908  16.670   7.141   4.638
  507    HB2  GLN 908           HB2      GLN 908  19.469   8.211   4.733
  508    HB3  GLN 908           HB1      GLN 908  18.043   9.182   4.467
  509    HG2  GLN 908           HG2      GLN 908  17.155   8.374   6.660
  510    HG3  GLN 908           HG1      GLN 908  18.735   7.648   6.957
  511   HE21  GLN 908          HE21      GLN 908  16.992  10.568   6.539
  512   HE22  GLN 908          HE22      GLN 908  18.163  11.645   7.210
  513    H    TRP 909           H        TRP 909  16.165   8.276   2.982
  514    HA   TRP 909           HA       TRP 909  17.584   7.958   0.473
  515    HD1  TRP 909           HD       TRP 909  16.950   6.071  -2.087
  516    HE1  TRP 909           HE1      TRP 909  15.786   6.899  -4.257
  517    HE3  TRP 909           HE3      TRP 909  13.142   8.705  -0.004
  518    HZ2  TRP 909           HZ2      TRP 909  13.551   8.462  -4.947
  519    HZ3  TRP 909           HZ3      TRP 909  11.531   9.846  -1.458
  520    HH2  TRP 909           HH       TRP 909  11.730   9.727  -3.883
  521    HB2  TRP 909           HB2      TRP 909  16.100   5.991   0.477
  522    HB3  TRP 909           HB1      TRP 909  14.731   7.015   0.896
  523    H    PHE 910           H        PHE 910  17.029   9.596  -0.962
  524    HA   PHE 910           HA       PHE 910  15.223  11.606   0.076
  525    HD1  PHE 910           HD2      PHE 910  16.141  13.131   2.113
  526    HD2  PHE 910           HD1      PHE 910  19.551  11.188   0.497
  527    HE1  PHE 910           HE2      PHE 910  17.039  12.821   4.390
  528    HE2  PHE 910           HE1      PHE 910  20.446  10.858   2.761
  529    HZ   PHE 910           HZ       PHE 910  19.184  11.679   4.710
  530    HB2  PHE 910           HB2      PHE 910  18.031  12.184  -0.922
  531    HB3  PHE 910           HB1      PHE 910  16.869  13.372  -0.333
  532    H    CYS 911           H        CYS 911  14.154  12.634  -1.503
  533    HA   CYS 911           HA       CYS 911  13.885  11.346  -3.997
  534    HB2  CYS 911           HB2      CYS 911  12.245  13.163  -4.423
  535    HB3  CYS 911           HB1      CYS 911  12.027  12.372  -2.875
  536    HA   PRO 912           HA       PRO 912  16.531  13.523  -6.881
  537    HB2  PRO 912           HB2      PRO 912  14.668  14.570  -8.689
  538    HB3  PRO 912           HB1      PRO 912  15.381  12.955  -8.763
  539    HG2  PRO 912           HG2      PRO 912  12.757  13.821  -7.609
  540    HG3  PRO 912           HG1      PRO 912  13.138  12.379  -8.569
  541    HD2  PRO 912           HD2      PRO 912  12.833  12.173  -5.954
  542    HD3  PRO 912           HD1      PRO 912  14.148  11.302  -6.760
  543    H    LYS 913           H        LYS 913  14.121  15.185  -5.160
  544    HA   LYS 913           HA       LYS 913  15.024  17.848  -5.902
  545    HB2  LYS 913           HB2      LYS 913  13.105  16.892  -3.771
  546    HB3  LYS 913           HB1      LYS 913  13.472  18.566  -4.105
  547    HG2  LYS 913           HG2      LYS 913  12.180  16.677  -6.060
  548    HG3  LYS 913           HG1      LYS 913  11.315  17.797  -5.015
  549    HD2  LYS 913           HD2      LYS 913  12.664  19.642  -6.064
  550    HD3  LYS 913           HD1      LYS 913  13.227  18.453  -7.241
  551    HE2  LYS 913           HE2      LYS 913  11.339  19.687  -8.137
  552    HE3  LYS 913           HE1      LYS 913  10.883  18.003  -7.860
  553    HZ1  LYS 913           HZ1      LYS 913   9.798  18.708  -5.788
  554    HZ2  LYS 913           HZ2      LYS 913   9.151  19.498  -7.099
  555    HZ3  LYS 913           HZ3      LYS 913  10.208  20.310  -6.090
  556    H    CYS 914           H        CYS 914  14.830  15.821  -3.000
  557    HA   CYS 914           HA       CYS 914  16.431  17.603  -1.511
  558    HB2  CYS 914           HB2      CYS 914  15.189  14.968  -0.905
  559    HB3  CYS 914           HB1      CYS 914  16.194  15.800   0.268
  560    H    ALA 915           H        ALA 915  17.086  14.469  -3.002
  561    HA   ALA 915           HA       ALA 915  19.596  14.153  -1.738
  562    HB1  ALA 915           HB1      ALA 915  18.718  13.034  -4.394
  563    HB2  ALA 915           HB2      ALA 915  18.293  12.358  -2.834
  564    HB3  ALA 915           HB3      ALA 915  19.989  12.384  -3.343
  565    H    ASN 916           H        ASN 916  18.474  15.904  -4.330
  566    HA   ASN 916           HA       ASN 916  20.842  16.228  -5.902
  567    HB2  ASN 916           HB2      ASN 916  18.574  16.480  -6.816
  568    HB3  ASN 916           HB1      ASN 916  18.318  17.879  -5.789
  569   HD21  ASN 916          HD21      ASN 916  19.782  16.660  -8.636
  570   HD22  ASN 916          HD22      ASN 916  20.250  18.185  -9.293
  571    H    LYS 917           H        LYS 917  19.135  18.166  -3.519
  572    HA   LYS 917           HA       LYS 917  20.793  20.462  -3.679
  573    HB2  LYS 917           HB2      LYS 917  19.532  21.310  -1.832
  574    HB3  LYS 917           HB1      LYS 917  18.418  20.439  -2.873
  575    HG2  LYS 917           HG2      LYS 917  18.768  18.467  -1.315
  576    HG3  LYS 917           HG1      LYS 917  19.551  19.623  -0.244
  577    HD2  LYS 917           HD2      LYS 917  17.467  20.943  -0.192
  578    HD3  LYS 917           HD1      LYS 917  16.696  19.743  -1.237
  579    HE2  LYS 917           HE2      LYS 917  17.300  18.026   0.539
  580    HE3  LYS 917           HE1      LYS 917  17.705  19.389   1.575
  581    HZ1  LYS 917           HZ1      LYS 917  15.042  18.709   0.454
  582    HZ2  LYS 917           HZ2      LYS 917  15.358  20.173   1.229
  583    HZ3  LYS 917           HZ3      LYS 917  15.505  18.714   2.066
  584    H    ILE 918           H        ILE 918  20.982  17.529  -1.861
  585    HA   ILE 918           HA       ILE 918  22.714  18.403   0.216
  586    HB   ILE 918           HB       ILE 918  22.488  15.605  -0.934
  587   HG12  ILE 918          HG12      ILE 918  20.878  16.918   1.282
  588   HG13  ILE 918          HG11      ILE 918  20.297  16.426  -0.307
  589   HG21  ILE 918          HG21      ILE 918  23.232  14.882   1.312
  590   HG22  ILE 918          HG22      ILE 918  23.444  16.576   1.762
  591   HG23  ILE 918          HG23      ILE 918  24.434  15.878   0.487
  592   HD11  ILE 918          HD11      ILE 918  21.305  14.568   1.834
  593   HD12  ILE 918          HD12      ILE 918  20.706  14.093   0.246
  594   HD13  ILE 918          HD13      ILE 918  19.616  14.852   1.407
  595    H    LYS 919           H        LYS 919  23.216  16.953  -2.920
  596    HA   LYS 919           HA       LYS 919  26.044  16.687  -2.589
  597    HB2  LYS 919           HB2      LYS 919  24.314  16.398  -5.045
  598    HB3  LYS 919           HB1      LYS 919  25.998  15.883  -4.909
  599    HG2  LYS 919           HG2      LYS 919  25.453  14.242  -3.272
  600    HG3  LYS 919           HG1      LYS 919  23.819  14.867  -3.098
  601    HD2  LYS 919           HD2      LYS 919  23.715  12.865  -4.368
  602    HD3  LYS 919           HD1      LYS 919  23.400  14.206  -5.463
  603    HE2  LYS 919           HE2      LYS 919  25.757  14.075  -6.221
  604    HE3  LYS 919           HE1      LYS 919  25.986  12.686  -5.157
  605    HZ1  LYS 919           HZ1      LYS 919  24.199  11.556  -6.387
  606    HZ2  LYS 919           HZ2      LYS 919  25.531  11.908  -7.351
  607    HZ3  LYS 919           HZ3      LYS 919  24.135  12.862  -7.456
  608    H    LYS 920           H        LYS 920  24.102  19.281  -3.223
  609    HA   LYS 920           HA       LYS 920  25.914  20.665  -5.001
  610    HB2  LYS 920           HB2      LYS 920  23.363  21.586  -3.669
  611    HB3  LYS 920           HB1      LYS 920  24.309  22.561  -4.788
  612    HG2  LYS 920           HG2      LYS 920  23.926  20.972  -6.561
  613    HG3  LYS 920           HG1      LYS 920  23.071  19.904  -5.449
  614    HD2  LYS 920           HD2      LYS 920  21.456  21.094  -6.768
  615    HD3  LYS 920           HD1      LYS 920  21.390  21.695  -5.119
  616    HE2  LYS 920           HE2      LYS 920  22.676  23.660  -5.745
  617    HE3  LYS 920           HE1      LYS 920  22.858  23.026  -7.383
  618    HZ1  LYS 920           HZ1      LYS 920  20.276  23.740  -6.101
  619    HZ2  LYS 920           HZ2      LYS 920  20.468  23.122  -7.640
  620    HZ3  LYS 920           HZ3      LYS 920  21.080  24.659  -7.281
  621    H    ASP 921           H        ASP 921  26.028  19.926  -1.878
  622    HA   ASP 921           HA       ASP 921  27.148  22.396  -0.817
  623    HB2  ASP 921           HB2      ASP 921  25.978  20.722   0.644
  624    HB3  ASP 921           HB1      ASP 921  27.229  19.550   0.266
  625    H    LYS 922           H        LYS 922  27.976  20.135  -2.911
  626    HA   LYS 922           HA       LYS 922  29.668  19.699  -4.155
  627    HB2  LYS 922           HB2      LYS 922  30.853  21.776  -3.851
  628    HB3  LYS 922           HB1      LYS 922  31.435  21.280  -2.271
  629    HG2  LYS 922           HG2      LYS 922  33.163  21.196  -4.074
  630    HG3  LYS 922           HG1      LYS 922  32.917  19.659  -3.248
  631    HD2  LYS 922           HD2      LYS 922  31.437  18.952  -5.103
  632    HD3  LYS 922           HD1      LYS 922  31.798  20.462  -5.933
  633    HE2  LYS 922           HE2      LYS 922  34.112  19.843  -6.152
  634    HE3  LYS 922           HE1      LYS 922  33.868  18.453  -5.088
  635    HZ1  LYS 922           HZ1      LYS 922  32.435  17.470  -6.741
  636    HZ2  LYS 922           HZ2      LYS 922  33.935  17.786  -7.420
  637    HZ3  LYS 922           HZ3      LYS 922  32.638  18.781  -7.782
  638    H    LYS 923           H        LYS 923  29.335  17.734  -4.081
  639    HA   LYS 923           HA       LYS 923  30.724  16.042  -2.169
  640    HB2  LYS 923           HB2      LYS 923  28.492  15.300  -2.748
  641    HB3  LYS 923           HB1      LYS 923  28.817  15.480  -4.464
  642    HG2  LYS 923           HG2      LYS 923  30.553  13.679  -4.236
  643    HG3  LYS 923           HG1      LYS 923  29.970  13.417  -2.596
  644    HD2  LYS 923           HD2      LYS 923  27.837  12.723  -3.386
  645    HD3  LYS 923           HD1      LYS 923  28.192  13.280  -5.024
  646    HE2  LYS 923           HE2      LYS 923  29.627  11.040  -3.589
  647    HE3  LYS 923           HE1      LYS 923  28.377  10.828  -4.810
  648    HZ1  LYS 923           HZ1      LYS 923  30.547  10.597  -5.842
  649    HZ2  LYS 923           HZ2      LYS 923  31.086  12.044  -5.239
  650    HZ3  LYS 923           HZ3      LYS 923  29.878  12.037  -6.398
  651    H    HIS 924           H        HIS 924  32.473  14.742  -2.840
  652    HA   HIS 924           HA       HIS 924  33.841  15.592  -5.204
  653    HD1  HIS 924           HD1      HIS 924  36.850  15.773  -4.674
  654    HD2  HIS 924           HD2      HIS 924  35.825  11.825  -5.383
  655    HE1  HIS 924           HE1      HIS 924  38.649  14.893  -6.196
  656    HE2  HIS 924           HE2      HIS 924  37.726  12.669  -6.913
  657    HB2  HIS 924           HB2      HIS 924  35.037  14.862  -3.090
  658    HB3  HIS 924           HB1      HIS 924  34.454  13.231  -3.393
  Start of MODEL    6
    1    HA   ALA   1           HA       ALA   1  12.167   6.233   3.114
    2    H1   ALA   1           HT1      ALA   1  13.948   6.351   4.594
    3    H2   ALA   1           HT2      ALA   1  13.739   4.759   5.120
    4    H3   ALA   1           HT3      ALA   1  12.584   5.940   5.506
    5    HB1  ALA   1           HB1      ALA   1  13.714   3.631   2.948
    6    HB2  ALA   1           HB2      ALA   1  14.217   5.168   2.253
    7    HB3  ALA   1           HB3      ALA   1  12.780   4.352   1.642
    8    H    ARG   2           H        ARG   2  10.181   6.103   3.900
    9    HA   ARG   2           HA       ARG   2   9.094   3.579   4.891
   10    HE   ARG   2           HE       ARG   2   5.675   3.451   7.666
   11    HB2  ARG   2           HB2      ARG   2   8.608   6.209   5.520
   12    HB3  ARG   2           HB1      ARG   2   7.358   5.903   4.348
   13    HG2  ARG   2           HG2      ARG   2   7.800   4.378   6.896
   14    HG3  ARG   2           HG1      ARG   2   6.571   5.610   6.582
   15    HD2  ARG   2           HD2      ARG   2   5.455   4.164   5.001
   16    HD3  ARG   2           HD1      ARG   2   6.744   2.971   5.119
   17   HH11  ARG   2          HH11      ARG   2   4.751   1.839   4.627
   18   HH12  ARG   2          HH12      ARG   2   3.677   0.779   5.407
   19   HH21  ARG   2          HH21      ARG   2   4.250   1.958   8.675
   20   HH22  ARG   2          HH22      ARG   2   3.398   0.809   7.756
   21    H    THR   3           H        THR   3   7.865   2.260   3.515
   22    HA   THR   3           HA       THR   3   7.155   3.499   0.982
   23    HB   THR   3           HB       THR   3   7.325   1.182  -0.005
   24    HG1  THR   3           HG1      THR   3   8.982   0.634   2.218
   25   HG21  THR   3          HG21      THR   3   9.773   1.306  -0.275
   26   HG22  THR   3          HG22      THR   3   9.855   2.426   1.085
   27   HG23  THR   3          HG23      THR   3   9.021   2.898  -0.397
   28    HA   M3L   4           HA       M3L   4   3.400   1.311   1.573
   29    H    M3L   4           H        M3L   4   5.217   3.027   0.103
   30    HB2  M3L   4           HB2      M3L   4   3.188   3.764   2.278
   31    HB3  M3L   4           HB1      M3L   4   1.721   2.943   1.763
   32    HG2  M3L   4           HG2      M3L   4   2.359   3.999  -0.568
   33    HG3  M3L   4           HG1      M3L   4   3.248   5.135   0.450
   34    HD2  M3L   4           HD2      M3L   4   0.870   5.774  -0.139
   35    HD3  M3L   4           HD1      M3L   4   0.354   4.450   0.909
   36    HE2  M3L   4           HE2      M3L   4   0.962   5.506   2.801
   37    HE3  M3L   4           HE1      M3L   4   2.364   6.219   2.079
   38   HM11  M3L   4          HM11      M3L   4  -1.353   6.801   2.706
   39   HM12  M3L   4          HM12      M3L   4  -1.563   7.927   1.396
   40   HM13  M3L   4          HM13      M3L   4  -1.206   6.260   1.063
   41   HM21  M3L   4          HM21      M3L   4   0.686   7.740   3.914
   42   HM22  M3L   4          HM22      M3L   4   0.174   9.130   3.023
   43   HM23  M3L   4          HM23      M3L   4   1.836   8.638   2.982
   44   HM31  M3L   4          HM31      M3L   4   0.350   7.804  -0.351
   45   HM32  M3L   4          HM32      M3L   4   1.977   7.892   0.253
   46   HM33  M3L   4          HM33      M3L   4   0.855   9.174   0.600
   47    H    GLN   5           H        GLN   5   1.333   1.227   0.174
   48    HA   GLN   5           HA       GLN   5   1.713   1.674  -2.646
   49    HB2  GLN   5           HB2      GLN   5   2.736  -0.541  -2.338
   50    HB3  GLN   5           HB1      GLN   5   1.285  -1.095  -1.511
   51    HG2  GLN   5           HG2      GLN   5  -0.007  -0.815  -3.543
   52    HG3  GLN   5           HG1      GLN   5   1.397  -0.149  -4.353
   53   HE21  GLN   5          HE21      GLN   5   1.223  -1.746  -5.908
   54   HE22  GLN   5          HE22      GLN   5   1.776  -3.344  -5.604
   55    H    THR   6           H        THR   6  -0.193  -0.145  -0.316
   56    HA   THR   6           HA       THR   6  -2.326  -0.258   0.168
   57    HB   THR   6           HB       THR   6  -2.431   2.669  -0.646
   58    HG1  THR   6           HG1      THR   6  -1.840   3.016   1.559
   59   HG21  THR   6          HG21      THR   6  -4.102   1.070   1.325
   60   HG22  THR   6          HG22      THR   6  -4.656   1.644  -0.247
   61   HG23  THR   6          HG23      THR   6  -4.248   2.802   1.022
   62    H    ALA   7           H        ALA   7  -2.560  -1.729  -1.536
   63    HA   ALA   7           HA       ALA   7  -3.708  -0.863  -4.010
   64    HB1  ALA   7           HB1      ALA   7  -3.950  -3.254  -4.514
   65    HB2  ALA   7           HB2      ALA   7  -3.514  -3.651  -2.852
   66    HB3  ALA   7           HB3      ALA   7  -2.330  -2.899  -3.916
   67    H    ARG   8           H        ARG   8  -5.374   0.374  -3.175
   68    HA   ARG   8           HA       ARG   8  -7.710  -1.180  -2.289
   69    HE   ARG   8           HE       ARG   8  -7.713  -0.316   1.315
   70    HB2  ARG   8           HB2      ARG   8  -6.686   0.404  -0.620
   71    HB3  ARG   8           HB1      ARG   8  -7.087   1.723  -1.702
   72    HG2  ARG   8           HG2      ARG   8  -8.685   1.581   0.076
   73    HG3  ARG   8           HG1      ARG   8  -9.469   1.176  -1.454
   74    HD2  ARG   8           HD2      ARG   8 -10.171  -0.345   0.338
   75    HD3  ARG   8           HD1      ARG   8  -9.302  -1.205  -0.928
   76   HH11  ARG   8          HH11      ARG   8  -9.582  -2.995  -0.072
   77   HH12  ARG   8          HH12      ARG   8  -8.843  -4.187   0.878
   78   HH21  ARG   8          HH21      ARG   8  -6.671  -1.976   2.600
   79   HH22  ARG   8          HH22      ARG   8  -7.140  -3.599   2.435
   80    H    LYS   9           H        LYS   9  -6.443   0.083  -4.915
   81    HA   LYS   9           HA       LYS   9  -8.934   0.505  -6.201
   82    HB2  LYS   9           HB2      LYS   9  -8.496   2.787  -5.270
   83    HB3  LYS   9           HB1      LYS   9  -6.962   2.814  -6.122
   84    HG2  LYS   9           HG2      LYS   9  -8.002   2.885  -8.219
   85    HG3  LYS   9           HG1      LYS   9  -9.576   2.469  -7.543
   86    HD2  LYS   9           HD2      LYS   9  -9.520   4.831  -8.100
   87    HD3  LYS   9           HD1      LYS   9  -9.607   4.636  -6.355
   88    HE2  LYS   9           HE2      LYS   9  -7.208   5.062  -6.182
   89    HE3  LYS   9           HE1      LYS   9  -7.098   5.220  -7.935
   90    HZ1  LYS   9           HZ1      LYS   9  -8.577   6.990  -6.069
   91    HZ2  LYS   9           HZ2      LYS   9  -8.747   7.068  -7.712
   92    HZ3  LYS   9           HZ3      LYS   9  -7.258   7.430  -7.024
   93    H    SER  10           H        SER  10  -5.550   1.474  -6.764
   94    HA   SER  10           HA       SER  10  -3.931   0.662  -8.026
   95    HG   SER  10           HG       SER  10  -3.587  -2.284  -6.996
   96    HB2  SER  10           HB2      SER  10  -5.713  -1.748  -8.386
   97    HB3  SER  10           HB1      SER  10  -4.032  -1.654  -8.903
   98    H    THR  11           H        THR  11  -3.226   0.594 -10.163
   99    HA   THR  11           HA       THR  11  -5.011   1.820 -12.051
  100    HB   THR  11           HB       THR  11  -2.151   0.875 -12.405
  101    HG1  THR  11           HG1      THR  11  -3.268   3.007 -11.045
  102   HG21  THR  11          HG21      THR  11  -3.762   2.957 -13.914
  103   HG22  THR  11          HG22      THR  11  -3.305   1.371 -14.528
  104   HG23  THR  11          HG23      THR  11  -2.062   2.577 -14.188
  105    H    GLY  12           H        GLY  12  -3.620  -1.276 -11.430
  106    HA2  GLY  12           HA2      GLY  12  -5.399  -2.575 -13.277
  107    HA3  GLY  12           HA1      GLY  12  -3.697  -2.693 -13.729
  108    H    GLY  13           H        GLY  13  -2.610  -2.707 -11.115
  109    HA2  GLY  13           HA2      GLY  13  -3.842  -4.873  -9.723
  110    HA3  GLY  13           HA1      GLY  13  -2.184  -5.076 -10.327
  111    H1   GLY 850           HT1      GLY 850  14.293  29.435  -7.432
  112    H2   GLY 850           HT2      GLY 850  14.584  28.982  -9.029
  113    H3   GLY 850           HT3      GLY 850  13.697  27.966  -7.998
  114    HA2  GLY 850           HA1      GLY 850  12.896  30.629  -8.966
  115    HA3  GLY 850           HA2      GLY 850  12.223  29.077  -9.469
  116    H    SER 851           H        SER 851  10.476  30.834  -8.560
  117    HA   SER 851           HA       SER 851  10.081  30.741  -5.755
  118    HG   SER 851           HG       SER 851  10.243  32.781  -6.942
  119    HB2  SER 851           HB2      SER 851   8.089  31.331  -7.942
  120    HB3  SER 851           HB1      SER 851   8.001  31.835  -6.253
  121    H    HIS 852           H        HIS 852   9.677  28.820  -4.820
  122    HA   HIS 852           HA       HIS 852   8.241  26.690  -6.098
  123    HD2  HIS 852           HD2      HIS 852  11.609  27.679  -4.603
  124    HE1  HIS 852           HE1      HIS 852  12.442  23.533  -4.445
  125    HE2  HIS 852           HE2      HIS 852  13.440  25.851  -4.434
  126    HB2  HIS 852           HB2      HIS 852   8.993  27.104  -3.174
  127    HB3  HIS 852           HB1      HIS 852   8.296  25.636  -3.821
  128    H    MET 853           H        MET 853   6.155  27.121  -6.530
  129    HA   MET 853           HA       MET 853   4.634  28.943  -4.978
  130    HB2  MET 853           HB2      MET 853   4.159  28.550  -7.376
  131    HB3  MET 853           HB1      MET 853   3.640  26.912  -6.994
  132    HG2  MET 853           HG2      MET 853   1.826  27.785  -5.639
  133    HG3  MET 853           HG1      MET 853   2.356  29.432  -5.963
  134    HE1  MET 853           HE1      MET 853  -0.976  29.270  -7.924
  135    HE2  MET 853           HE2      MET 853  -0.008  30.144  -6.740
  136    HE3  MET 853           HE3      MET 853  -0.602  28.524  -6.370
  137    H    ALA 854           H        ALA 854   3.720  28.587  -3.120
  138    HA   ALA 854           HA       ALA 854   3.948  26.154  -1.776
  139    HB1  ALA 854           HB1      ALA 854   3.867  28.316  -0.620
  140    HB2  ALA 854           HB2      ALA 854   2.681  27.162   0.001
  141    HB3  ALA 854           HB3      ALA 854   2.163  28.467  -1.057
  142    H    MET 855           H        MET 855   3.020  24.484  -2.537
  143    HA   MET 855           HA       MET 855   0.133  24.318  -2.398
  144    HB2  MET 855           HB2      MET 855   1.831  23.347  -4.710
  145    HB3  MET 855           HB1      MET 855   0.236  22.715  -4.372
  146    HG2  MET 855           HG2      MET 855  -0.698  24.965  -4.731
  147    HG3  MET 855           HG1      MET 855   0.921  25.547  -5.127
  148    HE1  MET 855           HE1      MET 855  -1.002  25.416  -8.593
  149    HE2  MET 855           HE2      MET 855  -0.195  26.460  -7.427
  150    HE3  MET 855           HE3      MET 855  -1.750  25.730  -7.030
  151    H    ALA 856           H        ALA 856  -0.139  22.881  -0.850
  152    HA   ALA 856           HA       ALA 856   1.789  20.864  -0.297
  153    HB1  ALA 856           HB1      ALA 856   0.125  20.000   1.278
  154    HB2  ALA 856           HB2      ALA 856  -1.089  21.069   0.593
  155    HB3  ALA 856           HB3      ALA 856   0.286  21.749   1.468
  156    H    TYR 857           H        TYR 857   1.796  18.829  -1.044
  157    HA   TYR 857           HA       TYR 857   0.129  18.306  -3.326
  158    HD1  TYR 857           HD2      TYR 857   1.636  17.164  -5.643
  159    HD2  TYR 857           HD1      TYR 857   3.974  18.596  -2.392
  160    HE1  TYR 857           HE2      TYR 857   3.053  18.382  -7.214
  161    HE2  TYR 857           HE1      TYR 857   5.410  19.823  -3.969
  162    HH   TYR 857           HH       TYR 857   4.548  20.341  -7.177
  163    HB2  TYR 857           HB2      TYR 857   2.382  16.787  -2.069
  164    HB3  TYR 857           HB1      TYR 857   1.444  16.138  -3.406
  165    H    VAL 858           H        VAL 858  -0.276  17.938  -0.183
  166    HA   VAL 858           HA       VAL 858  -1.884  15.524  -0.316
  167    HB   VAL 858           HB       VAL 858  -1.580  17.451   1.999
  168   HG11  VAL 858          HG11      VAL 858  -3.562  16.068   2.155
  169   HG12  VAL 858          HG12      VAL 858  -2.363  15.557   3.348
  170   HG13  VAL 858          HG13      VAL 858  -2.595  14.620   1.875
  171   HG21  VAL 858          HG21      VAL 858  -0.084  14.895   1.452
  172   HG22  VAL 858          HG22      VAL 858  -0.007  15.830   2.943
  173   HG23  VAL 858          HG23      VAL 858   0.594  16.527   1.432
  174    H    ILE 859           H        ILE 859  -3.777  15.753  -1.227
  175    HA   ILE 859           HA       ILE 859  -5.387  18.155  -0.650
  176    HB   ILE 859           HB       ILE 859  -6.559  17.805  -2.793
  177   HG12  ILE 859          HG12      ILE 859  -4.461  15.690  -3.375
  178   HG13  ILE 859          HG11      ILE 859  -6.134  15.350  -2.951
  179   HG21  ILE 859          HG21      ILE 859  -4.771  18.547  -4.309
  180   HG22  ILE 859          HG22      ILE 859  -3.573  18.076  -3.104
  181   HG23  ILE 859          HG23      ILE 859  -4.716  19.373  -2.752
  182   HD11  ILE 859          HD11      ILE 859  -5.782  15.158  -5.339
  183   HD12  ILE 859          HD12      ILE 859  -5.184  16.815  -5.404
  184   HD13  ILE 859          HD13      ILE 859  -6.866  16.502  -4.984
  185    H    ARG 860           H        ARG 860  -7.793  17.611  -0.896
  186    HA   ARG 860           HA       ARG 860  -8.248  14.996   0.330
  187    HE   ARG 860           HE       ARG 860  -8.216  17.946   4.350
  188    HB2  ARG 860           HB2      ARG 860  -9.890  17.517   0.445
  189    HB3  ARG 860           HB1      ARG 860 -10.443  15.963   1.040
  190    HG2  ARG 860           HG2      ARG 860  -8.610  15.898   2.606
  191    HG3  ARG 860           HG1      ARG 860  -8.033  17.467   2.022
  192    HD2  ARG 860           HD2      ARG 860 -10.159  18.476   2.722
  193    HD3  ARG 860           HD1      ARG 860 -10.703  16.904   3.310
  194   HH11  ARG 860          HH11      ARG 860 -11.682  17.497   4.942
  195   HH12  ARG 860          HH12      ARG 860 -11.544  17.598   6.634
  196   HH21  ARG 860          HH21      ARG 860  -8.034  18.101   6.622
  197   HH22  ARG 860          HH22      ARG 860  -9.389  17.937   7.639
  198    H    ASP 861           H        ASP 861  -9.739  13.614  -0.473
  199    HA   ASP 861           HA       ASP 861 -10.669  14.152  -3.178
  200    HB2  ASP 861           HB2      ASP 861 -11.197  11.792  -3.324
  201    HB3  ASP 861           HB1      ASP 861  -9.629  11.919  -2.551
  202    H    GLU 862           H        GLU 862 -13.048  12.776  -3.247
  203    HA   GLU 862           HA       GLU 862 -14.835  14.723  -2.310
  204    HB2  GLU 862           HB2      GLU 862 -16.604  13.158  -3.063
  205    HB3  GLU 862           HB1      GLU 862 -15.355  13.427  -4.267
  206    HG2  GLU 862           HG2      GLU 862 -14.306  11.289  -3.586
  207    HG3  GLU 862           HG1      GLU 862 -15.658  11.016  -2.494
  208    H    TRP 863           H        TRP 863 -13.735  11.736  -0.878
  209    HA   TRP 863           HA       TRP 863 -15.689  11.770   1.207
  210    HD1  TRP 863           HD       TRP 863 -13.407   8.407  -1.112
  211    HE1  TRP 863           HE1      TRP 863 -15.323   7.391  -2.546
  212    HE3  TRP 863           HE3      TRP 863 -17.265  10.653   1.127
  213    HZ2  TRP 863           HZ2      TRP 863 -18.137   7.569  -2.667
  214    HZ3  TRP 863           HZ3      TRP 863 -19.602  10.215   0.334
  215    HH2  TRP 863           HH       TRP 863 -19.993   8.701  -1.541
  216    HB2  TRP 863           HB2      TRP 863 -13.250  10.051   0.813
  217    HB3  TRP 863           HB1      TRP 863 -14.560   9.751   1.945
  218    H    GLY 864           H        GLY 864 -12.961  13.518   0.637
  219    HA2  GLY 864           HA2      GLY 864 -11.939  15.040   1.981
  220    HA3  GLY 864           HA1      GLY 864 -12.959  14.494   3.297
  221    H    ASN 865           H        ASN 865 -10.819  12.345   1.483
  222    HA   ASN 865           HA       ASN 865  -9.344  11.853   3.972
  223    HB2  ASN 865           HB2      ASN 865  -9.059  10.453   1.292
  224    HB3  ASN 865           HB1      ASN 865  -8.351   9.947   2.814
  225   HD21  ASN 865          HD21      ASN 865 -11.145  10.008   0.831
  226   HD22  ASN 865          HD22      ASN 865 -12.066   8.874   1.762
  227    H    GLN 866           H        GLN 866  -6.949  11.706   3.773
  228    HA   GLN 866           HA       GLN 866  -5.933  13.915   2.215
  229    HB2  GLN 866           HB2      GLN 866  -4.614  12.030   4.170
  230    HB3  GLN 866           HB1      GLN 866  -3.729  13.239   3.263
  231    HG2  GLN 866           HG2      GLN 866  -4.963  14.974   4.259
  232    HG3  GLN 866           HG1      GLN 866  -5.987  13.833   5.152
  233   HE21  GLN 866          HE21      GLN 866  -2.884  15.388   4.998
  234   HE22  GLN 866          HE22      GLN 866  -2.276  14.805   6.490
  235    H    ILE 867           H        ILE 867  -5.253  13.688   0.302
  236    HA   ILE 867           HA       ILE 867  -4.398  11.045  -0.679
  237    HB   ILE 867           HB       ILE 867  -5.531  13.355  -2.283
  238   HG12  ILE 867          HG12      ILE 867  -7.298  12.452  -0.830
  239   HG13  ILE 867          HG11      ILE 867  -7.596  12.057  -2.517
  240   HG21  ILE 867          HG21      ILE 867  -5.751  11.687  -4.083
  241   HG22  ILE 867          HG22      ILE 867  -4.956  10.498  -3.042
  242   HG23  ILE 867          HG23      ILE 867  -4.079  11.924  -3.575
  243   HD11  ILE 867          HD11      ILE 867  -6.485  10.196  -0.427
  244   HD12  ILE 867          HD12      ILE 867  -6.777   9.790  -2.118
  245   HD13  ILE 867          HD13      ILE 867  -8.132  10.193  -1.060
  246    H    TRP 868           H        TRP 868  -2.382  10.972  -1.421
  247    HA   TRP 868           HA       TRP 868  -0.826  13.437  -1.363
  248    HD1  TRP 868           HD       TRP 868   2.067  13.185   0.359
  249    HE1  TRP 868           HE1      TRP 868   1.770  13.309   2.922
  250    HE3  TRP 868           HE3      TRP 868  -2.060  10.246   0.798
  251    HZ2  TRP 868           HZ2      TRP 868  -0.012  12.280   4.864
  252    HZ3  TRP 868           HZ3      TRP 868  -3.007   9.859   3.035
  253    HH2  TRP 868           HH       TRP 868  -2.003  10.857   5.018
  254    HB2  TRP 868           HB2      TRP 868  -0.104  10.550  -1.075
  255    HB3  TRP 868           HB1      TRP 868   1.117  11.736  -1.505
  256    H    ILE 869           H        ILE 869  -0.467  14.391  -3.154
  257    HA   ILE 869           HA       ILE 869  -0.490  12.998  -5.691
  258    HB   ILE 869           HB       ILE 869   0.116  15.890  -5.003
  259   HG12  ILE 869          HG12      ILE 869  -2.216  15.309  -4.472
  260   HG13  ILE 869          HG11      ILE 869  -2.121  16.430  -5.821
  261   HG21  ILE 869          HG21      ILE 869  -0.398  14.627  -7.680
  262   HG22  ILE 869          HG22      ILE 869   1.139  15.273  -7.101
  263   HG23  ILE 869          HG23      ILE 869  -0.224  16.355  -7.386
  264   HD11  ILE 869          HD11      ILE 869  -3.814  14.750  -6.186
  265   HD12  ILE 869          HD12      ILE 869  -2.608  13.478  -5.993
  266   HD13  ILE 869          HD13      ILE 869  -2.511  14.580  -7.367
  267    H    CYS 870           H        CYS 870   1.305  12.155  -6.554
  268    HA   CYS 870           HA       CYS 870   3.868  12.424  -5.362
  269    HB2  CYS 870           HB2      CYS 870   3.211  10.376  -6.523
  270    HB3  CYS 870           HB1      CYS 870   2.929  11.266  -8.002
  271    HA   PRO 871           HA       PRO 871   4.768  16.176  -7.711
  272    HB2  PRO 871           HB2      PRO 871   7.527  15.838  -6.766
  273    HB3  PRO 871           HB1      PRO 871   6.403  17.163  -6.450
  274    HG2  PRO 871           HG2      PRO 871   7.106  15.408  -4.535
  275    HG3  PRO 871           HG1      PRO 871   5.483  16.117  -4.610
  276    HD2  PRO 871           HD2      PRO 871   6.417  13.406  -5.492
  277    HD3  PRO 871           HD1      PRO 871   4.937  13.873  -4.616
  278    H    GLY 872           H        GLY 872   5.873  13.059  -8.233
  279    HA2  GLY 872           HA2      GLY 872   7.829  13.634 -10.235
  280    HA3  GLY 872           HA1      GLY 872   7.075  12.075  -9.923
  281    H    CYS 873           H        CYS 873   4.486  12.300 -10.444
  282    HA   CYS 873           HA       CYS 873   4.404  12.940 -13.278
  283    HB2  CYS 873           HB2      CYS 873   2.394  11.410 -12.887
  284    HB3  CYS 873           HB1      CYS 873   4.022  10.718 -12.752
  285    H    ASN 874           H        ASN 874   3.035  13.523 -10.167
  286    HA   ASN 874           HA       ASN 874   1.592  14.866  -9.242
  287    HB2  ASN 874           HB2      ASN 874   1.066  16.035 -11.992
  288    HB3  ASN 874           HB1      ASN 874   0.276  16.611 -10.523
  289   HD21  ASN 874          HD21      ASN 874   2.779  16.147  -8.918
  290   HD22  ASN 874          HD22      ASN 874   3.819  17.445  -9.366
  291    H    LYS 875           H        LYS 875   1.258  12.312 -10.034
  292    HA   LYS 875           HA       LYS 875  -1.614  12.032 -10.252
  293    HB2  LYS 875           HB2      LYS 875  -0.578  10.635 -11.711
  294    HB3  LYS 875           HB1      LYS 875   0.768  10.270 -10.628
  295    HG2  LYS 875           HG2      LYS 875  -0.848   8.939  -9.274
  296    HG3  LYS 875           HG1      LYS 875  -2.051   9.211 -10.544
  297    HD2  LYS 875           HD2      LYS 875   0.643   8.013 -11.012
  298    HD3  LYS 875           HD1      LYS 875  -0.800   7.014 -10.713
  299    HE2  LYS 875           HE2      LYS 875  -1.838   8.124 -12.704
  300    HE3  LYS 875           HE1      LYS 875  -0.303   8.947 -12.978
  301    HZ1  LYS 875           HZ1      LYS 875  -0.763   6.018 -13.044
  302    HZ2  LYS 875           HZ2      LYS 875   0.740   6.757 -13.269
  303    HZ3  LYS 875           HZ3      LYS 875  -0.486   6.995 -14.375
  304    HA   PRO 876           HA       PRO 876  -1.880  11.537  -5.827
  305    HB2  PRO 876           HB2      PRO 876  -4.318  10.366  -5.748
  306    HB3  PRO 876           HB1      PRO 876  -4.107  12.077  -6.120
  307    HG2  PRO 876           HG2      PRO 876  -4.576   9.774  -7.957
  308    HG3  PRO 876           HG1      PRO 876  -5.259  11.410  -8.012
  309    HD2  PRO 876           HD2      PRO 876  -3.163  10.582  -9.577
  310    HD3  PRO 876           HD1      PRO 876  -3.373  12.260  -9.113
  311    H    ASP 877           H        ASP 877  -2.537   9.752  -4.188
  312    HA   ASP 877           HA       ASP 877  -1.241   7.346  -4.891
  313    HB2  ASP 877           HB2      ASP 877  -1.943   6.506  -2.604
  314    HB3  ASP 877           HB1      ASP 877  -1.007   7.987  -2.577
  315    H    ASP 878           H        ASP 878  -2.068   6.380  -6.418
  316    HA   ASP 878           HA       ASP 878  -4.907   5.788  -6.649
  317    HB2  ASP 878           HB2      ASP 878  -3.620   6.488  -8.619
  318    HB3  ASP 878           HB1      ASP 878  -2.554   5.109  -8.426
  319    H    GLY 879           H        GLY 879  -2.162   4.383  -5.387
  320    HA2  GLY 879           HA2      GLY 879  -2.499   2.295  -4.095
  321    HA3  GLY 879           HA1      GLY 879  -3.356   1.679  -5.501
  322    H    SER 880           H        SER 880  -0.519   3.608  -5.840
  323    HA   SER 880           HA       SER 880   0.926   1.300  -6.867
  324    HG   SER 880           HG       SER 880  -0.390   2.841  -8.254
  325    HB2  SER 880           HB2      SER 880   1.470   4.244  -7.221
  326    HB3  SER 880           HB1      SER 880   2.303   2.925  -8.038
  327    HA   PRO 881           HA       PRO 881   3.665   1.579  -3.391
  328    HB2  PRO 881           HB2      PRO 881   5.895   1.142  -5.295
  329    HB3  PRO 881           HB1      PRO 881   5.430   0.191  -3.882
  330    HG2  PRO 881           HG2      PRO 881   4.937  -0.774  -6.289
  331    HG3  PRO 881           HG1      PRO 881   3.713  -0.897  -5.018
  332    HD2  PRO 881           HD2      PRO 881   3.894   1.115  -7.233
  333    HD3  PRO 881           HD1      PRO 881   2.491   0.151  -6.714
  334    H    MET 882           H        MET 882   4.376   3.245  -2.417
  335    HA   MET 882           HA       MET 882   5.686   5.447  -3.890
  336    HB2  MET 882           HB2      MET 882   3.902   5.818  -1.474
  337    HB3  MET 882           HB1      MET 882   4.572   7.067  -2.509
  338    HG2  MET 882           HG2      MET 882   3.185   6.190  -4.354
  339    HG3  MET 882           HG1      MET 882   2.466   5.066  -3.190
  340    HE1  MET 882           HE1      MET 882   2.636   8.740  -4.518
  341    HE2  MET 882           HE2      MET 882   3.475   8.887  -2.977
  342    HE3  MET 882           HE3      MET 882   1.897   9.655  -3.201
  343    H    ILE 883           H        ILE 883   7.189   6.618  -2.668
  344    HA   ILE 883           HA       ILE 883   8.058   5.325  -0.201
  345    HB   ILE 883           HB       ILE 883   9.562   4.638  -2.074
  346   HG12  ILE 883          HG12      ILE 883  11.004   6.558  -0.244
  347   HG13  ILE 883          HG11      ILE 883  10.439   4.967   0.268
  348   HG21  ILE 883          HG21      ILE 883   9.303   6.598  -3.519
  349   HG22  ILE 883          HG22      ILE 883  11.009   6.296  -3.173
  350   HG23  ILE 883          HG23      ILE 883  10.163   7.590  -2.335
  351   HD11  ILE 883          HD11      ILE 883  12.810   4.966  -0.308
  352   HD12  ILE 883          HD12      ILE 883  12.414   5.530  -1.930
  353   HD13  ILE 883          HD13      ILE 883  11.883   3.937  -1.401
  354    H    GLY 884           H        GLY 884   8.570   6.714   1.403
  355    HA2  GLY 884           HA2      GLY 884   8.059   9.526   0.853
  356    HA3  GLY 884           HA1      GLY 884   8.112   8.760   2.440
  357    H    CYS 885           H        CYS 885   9.537  11.055   1.015
  358    HA   CYS 885           HA       CYS 885  12.301  10.317   1.194
  359    HB2  CYS 885           HB2      CYS 885  11.614  12.057  -0.329
  360    HB3  CYS 885           HB1      CYS 885  10.940  13.021   0.972
  361    H    ASP 886           H        ASP 886  13.684  10.742   2.803
  362    HA   ASP 886           HA       ASP 886  12.477  10.929   5.407
  363    HB2  ASP 886           HB2      ASP 886  15.229  10.263   4.453
  364    HB3  ASP 886           HB1      ASP 886  14.907  10.549   6.148
  365    H    ASP 887           H        ASP 887  13.803  13.123   3.234
  366    HA   ASP 887           HA       ASP 887  14.950  14.740   5.387
  367    HB2  ASP 887           HB2      ASP 887  16.178  14.627   3.206
  368    HB3  ASP 887           HB1      ASP 887  14.825  15.458   2.449
  369    H    CYS 888           H        CYS 888  12.609  15.131   2.798
  370    HA   CYS 888           HA       CYS 888  11.478  17.357   4.220
  371    HB2  CYS 888           HB2      CYS 888   9.835  17.473   2.292
  372    HB3  CYS 888           HB1      CYS 888  11.519  17.693   1.855
  373    H    ASP 889           H        ASP 889   9.676  14.880   2.693
  374    HA   ASP 889           HA       ASP 889   8.688  13.151   4.562
  375    HB2  ASP 889           HB2      ASP 889   8.018  15.230   5.945
  376    HB3  ASP 889           HB1      ASP 889   6.821  15.567   4.703
  377    H    ASP 890           H        ASP 890   8.703  14.389   1.589
  378    HA   ASP 890           HA       ASP 890   5.956  14.251   0.876
  379    HB2  ASP 890           HB2      ASP 890   7.919  15.762  -0.029
  380    HB3  ASP 890           HB1      ASP 890   8.230  14.374  -1.056
  381    H    TRP 891           H        TRP 891   5.441  12.920  -1.066
  382    HA   TRP 891           HA       TRP 891   6.595  10.269  -0.748
  383    HD1  TRP 891           HD       TRP 891   3.843  11.829   1.721
  384    HE1  TRP 891           HE1      TRP 891   3.988  10.526   3.925
  385    HE3  TRP 891           HE3      TRP 891   5.188   7.291  -0.142
  386    HZ2  TRP 891           HZ2      TRP 891   4.596   7.898   4.768
  387    HZ3  TRP 891           HZ3      TRP 891   5.531   5.422   1.414
  388    HH2  TRP 891           HH       TRP 891   5.245   5.735   3.836
  389    HB2  TRP 891           HB2      TRP 891   3.657  10.966  -0.822
  390    HB3  TRP 891           HB1      TRP 891   4.251   9.350  -1.162
  391    H    TYR 892           H        TYR 892   7.276   9.547  -2.647
  392    HA   TYR 892           HA       TYR 892   6.014  10.548  -5.122
  393    HD1  TYR 892           HD1      TYR 892   8.702  11.448  -2.779
  394    HD2  TYR 892           HD2      TYR 892   8.669  12.177  -6.963
  395    HE1  TYR 892           HE1      TYR 892   9.584  13.674  -2.383
  396    HE2  TYR 892           HE2      TYR 892   9.544  14.438  -6.578
  397    HH   TYR 892           HH       TYR 892  10.899  15.295  -3.627
  398    HB2  TYR 892           HB2      TYR 892   8.840   9.580  -4.649
  399    HB3  TYR 892           HB1      TYR 892   8.182  10.048  -6.202
  400    H    HIS 893           H        HIS 893   5.882   8.958  -6.774
  401    HA   HIS 893           HA       HIS 893   5.528   6.266  -5.732
  402    HD2  HIS 893           HD2      HIS 893   2.648   5.591  -6.114
  403    HE1  HIS 893           HE1      HIS 893   1.007   9.048  -7.910
  404    HE2  HIS 893           HE2      HIS 893   0.746   7.380  -6.093
  405    HB2  HIS 893           HB2      HIS 893   5.247   7.214  -8.602
  406    HB3  HIS 893           HB1      HIS 893   4.879   5.594  -8.042
  407    H    TRP 894           H        TRP 894   6.577   4.417  -6.642
  408    HA   TRP 894           HA       TRP 894   9.342   4.669  -6.556
  409    HD1  TRP 894           HD       TRP 894   8.392   4.340  -4.493
  410    HE1  TRP 894           HE1      TRP 894   8.286   2.943  -2.352
  411    HE3  TRP 894           HE3      TRP 894   8.506  -0.294  -6.592
  412    HZ2  TRP 894           HZ2      TRP 894   8.239   0.193  -1.649
  413    HZ3  TRP 894           HZ3      TRP 894   8.427  -2.253  -5.130
  414    HH2  TRP 894           HH       TRP 894   8.301  -2.015  -2.708
  415    HB2  TRP 894           HB2      TRP 894   7.603   2.375  -7.388
  416    HB3  TRP 894           HB1      TRP 894   9.354   2.265  -7.349
  417    HA   PRO 895           HA       PRO 895   9.528   3.812 -11.319
  418    HB2  PRO 895           HB2      PRO 895   7.344   4.618 -12.791
  419    HB3  PRO 895           HB1      PRO 895   7.610   2.957 -12.253
  420    HG2  PRO 895           HG2      PRO 895   5.936   5.103 -11.003
  421    HG3  PRO 895           HG1      PRO 895   5.532   3.398 -11.288
  422    HD2  PRO 895           HD2      PRO 895   6.289   4.223  -8.878
  423    HD3  PRO 895           HD1      PRO 895   6.847   2.663  -9.522
  424    H    CYS 896           H        CYS 896   8.029   6.481  -9.800
  425    HA   CYS 896           HA       CYS 896   8.573   8.430 -11.808
  426    HB2  CYS 896           HB2      CYS 896   7.773   8.716  -8.926
  427    HB3  CYS 896           HB1      CYS 896   7.653   9.968 -10.176
  428    H    VAL 897           H        VAL 897  10.162   7.188  -8.979
  429    HA   VAL 897           HA       VAL 897  12.241   9.239  -9.297
  430    HB   VAL 897           HB       VAL 897  12.969   8.700  -6.972
  431   HG11  VAL 897          HG11      VAL 897  11.583  10.637  -7.427
  432   HG12  VAL 897          HG12      VAL 897  11.075   9.903  -5.902
  433   HG13  VAL 897          HG13      VAL 897  10.134   9.642  -7.365
  434   HG21  VAL 897          HG21      VAL 897  10.373   7.153  -6.877
  435   HG22  VAL 897          HG22      VAL 897  11.436   7.481  -5.501
  436   HG23  VAL 897          HG23      VAL 897  11.989   6.458  -6.824
  437    H    GLY 898           H        GLY 898  11.701   5.882  -9.524
  438    HA2  GLY 898           HA2      GLY 898  13.282   4.595 -10.787
  439    HA3  GLY 898           HA1      GLY 898  14.573   5.570 -10.097
  440    H    ILE 899           H        ILE 899  11.960   4.324  -8.187
  441    HA   ILE 899           HA       ILE 899  13.864   2.587  -6.790
  442    HB   ILE 899           HB       ILE 899  11.132   3.667  -5.989
  443   HG12  ILE 899          HG12      ILE 899  13.114   5.201  -5.778
  444   HG13  ILE 899          HG11      ILE 899  12.231   4.910  -4.283
  445   HG21  ILE 899          HG21      ILE 899  11.315   1.380  -5.149
  446   HG22  ILE 899          HG22      ILE 899  11.412   2.536  -3.818
  447   HG23  ILE 899          HG23      ILE 899  12.875   1.759  -4.417
  448   HD11  ILE 899          HD11      ILE 899  14.838   3.635  -5.082
  449   HD12  ILE 899          HD12      ILE 899  13.944   3.383  -3.568
  450   HD13  ILE 899          HD13      ILE 899  14.607   4.970  -3.942
  451    H    MET 900           H        MET 900  13.727   0.444  -7.124
  452    HA   MET 900           HA       MET 900  11.323  -0.540  -8.498
  453    HB2  MET 900           HB2      MET 900  12.710  -2.395  -9.421
  454    HB3  MET 900           HB1      MET 900  13.204  -0.806  -9.965
  455    HG2  MET 900           HG2      MET 900  15.072  -0.843  -8.392
  456    HG3  MET 900           HG1      MET 900  14.562  -2.435  -7.826
  457    HE1  MET 900           HE1      MET 900  17.503  -1.634  -8.954
  458    HE2  MET 900           HE2      MET 900  17.884  -3.076  -9.896
  459    HE3  MET 900           HE3      MET 900  17.120  -3.232  -8.318
  460    H    ALA 901           H        ALA 901  13.321  -0.976  -5.735
  461    HA   ALA 901           HA       ALA 901  11.324  -2.816  -4.724
  462    HB1  ALA 901           HB1      ALA 901  14.303  -3.256  -4.457
  463    HB2  ALA 901           HB2      ALA 901  13.199  -4.238  -5.422
  464    HB3  ALA 901           HB3      ALA 901  13.050  -4.209  -3.665
  465    H    ALA 902           H        ALA 902  11.045  -2.624  -2.527
  466    HA   ALA 902           HA       ALA 902  11.410  -0.013  -1.540
  467    HB1  ALA 902           HB1      ALA 902   9.470  -1.374  -0.995
  468    HB2  ALA 902           HB2      ALA 902  10.312  -0.851   0.467
  469    HB3  ALA 902           HB3      ALA 902  10.507  -2.503  -0.127
  470    HA   PRO 903           HA       PRO 903  15.211  -0.954   0.648
  471    HB2  PRO 903           HB2      PRO 903  15.593   1.686   1.487
  472    HB3  PRO 903           HB1      PRO 903  16.277   0.980   0.024
  473    HG2  PRO 903           HG2      PRO 903  14.239   2.968   0.284
  474    HG3  PRO 903           HG1      PRO 903  14.961   2.345  -1.207
  475    HD2  PRO 903           HD2      PRO 903  12.371   1.738  -0.013
  476    HD3  PRO 903           HD1      PRO 903  12.980   1.330  -1.625
  477    HA   PRO 904           HA       PRO 904  13.351  -1.238   4.628
  478    HB2  PRO 904           HB2      PRO 904  15.426  -1.131   6.294
  479    HB3  PRO 904           HB1      PRO 904  15.160  -2.534   5.264
  480    HG2  PRO 904           HG2      PRO 904  17.036  -0.235   4.871
  481    HG3  PRO 904           HG1      PRO 904  17.331  -1.962   4.613
  482    HD2  PRO 904           HD2      PRO 904  16.743  -0.251   2.575
  483    HD3  PRO 904           HD1      PRO 904  16.241  -1.953   2.539
  484    H    GLU 905           H        GLU 905  12.985  -0.066   6.687
  485    HA   GLU 905           HA       GLU 905  13.052   2.748   6.180
  486    HB2  GLU 905           HB2      GLU 905  11.790   3.039   8.220
  487    HB3  GLU 905           HB1      GLU 905  11.112   1.719   7.293
  488    HG2  GLU 905           HG2      GLU 905  12.111   0.110   8.770
  489    HG3  GLU 905           HG1      GLU 905  12.948   1.390   9.649
  490    H    GLU 906           H        GLU 906  15.100   0.556   7.762
  491    HA   GLU 906           HA       GLU 906  16.431   2.430   9.464
  492    HB2  GLU 906           HB2      GLU 906  18.191   0.704   9.652
  493    HB3  GLU 906           HB1      GLU 906  16.588   0.038   9.928
  494    HG2  GLU 906           HG2      GLU 906  16.537  -0.890   7.745
  495    HG3  GLU 906           HG1      GLU 906  18.077  -0.141   7.320
  496    H    MET 907           H        MET 907  16.353   1.919   6.151
  497    HA   MET 907           HA       MET 907  18.863   3.356   5.739
  498    HB2  MET 907           HB2      MET 907  18.615   1.369   4.359
  499    HB3  MET 907           HB1      MET 907  17.029   1.918   3.826
  500    HG2  MET 907           HG2      MET 907  18.717   2.226   2.090
  501    HG3  MET 907           HG1      MET 907  18.044   3.762   2.624
  502    HE1  MET 907           HE1      MET 907  20.681   3.574   0.878
  503    HE2  MET 907           HE2      MET 907  21.684   4.769   1.702
  504    HE3  MET 907           HE3      MET 907  19.969   5.077   1.462
  505    H    GLN 908           H        GLN 908  18.820   5.328   4.922
  506    HA   GLN 908           HA       GLN 908  16.204   6.598   4.810
  507    HB2  GLN 908           HB2      GLN 908  18.940   7.840   5.007
  508    HB3  GLN 908           HB1      GLN 908  17.480   8.761   4.722
  509    HG2  GLN 908           HG2      GLN 908  16.564   7.886   6.852
  510    HG3  GLN 908           HG1      GLN 908  18.130   7.132   7.158
  511   HE21  GLN 908          HE21      GLN 908  16.417  10.102   6.858
  512   HE22  GLN 908          HE22      GLN 908  17.590  11.126   7.602
  513    H    TRP 909           H        TRP 909  15.712   8.007   3.189
  514    HA   TRP 909           HA       TRP 909  17.191   7.784   0.709
  515    HD1  TRP 909           HD       TRP 909  16.659   5.983  -1.868
  516    HE1  TRP 909           HE1      TRP 909  15.663   6.846  -4.099
  517    HE3  TRP 909           HE3      TRP 909  12.809   8.752  -0.010
  518    HZ2  TRP 909           HZ2      TRP 909  13.496   8.479  -4.931
  519    HZ3  TRP 909           HZ3      TRP 909  11.337   9.941  -1.557
  520    HH2  TRP 909           HH       TRP 909  11.675   9.814  -3.967
  521    HB2  TRP 909           HB2      TRP 909  15.613   5.886   0.613
  522    HB3  TRP 909           HB1      TRP 909  14.278   6.975   0.968
  523    H    PHE 910           H        PHE 910  16.764   9.496  -0.644
  524    HA   PHE 910           HA       PHE 910  15.071  11.586   0.443
  525    HD1  PHE 910           HD1      PHE 910  15.940  12.811   2.502
  526    HD2  PHE 910           HD2      PHE 910  19.431  10.981   0.935
  527    HE1  PHE 910           HE1      PHE 910  16.713  12.359   4.785
  528    HE2  PHE 910           HE2      PHE 910  20.215  10.511   3.214
  529    HZ   PHE 910           HZ       PHE 910  18.830  11.199   5.153
  530    HB2  PHE 910           HB2      PHE 910  17.922  11.984  -0.508
  531    HB3  PHE 910           HB1      PHE 910  16.845  13.237   0.110
  532    H    CYS 911           H        CYS 911  14.011  12.598  -1.098
  533    HA   CYS 911           HA       CYS 911  13.866  11.427  -3.645
  534    HB2  CYS 911           HB2      CYS 911  12.204  13.172  -4.160
  535    HB3  CYS 911           HB1      CYS 911  11.926  12.428  -2.610
  536    HA   PRO 912           HA       PRO 912  16.757  13.432  -6.311
  537    HB2  PRO 912           HB2      PRO 912  15.088  14.504  -8.277
  538    HB3  PRO 912           HB1      PRO 912  15.765  12.877  -8.270
  539    HG2  PRO 912           HG2      PRO 912  13.067  13.801  -7.372
  540    HG3  PRO 912           HG1      PRO 912  13.514  12.321  -8.241
  541    HD2  PRO 912           HD2      PRO 912  12.966  12.222  -5.660
  542    HD3  PRO 912           HD1      PRO 912  14.326  11.294  -6.312
  543    H    LYS 913           H        LYS 913  14.190  15.336  -4.989
  544    HA   LYS 913           HA       LYS 913  15.388  17.881  -5.717
  545    HB2  LYS 913           HB2      LYS 913  13.203  17.214  -3.729
  546    HB3  LYS 913           HB1      LYS 913  13.741  18.839  -4.101
  547    HG2  LYS 913           HG2      LYS 913  12.946  18.579  -6.396
  548    HG3  LYS 913           HG1      LYS 913  12.426  16.932  -6.029
  549    HD2  LYS 913           HD2      LYS 913  10.900  17.770  -4.329
  550    HD3  LYS 913           HD1      LYS 913  11.441  19.418  -4.630
  551    HE2  LYS 913           HE2      LYS 913  10.092  17.647  -6.662
  552    HE3  LYS 913           HE1      LYS 913   9.264  18.857  -5.690
  553    HZ1  LYS 913           HZ1      LYS 913   9.778  19.706  -7.866
  554    HZ2  LYS 913           HZ2      LYS 913  11.418  19.411  -7.684
  555    HZ3  LYS 913           HZ3      LYS 913  10.650  20.564  -6.720
  556    H    CYS 914           H        CYS 914  14.918  15.971  -2.783
  557    HA   CYS 914           HA       CYS 914  16.463  17.710  -1.176
  558    HB2  CYS 914           HB2      CYS 914  15.245  15.029  -0.697
  559    HB3  CYS 914           HB1      CYS 914  16.161  15.878   0.539
  560    H    ALA 915           H        ALA 915  17.135  14.658  -2.741
  561    HA   ALA 915           HA       ALA 915  19.604  14.252  -1.434
  562    HB1  ALA 915           HB1      ALA 915  18.342  12.475  -2.514
  563    HB2  ALA 915           HB2      ALA 915  20.001  12.549  -3.130
  564    HB3  ALA 915           HB3      ALA 915  18.663  13.192  -4.093
  565    H    ASN 916           H        ASN 916  18.625  16.144  -4.091
  566    HA   ASN 916           HA       ASN 916  21.205  16.441  -5.321
  567    HB2  ASN 916           HB2      ASN 916  19.165  16.615  -6.633
  568    HB3  ASN 916           HB1      ASN 916  18.642  17.994  -5.682
  569   HD21  ASN 916          HD21      ASN 916  19.524  20.017  -6.107
  570   HD22  ASN 916          HD22      ASN 916  20.517  20.324  -7.464
  571    H    LYS 917           H        LYS 917  19.191  18.349  -3.155
  572    HA   LYS 917           HA       LYS 917  20.731  20.731  -3.231
  573    HB2  LYS 917           HB2      LYS 917  19.359  21.501  -1.428
  574    HB3  LYS 917           HB1      LYS 917  18.328  20.575  -2.507
  575    HG2  LYS 917           HG2      LYS 917  18.738  18.614  -0.956
  576    HG3  LYS 917           HG1      LYS 917  19.424  19.801   0.149
  577    HD2  LYS 917           HD2      LYS 917  17.273  21.012   0.140
  578    HD3  LYS 917           HD1      LYS 917  16.593  19.787  -0.931
  579    HE2  LYS 917           HE2      LYS 917  17.286  18.089   0.856
  580    HE3  LYS 917           HE1      LYS 917  17.529  19.479   1.907
  581    HZ1  LYS 917           HZ1      LYS 917  14.993  18.572   0.669
  582    HZ2  LYS 917           HZ2      LYS 917  15.139  20.054   1.478
  583    HZ3  LYS 917           HZ3      LYS 917  15.392  18.594   2.291
  584    H    ILE 918           H        ILE 918  21.258  17.774  -1.679
  585    HA   ILE 918           HA       ILE 918  22.598  18.547   0.664
  586    HB   ILE 918           HB       ILE 918  22.981  16.026  -0.982
  587   HG12  ILE 918          HG12      ILE 918  21.230  16.555   1.435
  588   HG13  ILE 918          HG11      ILE 918  20.673  16.360  -0.223
  589   HG21  ILE 918          HG21      ILE 918  23.882  15.021   1.079
  590   HG22  ILE 918          HG22      ILE 918  23.765  16.585   1.883
  591   HG23  ILE 918          HG23      ILE 918  24.868  16.375   0.527
  592   HD11  ILE 918          HD11      ILE 918  21.471  14.049  -0.216
  593   HD12  ILE 918          HD12      ILE 918  20.298  14.340   1.068
  594   HD13  ILE 918          HD13      ILE 918  22.020  14.244   1.450
  595    H    LYS 919           H        LYS 919  23.774  17.999  -2.616
  596    HA   LYS 919           HA       LYS 919  26.068  19.641  -2.219
  597    HB2  LYS 919           HB2      LYS 919  26.839  17.642  -0.959
  598    HB3  LYS 919           HB1      LYS 919  26.625  16.682  -2.412
  599    HG2  LYS 919           HG2      LYS 919  28.280  18.152  -3.555
  600    HG3  LYS 919           HG1      LYS 919  28.580  18.928  -2.003
  601    HD2  LYS 919           HD2      LYS 919  29.272  16.767  -1.066
  602    HD3  LYS 919           HD1      LYS 919  28.981  16.003  -2.631
  603    HE2  LYS 919           HE2      LYS 919  30.627  17.549  -3.638
  604    HE3  LYS 919           HE1      LYS 919  30.973  18.178  -2.030
  605    HZ1  LYS 919           HZ1      LYS 919  31.430  15.422  -3.014
  606    HZ2  LYS 919           HZ2      LYS 919  31.629  15.875  -1.410
  607    HZ3  LYS 919           HZ3      LYS 919  32.607  16.548  -2.603
  608    H    LYS 920           H        LYS 920  24.738  16.911  -4.015
  609    HA   LYS 920           HA       LYS 920  25.066  16.114  -6.018
  610    HB2  LYS 920           HB2      LYS 920  24.436  17.551  -7.967
  611    HB3  LYS 920           HB1      LYS 920  23.285  17.633  -6.653
  612    HG2  LYS 920           HG2      LYS 920  24.140  19.823  -6.039
  613    HG3  LYS 920           HG1      LYS 920  25.372  19.705  -7.300
  614    HD2  LYS 920           HD2      LYS 920  23.668  19.638  -9.009
  615    HD3  LYS 920           HD1      LYS 920  22.399  19.625  -7.783
  616    HE2  LYS 920           HE2      LYS 920  22.606  21.848  -8.681
  617    HE3  LYS 920           HE1      LYS 920  23.171  21.817  -7.014
  618    HZ1  LYS 920           HZ1      LYS 920  25.439  21.796  -7.806
  619    HZ2  LYS 920           HZ2      LYS 920  24.613  23.110  -8.466
  620    HZ3  LYS 920           HZ3      LYS 920  24.915  21.753  -9.399
  621    H    ASP 921           H        ASP 921  26.977  15.412  -5.749
  622    HA   ASP 921           HA       ASP 921  29.384  16.883  -6.060
  623    HB2  ASP 921           HB2      ASP 921  28.959  14.726  -4.744
  624    HB3  ASP 921           HB1      ASP 921  29.055  13.901  -6.293
  625    H    LYS 922           H        LYS 922  30.830  16.859  -7.793
  626    HA   LYS 922           HA       LYS 922  29.666  16.558 -10.396
  627    HB2  LYS 922           HB2      LYS 922  32.447  17.309  -9.519
  628    HB3  LYS 922           HB1      LYS 922  31.964  17.226 -11.201
  629    HG2  LYS 922           HG2      LYS 922  30.788  19.053  -9.109
  630    HG3  LYS 922           HG1      LYS 922  31.943  19.519 -10.354
  631    HD2  LYS 922           HD2      LYS 922  29.116  18.518 -10.805
  632    HD3  LYS 922           HD1      LYS 922  29.685  20.171 -10.996
  633    HE2  LYS 922           HE2      LYS 922  30.576  17.785 -12.644
  634    HE3  LYS 922           HE1      LYS 922  29.454  19.033 -13.162
  635    HZ1  LYS 922           HZ1      LYS 922  31.246  20.661 -12.952
  636    HZ2  LYS 922           HZ2      LYS 922  31.643  19.439 -14.041
  637    HZ3  LYS 922           HZ3      LYS 922  32.329  19.445 -12.509
  638    H    LYS 923           H        LYS 923  31.350  14.502  -8.305
  639    HA   LYS 923           HA       LYS 923  32.225  12.760 -10.447
  640    HB2  LYS 923           HB2      LYS 923  32.468  12.564  -7.440
  641    HB3  LYS 923           HB1      LYS 923  33.048  11.336  -8.548
  642    HG2  LYS 923           HG2      LYS 923  34.007  14.191  -8.415
  643    HG3  LYS 923           HG1      LYS 923  34.849  12.784  -7.761
  644    HD2  LYS 923           HD2      LYS 923  35.006  11.838 -10.025
  645    HD3  LYS 923           HD1      LYS 923  34.185  13.252 -10.671
  646    HE2  LYS 923           HE2      LYS 923  36.841  13.231  -9.255
  647    HE3  LYS 923           HE1      LYS 923  36.592  13.404 -10.986
  648    HZ1  LYS 923           HZ1      LYS 923  35.676  15.334  -8.917
  649    HZ2  LYS 923           HZ2      LYS 923  35.399  15.481 -10.565
  650    HZ3  LYS 923           HZ3      LYS 923  36.968  15.534  -9.962
  651    H    HIS 924           H        HIS 924  30.713  11.618 -11.330
  652    HA   HIS 924           HA       HIS 924  28.987   9.997  -9.677
  653    HD1  HIS 924           HD1      HIS 924  26.317  10.341 -13.113
  654    HD2  HIS 924           HD2      HIS 924  25.998  10.005  -8.993
  655    HE1  HIS 924           HE1      HIS 924  24.270   8.962 -12.725
  656    HE2  HIS 924           HE2      HIS 924  23.917   9.096 -10.236
  657    HB2  HIS 924           HB2      HIS 924  27.671  12.050 -10.202
  658    HB3  HIS 924           HB1      HIS 924  27.965  11.783 -11.912
  Start of MODEL    7
    1    HA   ALA   1           HA       ALA   1  11.689   6.322   3.025
    2    H1   ALA   1           HT1      ALA   1  13.223   5.337   5.360
    3    H2   ALA   1           HT2      ALA   1  11.858   6.273   5.451
    4    H3   ALA   1           HT3      ALA   1  13.183   6.928   4.705
    5    HB1  ALA   1           HB1      ALA   1  13.435   3.872   3.305
    6    HB2  ALA   1           HB2      ALA   1  13.913   5.377   2.528
    7    HB3  ALA   1           HB3      ALA   1  12.595   4.416   1.852
    8    H    ARG   2           H        ARG   2   9.706   6.131   3.970
    9    HA   ARG   2           HA       ARG   2   8.884   3.505   4.887
   10    HE   ARG   2           HE       ARG   2   7.163   6.305   7.767
   11    HB2  ARG   2           HB2      ARG   2   8.169   5.948   5.750
   12    HB3  ARG   2           HB1      ARG   2   7.037   5.792   4.429
   13    HG2  ARG   2           HG2      ARG   2   6.225   3.688   5.402
   14    HG3  ARG   2           HG1      ARG   2   7.316   3.968   6.771
   15    HD2  ARG   2           HD2      ARG   2   5.035   5.719   5.881
   16    HD3  ARG   2           HD1      ARG   2   5.095   4.747   7.353
   17   HH11  ARG   2          HH11      ARG   2   3.926   7.135   6.629
   18   HH12  ARG   2          HH12      ARG   2   4.040   8.777   7.063
   19   HH21  ARG   2          HH21      ARG   2   7.291   8.572   8.433
   20   HH22  ARG   2          HH22      ARG   2   5.987   9.613   8.103
   21    H    THR   3           H        THR   3   7.803   2.161   3.487
   22    HA   THR   3           HA       THR   3   7.073   3.293   0.891
   23    HB   THR   3           HB       THR   3   7.531   0.975   0.004
   24    HG1  THR   3           HG1      THR   3   7.608   0.223   2.356
   25   HG21  THR   3          HG21      THR   3   9.095   2.845  -0.331
   26   HG22  THR   3          HG22      THR   3   9.959   1.322  -0.132
   27   HG23  THR   3          HG23      THR   3   9.874   2.469   1.205
   28    HA   M3L   4           HA       M3L   4   3.500   0.808   1.494
   29    H    M3L   4           H        M3L   4   5.090   2.805   0.111
   30    HB2  M3L   4           HB2      M3L   4   3.114   3.124   2.484
   31    HB3  M3L   4           HB1      M3L   4   1.685   2.322   1.852
   32    HG2  M3L   4           HG2      M3L   4   2.390   3.674  -0.336
   33    HG3  M3L   4           HG1      M3L   4   3.089   4.743   0.875
   34    HD2  M3L   4           HD2      M3L   4   0.683   5.187   0.136
   35    HD3  M3L   4           HD1      M3L   4   0.259   3.757   1.076
   36    HE2  M3L   4           HE2      M3L   4   0.483   4.801   3.005
   37    HE3  M3L   4           HE1      M3L   4   2.028   5.450   2.555
   38   HM11  M3L   4          HM11      M3L   4   0.795   8.577   0.958
   39   HM12  M3L   4          HM12      M3L   4   2.038   7.364   0.859
   40   HM13  M3L   4          HM13      M3L   4   0.588   7.207  -0.078
   41   HM21  M3L   4          HM21      M3L   4  -1.706   6.212   2.626
   42   HM22  M3L   4          HM22      M3L   4  -1.315   5.797   0.986
   43   HM23  M3L   4          HM23      M3L   4  -1.644   7.444   1.397
   44   HM31  M3L   4          HM31      M3L   4  -0.127   8.448   3.329
   45   HM32  M3L   4          HM32      M3L   4   1.503   7.862   3.484
   46   HM33  M3L   4          HM33      M3L   4   0.191   6.976   4.201
   47    H    GLN   5           H        GLN   5   1.500   0.367   0.233
   48    HA   GLN   5           HA       GLN   5   1.431   1.346  -2.494
   49    HB2  GLN   5           HB2      GLN   5   2.877  -0.729  -2.473
   50    HB3  GLN   5           HB1      GLN   5   1.442  -1.608  -1.940
   51    HG2  GLN   5           HG2      GLN   5   0.249  -0.788  -3.913
   52    HG3  GLN   5           HG1      GLN   5   1.735  -0.030  -4.464
   53   HE21  GLN   5          HE21      GLN   5   0.145  -1.934  -5.694
   54   HE22  GLN   5          HE22      GLN   5   1.103  -3.338  -5.975
   55    H    THR   6           H        THR   6  -0.605   1.793  -2.927
   56    HA   THR   6           HA       THR   6  -2.697   1.241  -1.119
   57    HB   THR   6           HB       THR   6  -2.804   2.146  -3.990
   58    HG1  THR   6           HG1      THR   6  -2.942   3.947  -1.871
   59   HG21  THR   6          HG21      THR   6  -4.959   1.460  -3.096
   60   HG22  THR   6          HG22      THR   6  -4.911   3.208  -3.336
   61   HG23  THR   6          HG23      THR   6  -4.756   2.533  -1.708
   62    H    ALA   7           H        ALA   7  -1.906   0.058  -4.375
   63    HA   ALA   7           HA       ALA   7  -2.970  -2.518  -4.059
   64    HB1  ALA   7           HB1      ALA   7  -5.141  -1.392  -4.162
   65    HB2  ALA   7           HB2      ALA   7  -4.805  -2.269  -5.674
   66    HB3  ALA   7           HB3      ALA   7  -4.601  -0.523  -5.612
   67    H    ARG   8           H        ARG   8  -3.408  -3.133  -6.639
   68    HA   ARG   8           HA       ARG   8  -1.305  -1.771  -8.103
   69    HE   ARG   8           HE       ARG   8  -0.104  -5.852  -9.827
   70    HB2  ARG   8           HB2      ARG   8  -0.375  -3.875  -8.949
   71    HB3  ARG   8           HB1      ARG   8  -0.216  -3.721  -7.212
   72    HG2  ARG   8           HG2      ARG   8  -2.107  -5.257  -6.915
   73    HG3  ARG   8           HG1      ARG   8  -2.234  -5.410  -8.670
   74    HD2  ARG   8           HD2      ARG   8   0.129  -6.173  -6.966
   75    HD3  ARG   8           HD1      ARG   8  -0.974  -7.280  -7.784
   76   HH11  ARG   8          HH11      ARG   8   1.743  -7.348  -7.200
   77   HH12  ARG   8          HH12      ARG   8   3.167  -7.475  -8.120
   78   HH21  ARG   8          HH21      ARG   8   1.863  -6.028 -11.057
   79   HH22  ARG   8          HH22      ARG   8   3.239  -6.716 -10.318
   80    H    LYS   9           H        LYS   9  -2.175  -0.911  -9.750
   81    HA   LYS   9           HA       LYS   9  -3.831  -2.609 -11.397
   82    HB2  LYS   9           HB2      LYS   9  -5.149  -0.592 -12.166
   83    HB3  LYS   9           HB1      LYS   9  -5.513  -1.154 -10.555
   84    HG2  LYS   9           HG2      LYS   9  -3.673   1.182 -11.085
   85    HG3  LYS   9           HG1      LYS   9  -5.419   1.369 -10.956
   86    HD2  LYS   9           HD2      LYS   9  -3.633   0.209  -8.805
   87    HD3  LYS   9           HD1      LYS   9  -4.212   1.875  -8.847
   88    HE2  LYS   9           HE2      LYS   9  -5.995  -0.577  -8.698
   89    HE3  LYS   9           HE1      LYS   9  -5.521   0.409  -7.329
   90    HZ1  LYS   9           HZ1      LYS   9  -7.721   0.974  -8.155
   91    HZ2  LYS   9           HZ2      LYS   9  -7.117   1.442  -9.650
   92    HZ3  LYS   9           HZ3      LYS   9  -6.695   2.278  -8.244
   93    H    SER  10           H        SER  10  -2.950  -2.999 -13.177
   94    HA   SER  10           HA       SER  10  -1.302  -0.954 -14.440
   95    HG   SER  10           HG       SER  10   0.941  -1.814 -15.221
   96    HB2  SER  10           HB2      SER  10   0.156  -2.592 -13.296
   97    HB3  SER  10           HB1      SER  10  -0.652  -3.896 -14.161
   98    H    THR  11           H        THR  11  -2.031  -0.562 -16.432
   99    HA   THR  11           HA       THR  11  -3.927  -2.316 -17.663
  100    HB   THR  11           HB       THR  11  -3.777  -0.295 -19.320
  101    HG1  THR  11           HG1      THR  11  -2.809   1.488 -18.435
  102   HG21  THR  11          HG21      THR  11  -4.834   0.023 -16.493
  103   HG22  THR  11          HG22      THR  11  -5.700  -0.745 -17.823
  104   HG23  THR  11          HG23      THR  11  -5.334   0.979 -17.885
  105    H    GLY  12           H        GLY  12  -0.582  -1.382 -17.881
  106    HA2  GLY  12           HA2      GLY  12   1.066  -2.630 -18.997
  107    HA3  GLY  12           HA1      GLY  12  -0.191  -3.343 -20.004
  108    H    GLY  13           H        GLY  13  -1.439  -1.497 -21.272
  109    HA2  GLY  13           HA2      GLY  13   0.060   0.737 -22.081
  110    HA3  GLY  13           HA1      GLY  13   0.152  -0.576 -23.262
  111    H1   GLY 850           HT1      GLY 850  -2.206  35.358  -7.706
  112    H2   GLY 850           HT2      GLY 850  -3.527  35.283  -8.734
  113    H3   GLY 850           HT3      GLY 850  -2.176  36.224  -9.156
  114    HA2  GLY 850           HA1      GLY 850  -2.182  34.167 -10.401
  115    HA3  GLY 850           HA2      GLY 850  -0.838  34.239  -9.261
  116    H    SER 851           H        SER 851  -1.817  31.826 -10.284
  117    HA   SER 851           HA       SER 851  -3.135  30.664  -7.937
  118    HG   SER 851           HG       SER 851  -3.519  29.086 -11.580
  119    HB2  SER 851           HB2      SER 851  -4.041  28.961  -9.577
  120    HB3  SER 851           HB1      SER 851  -4.665  30.592  -9.792
  121    H    HIS 852           H        HIS 852  -0.250  31.056  -8.535
  122    HA   HIS 852           HA       HIS 852   0.944  28.577  -9.300
  123    HD2  HIS 852           HD2      HIS 852   3.883  28.512  -6.813
  124    HE1  HIS 852           HE1      HIS 852   6.134  28.885 -10.383
  125    HE2  HIS 852           HE2      HIS 852   6.186  28.140  -7.987
  126    HB2  HIS 852           HB2      HIS 852   2.029  30.893  -9.389
  127    HB3  HIS 852           HB1      HIS 852   2.172  30.801  -7.644
  128    H    MET 853           H        MET 853   0.062  30.129  -6.298
  129    HA   MET 853           HA       MET 853   1.064  28.007  -4.635
  130    HB2  MET 853           HB2      MET 853  -0.726  30.360  -3.989
  131    HB3  MET 853           HB1      MET 853  -0.136  29.206  -2.804
  132    HG2  MET 853           HG2      MET 853   2.155  29.880  -3.269
  133    HG3  MET 853           HG1      MET 853   1.579  31.019  -4.483
  134    HE1  MET 853           HE1      MET 853  -0.056  30.223  -0.946
  135    HE2  MET 853           HE2      MET 853   0.745  31.435   0.053
  136    HE3  MET 853           HE3      MET 853   1.681  30.124  -0.663
  137    H    ALA 854           H        ALA 854   0.091  26.197  -4.375
  138    HA   ALA 854           HA       ALA 854  -2.828  26.033  -4.638
  139    HB1  ALA 854           HB1      ALA 854  -0.770  24.156  -5.804
  140    HB2  ALA 854           HB2      ALA 854  -1.811  25.246  -6.722
  141    HB3  ALA 854           HB3      ALA 854  -2.508  23.887  -5.832
  142    H    MET 855           H        MET 855  -3.395  23.634  -3.865
  143    HA   MET 855           HA       MET 855  -2.490  23.315  -1.223
  144    HB2  MET 855           HB2      MET 855  -4.118  21.534  -3.057
  145    HB3  MET 855           HB1      MET 855  -3.766  21.118  -1.387
  146    HG2  MET 855           HG2      MET 855  -4.967  23.078  -0.607
  147    HG3  MET 855           HG1      MET 855  -5.259  23.588  -2.267
  148    HE1  MET 855           HE1      MET 855  -6.074  20.970  -3.805
  149    HE2  MET 855           HE2      MET 855  -6.970  22.485  -3.892
  150    HE3  MET 855           HE3      MET 855  -7.824  20.980  -3.575
  151    H    ALA 856           H        ALA 856  -0.760  22.496  -0.689
  152    HA   ALA 856           HA       ALA 856   1.169  21.615  -2.553
  153    HB1  ALA 856           HB1      ALA 856   1.465  21.526   0.428
  154    HB2  ALA 856           HB2      ALA 856   1.766  22.941  -0.586
  155    HB3  ALA 856           HB3      ALA 856   2.754  21.490  -0.777
  156    H    TYR 857           H        TYR 857   0.049  19.915  -3.388
  157    HA   TYR 857           HA       TYR 857   0.006  17.887  -4.108
  158    HD1  TYR 857           HD1      TYR 857   1.871  16.742  -5.854
  159    HD2  TYR 857           HD2      TYR 857   3.455  19.574  -3.121
  160    HE1  TYR 857           HE1      TYR 857   2.951  17.899  -7.711
  161    HE2  TYR 857           HE2      TYR 857   4.563  20.745  -4.983
  162    HH   TYR 857           HH       TYR 857   3.752  20.193  -8.182
  163    HB2  TYR 857           HB2      TYR 857   2.332  17.615  -2.305
  164    HB3  TYR 857           HB1      TYR 857   1.826  16.305  -3.422
  165    H    VAL 858           H        VAL 858  -0.138  17.813  -0.639
  166    HA   VAL 858           HA       VAL 858  -1.731  15.408  -0.958
  167    HB   VAL 858           HB       VAL 858  -0.199  15.230   0.892
  168   HG11  VAL 858          HG11      VAL 858  -0.296  16.679   2.851
  169   HG12  VAL 858          HG12      VAL 858  -1.453  17.721   1.999
  170   HG13  VAL 858          HG13      VAL 858   0.191  17.519   1.376
  171   HG21  VAL 858          HG21      VAL 858  -1.728  14.729   2.769
  172   HG22  VAL 858          HG22      VAL 858  -2.334  14.130   1.230
  173   HG23  VAL 858          HG23      VAL 858  -3.016  15.592   1.932
  174    H    ILE 859           H        ILE 859  -3.659  15.579  -1.484
  175    HA   ILE 859           HA       ILE 859  -5.285  17.841  -0.531
  176    HB   ILE 859           HB       ILE 859  -6.681  17.544  -2.557
  177   HG12  ILE 859          HG12      ILE 859  -4.566  15.541  -3.429
  178   HG13  ILE 859          HG11      ILE 859  -6.215  15.154  -2.952
  179   HG21  ILE 859          HG21      ILE 859  -5.099  18.465  -4.202
  180   HG22  ILE 859          HG22      ILE 859  -3.759  17.991  -3.161
  181   HG23  ILE 859          HG23      ILE 859  -4.919  19.203  -2.608
  182   HD11  ILE 859          HD11      ILE 859  -5.946  15.123  -5.370
  183   HD12  ILE 859          HD12      ILE 859  -5.418  16.806  -5.344
  184   HD13  ILE 859          HD13      ILE 859  -7.065  16.393  -4.873
  185    H    ARG 860           H        ARG 860  -7.731  17.110  -0.547
  186    HA   ARG 860           HA       ARG 860  -7.714  14.383   0.532
  187    HE   ARG 860           HE       ARG 860 -11.427  18.911   1.656
  188    HB2  ARG 860           HB2      ARG 860  -9.631  14.999   1.952
  189    HB3  ARG 860           HB1      ARG 860  -8.198  15.951   2.313
  190    HG2  ARG 860           HG2      ARG 860  -9.121  17.825   1.075
  191    HG3  ARG 860           HG1      ARG 860 -10.548  16.866   0.671
  192    HD2  ARG 860           HD2      ARG 860 -11.125  16.689   3.004
  193    HD3  ARG 860           HD1      ARG 860  -9.662  17.553   3.471
  194   HH11  ARG 860          HH11      ARG 860 -10.502  18.438   5.028
  195   HH12  ARG 860          HH12      ARG 860 -11.170  19.895   5.578
  196   HH21  ARG 860          HH21      ARG 860 -12.335  20.952   2.408
  197   HH22  ARG 860          HH22      ARG 860 -12.213  21.379   4.052
  198    H    ASP 861           H        ASP 861  -9.529  13.070   0.154
  199    HA   ASP 861           HA       ASP 861 -10.916  13.823  -2.295
  200    HB2  ASP 861           HB2      ASP 861 -11.556  11.454  -2.554
  201    HB3  ASP 861           HB1      ASP 861  -9.817  11.630  -2.408
  202    H    GLU 862           H        GLU 862 -13.195  12.497  -2.248
  203    HA   GLU 862           HA       GLU 862 -14.819  14.162  -0.643
  204    HB2  GLU 862           HB2      GLU 862 -16.669  12.917  -1.602
  205    HB3  GLU 862           HB1      GLU 862 -15.508  13.424  -2.820
  206    HG2  GLU 862           HG2      GLU 862 -14.530  11.147  -2.768
  207    HG3  GLU 862           HG1      GLU 862 -15.802  10.676  -1.649
  208    H    TRP 863           H        TRP 863 -13.326  11.188   0.081
  209    HA   TRP 863           HA       TRP 863 -15.351  10.499   2.046
  210    HD1  TRP 863           HD       TRP 863 -16.574   8.999   0.627
  211    HE1  TRP 863           HE1      TRP 863 -16.981   7.824  -1.690
  212    HE3  TRP 863           HE3      TRP 863 -11.853   7.730  -0.371
  213    HZ2  TRP 863           HZ2      TRP 863 -15.407   6.532  -3.639
  214    HZ3  TRP 863           HZ3      TRP 863 -11.307   6.516  -2.467
  215    HH2  TRP 863           HH       TRP 863 -13.067   5.935  -4.062
  216    HB2  TRP 863           HB2      TRP 863 -12.845   9.000   1.295
  217    HB3  TRP 863           HB1      TRP 863 -14.151   8.391   2.309
  218    H    GLY 864           H        GLY 864 -12.433  12.078   1.661
  219    HA2  GLY 864           HA2      GLY 864 -11.703  13.597   3.364
  220    HA3  GLY 864           HA1      GLY 864 -12.217  12.428   4.569
  221    H    ASN 865           H        ASN 865 -10.560  11.075   1.878
  222    HA   ASN 865           HA       ASN 865  -8.392  10.380   3.684
  223    HB2  ASN 865           HB2      ASN 865  -8.788   9.558   0.800
  224    HB3  ASN 865           HB1      ASN 865  -7.599   8.898   1.913
  225   HD21  ASN 865          HD21      ASN 865 -10.795   8.875   0.851
  226   HD22  ASN 865          HD22      ASN 865 -11.356   7.555   1.845
  227    H    GLN 866           H        GLN 866  -6.268  10.821   3.312
  228    HA   GLN 866           HA       GLN 866  -5.775  13.241   1.821
  229    HB2  GLN 866           HB2      GLN 866  -3.978  11.509   3.514
  230    HB3  GLN 866           HB1      GLN 866  -3.417  12.930   2.650
  231    HG2  GLN 866           HG2      GLN 866  -4.900  14.312   3.858
  232    HG3  GLN 866           HG1      GLN 866  -5.593  12.939   4.708
  233   HE21  GLN 866          HE21      GLN 866  -2.166  13.365   4.036
  234   HE22  GLN 866          HE22      GLN 866  -1.670  13.582   5.665
  235    H    ILE 867           H        ILE 867  -5.195  13.254  -0.148
  236    HA   ILE 867           HA       ILE 867  -4.176  10.795  -1.390
  237    HB   ILE 867           HB       ILE 867  -5.427  13.196  -2.759
  238   HG12  ILE 867          HG12      ILE 867  -7.130  12.142  -1.351
  239   HG13  ILE 867          HG11      ILE 867  -7.461  11.825  -3.051
  240   HG21  ILE 867          HG21      ILE 867  -5.641  11.672  -4.683
  241   HG22  ILE 867          HG22      ILE 867  -4.789  10.422  -3.765
  242   HG23  ILE 867          HG23      ILE 867  -3.964  11.915  -4.195
  243   HD11  ILE 867          HD11      ILE 867  -7.875   9.877  -1.688
  244   HD12  ILE 867          HD12      ILE 867  -6.213   9.917  -1.095
  245   HD13  ILE 867          HD13      ILE 867  -6.535   9.582  -2.799
  246    H    TRP 868           H        TRP 868  -2.158  10.884  -2.038
  247    HA   TRP 868           HA       TRP 868  -0.777  13.430  -1.871
  248    HD1  TRP 868           HD       TRP 868   2.148  13.438  -0.444
  249    HE1  TRP 868           HE1      TRP 868   2.044  13.527   2.127
  250    HE3  TRP 868           HE3      TRP 868  -1.580  10.053   0.286
  251    HZ2  TRP 868           HZ2      TRP 868   0.555  12.303   4.182
  252    HZ3  TRP 868           HZ3      TRP 868  -2.300   9.568   2.590
  253    HH2  TRP 868           HH       TRP 868  -1.243  10.678   4.497
  254    HB2  TRP 868           HB2      TRP 868   0.085  10.594  -1.702
  255    HB3  TRP 868           HB1      TRP 868   1.249  11.815  -2.215
  256    H    ILE 869           H        ILE 869  -0.690  14.498  -3.646
  257    HA   ILE 869           HA       ILE 869  -0.548  13.300  -6.248
  258    HB   ILE 869           HB       ILE 869  -0.002  16.140  -5.314
  259   HG12  ILE 869          HG12      ILE 869  -2.321  15.542  -4.830
  260   HG13  ILE 869          HG11      ILE 869  -2.248  16.726  -6.126
  261   HG21  ILE 869          HG21      ILE 869  -0.318  16.824  -7.632
  262   HG22  ILE 869          HG22      ILE 869  -0.515  15.132  -8.094
  263   HG23  ILE 869          HG23      ILE 869   1.026  15.694  -7.454
  264   HD11  ILE 869          HD11      ILE 869  -2.690  13.787  -6.414
  265   HD12  ILE 869          HD12      ILE 869  -2.611  14.945  -7.745
  266   HD13  ILE 869          HD13      ILE 869  -3.921  15.046  -6.556
  267    H    CYS 870           H        CYS 870   1.292  12.297  -6.778
  268    HA   CYS 870           HA       CYS 870   3.746  12.595  -5.442
  269    HB2  CYS 870           HB2      CYS 870   3.205  10.560  -6.607
  270    HB3  CYS 870           HB1      CYS 870   3.003  11.410  -8.123
  271    HA   PRO 871           HA       PRO 871   4.796  16.501  -7.455
  272    HB2  PRO 871           HB2      PRO 871   7.433  16.069  -6.197
  273    HB3  PRO 871           HB1      PRO 871   6.316  17.424  -6.017
  274    HG2  PRO 871           HG2      PRO 871   6.655  15.659  -4.040
  275    HG3  PRO 871           HG1      PRO 871   5.063  16.354  -4.388
  276    HD2  PRO 871           HD2      PRO 871   6.149  13.662  -5.119
  277    HD3  PRO 871           HD1      PRO 871   4.540  14.117  -4.504
  278    H    GLY 872           H        GLY 872   6.031  13.467  -8.084
  279    HA2  GLY 872           HA2      GLY 872   8.101  14.316  -9.913
  280    HA3  GLY 872           HA1      GLY 872   7.547  12.661  -9.656
  281    H    CYS 873           H        CYS 873   4.846  12.880 -10.183
  282    HA   CYS 873           HA       CYS 873   4.906  13.383 -13.084
  283    HB2  CYS 873           HB2      CYS 873   3.103  11.638 -13.033
  284    HB3  CYS 873           HB1      CYS 873   4.711  11.085 -12.557
  285    H    ASN 874           H        ASN 874   3.472  14.234 -10.112
  286    HA   ASN 874           HA       ASN 874   1.869  15.507  -9.408
  287    HB2  ASN 874           HB2      ASN 874   1.594  16.388 -12.291
  288    HB3  ASN 874           HB1      ASN 874   0.639  17.065 -10.977
  289   HD21  ASN 874          HD21      ASN 874   2.545  18.341 -12.730
  290   HD22  ASN 874          HD22      ASN 874   3.748  19.054 -11.723
  291    H    LYS 875           H        LYS 875   1.509  12.761 -10.418
  292    HA   LYS 875           HA       LYS 875  -1.378  12.728 -10.804
  293    HB2  LYS 875           HB2      LYS 875   0.676  10.501 -10.896
  294    HB3  LYS 875           HB1      LYS 875  -1.044  10.290 -11.173
  295    HG2  LYS 875           HG2      LYS 875  -0.907  11.696 -13.163
  296    HG3  LYS 875           HG1      LYS 875   0.816  11.946 -12.869
  297    HD2  LYS 875           HD2      LYS 875   1.219   9.554 -13.103
  298    HD3  LYS 875           HD1      LYS 875  -0.501   9.272 -13.364
  299    HE2  LYS 875           HE2      LYS 875   0.693   9.274 -15.481
  300    HE3  LYS 875           HE1      LYS 875  -0.401  10.650 -15.393
  301    HZ1  LYS 875           HZ1      LYS 875   1.777  11.226 -16.288
  302    HZ2  LYS 875           HZ2      LYS 875   2.527  10.794 -14.846
  303    HZ3  LYS 875           HZ3      LYS 875   1.429  12.082 -14.906
  304    HA   PRO 876           HA       PRO 876  -1.995  11.852  -6.476
  305    HB2  PRO 876           HB2      PRO 876  -4.417  10.700  -6.600
  306    HB3  PRO 876           HB1      PRO 876  -4.198  12.419  -6.928
  307    HG2  PRO 876           HG2      PRO 876  -4.412  10.142  -8.857
  308    HG3  PRO 876           HG1      PRO 876  -5.262  11.701  -8.890
  309    HD2  PRO 876           HD2      PRO 876  -3.082  11.249 -10.403
  310    HD3  PRO 876           HD1      PRO 876  -3.397  12.836  -9.670
  311    H    ASP 877           H        ASP 877  -2.538   9.979  -4.990
  312    HA   ASP 877           HA       ASP 877  -1.431   7.535  -6.057
  313    HB2  ASP 877           HB2      ASP 877  -1.331   6.704  -3.833
  314    HB3  ASP 877           HB1      ASP 877  -0.599   8.289  -3.845
  315    H    ASP 878           H        ASP 878  -2.460   5.745  -6.219
  316    HA   ASP 878           HA       ASP 878  -4.945   5.122  -4.903
  317    HB2  ASP 878           HB2      ASP 878  -5.706   6.596  -6.846
  318    HB3  ASP 878           HB1      ASP 878  -5.126   5.332  -7.921
  319    H    GLY 879           H        GLY 879  -2.114   4.211  -5.838
  320    HA2  GLY 879           HA2      GLY 879  -2.742   1.467  -5.944
  321    HA3  GLY 879           HA1      GLY 879  -2.460   2.063  -7.564
  322    H    SER 880           H        SER 880  -0.460   3.151  -7.973
  323    HA   SER 880           HA       SER 880   1.576   1.422  -7.718
  324    HG   SER 880           HG       SER 880   0.836   2.363  -9.672
  325    HB2  SER 880           HB2      SER 880   1.939   4.366  -8.050
  326    HB3  SER 880           HB1      SER 880   2.966   3.090  -8.680
  327    HA   PRO 881           HA       PRO 881   3.259   1.799  -3.666
  328    HB2  PRO 881           HB2      PRO 881   5.923   1.337  -4.857
  329    HB3  PRO 881           HB1      PRO 881   5.046   0.376  -3.662
  330    HG2  PRO 881           HG2      PRO 881   5.336  -0.474  -6.182
  331    HG3  PRO 881           HG1      PRO 881   3.852  -0.776  -5.260
  332    HD2  PRO 881           HD2      PRO 881   4.385   1.267  -7.369
  333    HD3  PRO 881           HD1      PRO 881   2.933   0.293  -7.115
  334    H    MET 882           H        MET 882   4.263   3.243  -2.394
  335    HA   MET 882           HA       MET 882   5.418   5.595  -3.745
  336    HB2  MET 882           HB2      MET 882   3.681   5.741  -1.293
  337    HB3  MET 882           HB1      MET 882   4.233   7.061  -2.307
  338    HG2  MET 882           HG2      MET 882   2.841   6.146  -4.136
  339    HG3  MET 882           HG1      MET 882   2.198   4.963  -2.994
  340    HE1  MET 882           HE1      MET 882   2.026   8.514  -4.371
  341    HE2  MET 882           HE2      MET 882   3.060   8.811  -2.966
  342    HE3  MET 882           HE3      MET 882   1.424   9.486  -3.030
  343    H    ILE 883           H        ILE 883   6.847   6.806  -2.460
  344    HA   ILE 883           HA       ILE 883   7.748   5.552   0.007
  345    HB   ILE 883           HB       ILE 883   9.306   4.852  -1.841
  346   HG12  ILE 883          HG12      ILE 883  10.695   6.811  -0.018
  347   HG13  ILE 883          HG11      ILE 883  10.098   5.242   0.532
  348   HG21  ILE 883          HG21      ILE 883  10.747   6.543  -2.914
  349   HG22  ILE 883          HG22      ILE 883   9.850   7.814  -2.102
  350   HG23  ILE 883          HG23      ILE 883   9.045   6.804  -3.302
  351   HD11  ILE 883          HD11      ILE 883  12.490   5.208   0.001
  352   HD12  ILE 883          HD12      ILE 883  12.122   5.689  -1.652
  353   HD13  ILE 883          HD13      ILE 883  11.567   4.129  -1.042
  354    H    GLY 884           H        GLY 884   8.347   7.021   1.546
  355    HA2  GLY 884           HA2      GLY 884   7.536   9.753   0.938
  356    HA3  GLY 884           HA1      GLY 884   7.676   9.054   2.540
  357    H    CYS 885           H        CYS 885   8.961  11.449   0.911
  358    HA   CYS 885           HA       CYS 885  11.740  10.878   1.185
  359    HB2  CYS 885           HB2      CYS 885  10.770  12.574  -0.424
  360    HB3  CYS 885           HB1      CYS 885  10.380  13.571   0.956
  361    H    ASP 886           H        ASP 886  13.067  11.472   2.807
  362    HA   ASP 886           HA       ASP 886  11.744  12.029   5.327
  363    HB2  ASP 886           HB2      ASP 886  14.415  10.848   4.635
  364    HB3  ASP 886           HB1      ASP 886  13.982  11.268   6.277
  365    H    ASP 887           H        ASP 887  12.957  13.908   3.023
  366    HA   ASP 887           HA       ASP 887  14.365  15.633   4.983
  367    HB2  ASP 887           HB2      ASP 887  15.836  14.869   3.157
  368    HB3  ASP 887           HB1      ASP 887  14.791  15.653   1.995
  369    H    CYS 888           H        CYS 888  12.508  15.881   1.959
  370    HA   CYS 888           HA       CYS 888  12.142  18.664   2.526
  371    HB2  CYS 888           HB2      CYS 888  10.916  18.831   0.376
  372    HB3  CYS 888           HB1      CYS 888  12.510  18.121   0.201
  373    H    ASP 889           H        ASP 889   9.647  16.514   1.459
  374    HA   ASP 889           HA       ASP 889   8.123  17.266   3.783
  375    HB2  ASP 889           HB2      ASP 889   6.181  18.174   2.479
  376    HB3  ASP 889           HB1      ASP 889   7.618  19.169   2.549
  377    H    ASP 890           H        ASP 890   7.759  15.355   0.712
  378    HA   ASP 890           HA       ASP 890   5.955  13.742   2.279
  379    HB2  ASP 890           HB2      ASP 890   4.908  15.703   0.328
  380    HB3  ASP 890           HB1      ASP 890   4.098  14.158   0.331
  381    H    TRP 891           H        TRP 891   4.485  12.608   0.209
  382    HA   TRP 891           HA       TRP 891   6.341  10.521  -0.407
  383    HD1  TRP 891           HD       TRP 891   3.402  11.521   2.010
  384    HE1  TRP 891           HE1      TRP 891   3.506  10.060   4.107
  385    HE3  TRP 891           HE3      TRP 891   5.084   7.238  -0.129
  386    HZ2  TRP 891           HZ2      TRP 891   4.215   7.401   4.760
  387    HZ3  TRP 891           HZ3      TRP 891   5.457   5.291   1.258
  388    HH2  TRP 891           HH       TRP 891   5.030   5.354   3.684
  389    HB2  TRP 891           HB2      TRP 891   3.349  10.724  -0.671
  390    HB3  TRP 891           HB1      TRP 891   4.290   9.288  -1.042
  391    H    TYR 892           H        TYR 892   6.818   9.720  -2.359
  392    HA   TYR 892           HA       TYR 892   5.689  10.924  -4.801
  393    HD1  TYR 892           HD1      TYR 892   8.577  11.864  -2.536
  394    HD2  TYR 892           HD2      TYR 892   8.250  12.346  -6.745
  395    HE1  TYR 892           HE1      TYR 892   9.575  14.089  -2.353
  396    HE2  TYR 892           HE2      TYR 892   9.234  14.581  -6.579
  397    HH   TYR 892           HH       TYR 892  10.873  15.562  -3.862
  398    HB2  TYR 892           HB2      TYR 892   8.482   9.889  -4.251
  399    HB3  TYR 892           HB1      TYR 892   7.867  10.260  -5.842
  400    H    HIS 893           H        HIS 893   5.734   9.296  -6.559
  401    HA   HIS 893           HA       HIS 893   5.195   6.589  -5.565
  402    HD2  HIS 893           HD2      HIS 893   2.321   6.164  -6.079
  403    HE1  HIS 893           HE1      HIS 893   0.879   9.329  -8.477
  404    HE2  HIS 893           HE2      HIS 893   0.389   7.828  -6.543
  405    HB2  HIS 893           HB2      HIS 893   5.197   7.560  -8.447
  406    HB3  HIS 893           HB1      HIS 893   4.736   5.951  -7.944
  407    H    TRP 894           H        TRP 894   6.325   4.736  -6.346
  408    HA   TRP 894           HA       TRP 894   9.072   4.904  -6.123
  409    HD1  TRP 894           HD       TRP 894   7.998   4.375  -4.079
  410    HE1  TRP 894           HE1      TRP 894   8.134   2.786  -2.061
  411    HE3  TRP 894           HE3      TRP 894   8.561  -0.037  -6.569
  412    HZ2  TRP 894           HZ2      TRP 894   8.416   0.007  -1.598
  413    HZ3  TRP 894           HZ3      TRP 894   8.768  -2.117  -5.271
  414    HH2  TRP 894           HH       TRP 894   8.690  -2.088  -2.841
  415    HB2  TRP 894           HB2      TRP 894   7.251   2.717  -7.044
  416    HB3  TRP 894           HB1      TRP 894   8.988   2.517  -7.165
  417    HA   PRO 895           HA       PRO 895   9.572   4.011 -10.820
  418    HB2  PRO 895           HB2      PRO 895   7.515   4.554 -12.529
  419    HB3  PRO 895           HB1      PRO 895   7.757   2.978 -11.768
  420    HG2  PRO 895           HG2      PRO 895   5.987   5.235 -10.896
  421    HG3  PRO 895           HG1      PRO 895   5.566   3.520 -11.062
  422    HD2  PRO 895           HD2      PRO 895   6.139   4.554  -8.688
  423    HD3  PRO 895           HD1      PRO 895   6.729   2.939  -9.137
  424    H    CYS 896           H        CYS 896   7.865   6.714  -9.627
  425    HA   CYS 896           HA       CYS 896   8.509   8.547 -11.690
  426    HB2  CYS 896           HB2      CYS 896   7.574   8.913  -8.857
  427    HB3  CYS 896           HB1      CYS 896   7.493  10.146 -10.135
  428    H    VAL 897           H        VAL 897   9.876   7.612  -8.588
  429    HA   VAL 897           HA       VAL 897  11.960   9.634  -8.912
  430    HB   VAL 897           HB       VAL 897  12.601   9.134  -6.559
  431   HG11  VAL 897          HG11      VAL 897  11.165  11.007  -7.084
  432   HG12  VAL 897          HG12      VAL 897  10.590  10.244  -5.596
  433   HG13  VAL 897          HG13      VAL 897   9.759   9.951  -7.114
  434   HG21  VAL 897          HG21      VAL 897  10.061   7.504  -6.558
  435   HG22  VAL 897          HG22      VAL 897  11.081   7.848  -5.155
  436   HG23  VAL 897          HG23      VAL 897  11.689   6.848  -6.477
  437    H    GLY 898           H        GLY 898  11.563   6.283  -9.268
  438    HA2  GLY 898           HA2      GLY 898  13.292   5.098 -10.469
  439    HA3  GLY 898           HA1      GLY 898  14.483   6.073  -9.616
  440    H    ILE 899           H        ILE 899  11.797   4.750  -7.895
  441    HA   ILE 899           HA       ILE 899  13.615   2.918  -6.522
  442    HB   ILE 899           HB       ILE 899  10.877   3.992  -5.731
  443   HG12  ILE 899          HG12      ILE 899  12.828   5.573  -5.514
  444   HG13  ILE 899          HG11      ILE 899  11.963   5.251  -4.014
  445   HG21  ILE 899          HG21      ILE 899  12.676   2.136  -4.178
  446   HG22  ILE 899          HG22      ILE 899  11.136   1.710  -4.924
  447   HG23  ILE 899          HG23      ILE 899  11.179   2.857  -3.584
  448   HD11  ILE 899          HD11      ILE 899  14.337   5.335  -3.681
  449   HD12  ILE 899          HD12      ILE 899  14.581   4.036  -4.863
  450   HD13  ILE 899          HD13      ILE 899  13.706   3.724  -3.352
  451    H    MET 900           H        MET 900  13.379   0.787  -6.943
  452    HA   MET 900           HA       MET 900  10.782  -0.095  -7.987
  453    HB2  MET 900           HB2      MET 900  13.494  -1.110  -8.865
  454    HB3  MET 900           HB1      MET 900  11.962  -1.837  -9.331
  455    HG2  MET 900           HG2      MET 900  11.326   0.335 -10.363
  456    HG3  MET 900           HG1      MET 900  12.937   0.927 -10.010
  457    HE1  MET 900           HE1      MET 900  14.701  -1.722 -10.574
  458    HE2  MET 900           HE2      MET 900  15.164  -0.101 -11.092
  459    HE3  MET 900           HE3      MET 900  15.167  -1.428 -12.250
  460    H    ALA 901           H        ALA 901  12.942  -0.309  -5.520
  461    HA   ALA 901           HA       ALA 901  11.616  -2.692  -4.547
  462    HB1  ALA 901           HB1      ALA 901  13.729  -3.573  -3.666
  463    HB2  ALA 901           HB2      ALA 901  14.610  -2.287  -4.499
  464    HB3  ALA 901           HB3      ALA 901  13.720  -3.500  -5.422
  465    H    ALA 902           H        ALA 902  11.443  -2.714  -2.313
  466    HA   ALA 902           HA       ALA 902  11.364  -0.079  -1.187
  467    HB1  ALA 902           HB1      ALA 902  10.191  -1.115   0.659
  468    HB2  ALA 902           HB2      ALA 902  10.558  -2.719   0.021
  469    HB3  ALA 902           HB3      ALA 902   9.507  -1.623  -0.880
  470    HA   PRO 903           HA       PRO 903  15.183  -0.814   1.098
  471    HB2  PRO 903           HB2      PRO 903  15.050   1.898   2.023
  472    HB3  PRO 903           HB1      PRO 903  16.148   1.245   0.815
  473    HG2  PRO 903           HG2      PRO 903  14.141   3.065   0.313
  474    HG3  PRO 903           HG1      PRO 903  14.896   2.039  -0.914
  475    HD2  PRO 903           HD2      PRO 903  12.272   1.738   0.461
  476    HD3  PRO 903           HD1      PRO 903  12.758   1.291  -1.192
  477    HA   PRO 904           HA       PRO 904  13.428  -1.339   5.114
  478    HB2  PRO 904           HB2      PRO 904  15.481  -0.630   6.797
  479    HB3  PRO 904           HB1      PRO 904  15.410  -2.174   5.937
  480    HG2  PRO 904           HG2      PRO 904  16.966   0.281   5.296
  481    HG3  PRO 904           HG1      PRO 904  17.416  -1.421   5.110
  482    HD2  PRO 904           HD2      PRO 904  16.586   0.168   3.044
  483    HD3  PRO 904           HD1      PRO 904  16.368  -1.588   3.060
  484    H    GLU 905           H        GLU 905  12.297  -0.155   6.631
  485    HA   GLU 905           HA       GLU 905  12.202   2.643   6.062
  486    HB2  GLU 905           HB2      GLU 905  10.295   2.689   7.714
  487    HB3  GLU 905           HB1      GLU 905  10.068   1.722   6.265
  488    HG2  GLU 905           HG2      GLU 905  10.596  -0.292   7.601
  489    HG3  GLU 905           HG1      GLU 905  10.683   0.724   9.043
  490    H    GLU 906           H        GLU 906  14.016   0.921   8.104
  491    HA   GLU 906           HA       GLU 906  14.362   2.858  10.219
  492    HB2  GLU 906           HB2      GLU 906  16.326   0.813   9.169
  493    HB3  GLU 906           HB1      GLU 906  16.459   1.678  10.682
  494    HG2  GLU 906           HG2      GLU 906  14.501   0.508  11.524
  495    HG3  GLU 906           HG1      GLU 906  14.357  -0.351   9.983
  496    H    MET 907           H        MET 907  15.464   2.328   7.007
  497    HA   MET 907           HA       MET 907  17.725   4.130   7.128
  498    HB2  MET 907           HB2      MET 907  17.900   2.036   5.924
  499    HB3  MET 907           HB1      MET 907  16.520   2.450   4.914
  500    HG2  MET 907           HG2      MET 907  18.519   2.716   3.654
  501    HG3  MET 907           HG1      MET 907  17.883   4.318   4.001
  502    HE1  MET 907           HE1      MET 907  21.786   4.725   3.928
  503    HE2  MET 907           HE2      MET 907  20.257   5.162   3.157
  504    HE3  MET 907           HE3      MET 907  20.881   3.519   3.012
  505    H    GLN 908           H        GLN 908  17.756   6.041   5.977
  506    HA   GLN 908           HA       GLN 908  15.096   7.062   5.396
  507    HB2  GLN 908           HB2      GLN 908  17.650   8.609   5.829
  508    HB3  GLN 908           HB1      GLN 908  16.059   9.293   5.547
  509    HG2  GLN 908           HG2      GLN 908  15.269   8.213   7.625
  510    HG3  GLN 908           HG1      GLN 908  16.913   7.657   7.919
  511   HE21  GLN 908          HE21      GLN 908  16.104  10.755   6.540
  512   HE22  GLN 908          HE22      GLN 908  16.616  11.701   7.886
  513    H    TRP 909           H        TRP 909  14.780   8.428   3.627
  514    HA   TRP 909           HA       TRP 909  16.569   8.057   1.380
  515    HD1  TRP 909           HD       TRP 909  16.177   6.179  -1.277
  516    HE1  TRP 909           HE1      TRP 909  15.348   7.030  -3.572
  517    HE3  TRP 909           HE3      TRP 909  12.285   9.065   0.287
  518    HZ2  TRP 909           HZ2      TRP 909  13.304   8.673  -4.564
  519    HZ3  TRP 909           HZ3      TRP 909  10.946  10.253  -1.375
  520    HH2  TRP 909           HH       TRP 909  11.435  10.065  -3.755
  521    HB2  TRP 909           HB2      TRP 909  15.056   6.190   1.127
  522    HB3  TRP 909           HB1      TRP 909  13.652   7.229   1.389
  523    H    PHE 910           H        PHE 910  16.311   9.642  -0.145
  524    HA   PHE 910           HA       PHE 910  14.566  11.854   0.550
  525    HD1  PHE 910           HD1      PHE 910  15.343  13.090   2.679
  526    HD2  PHE 910           HD2      PHE 910  18.904  11.161   1.439
  527    HE1  PHE 910           HE1      PHE 910  15.934  12.735   5.008
  528    HE2  PHE 910           HE2      PHE 910  19.523  10.771   3.786
  529    HZ   PHE 910           HZ       PHE 910  18.011  11.546   5.592
  530    HB2  PHE 910           HB2      PHE 910  17.518  12.149  -0.136
  531    HB3  PHE 910           HB1      PHE 910  16.410  13.417   0.372
  532    H    CYS 911           H        CYS 911  13.725  12.721  -1.263
  533    HA   CYS 911           HA       CYS 911  13.760  11.271  -3.640
  534    HB2  CYS 911           HB2      CYS 911  12.431  13.157  -4.610
  535    HB3  CYS 911           HB1      CYS 911  11.865  12.669  -3.027
  536    HA   PRO 912           HA       PRO 912  17.092  12.555  -6.301
  537    HB2  PRO 912           HB2      PRO 912  15.683  13.696  -8.448
  538    HB3  PRO 912           HB1      PRO 912  16.173  12.007  -8.282
  539    HG2  PRO 912           HG2      PRO 912  13.547  13.285  -7.653
  540    HG3  PRO 912           HG1      PRO 912  13.879  11.692  -8.355
  541    HD2  PRO 912           HD2      PRO 912  13.166  11.891  -5.811
  542    HD3  PRO 912           HD1      PRO 912  14.453  10.771  -6.286
  543    H    LYS 913           H        LYS 913  14.801  14.902  -5.243
  544    HA   LYS 913           HA       LYS 913  16.347  17.211  -6.111
  545    HB2  LYS 913           HB2      LYS 913  14.193  16.993  -3.997
  546    HB3  LYS 913           HB1      LYS 913  14.833  18.479  -4.657
  547    HG2  LYS 913           HG2      LYS 913  13.785  18.019  -6.782
  548    HG3  LYS 913           HG1      LYS 913  13.238  16.439  -6.190
  549    HD2  LYS 913           HD2      LYS 913  11.978  17.563  -4.405
  550    HD3  LYS 913           HD1      LYS 913  12.482  19.124  -5.045
  551    HE2  LYS 913           HE2      LYS 913  11.275  18.725  -7.082
  552    HE3  LYS 913           HE1      LYS 913  10.897  17.078  -6.571
  553    HZ1  LYS 913           HZ1      LYS 913   9.974  19.554  -5.223
  554    HZ2  LYS 913           HZ2      LYS 913   9.631  17.975  -4.730
  555    HZ3  LYS 913           HZ3      LYS 913   9.040  18.555  -6.213
  556    H    CYS 914           H        CYS 914  15.482  15.598  -3.094
  557    HA   CYS 914           HA       CYS 914  17.139  17.246  -1.538
  558    HB2  CYS 914           HB2      CYS 914  15.584  14.775  -0.896
  559    HB3  CYS 914           HB1      CYS 914  16.441  15.736   0.317
  560    H    ALA 915           H        ALA 915  17.410  13.885  -2.558
  561    HA   ALA 915           HA       ALA 915  19.759  13.485  -1.046
  562    HB1  ALA 915           HB1      ALA 915  20.040  11.425  -2.286
  563    HB2  ALA 915           HB2      ALA 915  18.803  11.964  -3.444
  564    HB3  ALA 915           HB3      ALA 915  18.365  11.641  -1.768
  565    H    ASN 916           H        ASN 916  19.169  14.983  -4.004
  566    HA   ASN 916           HA       ASN 916  21.772  14.776  -5.178
  567    HB2  ASN 916           HB2      ASN 916  19.660  15.259  -6.451
  568    HB3  ASN 916           HB1      ASN 916  19.592  16.819  -5.655
  569   HD21  ASN 916          HD21      ASN 916  21.045  14.937  -8.064
  570   HD22  ASN 916          HD22      ASN 916  21.970  16.163  -8.851
  571    H    LYS 917           H        LYS 917  19.946  17.239  -3.380
  572    HA   LYS 917           HA       LYS 917  21.968  19.198  -3.374
  573    HB2  LYS 917           HB2      LYS 917  20.547  20.474  -1.953
  574    HB3  LYS 917           HB1      LYS 917  19.483  19.576  -3.023
  575    HG2  LYS 917           HG2      LYS 917  19.367  17.857  -1.141
  576    HG3  LYS 917           HG1      LYS 917  20.071  19.126  -0.147
  577    HD2  LYS 917           HD2      LYS 917  18.179  20.580  -0.670
  578    HD3  LYS 917           HD1      LYS 917  17.466  19.314  -1.674
  579    HE2  LYS 917           HE2      LYS 917  17.612  17.840   0.409
  580    HE3  LYS 917           HE1      LYS 917  17.910  19.326   1.295
  581    HZ1  LYS 917           HZ1      LYS 917  15.726  20.155   0.351
  582    HZ2  LYS 917           HZ2      LYS 917  15.663  18.853   1.439
  583    HZ3  LYS 917           HZ3      LYS 917  15.452  18.543  -0.165
  584    H    ILE 918           H        ILE 918  21.337  16.502  -1.278
  585    HA   ILE 918           HA       ILE 918  22.878  17.250   0.986
  586    HB   ILE 918           HB       ILE 918  22.562  14.426  -0.060
  587   HG12  ILE 918          HG12      ILE 918  20.335  15.432   0.134
  588   HG13  ILE 918          HG11      ILE 918  20.568  14.165   1.320
  589   HG21  ILE 918          HG21      ILE 918  24.203  14.605   1.691
  590   HG22  ILE 918          HG22      ILE 918  22.778  13.751   2.291
  591   HG23  ILE 918          HG23      ILE 918  23.049  15.436   2.734
  592   HD11  ILE 918          HD11      ILE 918  20.667  17.128   1.813
  593   HD12  ILE 918          HD12      ILE 918  20.906  15.863   3.034
  594   HD13  ILE 918          HD13      ILE 918  19.352  16.017   2.202
  595    H    LYS 919           H        LYS 919  23.641  15.527  -1.976
  596    HA   LYS 919           HA       LYS 919  26.317  14.944  -1.036
  597    HB2  LYS 919           HB2      LYS 919  24.852  13.239  -2.167
  598    HB3  LYS 919           HB1      LYS 919  25.071  14.140  -3.657
  599    HG2  LYS 919           HG2      LYS 919  27.466  13.768  -3.538
  600    HG3  LYS 919           HG1      LYS 919  27.267  12.857  -2.042
  601    HD2  LYS 919           HD2      LYS 919  25.816  11.264  -3.285
  602    HD3  LYS 919           HD1      LYS 919  26.188  12.147  -4.768
  603    HE2  LYS 919           HE2      LYS 919  28.176  10.730  -2.982
  604    HE3  LYS 919           HE1      LYS 919  27.602  10.184  -4.557
  605    HZ1  LYS 919           HZ1      LYS 919  29.190  12.641  -4.041
  606    HZ2  LYS 919           HZ2      LYS 919  28.654  12.149  -5.554
  607    HZ3  LYS 919           HZ3      LYS 919  29.777  11.228  -4.712
  608    H    LYS 920           H        LYS 920  24.803  17.264  -3.095
  609    HA   LYS 920           HA       LYS 920  27.014  17.588  -4.787
  610    HB2  LYS 920           HB2      LYS 920  26.007  19.739  -5.578
  611    HB3  LYS 920           HB1      LYS 920  24.965  18.350  -5.711
  612    HG2  LYS 920           HG2      LYS 920  23.546  20.077  -5.013
  613    HG3  LYS 920           HG1      LYS 920  23.891  19.144  -3.558
  614    HD2  LYS 920           HD2      LYS 920  23.929  21.529  -3.068
  615    HD3  LYS 920           HD1      LYS 920  25.528  20.825  -2.861
  616    HE2  LYS 920           HE2      LYS 920  26.232  21.737  -5.012
  617    HE3  LYS 920           HE1      LYS 920  24.607  22.364  -5.301
  618    HZ1  LYS 920           HZ1      LYS 920  26.084  24.099  -4.502
  619    HZ2  LYS 920           HZ2      LYS 920  26.435  23.218  -3.112
  620    HZ3  LYS 920           HZ3      LYS 920  24.878  23.797  -3.374
  621    H    ASP 921           H        ASP 921  28.792  18.353  -4.592
  622    HA   ASP 921           HA       ASP 921  29.479  20.185  -2.413
  623    HB2  ASP 921           HB2      ASP 921  30.857  18.155  -2.641
  624    HB3  ASP 921           HB1      ASP 921  31.184  18.543  -4.323
  625    H    LYS 922           H        LYS 922  30.301  19.566  -5.738
  626    HA   LYS 922           HA       LYS 922  30.862  20.784  -7.477
  627    HB2  LYS 922           HB2      LYS 922  28.468  20.571  -7.660
  628    HB3  LYS 922           HB1      LYS 922  28.251  22.095  -6.811
  629    HG2  LYS 922           HG2      LYS 922  29.441  23.250  -8.633
  630    HG3  LYS 922           HG1      LYS 922  29.588  21.717  -9.477
  631    HD2  LYS 922           HD2      LYS 922  27.218  21.523  -9.704
  632    HD3  LYS 922           HD1      LYS 922  26.958  22.933  -8.670
  633    HE2  LYS 922           HE2      LYS 922  28.362  22.945 -11.337
  634    HE3  LYS 922           HE1      LYS 922  26.705  23.470 -11.059
  635    HZ1  LYS 922           HZ1      LYS 922  29.136  24.719  -9.859
  636    HZ2  LYS 922           HZ2      LYS 922  27.563  25.145  -9.529
  637    HZ3  LYS 922           HZ3      LYS 922  28.178  25.368 -11.093
  638    H    LYS 923           H        LYS 923  32.739  21.724  -6.765
  639    HA   LYS 923           HA       LYS 923  32.906  24.195  -7.869
  640    HB2  LYS 923           HB2      LYS 923  33.923  25.620  -6.093
  641    HB3  LYS 923           HB1      LYS 923  32.230  25.329  -5.803
  642    HG2  LYS 923           HG2      LYS 923  34.493  23.950  -4.292
  643    HG3  LYS 923           HG1      LYS 923  33.710  25.425  -3.804
  644    HD2  LYS 923           HD2      LYS 923  31.604  24.329  -3.542
  645    HD3  LYS 923           HD1      LYS 923  32.255  22.832  -4.217
  646    HE2  LYS 923           HE2      LYS 923  33.300  24.153  -1.718
  647    HE3  LYS 923           HE1      LYS 923  32.102  22.859  -1.723
  648    HZ1  LYS 923           HZ1      LYS 923  34.858  22.588  -2.875
  649    HZ2  LYS 923           HZ2      LYS 923  33.657  21.429  -2.808
  650    HZ3  LYS 923           HZ3      LYS 923  34.337  21.985  -1.381
  651    H    HIS 924           H        HIS 924  34.893  22.900  -5.422
  652    HA   HIS 924           HA       HIS 924  36.599  21.327  -6.651
  653    HD1  HIS 924           HD1      HIS 924  39.239  24.509  -5.252
  654    HD2  HIS 924           HD2      HIS 924  36.557  25.789  -8.155
  655    HE1  HIS 924           HE1      HIS 924  39.248  27.002  -5.105
  656    HE2  HIS 924           HE2      HIS 924  37.455  27.746  -6.700
  657    HB2  HIS 924           HB2      HIS 924  38.646  22.723  -7.119
  658    HB3  HIS 924           HB1      HIS 924  37.330  23.130  -8.202
  Start of MODEL    8
    1    HA   ALA   1           HA       ALA   1  12.465   6.570   2.749
    2    H1   ALA   1           HT1      ALA   1  12.829   6.530   5.177
    3    H2   ALA   1           HT2      ALA   1  14.146   6.879   4.288
    4    H3   ALA   1           HT3      ALA   1  13.983   5.318   4.966
    5    HB1  ALA   1           HB1      ALA   1  13.880   3.900   2.961
    6    HB2  ALA   1           HB2      ALA   1  14.480   5.300   2.084
    7    HB3  ALA   1           HB3      ALA   1  13.011   4.486   1.549
    8    H    ARG   2           H        ARG   2  10.496   6.643   3.728
    9    HA   ARG   2           HA       ARG   2   9.411   4.357   5.107
   10    HE   ARG   2           HE       ARG   2   7.458   8.749   6.079
   11    HB2  ARG   2           HB2      ARG   2   8.878   7.051   5.161
   12    HB3  ARG   2           HB1      ARG   2   7.644   6.472   4.084
   13    HG2  ARG   2           HG2      ARG   2   6.834   4.928   5.746
   14    HG3  ARG   2           HG1      ARG   2   8.110   5.441   6.853
   15    HD2  ARG   2           HD2      ARG   2   5.897   7.130   5.737
   16    HD3  ARG   2           HD1      ARG   2   6.053   6.585   7.408
   17   HH11  ARG   2          HH11      ARG   2   7.433   6.654   8.945
   18   HH12  ARG   2          HH12      ARG   2   8.104   7.846   9.956
   19   HH21  ARG   2          HH21      ARG   2   8.305  10.393   7.522
   20   HH22  ARG   2          HH22      ARG   2   8.597   9.971   9.147
   21    H    THR   3           H        THR   3   8.176   2.774   4.131
   22    HA   THR   3           HA       THR   3   7.446   3.307   1.346
   23    HB   THR   3           HB       THR   3   7.815   0.802   0.966
   24    HG1  THR   3           HG1      THR   3   8.792   1.147   3.544
   25   HG21  THR   3          HG21      THR   3   9.300   2.526   0.034
   26   HG22  THR   3          HG22      THR   3  10.225   1.113   0.536
   27   HG23  THR   3          HG23      THR   3  10.212   2.562   1.543
   28    HA   M3L   4           HA       M3L   4   3.842   1.000   2.170
   29    H    M3L   4           H        M3L   4   5.396   2.961   0.777
   30    HB2  M3L   4           HB2      M3L   4   3.440   3.022   3.546
   31    HB3  M3L   4           HB1      M3L   4   1.985   2.549   2.680
   32    HG2  M3L   4           HG2      M3L   4   3.433   4.372   1.082
   33    HG3  M3L   4           HG1      M3L   4   3.370   5.024   2.718
   34    HD2  M3L   4           HD2      M3L   4   0.907   3.971   1.394
   35    HD3  M3L   4           HD1      M3L   4   1.059   5.126   2.723
   36    HE2  M3L   4           HE2      M3L   4   2.404   6.476   0.904
   37    HE3  M3L   4           HE1      M3L   4   1.524   5.460  -0.195
   38   HM11  M3L   4          HM11      M3L   4   0.145   6.879   3.154
   39   HM12  M3L   4          HM12      M3L   4   1.377   7.929   2.535
   40   HM13  M3L   4          HM13      M3L   4  -0.291   8.395   2.434
   41   HM21  M3L   4          HM21      M3L   4   0.641   7.563  -1.054
   42   HM22  M3L   4          HM22      M3L   4   0.908   8.770   0.161
   43   HM23  M3L   4          HM23      M3L   4  -0.713   8.328  -0.294
   44   HM31  M3L   4          HM31      M3L   4  -1.166   5.594  -0.063
   45   HM32  M3L   4          HM32      M3L   4  -1.907   6.700   1.037
   46   HM33  M3L   4          HM33      M3L   4  -1.079   5.298   1.645
   47    H    GLN   5           H        GLN   5   1.711   0.809   1.184
   48    HA   GLN   5           HA       GLN   5   1.432   1.705  -1.559
   49    HB2  GLN   5           HB2      GLN   5   2.714  -0.502  -1.490
   50    HB3  GLN   5           HB1      GLN   5   1.287  -1.192  -0.721
   51    HG2  GLN   5           HG2      GLN   5  -0.053  -0.569  -2.648
   52    HG3  GLN   5           HG1      GLN   5   1.371   0.127  -3.403
   53   HE21  GLN   5          HE21      GLN   5  -0.377  -1.989  -4.271
   54   HE22  GLN   5          HE22      GLN   5   0.681  -3.333  -4.493
   55    H    THR   6           H        THR   6  -0.866   1.671  -2.027
   56    HA   THR   6           HA       THR   6  -2.568   2.034   0.146
   57    HB   THR   6           HB       THR   6  -3.325   1.163  -2.639
   58    HG1  THR   6           HG1      THR   6  -3.269   3.837  -1.808
   59   HG21  THR   6          HG21      THR   6  -5.173   1.120  -1.052
   60   HG22  THR   6          HG22      THR   6  -5.380   2.494  -2.146
   61   HG23  THR   6          HG23      THR   6  -4.786   2.747  -0.508
   62    H    ALA   7           H        ALA   7  -2.095  -0.836  -1.839
   63    HA   ALA   7           HA       ALA   7  -3.309  -2.314   0.345
   64    HB1  ALA   7           HB1      ALA   7  -4.809  -2.080  -1.540
   65    HB2  ALA   7           HB2      ALA   7  -4.373  -3.772  -1.236
   66    HB3  ALA   7           HB3      ALA   7  -3.639  -2.881  -2.585
   67    H    ARG   8           H        ARG   8  -1.542  -3.124   1.227
   68    HA   ARG   8           HA       ARG   8   0.729  -3.935  -0.393
   69    HE   ARG   8           HE       ARG   8   1.408  -0.767   3.790
   70    HB2  ARG   8           HB2      ARG   8   0.306  -4.634   2.527
   71    HB3  ARG   8           HB1      ARG   8   1.801  -4.737   1.638
   72    HG2  ARG   8           HG2      ARG   8   2.066  -2.853   2.982
   73    HG3  ARG   8           HG1      ARG   8   1.609  -2.179   1.421
   74    HD2  ARG   8           HD2      ARG   8  -0.627  -1.831   2.126
   75    HD3  ARG   8           HD1      ARG   8  -0.374  -2.751   3.610
   76   HH11  ARG   8          HH11      ARG   8  -2.091  -0.808   3.144
   77   HH12  ARG   8          HH12      ARG   8  -2.404   0.656   3.932
   78   HH21  ARG   8          HH21      ARG   8   0.961   1.256   4.885
   79   HH22  ARG   8          HH22      ARG   8  -0.626   1.871   4.934
   80    H    LYS   9           H        LYS   9  -1.858  -5.421   1.380
   81    HA   LYS   9           HA       LYS   9  -2.805  -7.420   1.441
   82    HB2  LYS   9           HB2      LYS   9  -1.270  -7.961  -1.117
   83    HB3  LYS   9           HB1      LYS   9  -2.529  -9.010  -0.476
   84    HG2  LYS   9           HG2      LYS   9  -4.132  -7.114  -0.651
   85    HG3  LYS   9           HG1      LYS   9  -2.862  -6.164  -1.415
   86    HD2  LYS   9           HD2      LYS   9  -4.034  -8.742  -2.467
   87    HD3  LYS   9           HD1      LYS   9  -4.385  -7.127  -3.074
   88    HE2  LYS   9           HE2      LYS   9  -2.011  -6.873  -3.687
   89    HE3  LYS   9           HE1      LYS   9  -1.718  -8.508  -3.106
   90    HZ1  LYS   9           HZ1      LYS   9  -3.532  -7.779  -5.332
   91    HZ2  LYS   9           HZ2      LYS   9  -3.238  -9.344  -4.785
   92    HZ3  LYS   9           HZ3      LYS   9  -2.004  -8.454  -5.495
   93    H    SER  10           H        SER  10  -0.427  -6.812   2.761
   94    HA   SER  10           HA       SER  10   1.142  -9.243   2.891
   95    HG   SER  10           HG       SER  10   3.069  -7.422   5.342
   96    HB2  SER  10           HB2      SER  10   2.200  -6.997   3.115
   97    HB3  SER  10           HB1      SER  10   1.256  -6.715   4.569
   98    H    THR  11           H        THR  11  -1.465  -7.633   4.579
   99    HA   THR  11           HA       THR  11  -1.360  -9.419   6.830
  100    HB   THR  11           HB       THR  11  -3.532  -7.427   6.102
  101    HG1  THR  11           HG1      THR  11  -1.348  -6.913   7.835
  102   HG21  THR  11          HG21      THR  11  -3.928  -7.383   8.537
  103   HG22  THR  11          HG22      THR  11  -2.634  -8.554   8.770
  104   HG23  THR  11          HG23      THR  11  -4.096  -9.021   7.905
  105    H    GLY  12           H        GLY  12  -1.554 -11.352   5.384
  106    HA2  GLY  12           HA2      GLY  12  -3.913 -12.631   5.556
  107    HA3  GLY  12           HA1      GLY  12  -4.040 -11.746   4.047
  108    H    GLY  13           H        GLY  13  -4.237 -14.041   3.370
  109    HA2  GLY  13           HA2      GLY  13  -2.846 -15.087   1.628
  110    HA3  GLY  13           HA1      GLY  13  -1.579 -15.167   2.850
  111    H1   GLY 850           HT1      GLY 850  -7.283  21.675  11.759
  112    H2   GLY 850           HT2      GLY 850  -7.530  20.067  11.307
  113    H3   GLY 850           HT3      GLY 850  -6.601  21.091  10.333
  114    HA2  GLY 850           HA1      GLY 850  -5.899  20.221  13.055
  115    HA3  GLY 850           HA2      GLY 850  -5.191  19.608  11.565
  116    H    SER 851           H        SER 851  -3.377  20.546  13.199
  117    HA   SER 851           HA       SER 851  -2.940  23.331  13.005
  118    HG   SER 851           HG       SER 851  -0.496  20.491  14.571
  119    HB2  SER 851           HB2      SER 851  -0.656  22.624  13.892
  120    HB3  SER 851           HB1      SER 851  -2.046  22.201  14.897
  121    H    HIS 852           H        HIS 852  -1.685  20.488  11.341
  122    HA   HIS 852           HA       HIS 852  -0.273  22.249   9.502
  123    HD2  HIS 852           HD2      HIS 852   0.850  20.223  12.691
  124    HE1  HIS 852           HE1      HIS 852   4.559  21.710  11.286
  125    HE2  HIS 852           HE2      HIS 852   3.277  20.874  13.315
  126    HB2  HIS 852           HB2      HIS 852   0.119  19.295  10.047
  127    HB3  HIS 852           HB1      HIS 852   0.923  20.161   8.749
  128    H    MET 853           H        MET 853  -2.024  22.844   8.360
  129    HA   MET 853           HA       MET 853  -3.346  20.811   6.722
  130    HB2  MET 853           HB2      MET 853  -4.735  22.593   7.789
  131    HB3  MET 853           HB1      MET 853  -3.806  23.805   6.927
  132    HG2  MET 853           HG2      MET 853  -5.898  23.493   5.814
  133    HG3  MET 853           HG1      MET 853  -4.608  22.854   4.797
  134    HE1  MET 853           HE1      MET 853  -7.664  20.569   3.967
  135    HE2  MET 853           HE2      MET 853  -6.416  21.635   3.321
  136    HE3  MET 853           HE3      MET 853  -7.684  22.289   4.358
  137    H    ALA 854           H        ALA 854  -1.695  23.941   6.459
  138    HA   ALA 854           HA       ALA 854  -0.312  24.898   4.967
  139    HB1  ALA 854           HB1      ALA 854   0.606  22.047   4.555
  140    HB2  ALA 854           HB2      ALA 854   1.125  23.104   5.865
  141    HB3  ALA 854           HB3      ALA 854   1.535  23.503   4.198
  142    H    MET 855           H        MET 855   0.783  23.959   2.539
  143    HA   MET 855           HA       MET 855  -1.416  23.082   0.917
  144    HB2  MET 855           HB2      MET 855  -1.543  25.547   0.720
  145    HB3  MET 855           HB1      MET 855   0.153  25.597   0.260
  146    HG2  MET 855           HG2      MET 855  -0.327  24.359  -1.770
  147    HG3  MET 855           HG1      MET 855  -2.014  24.204  -1.292
  148    HE1  MET 855           HE1      MET 855  -2.667  25.086  -3.679
  149    HE2  MET 855           HE2      MET 855  -0.976  25.336  -4.126
  150    HE3  MET 855           HE3      MET 855  -2.150  26.635  -4.339
  151    H    ALA 856           H        ALA 856  -0.366  21.233   0.802
  152    HA   ALA 856           HA       ALA 856   2.151  21.217  -0.684
  153    HB1  ALA 856           HB1      ALA 856   1.273  19.319   1.502
  154    HB2  ALA 856           HB2      ALA 856   2.471  20.598   1.677
  155    HB3  ALA 856           HB3      ALA 856   2.791  19.239   0.601
  156    H    TYR 857           H        TYR 857   2.076  18.332  -0.915
  157    HA   TYR 857           HA       TYR 857   0.182  18.236  -3.080
  158    HD1  TYR 857           HD2      TYR 857   0.984  17.459  -5.567
  159    HD2  TYR 857           HD1      TYR 857   4.223  18.165  -2.894
  160    HE1  TYR 857           HE2      TYR 857   2.075  18.783  -7.272
  161    HE2  TYR 857           HE1      TYR 857   5.330  19.521  -4.612
  162    HH   TYR 857           HH       TYR 857   3.717  20.629  -7.325
  163    HB2  TYR 857           HB2      TYR 857   2.540  16.580  -2.310
  164    HB3  TYR 857           HB1      TYR 857   1.398  16.001  -3.512
  165    H    VAL 858           H        VAL 858   0.171  17.342   0.086
  166    HA   VAL 858           HA       VAL 858  -1.713  15.218  -0.392
  167    HB   VAL 858           HB       VAL 858  -0.352  14.889   1.596
  168   HG11  VAL 858          HG11      VAL 858  -0.447  16.350   3.540
  169   HG12  VAL 858          HG12      VAL 858  -1.472  17.468   2.631
  170   HG13  VAL 858          HG13      VAL 858   0.194  17.184   2.117
  171   HG21  VAL 858          HG21      VAL 858  -2.619  14.022   1.724
  172   HG22  VAL 858          HG22      VAL 858  -3.199  15.549   2.374
  173   HG23  VAL 858          HG23      VAL 858  -2.089  14.559   3.315
  174    H    ILE 859           H        ILE 859  -3.570  15.644  -1.083
  175    HA   ILE 859           HA       ILE 859  -4.927  18.095  -0.197
  176    HB   ILE 859           HB       ILE 859  -6.133  18.066  -2.354
  177   HG12  ILE 859          HG12      ILE 859  -4.246  15.810  -3.101
  178   HG13  ILE 859          HG11      ILE 859  -5.971  15.639  -2.799
  179   HG21  ILE 859          HG21      ILE 859  -4.155  19.453  -2.164
  180   HG22  ILE 859          HG22      ILE 859  -4.274  18.794  -3.795
  181   HG23  ILE 859          HG23      ILE 859  -3.130  18.101  -2.648
  182   HD11  ILE 859          HD11      ILE 859  -4.685  17.182  -5.041
  183   HD12  ILE 859          HD12      ILE 859  -6.415  17.099  -4.726
  184   HD13  ILE 859          HD13      ILE 859  -5.532  15.639  -5.167
  185    H    ARG 860           H        ARG 860  -7.382  17.773  -0.393
  186    HA   ARG 860           HA       ARG 860  -7.902  15.069   0.538
  187    HE   ARG 860           HE       ARG 860  -8.761  18.629   3.217
  188    HB2  ARG 860           HB2      ARG 860  -9.896  15.872   1.629
  189    HB3  ARG 860           HB1      ARG 860  -8.469  16.713   2.191
  190    HG2  ARG 860           HG2      ARG 860  -9.068  18.642   0.842
  191    HG3  ARG 860           HG1      ARG 860 -10.483  17.775   0.233
  192    HD2  ARG 860           HD2      ARG 860 -11.145  19.219   2.037
  193    HD3  ARG 860           HD1      ARG 860 -11.257  17.507   2.505
  194   HH11  ARG 860          HH11      ARG 860 -12.111  18.293   4.322
  195   HH12  ARG 860          HH12      ARG 860 -11.751  18.672   5.944
  196   HH21  ARG 860          HH21      ARG 860  -8.286  19.125   5.460
  197   HH22  ARG 860          HH22      ARG 860  -9.566  19.176   6.608
  198    H    ASP 861           H        ASP 861  -9.245  13.829  -0.271
  199    HA   ASP 861           HA       ASP 861 -10.301  14.216  -2.919
  200    HB2  ASP 861           HB2      ASP 861  -9.420  12.035  -2.177
  201    HB3  ASP 861           HB1      ASP 861 -10.623  12.000  -0.890
  202    H    GLU 862           H        GLU 862 -12.678  13.431  -3.149
  203    HA   GLU 862           HA       GLU 862 -14.319  15.418  -1.917
  204    HB2  GLU 862           HB2      GLU 862 -16.118  14.471  -3.285
  205    HB3  GLU 862           HB1      GLU 862 -14.669  14.794  -4.226
  206    HG2  GLU 862           HG2      GLU 862 -14.090  12.365  -3.990
  207    HG3  GLU 862           HG1      GLU 862 -15.681  12.128  -3.276
  208    H    TRP 863           H        TRP 863 -13.742  11.992  -1.377
  209    HA   TRP 863           HA       TRP 863 -15.968  11.799   0.463
  210    HD1  TRP 863           HD       TRP 863 -17.318  10.399  -1.039
  211    HE1  TRP 863           HE1      TRP 863 -17.646   9.171  -3.319
  212    HE3  TRP 863           HE3      TRP 863 -12.774   8.380  -1.418
  213    HZ2  TRP 863           HZ2      TRP 863 -16.101   7.525  -5.019
  214    HZ3  TRP 863           HZ3      TRP 863 -12.203   6.938  -3.382
  215    HH2  TRP 863           HH       TRP 863 -13.857   6.537  -5.140
  216    HB2  TRP 863           HB2      TRP 863 -13.711   9.857   0.013
  217    HB3  TRP 863           HB1      TRP 863 -15.184   9.535   0.920
  218    H    GLY 864           H        GLY 864 -13.131  13.273   0.595
  219    HA2  GLY 864           HA2      GLY 864 -12.127  14.321   2.417
  220    HA3  GLY 864           HA1      GLY 864 -13.159  13.378   3.483
  221    H    ASN 865           H        ASN 865 -10.925  12.291   1.022
  222    HA   ASN 865           HA       ASN 865  -9.433  10.829   3.108
  223    HB2  ASN 865           HB2      ASN 865  -9.572  10.339   0.109
  224    HB3  ASN 865           HB1      ASN 865  -8.500   9.482   1.199
  225   HD21  ASN 865          HD21      ASN 865 -11.744   9.803   0.032
  226   HD22  ASN 865          HD22      ASN 865 -12.364   8.417   0.858
  227    H    GLN 866           H        GLN 866  -7.194  11.107   3.191
  228    HA   GLN 866           HA       GLN 866  -6.253  13.490   1.866
  229    HB2  GLN 866           HB2      GLN 866  -5.022  11.678   3.928
  230    HB3  GLN 866           HB1      GLN 866  -4.055  12.863   3.063
  231    HG2  GLN 866           HG2      GLN 866  -5.530  14.637   3.864
  232    HG3  GLN 866           HG1      GLN 866  -6.466  13.448   4.752
  233   HE21  GLN 866          HE21      GLN 866  -2.997  13.245   4.505
  234   HE22  GLN 866          HE22      GLN 866  -2.641  13.689   6.120
  235    H    ILE 867           H        ILE 867  -5.443  13.468  -0.007
  236    HA   ILE 867           HA       ILE 867  -4.402  10.946  -1.066
  237    HB   ILE 867           HB       ILE 867  -5.511  13.327  -2.574
  238   HG12  ILE 867          HG12      ILE 867  -7.316  12.206  -1.384
  239   HG13  ILE 867          HG11      ILE 867  -7.436  11.881  -3.111
  240   HG21  ILE 867          HG21      ILE 867  -4.678  10.591  -3.523
  241   HG22  ILE 867          HG22      ILE 867  -3.850  12.111  -3.841
  242   HG23  ILE 867          HG23      ILE 867  -5.452  11.823  -4.520
  243   HD11  ILE 867          HD11      ILE 867  -6.353  10.032  -1.012
  244   HD12  ILE 867          HD12      ILE 867  -6.429   9.680  -2.740
  245   HD13  ILE 867          HD13      ILE 867  -7.924   9.892  -1.811
  246    H    TRP 868           H        TRP 868  -2.363  10.928  -1.539
  247    HA   TRP 868           HA       TRP 868  -0.882  13.428  -1.402
  248    HD1  TRP 868           HD       TRP 868   1.908  13.374   0.328
  249    HE1  TRP 868           HE1      TRP 868   1.608  13.480   2.884
  250    HE3  TRP 868           HE3      TRP 868  -1.970  10.108   0.790
  251    HZ2  TRP 868           HZ2      TRP 868  -0.086  12.324   4.839
  252    HZ3  TRP 868           HZ3      TRP 868  -2.887   9.665   3.034
  253    HH2  TRP 868           HH       TRP 868  -1.961  10.752   5.012
  254    HB2  TRP 868           HB2      TRP 868  -0.116  10.560  -1.071
  255    HB3  TRP 868           HB1      TRP 868   1.103  11.756  -1.504
  256    H    ILE 869           H        ILE 869  -0.595  14.366  -3.211
  257    HA   ILE 869           HA       ILE 869  -0.593  12.968  -5.725
  258    HB   ILE 869           HB       ILE 869   0.110  15.823  -5.030
  259   HG12  ILE 869          HG12      ILE 869  -2.220  15.362  -4.461
  260   HG13  ILE 869          HG11      ILE 869  -2.121  16.449  -5.836
  261   HG21  ILE 869          HG21      ILE 869   1.080  15.180  -7.136
  262   HG22  ILE 869          HG22      ILE 869  -0.251  16.310  -7.413
  263   HG23  ILE 869          HG23      ILE 869  -0.480  14.587  -7.705
  264   HD11  ILE 869          HD11      ILE 869  -3.873  14.835  -6.144
  265   HD12  ILE 869          HD12      ILE 869  -2.735  13.517  -5.893
  266   HD13  ILE 869          HD13      ILE 869  -2.589  14.548  -7.324
  267    H    CYS 870           H        CYS 870   1.207  12.088  -6.597
  268    HA   CYS 870           HA       CYS 870   3.730  12.307  -5.334
  269    HB2  CYS 870           HB2      CYS 870   3.072  10.306  -6.600
  270    HB3  CYS 870           HB1      CYS 870   2.926  11.260  -8.061
  271    HA   PRO 871           HA       PRO 871   4.582  16.231  -7.398
  272    HB2  PRO 871           HB2      PRO 871   7.283  15.858  -6.268
  273    HB3  PRO 871           HB1      PRO 871   6.142  17.184  -6.024
  274    HG2  PRO 871           HG2      PRO 871   6.632  15.424  -4.075
  275    HG3  PRO 871           HG1      PRO 871   5.002  16.071  -4.341
  276    HD2  PRO 871           HD2      PRO 871   6.139  13.424  -5.161
  277    HD3  PRO 871           HD1      PRO 871   4.562  13.813  -4.429
  278    H    GLY 872           H        GLY 872   5.789  13.188  -8.058
  279    HA2  GLY 872           HA2      GLY 872   7.806  13.983  -9.939
  280    HA3  GLY 872           HA1      GLY 872   7.202  12.352  -9.663
  281    H    CYS 873           H        CYS 873   4.552  12.445 -10.217
  282    HA   CYS 873           HA       CYS 873   4.561  13.073 -13.080
  283    HB2  CYS 873           HB2      CYS 873   2.736  11.336 -12.929
  284    HB3  CYS 873           HB1      CYS 873   4.390  10.791 -12.590
  285    H    ASN 874           H        ASN 874   3.238  13.992 -10.093
  286    HA   ASN 874           HA       ASN 874   1.612  15.342  -9.371
  287    HB2  ASN 874           HB2      ASN 874   2.077  16.724 -11.513
  288    HB3  ASN 874           HB1      ASN 874   0.736  15.863 -12.251
  289   HD21  ASN 874          HD21      ASN 874  -0.557  17.692 -12.505
  290   HD22  ASN 874          HD22      ASN 874  -1.248  18.537 -11.166
  291    H    LYS 875           H        LYS 875   1.351  12.423 -10.074
  292    HA   LYS 875           HA       LYS 875  -1.489  12.215 -10.496
  293    HB2  LYS 875           HB2      LYS 875  -0.281  10.944 -11.988
  294    HB3  LYS 875           HB1      LYS 875   0.877  10.395 -10.777
  295    HG2  LYS 875           HG2      LYS 875  -0.954   9.051  -9.807
  296    HG3  LYS 875           HG1      LYS 875  -1.974   9.519 -11.181
  297    HD2  LYS 875           HD2      LYS 875  -0.301   8.580 -12.724
  298    HD3  LYS 875           HD1      LYS 875   0.677   8.095 -11.344
  299    HE2  LYS 875           HE2      LYS 875  -0.569   6.186 -12.198
  300    HE3  LYS 875           HE1      LYS 875  -1.147   6.611 -10.590
  301    HZ1  LYS 875           HZ1      LYS 875  -2.967   6.125 -12.108
  302    HZ2  LYS 875           HZ2      LYS 875  -2.468   7.342 -13.151
  303    HZ3  LYS 875           HZ3      LYS 875  -3.046   7.739 -11.631
  304    HA   PRO 876           HA       PRO 876  -1.953  11.603  -6.150
  305    HB2  PRO 876           HB2      PRO 876  -4.362  10.370  -6.176
  306    HB3  PRO 876           HB1      PRO 876  -4.174  12.089  -6.522
  307    HG2  PRO 876           HG2      PRO 876  -4.520   9.799  -8.386
  308    HG3  PRO 876           HG1      PRO 876  -5.248  11.418  -8.460
  309    HD2  PRO 876           HD2      PRO 876  -3.098  10.634  -9.944
  310    HD3  PRO 876           HD1      PRO 876  -3.333  12.317  -9.505
  311    H    ASP 877           H        ASP 877  -2.525   9.815  -4.546
  312    HA   ASP 877           HA       ASP 877  -1.072   7.510  -5.255
  313    HB2  ASP 877           HB2      ASP 877  -1.632   6.620  -2.976
  314    HB3  ASP 877           HB1      ASP 877  -0.862   8.191  -2.940
  315    H    ASP 878           H        ASP 878  -1.733   6.333  -6.628
  316    HA   ASP 878           HA       ASP 878  -4.518   5.787  -7.154
  317    HB2  ASP 878           HB2      ASP 878  -3.681   4.903  -9.222
  318    HB3  ASP 878           HB1      ASP 878  -2.917   6.461  -8.910
  319    H    GLY 879           H        GLY 879  -1.980   4.399  -5.470
  320    HA2  GLY 879           HA2      GLY 879  -2.667   2.344  -4.261
  321    HA3  GLY 879           HA1      GLY 879  -3.130   1.711  -5.836
  322    H    SER 880           H        SER 880  -0.637   3.295  -6.824
  323    HA   SER 880           HA       SER 880   1.096   1.088  -6.779
  324    HG   SER 880           HG       SER 880   0.076   3.234  -8.906
  325    HB2  SER 880           HB2      SER 880   1.654   3.954  -7.546
  326    HB3  SER 880           HB1      SER 880   2.662   2.573  -7.957
  327    HA   PRO 881           HA       PRO 881   3.241   1.811  -2.962
  328    HB2  PRO 881           HB2      PRO 881   5.754   1.035  -4.320
  329    HB3  PRO 881           HB1      PRO 881   4.944   0.272  -2.947
  330    HG2  PRO 881           HG2      PRO 881   4.909  -0.905  -5.330
  331    HG3  PRO 881           HG1      PRO 881   3.472  -0.902  -4.299
  332    HD2  PRO 881           HD2      PRO 881   4.097   0.871  -6.634
  333    HD3  PRO 881           HD1      PRO 881   2.597   0.002  -6.272
  334    H    MET 882           H        MET 882   4.382   3.363  -1.969
  335    HA   MET 882           HA       MET 882   5.706   5.344  -3.676
  336    HB2  MET 882           HB2      MET 882   3.889   6.063  -1.368
  337    HB3  MET 882           HB1      MET 882   4.648   7.159  -2.515
  338    HG2  MET 882           HG2      MET 882   3.270   6.115  -4.309
  339    HG3  MET 882           HG1      MET 882   2.490   5.174  -3.034
  340    HE1  MET 882           HE1      MET 882   2.871   8.651  -4.749
  341    HE2  MET 882           HE2      MET 882   3.639   8.931  -3.189
  342    HE3  MET 882           HE3      MET 882   2.111   9.734  -3.574
  343    H    ILE 883           H        ILE 883   7.200   6.649  -2.539
  344    HA   ILE 883           HA       ILE 883   8.128   5.419  -0.069
  345    HB   ILE 883           HB       ILE 883   9.592   4.784  -1.957
  346   HG12  ILE 883          HG12      ILE 883  11.043   6.787  -0.226
  347   HG13  ILE 883          HG11      ILE 883  10.541   5.197   0.348
  348   HG21  ILE 883          HG21      ILE 883  10.933   6.473  -3.133
  349   HG22  ILE 883          HG22      ILE 883  10.043   7.745  -2.304
  350   HG23  ILE 883          HG23      ILE 883   9.203   6.674  -3.431
  351   HD11  ILE 883          HD11      ILE 883  11.962   4.152  -1.322
  352   HD12  ILE 883          HD12      ILE 883  12.898   5.280  -0.333
  353   HD13  ILE 883          HD13      ILE 883  12.397   5.736  -1.954
  354    H    GLY 884           H        GLY 884   8.679   6.740   1.494
  355    HA2  GLY 884           HA2      GLY 884   7.829   9.522   1.324
  356    HA3  GLY 884           HA1      GLY 884   8.215   8.599   2.742
  357    H    CYS 885           H        CYS 885   9.344  11.025   0.938
  358    HA   CYS 885           HA       CYS 885  12.175  10.617   1.009
  359    HB2  CYS 885           HB2      CYS 885  11.047  12.312  -0.429
  360    HB3  CYS 885           HB1      CYS 885  10.506  13.129   1.017
  361    H    ASP 886           H        ASP 886  13.588  11.013   2.673
  362    HA   ASP 886           HA       ASP 886  12.425  11.298   5.262
  363    HB2  ASP 886           HB2      ASP 886  15.216  10.850   4.296
  364    HB3  ASP 886           HB1      ASP 886  14.918  11.280   5.977
  365    H    ASP 887           H        ASP 887  13.312  13.495   2.970
  366    HA   ASP 887           HA       ASP 887  13.867  15.501   5.057
  367    HB2  ASP 887           HB2      ASP 887  15.511  15.384   3.181
  368    HB3  ASP 887           HB1      ASP 887  14.223  15.867   2.076
  369    H    CYS 888           H        CYS 888  12.071  15.124   2.054
  370    HA   CYS 888           HA       CYS 888  10.273  17.303   2.520
  371    HB2  CYS 888           HB2      CYS 888   9.781  14.823   0.848
  372    HB3  CYS 888           HB1      CYS 888   8.753  16.227   0.878
  373    H    ASP 889           H        ASP 889  10.079  13.873   3.277
  374    HA   ASP 889           HA       ASP 889   8.788  12.553   4.503
  375    HB2  ASP 889           HB2      ASP 889   8.996  14.462   6.254
  376    HB3  ASP 889           HB1      ASP 889   7.399  14.970   5.725
  377    H    ASP 890           H        ASP 890   8.037  13.970   1.984
  378    HA   ASP 890           HA       ASP 890   5.151  13.554   1.967
  379    HB2  ASP 890           HB2      ASP 890   6.924  14.870  -0.119
  380    HB3  ASP 890           HB1      ASP 890   5.191  14.646  -0.272
  381    H    TRP 891           H        TRP 891   4.430  12.641  -0.236
  382    HA   TRP 891           HA       TRP 891   5.892  10.130  -0.437
  383    HD1  TRP 891           HD       TRP 891   2.614  11.152   1.873
  384    HE1  TRP 891           HE1      TRP 891   3.083   9.764   3.978
  385    HE3  TRP 891           HE3      TRP 891   5.270   7.399  -0.217
  386    HZ2  TRP 891           HZ2      TRP 891   4.369   7.411   4.662
  387    HZ3  TRP 891           HZ3      TRP 891   6.094   5.619   1.153
  388    HH2  TRP 891           HH       TRP 891   5.688   5.601   3.620
  389    HB2  TRP 891           HB2      TRP 891   2.954  10.693  -0.691
  390    HB3  TRP 891           HB1      TRP 891   3.691   9.150  -1.138
  391    H    TYR 892           H        TYR 892   6.770   9.528  -2.211
  392    HA   TYR 892           HA       TYR 892   5.953  10.730  -4.762
  393    HD1  TYR 892           HD2      TYR 892   8.232  11.443  -1.808
  394    HD2  TYR 892           HD1      TYR 892   8.670  12.632  -5.862
  395    HE1  TYR 892           HE2      TYR 892   8.757  13.712  -1.064
  396    HE2  TYR 892           HE1      TYR 892   9.198  14.906  -5.141
  397    HH   TYR 892           HH       TYR 892   9.687  15.782  -1.773
  398    HB2  TYR 892           HB2      TYR 892   8.675   9.778  -3.796
  399    HB3  TYR 892           HB1      TYR 892   8.317  10.387  -5.405
  400    H    HIS 893           H        HIS 893   5.661   9.161  -6.394
  401    HA   HIS 893           HA       HIS 893   5.371   6.425  -5.485
  402    HD2  HIS 893           HD2      HIS 893   2.614   5.398  -6.290
  403    HE1  HIS 893           HE1      HIS 893   0.814   8.799  -8.085
  404    HE2  HIS 893           HE2      HIS 893   0.471   6.393  -7.317
  405    HB2  HIS 893           HB2      HIS 893   5.239   7.518  -8.297
  406    HB3  HIS 893           HB1      HIS 893   5.014   5.830  -7.912
  407    H    TRP 894           H        TRP 894   6.424   4.612  -6.430
  408    HA   TRP 894           HA       TRP 894   9.181   4.837  -6.221
  409    HD1  TRP 894           HD       TRP 894   8.309   4.480  -4.172
  410    HE1  TRP 894           HE1      TRP 894   8.311   3.035  -2.040
  411    HE3  TRP 894           HE3      TRP 894   8.338  -0.119  -6.343
  412    HZ2  TRP 894           HZ2      TRP 894   8.298   0.283  -1.382
  413    HZ3  TRP 894           HZ3      TRP 894   8.339  -2.103  -4.924
  414    HH2  TRP 894           HH       TRP 894   8.322  -1.909  -2.479
  415    HB2  TRP 894           HB2      TRP 894   7.399   2.580  -7.059
  416    HB3  TRP 894           HB1      TRP 894   9.146   2.424  -7.098
  417    HA   PRO 895           HA       PRO 895   9.596   3.903 -10.938
  418    HB2  PRO 895           HB2      PRO 895   7.490   4.653 -12.556
  419    HB3  PRO 895           HB1      PRO 895   7.745   3.009 -11.962
  420    HG2  PRO 895           HG2      PRO 895   5.988   5.168 -10.845
  421    HG3  PRO 895           HG1      PRO 895   5.604   3.456 -11.114
  422    HD2  PRO 895           HD2      PRO 895   6.231   4.324  -8.685
  423    HD3  PRO 895           HD1      PRO 895   6.851   2.766  -9.275
  424    H    CYS 896           H        CYS 896   7.832   6.606  -9.738
  425    HA   CYS 896           HA       CYS 896   8.469   8.520 -11.699
  426    HB2  CYS 896           HB2      CYS 896   7.670   8.839  -8.827
  427    HB3  CYS 896           HB1      CYS 896   7.412  10.004 -10.145
  428    H    VAL 897           H        VAL 897   9.813   7.637  -8.558
  429    HA   VAL 897           HA       VAL 897  11.892   9.633  -8.905
  430    HB   VAL 897           HB       VAL 897  12.605   9.058  -6.599
  431   HG11  VAL 897          HG11      VAL 897   9.697   9.731  -6.992
  432   HG12  VAL 897          HG12      VAL 897  11.041  10.873  -6.929
  433   HG13  VAL 897          HG13      VAL 897  10.567   9.970  -5.488
  434   HG21  VAL 897          HG21      VAL 897  11.182   7.616  -5.220
  435   HG22  VAL 897          HG22      VAL 897  11.862   6.725  -6.587
  436   HG23  VAL 897          HG23      VAL 897  10.185   7.256  -6.633
  437    H    GLY 898           H        GLY 898  11.489   6.240  -9.245
  438    HA2  GLY 898           HA2      GLY 898  13.149   5.168 -10.697
  439    HA3  GLY 898           HA1      GLY 898  14.382   6.048  -9.815
  440    H    ILE 899           H        ILE 899  11.831   4.747  -7.952
  441    HA   ILE 899           HA       ILE 899  13.681   2.785  -6.808
  442    HB   ILE 899           HB       ILE 899  10.981   3.821  -5.872
  443   HG12  ILE 899          HG12      ILE 899  12.925   5.392  -5.645
  444   HG13  ILE 899          HG11      ILE 899  12.121   4.999  -4.131
  445   HG21  ILE 899          HG21      ILE 899  11.363   2.582  -3.779
  446   HG22  ILE 899          HG22      ILE 899  12.817   1.871  -4.479
  447   HG23  ILE 899          HG23      ILE 899  11.236   1.510  -5.173
  448   HD11  ILE 899          HD11      ILE 899  13.905   3.445  -3.622
  449   HD12  ILE 899          HD12      ILE 899  14.495   5.088  -3.879
  450   HD13  ILE 899          HD13      ILE 899  14.716   3.863  -5.142
  451    H    MET 900           H        MET 900  13.409   0.639  -7.299
  452    HA   MET 900           HA       MET 900  10.803  -0.078  -8.488
  453    HB2  MET 900           HB2      MET 900  11.856  -1.851  -9.773
  454    HB3  MET 900           HB1      MET 900  12.661  -0.326 -10.104
  455    HG2  MET 900           HG2      MET 900  14.500  -0.954  -8.669
  456    HG3  MET 900           HG1      MET 900  13.682  -2.458  -8.239
  457    HE1  MET 900           HE1      MET 900  13.930  -0.672 -11.757
  458    HE2  MET 900           HE2      MET 900  15.348  -1.470 -12.428
  459    HE3  MET 900           HE3      MET 900  15.514  -0.414 -11.025
  460    H    ALA 901           H        ALA 901  13.106  -0.799  -6.045
  461    HA   ALA 901           HA       ALA 901  11.213  -2.686  -4.932
  462    HB1  ALA 901           HB1      ALA 901  13.038  -4.018  -5.883
  463    HB2  ALA 901           HB2      ALA 901  13.112  -4.055  -4.120
  464    HB3  ALA 901           HB3      ALA 901  14.214  -3.021  -5.028
  465    H    ALA 902           H        ALA 902  11.163  -2.604  -2.692
  466    HA   ALA 902           HA       ALA 902  11.621  -0.023  -1.647
  467    HB1  ALA 902           HB1      ALA 902  10.714  -0.950   0.445
  468    HB2  ALA 902           HB2      ALA 902  10.746  -2.560  -0.278
  469    HB3  ALA 902           HB3      ALA 902   9.709  -1.306  -0.955
  470    HA   PRO 903           HA       PRO 903  15.661  -0.938   0.178
  471    HB2  PRO 903           HB2      PRO 903  16.114   1.540   1.126
  472    HB3  PRO 903           HB1      PRO 903  16.215   1.234  -0.613
  473    HG2  PRO 903           HG2      PRO 903  14.016   2.483   0.974
  474    HG3  PRO 903           HG1      PRO 903  14.659   2.950  -0.610
  475    HD2  PRO 903           HD2      PRO 903  12.371   1.487  -0.232
  476    HD3  PRO 903           HD1      PRO 903  13.351   1.465  -1.710
  477    HA   PRO 904           HA       PRO 904  14.427  -1.536   4.418
  478    HB2  PRO 904           HB2      PRO 904  16.794  -0.118   5.439
  479    HB3  PRO 904           HB1      PRO 904  16.326  -1.801   5.673
  480    HG2  PRO 904           HG2      PRO 904  18.372  -1.053   4.121
  481    HG3  PRO 904           HG1      PRO 904  17.387  -2.499   3.776
  482    HD2  PRO 904           HD2      PRO 904  17.395   0.194   2.490
  483    HD3  PRO 904           HD1      PRO 904  17.103  -1.392   1.752
  484    H    GLU 905           H        GLU 905  13.224  -0.379   5.871
  485    HA   GLU 905           HA       GLU 905  12.965   2.410   5.323
  486    HB2  GLU 905           HB2      GLU 905  11.577   0.742   7.423
  487    HB3  GLU 905           HB1      GLU 905  11.128   2.372   6.937
  488    HG2  GLU 905           HG2      GLU 905  10.779   1.521   4.640
  489    HG3  GLU 905           HG1      GLU 905  11.047  -0.102   5.261
  490    H    GLU 906           H        GLU 906  15.057   0.706   7.107
  491    HA   GLU 906           HA       GLU 906  15.412   2.756   9.143
  492    HB2  GLU 906           HB2      GLU 906  17.348   1.422   9.906
  493    HB3  GLU 906           HB1      GLU 906  15.897   0.441   9.799
  494    HG2  GLU 906           HG2      GLU 906  16.667  -0.515   7.711
  495    HG3  GLU 906           HG1      GLU 906  18.094   0.520   7.746
  496    H    MET 907           H        MET 907  16.283   2.084   5.988
  497    HA   MET 907           HA       MET 907  18.736   3.601   5.881
  498    HB2  MET 907           HB2      MET 907  18.504   1.710   4.391
  499    HB3  MET 907           HB1      MET 907  16.953   2.311   3.824
  500    HG2  MET 907           HG2      MET 907  18.597   2.665   2.120
  501    HG3  MET 907           HG1      MET 907  18.116   4.219   2.784
  502    HE1  MET 907           HE1      MET 907  20.681   3.774   0.966
  503    HE2  MET 907           HE2      MET 907  21.855   4.777   1.819
  504    HE3  MET 907           HE3      MET 907  20.196   5.339   1.621
  505    H    GLN 908           H        GLN 908  18.824   5.629   5.075
  506    HA   GLN 908           HA       GLN 908  16.241   6.921   4.865
  507    HB2  GLN 908           HB2      GLN 908  18.932   8.158   5.350
  508    HB3  GLN 908           HB1      GLN 908  17.443   9.057   5.137
  509    HG2  GLN 908           HG2      GLN 908  16.456   7.818   7.049
  510    HG3  GLN 908           HG1      GLN 908  18.041   7.108   7.339
  511   HE21  GLN 908          HE21      GLN 908  16.177   9.976   7.335
  512   HE22  GLN 908          HE22      GLN 908  17.226  10.928   8.337
  513    H    TRP 909           H        TRP 909  15.833   8.406   3.330
  514    HA   TRP 909           HA       TRP 909  17.325   8.168   0.857
  515    HD1  TRP 909           HD       TRP 909  16.765   6.146  -1.746
  516    HE1  TRP 909           HE1      TRP 909  15.695   6.900  -3.954
  517    HE3  TRP 909           HE3      TRP 909  12.968   8.962   0.149
  518    HZ2  TRP 909           HZ2      TRP 909  13.488   8.515  -4.779
  519    HZ3  TRP 909           HZ3      TRP 909  11.425  10.082  -1.397
  520    HH2  TRP 909           HH       TRP 909  11.683   9.861  -3.808
  521    HB2  TRP 909           HB2      TRP 909  15.901   6.180   0.770
  522    HB3  TRP 909           HB1      TRP 909  14.485   7.157   1.142
  523    H    PHE 910           H        PHE 910  16.860   9.824  -0.523
  524    HA   PHE 910           HA       PHE 910  14.927  11.788   0.396
  525    HD1  PHE 910           HD1      PHE 910  15.831  13.653   2.371
  526    HD2  PHE 910           HD2      PHE 910  19.054  11.169   1.166
  527    HE1  PHE 910           HE1      PHE 910  16.537  13.417   4.728
  528    HE2  PHE 910           HE2      PHE 910  19.758  10.927   3.500
  529    HZ   PHE 910           HZ       PHE 910  18.490  12.036   5.285
  530    HB2  PHE 910           HB2      PHE 910  17.791  12.376  -0.441
  531    HB3  PHE 910           HB1      PHE 910  16.584  13.572   0.027
  532    H    CYS 911           H        CYS 911  13.913  12.794  -1.291
  533    HA   CYS 911           HA       CYS 911  13.744  11.472  -3.748
  534    HB2  CYS 911           HB2      CYS 911  12.280  13.287  -4.449
  535    HB3  CYS 911           HB1      CYS 911  11.976  12.920  -2.769
  536    HA   PRO 912           HA       PRO 912  16.897  13.004  -6.517
  537    HB2  PRO 912           HB2      PRO 912  15.374  14.178  -8.557
  538    HB3  PRO 912           HB1      PRO 912  15.878  12.487  -8.470
  539    HG2  PRO 912           HG2      PRO 912  13.289  13.736  -7.655
  540    HG3  PRO 912           HG1      PRO 912  13.578  12.181  -8.456
  541    HD2  PRO 912           HD2      PRO 912  12.988  12.238  -5.885
  542    HD3  PRO 912           HD1      PRO 912  14.254  11.151  -6.473
  543    H    LYS 913           H        LYS 913  14.689  15.190  -5.130
  544    HA   LYS 913           HA       LYS 913  16.213  17.544  -6.003
  545    HB2  LYS 913           HB2      LYS 913  13.895  17.374  -4.086
  546    HB3  LYS 913           HB1      LYS 913  14.607  18.856  -4.686
  547    HG2  LYS 913           HG2      LYS 913  13.874  18.160  -6.976
  548    HG3  LYS 913           HG1      LYS 913  13.009  16.821  -6.215
  549    HD2  LYS 913           HD2      LYS 913  12.559  19.773  -5.742
  550    HD3  LYS 913           HD1      LYS 913  11.478  18.669  -6.584
  551    HE2  LYS 913           HE2      LYS 913  12.197  18.605  -3.641
  552    HE3  LYS 913           HE1      LYS 913  10.663  19.100  -4.334
  553    HZ1  LYS 913           HZ1      LYS 913  10.387  16.918  -3.564
  554    HZ2  LYS 913           HZ2      LYS 913  11.805  16.353  -4.233
  555    HZ3  LYS 913           HZ3      LYS 913  10.498  16.785  -5.234
  556    H    CYS 914           H        CYS 914  15.260  15.832  -3.068
  557    HA   CYS 914           HA       CYS 914  16.820  17.468  -1.413
  558    HB2  CYS 914           HB2      CYS 914  15.217  15.005  -0.963
  559    HB3  CYS 914           HB1      CYS 914  16.107  15.660   0.390
  560    H    ALA 915           H        ALA 915  17.403  14.325  -2.830
  561    HA   ALA 915           HA       ALA 915  19.776  13.967  -1.305
  562    HB1  ALA 915           HB1      ALA 915  20.172  12.019  -2.737
  563    HB2  ALA 915           HB2      ALA 915  18.918  12.591  -3.839
  564    HB3  ALA 915           HB3      ALA 915  18.481  12.075  -2.218
  565    H    ASN 916           H        ASN 916  18.950  15.786  -3.903
  566    HA   ASN 916           HA       ASN 916  21.529  15.715  -5.261
  567    HB2  ASN 916           HB2      ASN 916  19.464  15.713  -6.606
  568    HB3  ASN 916           HB1      ASN 916  19.037  17.280  -5.930
  569   HD21  ASN 916          HD21      ASN 916  20.131  19.103  -6.637
  570   HD22  ASN 916          HD22      ASN 916  21.124  19.094  -8.039
  571    H    LYS 917           H        LYS 917  19.471  17.931  -3.458
  572    HA   LYS 917           HA       LYS 917  21.107  20.194  -3.681
  573    HB2  LYS 917           HB2      LYS 917  19.829  21.135  -1.837
  574    HB3  LYS 917           HB1      LYS 917  18.752  20.285  -2.929
  575    HG2  LYS 917           HG2      LYS 917  18.816  18.349  -1.374
  576    HG3  LYS 917           HG1      LYS 917  19.763  19.360  -0.279
  577    HD2  LYS 917           HD2      LYS 917  17.916  20.965  -0.152
  578    HD3  LYS 917           HD1      LYS 917  16.984  19.979  -1.279
  579    HE2  LYS 917           HE2      LYS 917  17.142  18.094   0.394
  580    HE3  LYS 917           HE1      LYS 917  17.868  19.240   1.499
  581    HZ1  LYS 917           HZ1      LYS 917  15.200  19.638   0.282
  582    HZ2  LYS 917           HZ2      LYS 917  15.871  20.565   1.514
  583    HZ3  LYS 917           HZ3      LYS 917  15.409  18.980   1.798
  584    H    ILE 918           H        ILE 918  21.315  17.430  -1.649
  585    HA   ILE 918           HA       ILE 918  23.113  18.547   0.265
  586    HB   ILE 918           HB       ILE 918  22.650  15.619  -0.399
  587   HG12  ILE 918          HG12      ILE 918  21.227  17.392   1.611
  588   HG13  ILE 918          HG11      ILE 918  20.560  16.750   0.110
  589   HG21  ILE 918          HG21      ILE 918  23.706  16.941   2.105
  590   HG22  ILE 918          HG22      ILE 918  24.658  16.009   0.947
  591   HG23  ILE 918          HG23      ILE 918  23.410  15.213   1.904
  592   HD11  ILE 918          HD11      ILE 918  20.743  14.491   0.970
  593   HD12  ILE 918          HD12      ILE 918  19.783  15.498   2.047
  594   HD13  ILE 918          HD13      ILE 918  21.453  15.104   2.462
  595    H    LYS 919           H        LYS 919  23.457  17.042  -2.863
  596    HA   LYS 919           HA       LYS 919  26.287  16.659  -2.329
  597    HB2  LYS 919           HB2      LYS 919  24.895  14.722  -3.211
  598    HB3  LYS 919           HB1      LYS 919  24.823  15.605  -4.731
  599    HG2  LYS 919           HG2      LYS 919  27.259  15.581  -4.867
  600    HG3  LYS 919           HG1      LYS 919  27.329  14.692  -3.349
  601    HD2  LYS 919           HD2      LYS 919  25.993  12.884  -4.446
  602    HD3  LYS 919           HD1      LYS 919  26.175  13.757  -5.970
  603    HE2  LYS 919           HE2      LYS 919  28.412  12.667  -4.254
  604    HE3  LYS 919           HE1      LYS 919  27.867  12.010  -5.793
  605    HZ1  LYS 919           HZ1      LYS 919  29.849  13.333  -6.060
  606    HZ2  LYS 919           HZ2      LYS 919  29.106  14.685  -5.391
  607    HZ3  LYS 919           HZ3      LYS 919  28.565  14.060  -6.864
  608    H    LYS 920           H        LYS 920  26.605  18.862  -2.445
  609    HA   LYS 920           HA       LYS 920  27.187  19.731  -5.203
  610    HB2  LYS 920           HB2      LYS 920  26.606  22.011  -4.649
  611    HB3  LYS 920           HB1      LYS 920  25.215  20.947  -4.459
  612    HG2  LYS 920           HG2      LYS 920  25.245  21.104  -2.156
  613    HG3  LYS 920           HG1      LYS 920  26.919  21.666  -2.104
  614    HD2  LYS 920           HD2      LYS 920  25.571  23.579  -1.646
  615    HD3  LYS 920           HD1      LYS 920  26.154  23.723  -3.305
  616    HE2  LYS 920           HE2      LYS 920  23.854  24.361  -3.322
  617    HE3  LYS 920           HE1      LYS 920  23.969  22.768  -4.061
  618    HZ1  LYS 920           HZ1      LYS 920  23.196  21.771  -2.000
  619    HZ2  LYS 920           HZ2      LYS 920  22.114  22.978  -2.471
  620    HZ3  LYS 920           HZ3      LYS 920  23.208  23.265  -1.246
  621    H    ASP 921           H        ASP 921  28.565  18.557  -2.868
  622    HA   ASP 921           HA       ASP 921  30.230  20.419  -1.557
  623    HB2  ASP 921           HB2      ASP 921  29.887  18.141  -0.708
  624    HB3  ASP 921           HB1      ASP 921  30.730  17.490  -2.103
  625    H    LYS 922           H        LYS 922  31.324  21.818  -2.713
  626    HA   LYS 922           HA       LYS 922  32.778  22.786  -4.149
  627    HB2  LYS 922           HB2      LYS 922  34.164  20.104  -3.904
  628    HB3  LYS 922           HB1      LYS 922  34.899  21.543  -4.609
  629    HG2  LYS 922           HG2      LYS 922  34.676  22.716  -2.489
  630    HG3  LYS 922           HG1      LYS 922  33.891  21.305  -1.789
  631    HD2  LYS 922           HD2      LYS 922  35.921  20.003  -2.113
  632    HD3  LYS 922           HD1      LYS 922  36.706  21.409  -2.845
  633    HE2  LYS 922           HE2      LYS 922  36.474  22.657  -0.786
  634    HE3  LYS 922           HE1      LYS 922  35.579  21.338  -0.052
  635    HZ1  LYS 922           HZ1      LYS 922  37.839  21.323   0.700
  636    HZ2  LYS 922           HZ2      LYS 922  38.442  21.300  -0.858
  637    HZ3  LYS 922           HZ3      LYS 922  37.597  19.969  -0.256
  638    H    LYS 923           H        LYS 923  30.494  21.403  -5.192
  639    HA   LYS 923           HA       LYS 923  31.271  21.132  -7.984
  640    HB2  LYS 923           HB2      LYS 923  29.603  19.122  -6.429
  641    HB3  LYS 923           HB1      LYS 923  29.721  19.157  -8.179
  642    HG2  LYS 923           HG2      LYS 923  32.088  18.782  -6.358
  643    HG3  LYS 923           HG1      LYS 923  31.155  17.448  -7.038
  644    HD2  LYS 923           HD2      LYS 923  31.755  18.082  -9.269
  645    HD3  LYS 923           HD1      LYS 923  32.481  19.585  -8.705
  646    HE2  LYS 923           HE2      LYS 923  33.460  16.849  -7.914
  647    HE3  LYS 923           HE1      LYS 923  34.117  17.763  -9.270
  648    HZ1  LYS 923           HZ1      LYS 923  34.716  19.520  -7.747
  649    HZ2  LYS 923           HZ2      LYS 923  35.465  18.087  -7.308
  650    HZ3  LYS 923           HZ3      LYS 923  34.140  18.653  -6.420
  651    H    HIS 924           H        HIS 924  29.011  20.818  -9.167
  652    HA   HIS 924           HA       HIS 924  26.835  22.216  -7.945
  653    HD1  HIS 924           HD1      HIS 924  26.362  23.741 -12.032
  654    HD2  HIS 924           HD2      HIS 924  25.469  25.018  -8.181
  655    HE1  HIS 924           HE1      HIS 924  24.207  25.027 -12.233
  656    HE2  HIS 924           HE2      HIS 924  23.536  25.398  -9.861
  657    HB2  HIS 924           HB2      HIS 924  28.154  24.094  -8.879
  658    HB3  HIS 924           HB1      HIS 924  28.217  23.271 -10.433
  Start of MODEL    9
    1    HA   ALA   1           HA       ALA   1  12.525   6.508   2.710
    2    H1   ALA   1           HT1      ALA   1  14.210   5.080   4.685
    3    H2   ALA   1           HT2      ALA   1  13.064   6.206   5.097
    4    H3   ALA   1           HT3      ALA   1  14.319   6.724   4.160
    5    HB1  ALA   1           HB1      ALA   1  12.786   4.437   1.407
    6    HB2  ALA   1           HB2      ALA   1  13.715   3.727   2.718
    7    HB3  ALA   1           HB3      ALA   1  14.367   5.098   1.833
    8    H    ARG   2           H        ARG   2  10.532   6.631   3.677
    9    HA   ARG   2           HA       ARG   2   9.565   4.216   4.983
   10    HE   ARG   2           HE       ARG   2   5.289   6.299   6.069
   11    HB2  ARG   2           HB2      ARG   2   9.114   6.843   5.624
   12    HB3  ARG   2           HB1      ARG   2   7.759   6.530   4.575
   13    HG2  ARG   2           HG2      ARG   2   7.022   4.686   5.935
   14    HG3  ARG   2           HG1      ARG   2   8.443   4.835   6.955
   15    HD2  ARG   2           HD2      ARG   2   6.689   5.854   8.168
   16    HD3  ARG   2           HD1      ARG   2   7.652   7.170   7.516
   17   HH11  ARG   2          HH11      ARG   2   6.944   8.835   7.909
   18   HH12  ARG   2          HH12      ARG   2   5.699   9.967   7.842
   19   HH21  ARG   2          HH21      ARG   2   3.464   7.928   5.976
   20   HH22  ARG   2          HH22      ARG   2   3.695   9.441   6.715
   21    H    THR   3           H        THR   3   8.289   2.805   3.931
   22    HA   THR   3           HA       THR   3   7.410   3.621   1.277
   23    HB   THR   3           HB       THR   3   7.454   1.081   0.862
   24    HG1  THR   3           HG1      THR   3   7.800   0.592   3.162
   25   HG21  THR   3          HG21      THR   3  10.040   2.589   1.294
   26   HG22  THR   3          HG22      THR   3   9.029   2.671  -0.144
   27   HG23  THR   3          HG23      THR   3   9.845   1.161   0.277
   28    HA   M3L   4           HA       M3L   4   3.618   1.922   2.597
   29    H    M3L   4           H        M3L   4   5.290   3.440   0.768
   30    HB2  M3L   4           HB2      M3L   4   3.538   4.420   2.947
   31    HB3  M3L   4           HB1      M3L   4   2.008   3.699   2.483
   32    HG2  M3L   4           HG2      M3L   4   3.424   4.487   0.127
   33    HG3  M3L   4           HG1      M3L   4   3.374   5.845   1.253
   34    HD2  M3L   4           HD2      M3L   4   1.438   5.895  -0.199
   35    HD3  M3L   4           HD1      M3L   4   1.022   4.244   0.269
   36    HE2  M3L   4           HE2      M3L   4   0.063   4.903   2.146
   37    HE3  M3L   4           HE1      M3L   4   1.501   5.807   2.541
   38   HM11  M3L   4          HM11      M3L   4  -1.774   6.984   2.746
   39   HM12  M3L   4          HM12      M3L   4  -0.280   7.138   3.607
   40   HM13  M3L   4          HM13      M3L   4  -0.917   8.501   2.741
   41   HM21  M3L   4          HM21      M3L   4   1.839   8.080   1.659
   42   HM22  M3L   4          HM22      M3L   4   0.525   9.063   1.061
   43   HM23  M3L   4          HM23      M3L   4   1.297   7.914   0.020
   44   HM31  M3L   4          HM31      M3L   4  -1.484   5.732   0.434
   45   HM32  M3L   4          HM32      M3L   4  -0.581   6.719  -0.649
   46   HM33  M3L   4          HM33      M3L   4  -1.841   7.423   0.314
   47    H    GLN   5           H        GLN   5   1.592   1.356   1.605
   48    HA   GLN   5           HA       GLN   5   1.019   1.889  -1.108
   49    HB2  GLN   5           HB2      GLN   5   2.621  -0.113  -1.274
   50    HB3  GLN   5           HB1      GLN   5   1.440  -1.028  -0.344
   51    HG2  GLN   5           HG2      GLN   5  -0.246  -0.554  -2.115
   52    HG3  GLN   5           HG1      GLN   5   1.009   0.242  -3.034
   53   HE21  GLN   5          HE21      GLN   5   3.033  -1.769  -2.262
   54   HE22  GLN   5          HE22      GLN   5   2.620  -3.134  -3.234
   55    H    THR   6           H        THR   6  -1.246   1.288  -1.434
   56    HA   THR   6           HA       THR   6  -2.469   0.147   0.920
   57    HB   THR   6           HB       THR   6  -3.596   2.604  -0.459
   58    HG1  THR   6           HG1      THR   6  -1.767   2.298   1.499
   59   HG21  THR   6          HG21      THR   6  -4.477   1.134   2.039
   60   HG22  THR   6          HG22      THR   6  -5.242   0.992   0.469
   61   HG23  THR   6          HG23      THR   6  -5.276   2.546   1.323
   62    H    ALA   7           H        ALA   7  -2.489  -1.701  -0.354
   63    HA   ALA   7           HA       ALA   7  -4.661  -1.690  -2.299
   64    HB1  ALA   7           HB1      ALA   7  -2.033  -3.150  -2.515
   65    HB2  ALA   7           HB2      ALA   7  -2.532  -1.771  -3.495
   66    HB3  ALA   7           HB3      ALA   7  -3.389  -3.308  -3.629
   67    H    ARG   8           H        ARG   8  -5.014  -4.140  -2.750
   68    HA   ARG   8           HA       ARG   8  -6.228  -5.415  -0.606
   69    HE   ARG   8           HE       ARG   8  -8.429  -7.297  -3.940
   70    HB2  ARG   8           HB2      ARG   8  -6.426  -5.914  -3.094
   71    HB3  ARG   8           HB1      ARG   8  -4.935  -6.816  -2.941
   72    HG2  ARG   8           HG2      ARG   8  -6.025  -8.315  -1.327
   73    HG3  ARG   8           HG1      ARG   8  -7.531  -7.422  -1.554
   74    HD2  ARG   8           HD2      ARG   8  -6.002  -8.923  -3.671
   75    HD3  ARG   8           HD1      ARG   8  -7.534  -9.402  -2.953
   76   HH11  ARG   8          HH11      ARG   8  -5.643  -8.958  -5.446
   77   HH12  ARG   8          HH12      ARG   8  -5.986  -8.397  -7.009
   78   HH21  ARG   8          HH21      ARG   8  -8.889  -6.571  -6.136
   79   HH22  ARG   8          HH22      ARG   8  -7.845  -7.013  -7.411
   80    H    LYS   9           H        LYS   9  -3.043  -6.020  -2.028
   81    HA   LYS   9           HA       LYS   9  -2.196  -7.185   0.506
   82    HB2  LYS   9           HB2      LYS   9  -0.201  -8.015  -0.749
   83    HB3  LYS   9           HB1      LYS   9  -1.696  -8.696  -1.344
   84    HG2  LYS   9           HG2      LYS   9  -1.641  -7.148  -3.238
   85    HG3  LYS   9           HG1      LYS   9  -0.141  -6.450  -2.618
   86    HD2  LYS   9           HD2      LYS   9   0.954  -8.633  -2.822
   87    HD3  LYS   9           HD1      LYS   9  -0.546  -9.326  -3.436
   88    HE2  LYS   9           HE2      LYS   9  -0.455  -7.815  -5.354
   89    HE3  LYS   9           HE1      LYS   9   1.037  -7.111  -4.732
   90    HZ1  LYS   9           HZ1      LYS   9   1.459  -8.764  -6.434
   91    HZ2  LYS   9           HZ2      LYS   9   0.692  -9.957  -5.528
   92    HZ3  LYS   9           HZ3      LYS   9   2.109  -9.242  -4.962
   93    H    SER  10           H        SER  10  -0.654  -6.174   1.629
   94    HA   SER  10           HA       SER  10   0.455  -4.463   2.496
   95    HG   SER  10           HG       SER  10   1.646  -2.113   1.345
   96    HB2  SER  10           HB2      SER  10   1.998  -4.805   0.509
   97    HB3  SER  10           HB1      SER  10   1.072  -3.583  -0.355
   98    H    THR  11           H        THR  11  -1.487  -3.690   3.328
   99    HA   THR  11           HA       THR  11  -2.787  -1.540   1.884
  100    HB   THR  11           HB       THR  11  -3.544  -2.763   4.552
  101    HG1  THR  11           HG1      THR  11  -4.225  -3.451   1.864
  102   HG21  THR  11          HG21      THR  11  -5.776  -1.879   4.030
  103   HG22  THR  11          HG22      THR  11  -5.173  -1.231   2.508
  104   HG23  THR  11          HG23      THR  11  -4.590  -0.573   4.038
  105    H    GLY  12           H        GLY  12  -0.502  -2.106   4.375
  106    HA2  GLY  12           HA2      GLY  12  -0.609   0.734   5.140
  107    HA3  GLY  12           HA1      GLY  12  -0.227  -0.546   6.285
  108    H    GLY  13           H        GLY  13   1.763   0.106   6.820
  109    HA2  GLY  13           HA2      GLY  13   3.922  -0.649   5.224
  110    HA3  GLY  13           HA1      GLY  13   3.753   1.108   5.197
  111    H1   GLY 850           HT1      GLY 850   3.480  21.497  11.182
  112    H2   GLY 850           HT2      GLY 850   4.291  20.029  10.923
  113    H3   GLY 850           HT3      GLY 850   2.931  20.094  11.939
  114    HA2  GLY 850           HA1      GLY 850   2.901  20.624   9.054
  115    HA3  GLY 850           HA2      GLY 850   2.394  19.122   9.818
  116    H    SER 851           H        SER 851   0.957  21.158   8.228
  117    HA   SER 851           HA       SER 851  -1.444  21.245   9.740
  118    HG   SER 851           HG       SER 851  -2.647  23.283   9.525
  119    HB2  SER 851           HB2      SER 851  -0.197  23.290  10.592
  120    HB3  SER 851           HB1      SER 851  -0.080  23.856   8.934
  121    H    HIS 852           H        HIS 852  -3.125  21.239   8.148
  122    HA   HIS 852           HA       HIS 852  -2.233  21.956   5.503
  123    HD2  HIS 852           HD2      HIS 852  -5.173  19.222   3.837
  124    HE1  HIS 852           HE1      HIS 852  -2.183  20.316   1.063
  125    HE2  HIS 852           HE2      HIS 852  -4.425  19.302   1.324
  126    HB2  HIS 852           HB2      HIS 852  -1.874  19.515   5.748
  127    HB3  HIS 852           HB1      HIS 852  -3.600  19.322   6.048
  128    H    MET 853           H        MET 853  -3.446  23.557   5.155
  129    HA   MET 853           HA       MET 853  -6.265  23.087   4.701
  130    HB2  MET 853           HB2      MET 853  -6.106  24.162   6.936
  131    HB3  MET 853           HB1      MET 853  -5.150  25.458   6.254
  132    HG2  MET 853           HG2      MET 853  -7.417  26.209   6.689
  133    HG3  MET 853           HG1      MET 853  -7.100  26.220   4.963
  134    HE1  MET 853           HE1      MET 853  -8.650  25.034   3.214
  135    HE2  MET 853           HE2      MET 853  -9.534  23.553   3.548
  136    HE3  MET 853           HE3      MET 853  -7.779  23.560   3.623
  137    H    ALA 854           H        ALA 854  -4.010  23.059   3.095
  138    HA   ALA 854           HA       ALA 854  -4.064  25.622   1.671
  139    HB1  ALA 854           HB1      ALA 854  -1.817  23.637   1.967
  140    HB2  ALA 854           HB2      ALA 854  -1.899  25.240   2.702
  141    HB3  ALA 854           HB3      ALA 854  -1.783  25.072   0.950
  142    H    MET 855           H        MET 855  -4.338  25.512  -0.507
  143    HA   MET 855           HA       MET 855  -5.152  23.012  -1.643
  144    HB2  MET 855           HB2      MET 855  -4.663  25.718  -2.953
  145    HB3  MET 855           HB1      MET 855  -5.325  24.325  -3.781
  146    HG2  MET 855           HG2      MET 855  -7.101  25.844  -3.253
  147    HG3  MET 855           HG1      MET 855  -7.285  24.404  -2.262
  148    HE1  MET 855           HE1      MET 855  -9.016  25.704  -0.693
  149    HE2  MET 855           HE2      MET 855  -8.829  27.134  -1.707
  150    HE3  MET 855           HE3      MET 855  -8.674  27.272   0.043
  151    H    ALA 856           H        ALA 856  -3.422  21.704  -1.491
  152    HA   ALA 856           HA       ALA 856  -1.040  22.439  -3.029
  153    HB1  ALA 856           HB1      ALA 856  -1.044  21.156  -0.295
  154    HB2  ALA 856           HB2      ALA 856  -0.633  22.835  -0.634
  155    HB3  ALA 856           HB3      ALA 856   0.378  21.537  -1.265
  156    H    TYR 857           H        TYR 857   0.247  19.945  -2.170
  157    HA   TYR 857           HA       TYR 857  -0.879  18.325  -4.224
  158    HD1  TYR 857           HD2      TYR 857   2.247  20.269  -3.300
  159    HD2  TYR 857           HD1      TYR 857   1.405  17.063  -5.935
  160    HE1  TYR 857           HE2      TYR 857   3.398  21.464  -5.098
  161    HE2  TYR 857           HE1      TYR 857   2.560  18.235  -7.759
  162    HH   TYR 857           HH       TYR 857   3.140  20.541  -8.341
  163    HB2  TYR 857           HB2      TYR 857   1.543  18.010  -2.480
  164    HB3  TYR 857           HB1      TYR 857   1.044  16.781  -3.640
  165    H    VAL 858           H        VAL 858  -1.087  18.376  -0.809
  166    HA   VAL 858           HA       VAL 858  -2.322  15.737  -0.802
  167    HB   VAL 858           HB       VAL 858  -2.119  17.745   1.485
  168   HG11  VAL 858          HG11      VAL 858  -2.986  14.849   1.526
  169   HG12  VAL 858          HG12      VAL 858  -4.034  16.246   1.749
  170   HG13  VAL 858          HG13      VAL 858  -2.784  15.884   2.939
  171   HG21  VAL 858          HG21      VAL 858  -0.571  15.212   0.999
  172   HG22  VAL 858          HG22      VAL 858  -0.418  16.274   2.399
  173   HG23  VAL 858          HG23      VAL 858   0.053  16.845   0.794
  174    H    ILE 859           H        ILE 859  -4.325  15.540  -1.438
  175    HA   ILE 859           HA       ILE 859  -6.222  17.692  -0.794
  176    HB   ILE 859           HB       ILE 859  -7.478  17.202  -2.845
  177   HG12  ILE 859          HG12      ILE 859  -5.227  15.303  -3.582
  178   HG13  ILE 859          HG11      ILE 859  -6.815  14.806  -3.017
  179   HG21  ILE 859          HG21      ILE 859  -5.920  18.097  -4.535
  180   HG22  ILE 859          HG22      ILE 859  -4.572  17.772  -3.448
  181   HG23  ILE 859          HG23      ILE 859  -5.796  18.957  -2.998
  182   HD11  ILE 859          HD11      ILE 859  -6.626  14.607  -5.427
  183   HD12  ILE 859          HD12      ILE 859  -6.242  16.324  -5.546
  184   HD13  ILE 859          HD13      ILE 859  -7.835  15.814  -4.985
  185    H    ARG 860           H        ARG 860  -8.504  16.702  -0.779
  186    HA   ARG 860           HA       ARG 860  -8.277  14.001   0.306
  187    HE   ARG 860           HE       ARG 860 -10.626  17.944   2.087
  188    HB2  ARG 860           HB2      ARG 860 -10.531  16.008   0.533
  189    HB3  ARG 860           HB1      ARG 860 -10.590  14.365   1.140
  190    HG2  ARG 860           HG2      ARG 860  -8.859  14.807   2.694
  191    HG3  ARG 860           HG1      ARG 860  -8.608  16.438   2.044
  192    HD2  ARG 860           HD2      ARG 860 -11.082  15.368   3.407
  193    HD3  ARG 860           HD1      ARG 860  -9.942  16.540   4.074
  194   HH11  ARG 860          HH11      ARG 860 -12.811  15.873   3.932
  195   HH12  ARG 860          HH12      ARG 860 -14.246  16.560   3.354
  196   HH21  ARG 860          HH21      ARG 860 -12.624  19.011   1.323
  197   HH22  ARG 860          HH22      ARG 860 -14.126  18.407   1.822
  198    H    ASP 861           H        ASP 861  -9.612  12.387  -0.473
  199    HA   ASP 861           HA       ASP 861 -10.399  12.726  -3.243
  200    HB2  ASP 861           HB2      ASP 861 -10.607  10.368  -3.341
  201    HB3  ASP 861           HB1      ASP 861  -9.299  10.604  -2.196
  202    H    GLU 862           H        GLU 862 -12.672  11.201  -3.453
  203    HA   GLU 862           HA       GLU 862 -14.668  13.019  -2.674
  204    HB2  GLU 862           HB2      GLU 862 -16.251  11.371  -3.566
  205    HB3  GLU 862           HB1      GLU 862 -14.903  11.660  -4.658
  206    HG2  GLU 862           HG2      GLU 862 -13.862   9.578  -3.857
  207    HG3  GLU 862           HG1      GLU 862 -15.272   9.291  -2.847
  208    H    TRP 863           H        TRP 863 -13.399  10.145  -1.096
  209    HA   TRP 863           HA       TRP 863 -15.610  10.108   0.762
  210    HD1  TRP 863           HD       TRP 863 -16.854   8.472  -0.233
  211    HE1  TRP 863           HE1      TRP 863 -17.296   6.697  -2.119
  212    HE3  TRP 863           HE3      TRP 863 -12.277   6.495  -0.430
  213    HZ2  TRP 863           HZ2      TRP 863 -15.806   4.708  -3.455
  214    HZ3  TRP 863           HZ3      TRP 863 -11.794   4.626  -2.017
  215    HH2  TRP 863           HH       TRP 863 -13.537   3.771  -3.491
  216    HB2  TRP 863           HB2      TRP 863 -13.168   8.359   0.636
  217    HB3  TRP 863           HB1      TRP 863 -14.528   8.123   1.735
  218    H    GLY 864           H        GLY 864 -12.626  11.658   0.559
  219    HA2  GLY 864           HA2      GLY 864 -12.210  13.453   2.113
  220    HA3  GLY 864           HA1      GLY 864 -12.992  12.499   3.355
  221    H    ASN 865           H        ASN 865 -10.765  10.781   1.391
  222    HA   ASN 865           HA       ASN 865  -8.949  10.539   3.665
  223    HB2  ASN 865           HB2      ASN 865  -8.907   9.113   0.985
  224    HB3  ASN 865           HB1      ASN 865  -7.923   8.715   2.386
  225   HD21  ASN 865          HD21      ASN 865 -11.031   8.563   0.940
  226   HD22  ASN 865          HD22      ASN 865 -11.733   7.408   2.028
  227    H    GLN 866           H        GLN 866  -6.725  11.001   3.454
  228    HA   GLN 866           HA       GLN 866  -6.171  13.216   1.752
  229    HB2  GLN 866           HB2      GLN 866  -4.452  11.638   3.641
  230    HB3  GLN 866           HB1      GLN 866  -3.850  12.978   2.687
  231    HG2  GLN 866           HG2      GLN 866  -5.214  14.503   3.754
  232    HG3  GLN 866           HG1      GLN 866  -6.176  13.250   4.553
  233   HE21  GLN 866          HE21      GLN 866  -3.163  14.993   4.568
  234   HE22  GLN 866          HE22      GLN 866  -2.638  14.414   6.109
  235    H    ILE 867           H        ILE 867  -5.524  13.160  -0.161
  236    HA   ILE 867           HA       ILE 867  -4.218  10.771  -1.238
  237    HB   ILE 867           HB       ILE 867  -5.759  12.938  -2.695
  238   HG12  ILE 867          HG12      ILE 867  -7.289  11.532  -1.428
  239   HG13  ILE 867          HG11      ILE 867  -7.446  11.197  -3.146
  240   HG21  ILE 867          HG21      ILE 867  -5.563  11.502  -4.675
  241   HG22  ILE 867          HG22      ILE 867  -4.555  10.385  -3.755
  242   HG23  ILE 867          HG23      ILE 867  -3.989  12.026  -4.074
  243   HD11  ILE 867          HD11      ILE 867  -6.100   9.173  -2.867
  244   HD12  ILE 867          HD12      ILE 867  -7.535   9.153  -1.835
  245   HD13  ILE 867          HD13      ILE 867  -5.955   9.518  -1.143
  246    H    TRP 868           H        TRP 868  -2.157  11.061  -1.541
  247    HA   TRP 868           HA       TRP 868  -1.025  13.714  -1.664
  248    HD1  TRP 868           HD       TRP 868   2.037  13.823  -0.041
  249    HE1  TRP 868           HE1      TRP 868   1.840  13.968   2.503
  250    HE3  TRP 868           HE3      TRP 868  -1.780  10.492   0.646
  251    HZ2  TRP 868           HZ2      TRP 868   0.252  12.815   4.563
  252    HZ3  TRP 868           HZ3      TRP 868  -2.577  10.080   2.932
  253    HH2  TRP 868           HH       TRP 868  -1.576  11.221   4.849
  254    HB2  TRP 868           HB2      TRP 868   0.100  10.951  -1.349
  255    HB3  TRP 868           HB1      TRP 868   1.140  12.270  -1.852
  256    H    ILE 869           H        ILE 869  -0.698  14.674  -3.535
  257    HA   ILE 869           HA       ILE 869  -0.442  13.071  -5.928
  258    HB   ILE 869           HB       ILE 869  -0.571  16.089  -5.507
  259   HG12  ILE 869          HG12      ILE 869  -2.471  15.999  -7.064
  260   HG13  ILE 869          HG11      ILE 869  -2.276  14.264  -7.225
  261   HG21  ILE 869          HG21      ILE 869  -0.236  16.446  -7.886
  262   HG22  ILE 869          HG22      ILE 869  -0.062  14.712  -8.134
  263   HG23  ILE 869          HG23      ILE 869   1.162  15.585  -7.221
  264   HD11  ILE 869          HD11      ILE 869  -2.875  14.035  -4.846
  265   HD12  ILE 869          HD12      ILE 869  -4.134  14.761  -5.836
  266   HD13  ILE 869          HD13      ILE 869  -3.149  15.782  -4.776
  267    H    CYS 870           H        CYS 870   1.342  12.413  -6.705
  268    HA   CYS 870           HA       CYS 870   3.787  12.786  -5.350
  269    HB2  CYS 870           HB2      CYS 870   3.279  10.717  -6.494
  270    HB3  CYS 870           HB1      CYS 870   3.054  11.563  -8.010
  271    HA   PRO 871           HA       PRO 871   4.641  16.596  -7.626
  272    HB2  PRO 871           HB2      PRO 871   7.138  16.672  -6.136
  273    HB3  PRO 871           HB1      PRO 871   5.773  17.786  -6.070
  274    HG2  PRO 871           HG2      PRO 871   6.429  16.084  -4.045
  275    HG3  PRO 871           HG1      PRO 871   4.786  16.656  -4.322
  276    HD2  PRO 871           HD2      PRO 871   6.029  14.034  -4.987
  277    HD3  PRO 871           HD1      PRO 871   4.378  14.422  -4.450
  278    H    GLY 872           H        GLY 872   5.942  13.630  -7.954
  279    HA2  GLY 872           HA2      GLY 872   8.223  14.412  -9.586
  280    HA3  GLY 872           HA1      GLY 872   7.703  12.772  -9.193
  281    H    CYS 873           H        CYS 873   4.911  13.354  -9.934
  282    HA   CYS 873           HA       CYS 873   5.228  13.388 -12.869
  283    HB2  CYS 873           HB2      CYS 873   3.417  11.686 -12.864
  284    HB3  CYS 873           HB1      CYS 873   4.919  11.140 -12.119
  285    H    ASN 874           H        ASN 874   3.451  14.316 -10.064
  286    HA   ASN 874           HA       ASN 874   1.817  15.681  -9.601
  287    HB2  ASN 874           HB2      ASN 874   1.936  16.497 -12.523
  288    HB3  ASN 874           HB1      ASN 874   0.799  17.212 -11.381
  289   HD21  ASN 874          HD21      ASN 874   4.120  16.967 -12.327
  290   HD22  ASN 874          HD22      ASN 874   4.714  18.243 -11.330
  291    H    LYS 875           H        LYS 875   1.564  12.936 -10.420
  292    HA   LYS 875           HA       LYS 875  -1.297  12.892 -11.001
  293    HB2  LYS 875           HB2      LYS 875   0.758  10.660 -10.987
  294    HB3  LYS 875           HB1      LYS 875  -0.945  10.473 -11.391
  295    HG2  LYS 875           HG2      LYS 875  -0.707  11.765 -13.365
  296    HG3  LYS 875           HG1      LYS 875   0.910  12.283 -12.899
  297    HD2  LYS 875           HD2      LYS 875   1.674   9.922 -13.093
  298    HD3  LYS 875           HD1      LYS 875   0.056   9.475 -13.641
  299    HE2  LYS 875           HE2      LYS 875   0.280  10.912 -15.583
  300    HE3  LYS 875           HE1      LYS 875   1.840  11.483 -15.003
  301    HZ1  LYS 875           HZ1      LYS 875   1.255   8.682 -15.811
  302    HZ2  LYS 875           HZ2      LYS 875   2.733   9.272 -15.282
  303    HZ3  LYS 875           HZ3      LYS 875   2.079   9.837 -16.725
  304    HA   PRO 876           HA       PRO 876  -1.866  12.144  -6.640
  305    HB2  PRO 876           HB2      PRO 876  -4.345  11.045  -6.746
  306    HB3  PRO 876           HB1      PRO 876  -4.043  12.778  -6.857
  307    HG2  PRO 876           HG2      PRO 876  -4.629  10.810  -8.984
  308    HG3  PRO 876           HG1      PRO 876  -5.136  12.510  -8.804
  309    HD2  PRO 876           HD2      PRO 876  -3.100  11.717 -10.499
  310    HD3  PRO 876           HD1      PRO 876  -3.204  13.320  -9.748
  311    H    ASP 877           H        ASP 877  -2.446  10.390  -5.204
  312    HA   ASP 877           HA       ASP 877  -1.377   7.925  -6.282
  313    HB2  ASP 877           HB2      ASP 877  -0.207   8.710  -4.351
  314    HB3  ASP 877           HB1      ASP 877  -1.705   8.788  -3.417
  315    H    ASP 878           H        ASP 878  -2.368   5.994  -6.023
  316    HA   ASP 878           HA       ASP 878  -5.308   6.035  -5.592
  317    HB2  ASP 878           HB2      ASP 878  -3.629   4.002  -7.070
  318    HB3  ASP 878           HB1      ASP 878  -5.377   4.023  -6.960
  319    H    GLY 879           H        GLY 879  -2.596   5.345  -3.944
  320    HA2  GLY 879           HA2      GLY 879  -2.509   4.122  -1.950
  321    HA3  GLY 879           HA1      GLY 879  -3.708   2.998  -2.612
  322    H    SER 880           H        SER 880  -0.776   4.350  -4.009
  323    HA   SER 880           HA       SER 880  -0.065   1.664  -4.976
  324    HG   SER 880           HG       SER 880  -0.794   4.815  -5.926
  325    HB2  SER 880           HB2      SER 880   1.194   4.241  -5.849
  326    HB3  SER 880           HB1      SER 880   0.856   2.787  -6.791
  327    HA   PRO 881           HA       PRO 881   3.667   1.693  -2.534
  328    HB2  PRO 881           HB2      PRO 881   5.278   1.264  -4.981
  329    HB3  PRO 881           HB1      PRO 881   5.146   0.249  -3.540
  330    HG2  PRO 881           HG2      PRO 881   4.030  -0.515  -5.824
  331    HG3  PRO 881           HG1      PRO 881   3.215  -0.772  -4.277
  332    HD2  PRO 881           HD2      PRO 881   2.721   1.366  -6.313
  333    HD3  PRO 881           HD1      PRO 881   1.555   0.379  -5.406
  334    H    MET 882           H        MET 882   4.175   3.607  -1.844
  335    HA   MET 882           HA       MET 882   5.489   5.510  -3.687
  336    HB2  MET 882           HB2      MET 882   4.005   6.294  -1.179
  337    HB3  MET 882           HB1      MET 882   4.603   7.350  -2.445
  338    HG2  MET 882           HG2      MET 882   2.923   6.352  -3.965
  339    HG3  MET 882           HG1      MET 882   2.279   5.452  -2.594
  340    HE1  MET 882           HE1      MET 882   1.972   9.961  -3.346
  341    HE2  MET 882           HE2      MET 882   2.130   8.703  -4.562
  342    HE3  MET 882           HE3      MET 882   3.497   9.053  -3.472
  343    H    ILE 883           H        ILE 883   7.091   6.878  -2.601
  344    HA   ILE 883           HA       ILE 883   8.136   5.628  -0.188
  345    HB   ILE 883           HB       ILE 883   9.496   4.951  -2.186
  346   HG12  ILE 883          HG12      ILE 883  11.068   6.788  -0.377
  347   HG13  ILE 883          HG11      ILE 883  10.477   5.203   0.129
  348   HG21  ILE 883          HG21      ILE 883  10.123   7.901  -2.376
  349   HG22  ILE 883          HG22      ILE 883   9.194   6.964  -3.546
  350   HG23  ILE 883          HG23      ILE 883  10.912   6.628  -3.305
  351   HD11  ILE 883          HD11      ILE 883  11.818   4.162  -1.619
  352   HD12  ILE 883          HD12      ILE 883  12.820   5.149  -0.549
  353   HD13  ILE 883          HD13      ILE 883  12.373   5.751  -2.138
  354    H    GLY 884           H        GLY 884   8.807   6.982   1.344
  355    HA2  GLY 884           HA2      GLY 884   8.126   9.787   0.919
  356    HA3  GLY 884           HA1      GLY 884   8.229   8.964   2.468
  357    H    CYS 885           H        CYS 885   9.559  11.240   0.792
  358    HA   CYS 885           HA       CYS 885  12.352  10.821   1.027
  359    HB2  CYS 885           HB2      CYS 885  11.450  12.446  -0.480
  360    HB3  CYS 885           HB1      CYS 885  10.654  13.331   0.812
  361    H    ASP 886           H        ASP 886  13.593  10.895   2.782
  362    HA   ASP 886           HA       ASP 886  12.451  11.295   5.352
  363    HB2  ASP 886           HB2      ASP 886  15.259  10.751   4.415
  364    HB3  ASP 886           HB1      ASP 886  14.917  11.085   6.099
  365    H    ASP 887           H        ASP 887  13.639  13.451   3.075
  366    HA   ASP 887           HA       ASP 887  14.388  15.381   5.172
  367    HB2  ASP 887           HB2      ASP 887  16.046  15.076   3.348
  368    HB3  ASP 887           HB1      ASP 887  14.845  15.638   2.190
  369    H    CYS 888           H        CYS 888  12.659  15.344   2.096
  370    HA   CYS 888           HA       CYS 888  11.233  17.779   2.664
  371    HB2  CYS 888           HB2      CYS 888  10.641  15.648   0.604
  372    HB3  CYS 888           HB1      CYS 888   9.776  17.167   0.721
  373    H    ASP 889           H        ASP 889  10.531  14.420   3.295
  374    HA   ASP 889           HA       ASP 889   8.753  13.259   3.958
  375    HB2  ASP 889           HB2      ASP 889   8.916  14.533   6.076
  376    HB3  ASP 889           HB1      ASP 889   7.912  15.812   5.396
  377    H    ASP 890           H        ASP 890   8.303  13.205   1.805
  378    HA   ASP 890           HA       ASP 890   5.729  14.345   1.112
  379    HB2  ASP 890           HB2      ASP 890   7.705  15.822   0.310
  380    HB3  ASP 890           HB1      ASP 890   8.096  14.486  -0.764
  381    H    TRP 891           H        TRP 891   5.035  13.191  -0.871
  382    HA   TRP 891           HA       TRP 891   6.068  10.472  -0.723
  383    HD1  TRP 891           HD       TRP 891   3.200  11.934   1.852
  384    HE1  TRP 891           HE1      TRP 891   3.810  10.619   3.983
  385    HE3  TRP 891           HE3      TRP 891   5.219   7.824  -0.311
  386    HZ2  TRP 891           HZ2      TRP 891   4.986   8.145   4.631
  387    HZ3  TRP 891           HZ3      TRP 891   6.066   6.029   1.094
  388    HH2  TRP 891           HH       TRP 891   5.965   6.190   3.552
  389    HB2  TRP 891           HB2      TRP 891   3.195  11.341  -0.709
  390    HB3  TRP 891           HB1      TRP 891   3.678   9.699  -1.149
  391    H    TYR 892           H        TYR 892   7.019   9.980  -2.414
  392    HA   TYR 892           HA       TYR 892   6.034  10.947  -4.992
  393    HD1  TYR 892           HD2      TYR 892   7.835  13.010  -5.927
  394    HD2  TYR 892           HD1      TYR 892   9.380  11.276  -2.370
  395    HE1  TYR 892           HE2      TYR 892   8.473  15.253  -5.095
  396    HE2  TYR 892           HE1      TYR 892  10.003  13.530  -1.555
  397    HH   TYR 892           HH       TYR 892   8.720  16.242  -2.702
  398    HB2  TYR 892           HB2      TYR 892   8.765   9.883  -4.216
  399    HB3  TYR 892           HB1      TYR 892   8.308  10.574  -5.769
  400    H    HIS 893           H        HIS 893   5.710   9.421  -6.544
  401    HA   HIS 893           HA       HIS 893   5.232   6.706  -5.637
  402    HD2  HIS 893           HD2      HIS 893   2.424   6.248  -6.087
  403    HE1  HIS 893           HE1      HIS 893   0.878   9.519  -8.266
  404    HE2  HIS 893           HE2      HIS 893   0.328   7.507  -6.858
  405    HB2  HIS 893           HB2      HIS 893   5.195   7.776  -8.471
  406    HB3  HIS 893           HB1      HIS 893   4.744   6.146  -8.026
  407    H    TRP 894           H        TRP 894   6.265   4.836  -6.497
  408    HA   TRP 894           HA       TRP 894   9.015   4.987  -6.355
  409    HD1  TRP 894           HD       TRP 894   8.228   4.596  -4.274
  410    HE1  TRP 894           HE1      TRP 894   8.154   3.082  -2.187
  411    HE3  TRP 894           HE3      TRP 894   7.893   0.091  -6.588
  412    HZ2  TRP 894           HZ2      TRP 894   7.946   0.324  -1.620
  413    HZ3  TRP 894           HZ3      TRP 894   7.766  -1.924  -5.253
  414    HH2  TRP 894           HH       TRP 894   7.787  -1.831  -2.798
  415    HB2  TRP 894           HB2      TRP 894   7.172   2.792  -7.216
  416    HB3  TRP 894           HB1      TRP 894   8.915   2.590  -7.262
  417    HA   PRO 895           HA       PRO 895   9.291   4.112 -11.107
  418    HB2  PRO 895           HB2      PRO 895   7.164   4.954 -12.651
  419    HB3  PRO 895           HB1      PRO 895   7.414   3.287 -12.121
  420    HG2  PRO 895           HG2      PRO 895   5.703   5.423 -10.907
  421    HG3  PRO 895           HG1      PRO 895   5.309   3.717 -11.192
  422    HD2  PRO 895           HD2      PRO 895   6.005   4.566  -8.768
  423    HD3  PRO 895           HD1      PRO 895   6.583   3.002  -9.379
  424    H    CYS 896           H        CYS 896   7.704   6.858  -9.766
  425    HA   CYS 896           HA       CYS 896   8.417   8.745 -11.744
  426    HB2  CYS 896           HB2      CYS 896   7.551   9.062  -8.885
  427    HB3  CYS 896           HB1      CYS 896   7.509  10.334 -10.124
  428    H    VAL 897           H        VAL 897   9.842   7.678  -8.697
  429    HA   VAL 897           HA       VAL 897  11.979   9.639  -9.079
  430    HB   VAL 897           HB       VAL 897  12.686   9.095  -6.745
  431   HG11  VAL 897          HG11      VAL 897  11.324  11.041  -7.209
  432   HG12  VAL 897          HG12      VAL 897  10.779  10.298  -5.700
  433   HG13  VAL 897          HG13      VAL 897   9.868  10.052  -7.185
  434   HG21  VAL 897          HG21      VAL 897  10.085   7.563  -6.697
  435   HG22  VAL 897          HG22      VAL 897  11.127   7.878  -5.302
  436   HG23  VAL 897          HG23      VAL 897  11.695   6.858  -6.624
  437    H    GLY 898           H        GLY 898  11.437   6.364  -9.544
  438    HA2  GLY 898           HA2      GLY 898  13.112   5.162 -10.823
  439    HA3  GLY 898           HA1      GLY 898  14.345   6.005  -9.899
  440    H    ILE 899           H        ILE 899  11.651   4.836  -8.147
  441    HA   ILE 899           HA       ILE 899  13.366   2.797  -6.956
  442    HB   ILE 899           HB       ILE 899  10.748   4.027  -6.028
  443   HG12  ILE 899          HG12      ILE 899  12.765   5.467  -5.809
  444   HG13  ILE 899          HG11      ILE 899  12.010   5.076  -4.265
  445   HG21  ILE 899          HG21      ILE 899  12.428   1.935  -4.642
  446   HG22  ILE 899          HG22      ILE 899  10.811   1.703  -5.304
  447   HG23  ILE 899          HG23      ILE 899  11.052   2.772  -3.929
  448   HD11  ILE 899          HD11      ILE 899  13.728   3.406  -3.890
  449   HD12  ILE 899          HD12      ILE 899  14.386   5.032  -4.111
  450   HD13  ILE 899          HD13      ILE 899  14.499   3.848  -5.426
  451    H    MET 900           H        MET 900  12.919   0.690  -7.242
  452    HA   MET 900           HA       MET 900  10.455  -0.010  -8.691
  453    HB2  MET 900           HB2      MET 900  13.170  -1.318  -8.782
  454    HB3  MET 900           HB1      MET 900  11.738  -1.898  -9.623
  455    HG2  MET 900           HG2      MET 900  13.012   0.781 -10.063
  456    HG3  MET 900           HG1      MET 900  13.321  -0.646 -11.043
  457    HE1  MET 900           HE1      MET 900  12.655   0.748 -13.227
  458    HE2  MET 900           HE2      MET 900  12.356   2.170 -12.230
  459    HE3  MET 900           HE3      MET 900  11.146   1.644 -13.402
  460    H    ALA 901           H        ALA 901  12.447  -0.567  -5.936
  461    HA   ALA 901           HA       ALA 901  10.577  -2.567  -4.978
  462    HB1  ALA 901           HB1      ALA 901  13.572  -2.838  -4.769
  463    HB2  ALA 901           HB2      ALA 901  12.578  -3.692  -5.935
  464    HB3  ALA 901           HB3      ALA 901  12.359  -4.000  -4.216
  465    H    ALA 902           H        ALA 902  10.883  -2.824  -2.569
  466    HA   ALA 902           HA       ALA 902  10.944  -0.119  -1.514
  467    HB1  ALA 902           HB1      ALA 902   9.809  -1.045   0.423
  468    HB2  ALA 902           HB2      ALA 902  10.003  -2.677  -0.229
  469    HB3  ALA 902           HB3      ALA 902   9.000  -1.494  -1.074
  470    HA   PRO 903           HA       PRO 903  14.804  -1.142   0.554
  471    HB2  PRO 903           HB2      PRO 903  15.458   1.493   1.088
  472    HB3  PRO 903           HB1      PRO 903  15.879   0.643  -0.397
  473    HG2  PRO 903           HG2      PRO 903  14.013   2.806  -0.023
  474    HG3  PRO 903           HG1      PRO 903  14.518   2.044  -1.538
  475    HD2  PRO 903           HD2      PRO 903  12.076   1.655   0.024
  476    HD3  PRO 903           HD1      PRO 903  12.435   1.184  -1.645
  477    HA   PRO 904           HA       PRO 904  13.405  -0.910   4.743
  478    HB2  PRO 904           HB2      PRO 904  15.718  -0.795   6.146
  479    HB3  PRO 904           HB1      PRO 904  15.208  -2.255   5.294
  480    HG2  PRO 904           HG2      PRO 904  17.167  -0.159   4.442
  481    HG3  PRO 904           HG1      PRO 904  17.299  -1.923   4.323
  482    HD2  PRO 904           HD2      PRO 904  16.584  -0.350   2.225
  483    HD3  PRO 904           HD1      PRO 904  15.985  -2.009   2.415
  484    H    GLU 905           H        GLU 905  13.016   0.515   6.469
  485    HA   GLU 905           HA       GLU 905  13.346   3.289   5.954
  486    HB2  GLU 905           HB2      GLU 905  12.465   1.860   8.448
  487    HB3  GLU 905           HB1      GLU 905  12.407   3.602   8.216
  488    HG2  GLU 905           HG2      GLU 905  10.906   3.260   6.314
  489    HG3  GLU 905           HG1      GLU 905  10.910   1.529   6.657
  490    H    GLU 906           H        GLU 906  15.248   0.990   7.441
  491    HA   GLU 906           HA       GLU 906  16.863   2.484   9.209
  492    HB2  GLU 906           HB2      GLU 906  17.665   0.209   7.401
  493    HB3  GLU 906           HB1      GLU 906  18.583   0.785   8.781
  494    HG2  GLU 906           HG2      GLU 906  16.772   0.132  10.262
  495    HG3  GLU 906           HG1      GLU 906  15.845  -0.430   8.871
  496    H    MET 907           H        MET 907  16.840   2.067   5.758
  497    HA   MET 907           HA       MET 907  19.169   3.741   5.387
  498    HB2  MET 907           HB2      MET 907  18.932   1.847   3.906
  499    HB3  MET 907           HB1      MET 907  17.298   2.376   3.479
  500    HG2  MET 907           HG2      MET 907  18.865   2.860   1.680
  501    HG3  MET 907           HG1      MET 907  18.222   4.340   2.378
  502    HE1  MET 907           HE1      MET 907  21.800   5.416   1.293
  503    HE2  MET 907           HE2      MET 907  20.077   5.791   1.231
  504    HE3  MET 907           HE3      MET 907  20.688   4.331   0.458
  505    H    GLN 908           H        GLN 908  18.987   5.743   4.953
  506    HA   GLN 908           HA       GLN 908  16.313   6.877   4.874
  507    HB2  GLN 908           HB2      GLN 908  18.953   8.325   5.101
  508    HB3  GLN 908           HB1      GLN 908  17.369   9.068   5.159
  509    HG2  GLN 908           HG2      GLN 908  16.824   7.777   7.183
  510    HG3  GLN 908           HG1      GLN 908  18.444   7.089   7.157
  511   HE21  GLN 908          HE21      GLN 908  17.738  10.410   6.340
  512   HE22  GLN 908          HE22      GLN 908  18.499  11.114   7.717
  513    H    TRP 909           H        TRP 909  15.703   8.283   3.290
  514    HA   TRP 909           HA       TRP 909  17.187   8.076   0.803
  515    HD1  TRP 909           HD       TRP 909  16.498   6.003  -1.748
  516    HE1  TRP 909           HE1      TRP 909  15.467   6.830  -3.958
  517    HE3  TRP 909           HE3      TRP 909  12.908   9.083   0.147
  518    HZ2  TRP 909           HZ2      TRP 909  13.390   8.589  -4.781
  519    HZ3  TRP 909           HZ3      TRP 909  11.452  10.304  -1.395
  520    HH2  TRP 909           HH       TRP 909  11.686  10.058  -3.811
  521    HB2  TRP 909           HB2      TRP 909  15.722   6.133   0.754
  522    HB3  TRP 909           HB1      TRP 909  14.326   7.135   1.151
  523    H    PHE 910           H        PHE 910  16.868   9.771  -0.444
  524    HA   PHE 910           HA       PHE 910  14.942  11.761   0.432
  525    HD1  PHE 910           HD1      PHE 910  15.920  13.233   2.571
  526    HD2  PHE 910           HD2      PHE 910  19.234  11.142   0.942
  527    HE1  PHE 910           HE1      PHE 910  16.771  12.825   4.842
  528    HE2  PHE 910           HE2      PHE 910  20.097  10.721   3.200
  529    HZ   PHE 910           HZ       PHE 910  18.854  11.552   5.157
  530    HB2  PHE 910           HB2      PHE 910  17.789  12.315  -0.470
  531    HB3  PHE 910           HB1      PHE 910  16.626  13.465   0.175
  532    H    CYS 911           H        CYS 911  14.109  12.900  -1.339
  533    HA   CYS 911           HA       CYS 911  13.971  11.503  -3.765
  534    HB2  CYS 911           HB2      CYS 911  12.710  13.468  -4.570
  535    HB3  CYS 911           HB1      CYS 911  12.192  12.994  -2.970
  536    HA   PRO 912           HA       PRO 912  17.352  12.897  -6.352
  537    HB2  PRO 912           HB2      PRO 912  15.907  14.279  -8.360
  538    HB3  PRO 912           HB1      PRO 912  16.429  12.592  -8.410
  539    HG2  PRO 912           HG2      PRO 912  13.791  13.746  -7.647
  540    HG3  PRO 912           HG1      PRO 912  14.154  12.215  -8.464
  541    HD2  PRO 912           HD2      PRO 912  13.417  12.224  -5.921
  542    HD3  PRO 912           HD1      PRO 912  14.705  11.143  -6.470
  543    H    LYS 913           H        LYS 913  15.037  15.167  -5.168
  544    HA   LYS 913           HA       LYS 913  16.571  17.517  -5.873
  545    HB2  LYS 913           HB2      LYS 913  14.196  17.172  -4.021
  546    HB3  LYS 913           HB1      LYS 913  14.889  18.733  -4.467
  547    HG2  LYS 913           HG2      LYS 913  14.305  18.142  -6.837
  548    HG3  LYS 913           HG1      LYS 913  13.447  16.743  -6.191
  549    HD2  LYS 913           HD2      LYS 913  12.879  19.652  -5.605
  550    HD3  LYS 913           HD1      LYS 913  11.880  18.555  -6.550
  551    HE2  LYS 913           HE2      LYS 913  12.450  18.399  -3.585
  552    HE3  LYS 913           HE1      LYS 913  10.927  18.855  -4.345
  553    HZ1  LYS 913           HZ1      LYS 913  10.706  16.639  -3.659
  554    HZ2  LYS 913           HZ2      LYS 913  12.191  16.187  -4.188
  555    HZ3  LYS 913           HZ3      LYS 913  10.958  16.528  -5.322
  556    H    CYS 914           H        CYS 914  15.907  15.574  -3.030
  557    HA   CYS 914           HA       CYS 914  17.527  17.244  -1.367
  558    HB2  CYS 914           HB2      CYS 914  15.774  14.900  -0.901
  559    HB3  CYS 914           HB1      CYS 914  16.718  15.537   0.438
  560    H    ALA 915           H        ALA 915  17.799  14.030  -2.739
  561    HA   ALA 915           HA       ALA 915  20.043  13.370  -1.164
  562    HB1  ALA 915           HB1      ALA 915  20.291  11.437  -2.660
  563    HB2  ALA 915           HB2      ALA 915  19.126  12.166  -3.768
  564    HB3  ALA 915           HB3      ALA 915  18.611  11.664  -2.164
  565    H    ASN 916           H        ASN 916  19.595  15.036  -4.061
  566    HA   ASN 916           HA       ASN 916  22.344  14.832  -4.971
  567    HB2  ASN 916           HB2      ASN 916  20.409  14.894  -6.561
  568    HB3  ASN 916           HB1      ASN 916  20.068  16.531  -6.047
  569   HD21  ASN 916          HD21      ASN 916  20.713  15.368  -8.664
  570   HD22  ASN 916          HD22      ASN 916  22.057  16.246  -9.276
  571    H    LYS 917           H        LYS 917  20.350  17.044  -3.161
  572    HA   LYS 917           HA       LYS 917  22.132  19.285  -3.429
  573    HB2  LYS 917           HB2      LYS 917  20.733  20.461  -1.873
  574    HB3  LYS 917           HB1      LYS 917  19.661  19.503  -2.884
  575    HG2  LYS 917           HG2      LYS 917  19.661  17.774  -1.073
  576    HG3  LYS 917           HG1      LYS 917  20.538  18.931  -0.080
  577    HD2  LYS 917           HD2      LYS 917  18.671  20.504  -0.269
  578    HD3  LYS 917           HD1      LYS 917  17.812  19.354  -1.293
  579    HE2  LYS 917           HE2      LYS 917  17.934  17.706   0.602
  580    HE3  LYS 917           HE1      LYS 917  18.571  18.998   1.606
  581    HZ1  LYS 917           HZ1      LYS 917  16.496  20.268   1.166
  582    HZ2  LYS 917           HZ2      LYS 917  16.169  18.784   1.908
  583    HZ3  LYS 917           HZ3      LYS 917  15.910  18.952   0.286
  584    H    ILE 918           H        ILE 918  22.030  16.542  -1.448
  585    HA   ILE 918           HA       ILE 918  23.595  17.371   0.750
  586    HB   ILE 918           HB       ILE 918  23.514  14.685  -0.640
  587   HG12  ILE 918          HG12      ILE 918  21.835  15.721   1.668
  588   HG13  ILE 918          HG11      ILE 918  21.297  15.353   0.028
  589   HG21  ILE 918          HG21      ILE 918  24.440  15.397   2.137
  590   HG22  ILE 918          HG22      ILE 918  25.432  14.869   0.767
  591   HG23  ILE 918          HG23      ILE 918  24.272  13.755   1.496
  592   HD11  ILE 918          HD11      ILE 918  21.766  13.004   0.370
  593   HD12  ILE 918          HD12      ILE 918  20.658  13.607   1.603
  594   HD13  ILE 918          HD13      ILE 918  22.356  13.338   1.998
  595    H    LYS 919           H        LYS 919  24.394  15.705  -2.230
  596    HA   LYS 919           HA       LYS 919  25.975  15.774  -3.697
  597    HB2  LYS 919           HB2      LYS 919  25.715  18.175  -3.548
  598    HB3  LYS 919           HB1      LYS 919  26.936  18.253  -2.301
  599    HG2  LYS 919           HG2      LYS 919  28.664  17.639  -3.837
  600    HG3  LYS 919           HG1      LYS 919  27.479  17.265  -5.092
  601    HD2  LYS 919           HD2      LYS 919  27.866  20.005  -3.885
  602    HD3  LYS 919           HD1      LYS 919  28.591  19.478  -5.402
  603    HE2  LYS 919           HE2      LYS 919  26.412  19.141  -6.378
  604    HE3  LYS 919           HE1      LYS 919  25.608  19.522  -4.861
  605    HZ1  LYS 919           HZ1      LYS 919  26.487  21.758  -5.021
  606    HZ2  LYS 919           HZ2      LYS 919  25.592  21.372  -6.381
  607    HZ3  LYS 919           HZ3      LYS 919  27.271  21.370  -6.454
  608    H    LYS 920           H        LYS 920  27.201  16.117  -0.445
  609    HA   LYS 920           HA       LYS 920  28.577  14.848   0.742
  610    HB2  LYS 920           HB2      LYS 920  28.754  13.175  -1.731
  611    HB3  LYS 920           HB1      LYS 920  29.568  12.741  -0.218
  612    HG2  LYS 920           HG2      LYS 920  27.298  12.718   0.850
  613    HG3  LYS 920           HG1      LYS 920  26.601  12.977  -0.747
  614    HD2  LYS 920           HD2      LYS 920  28.307  10.614   0.072
  615    HD3  LYS 920           HD1      LYS 920  26.561  10.596  -0.077
  616    HE2  LYS 920           HE2      LYS 920  28.466  11.170  -2.357
  617    HE3  LYS 920           HE1      LYS 920  27.768   9.598  -2.014
  618    HZ1  LYS 920           HZ1      LYS 920  26.211  12.045  -2.740
  619    HZ2  LYS 920           HZ2      LYS 920  25.559  10.526  -2.430
  620    HZ3  LYS 920           HZ3      LYS 920  26.569  10.747  -3.744
  621    H    ASP 921           H        ASP 921  29.760  16.112  -2.246
  622    HA   ASP 921           HA       ASP 921  32.523  15.783  -1.841
  623    HB2  ASP 921           HB2      ASP 921  30.977  17.846  -3.383
  624    HB3  ASP 921           HB1      ASP 921  32.729  17.928  -3.258
  625    H    LYS 922           H        LYS 922  30.401  18.416  -0.910
  626    HA   LYS 922           HA       LYS 922  30.482  20.000   0.684
  627    HB2  LYS 922           HB2      LYS 922  32.807  18.413   1.810
  628    HB3  LYS 922           HB1      LYS 922  31.995  19.729   2.635
  629    HG2  LYS 922           HG2      LYS 922  29.938  18.426   2.716
  630    HG3  LYS 922           HG1      LYS 922  30.728  17.111   1.838
  631    HD2  LYS 922           HD2      LYS 922  32.356  16.884   3.662
  632    HD3  LYS 922           HD1      LYS 922  31.550  18.182   4.540
  633    HE2  LYS 922           HE2      LYS 922  30.293  15.552   3.756
  634    HE3  LYS 922           HE1      LYS 922  30.914  15.949   5.356
  635    HZ1  LYS 922           HZ1      LYS 922  28.537  16.221   5.270
  636    HZ2  LYS 922           HZ2      LYS 922  28.632  17.270   3.978
  637    HZ3  LYS 922           HZ3      LYS 922  29.242  17.728   5.480
  638    H    LYS 923           H        LYS 923  32.223  20.036  -1.787
  639    HA   LYS 923           HA       LYS 923  33.874  22.273  -0.968
  640    HB2  LYS 923           HB2      LYS 923  35.408  20.474  -0.755
  641    HB3  LYS 923           HB1      LYS 923  34.939  19.795  -2.304
  642    HG2  LYS 923           HG2      LYS 923  35.984  21.611  -3.476
  643    HG3  LYS 923           HG1      LYS 923  36.299  22.446  -1.951
  644    HD2  LYS 923           HD2      LYS 923  37.819  20.723  -1.258
  645    HD3  LYS 923           HD1      LYS 923  37.401  19.734  -2.657
  646    HE2  LYS 923           HE2      LYS 923  38.634  22.474  -2.864
  647    HE3  LYS 923           HE1      LYS 923  39.579  20.991  -2.827
  648    HZ1  LYS 923           HZ1      LYS 923  37.524  21.640  -4.898
  649    HZ2  LYS 923           HZ2      LYS 923  38.449  20.247  -4.797
  650    HZ3  LYS 923           HZ3      LYS 923  39.201  21.721  -5.082
  651    H    HIS 924           H        HIS 924  32.989  23.796  -2.091
  652    HA   HIS 924           HA       HIS 924  32.544  25.198  -3.777
  653    HD1  HIS 924           HD1      HIS 924  34.906  27.011  -5.240
  654    HD2  HIS 924           HD2      HIS 924  32.996  24.416  -7.849
  655    HE1  HIS 924           HE1      HIS 924  34.578  28.316  -7.356
  656    HE2  HIS 924           HE2      HIS 924  33.783  26.601  -8.994
  657    HB2  HIS 924           HB2      HIS 924  34.909  24.606  -4.428
  658    HB3  HIS 924           HB1      HIS 924  34.264  23.375  -5.495
  Start of MODEL   10
    1    HA   ALA   1           HA       ALA   1  11.969   6.806   2.543
    2    H1   ALA   1           HT1      ALA   1  13.772   7.025   4.131
    3    H2   ALA   1           HT2      ALA   1  13.170   5.738   5.008
    4    H3   ALA   1           HT3      ALA   1  12.315   7.163   4.938
    5    HB1  ALA   1           HB1      ALA   1  13.058   4.054   3.151
    6    HB2  ALA   1           HB2      ALA   1  13.928   5.281   2.263
    7    HB3  ALA   1           HB3      ALA   1  12.424   4.612   1.602
    8    H    ARG   2           H        ARG   2   9.928   7.141   3.331
    9    HA   ARG   2           HA       ARG   2   8.728   5.000   4.876
   10    HE   ARG   2           HE       ARG   2   4.852   5.487   7.350
   11    HB2  ARG   2           HB2      ARG   2   8.308   7.714   4.893
   12    HB3  ARG   2           HB1      ARG   2   7.040   7.177   3.830
   13    HG2  ARG   2           HG2      ARG   2   7.474   6.318   6.690
   14    HG3  ARG   2           HG1      ARG   2   6.183   7.329   6.035
   15    HD2  ARG   2           HD2      ARG   2   5.187   5.467   4.913
   16    HD3  ARG   2           HD1      ARG   2   6.595   4.455   5.228
   17   HH11  ARG   2          HH11      ARG   2   6.360   2.700   5.715
   18   HH12  ARG   2          HH12      ARG   2   6.216   1.678   7.066
   19   HH21  ARG   2          HH21      ARG   2   4.536   4.002   9.131
   20   HH22  ARG   2          HH22      ARG   2   5.083   2.393   9.004
   21    H    THR   3           H        THR   3   8.209   3.268   3.612
   22    HA   THR   3           HA       THR   3   6.935   3.885   1.098
   23    HB   THR   3           HB       THR   3   7.348   1.363   0.766
   24    HG1  THR   3           HG1      THR   3   9.570   1.123   2.134
   25   HG21  THR   3          HG21      THR   3   8.459   3.298  -0.363
   26   HG22  THR   3          HG22      THR   3   9.439   1.849  -0.234
   27   HG23  THR   3          HG23      THR   3   9.736   3.218   0.859
   28    HA   M3L   4           HA       M3L   4   3.597   1.196   2.084
   29    H    M3L   4           H        M3L   4   4.978   3.135   0.600
   30    HB2  M3L   4           HB2      M3L   4   3.156   2.937   3.684
   31    HB3  M3L   4           HB1      M3L   4   1.692   2.717   2.743
   32    HG2  M3L   4           HG2      M3L   4   3.464   4.737   1.658
   33    HG3  M3L   4           HG1      M3L   4   2.965   5.086   3.316
   34    HD2  M3L   4           HD2      M3L   4   0.817   4.159   1.538
   35    HD3  M3L   4           HD1      M3L   4   0.825   5.459   2.731
   36    HE2  M3L   4           HE2      M3L   4   2.531   6.425   0.841
   37    HE3  M3L   4           HE1      M3L   4   1.454   5.450  -0.130
   38   HM11  M3L   4          HM11      M3L   4  -0.069   8.852  -0.290
   39   HM12  M3L   4          HM12      M3L   4   1.612   8.839   0.171
   40   HM13  M3L   4          HM13      M3L   4   1.031   7.798  -1.104
   41   HM21  M3L   4          HM21      M3L   4  -1.690   6.976   1.220
   42   HM22  M3L   4          HM22      M3L   4  -0.944   5.475   0.775
   43   HM23  M3L   4          HM23      M3L   4  -1.233   6.684  -0.420
   44   HM31  M3L   4          HM31      M3L   4   0.302   8.808   2.301
   45   HM32  M3L   4          HM32      M3L   4   1.480   7.628   2.755
   46   HM33  M3L   4          HM33      M3L   4  -0.205   7.286   2.960
   47    H    GLN   5           H        GLN   5   1.450   0.925   1.091
   48    HA   GLN   5           HA       GLN   5   1.306   2.037  -1.631
   49    HB2  GLN   5           HB2      GLN   5   2.176  -0.230  -1.705
   50    HB3  GLN   5           HB1      GLN   5   0.791  -0.807  -0.790
   51    HG2  GLN   5           HG2      GLN   5  -0.671  -0.078  -2.624
   52    HG3  GLN   5           HG1      GLN   5   0.749   0.432  -3.519
   53   HE21  GLN   5          HE21      GLN   5   0.301  -0.979  -5.172
   54   HE22  GLN   5          HE22      GLN   5   0.604  -2.666  -5.014
   55    H    THR   6           H        THR   6  -0.615  -0.022   0.585
   56    HA   THR   6           HA       THR   6  -2.754   0.028   1.260
   57    HB   THR   6           HB       THR   6  -2.733   3.013   0.585
   58    HG1  THR   6           HG1      THR   6  -1.046   1.797   2.067
   59   HG21  THR   6          HG21      THR   6  -4.917   2.163   1.275
   60   HG22  THR   6          HG22      THR   6  -4.239   3.150   2.573
   61   HG23  THR   6          HG23      THR   6  -4.204   1.392   2.690
   62    H    ALA   7           H        ALA   7  -2.435  -1.014  -1.079
   63    HA   ALA   7           HA       ALA   7  -3.475   0.100  -3.414
   64    HB1  ALA   7           HB1      ALA   7  -2.076  -1.915  -3.376
   65    HB2  ALA   7           HB2      ALA   7  -3.563  -2.166  -4.291
   66    HB3  ALA   7           HB3      ALA   7  -3.410  -2.819  -2.659
   67    H    ARG   8           H        ARG   8  -5.377   0.971  -3.532
   68    HA   ARG   8           HA       ARG   8  -7.543   1.437  -3.392
   69    HE   ARG   8           HE       ARG   8  -8.904  -0.153  -6.864
   70    HB2  ARG   8           HB2      ARG   8  -7.480  -0.486  -5.054
   71    HB3  ARG   8           HB1      ARG   8  -7.936  -1.554  -3.735
   72    HG2  ARG   8           HG2      ARG   8 -10.001  -0.387  -3.448
   73    HG3  ARG   8           HG1      ARG   8  -9.577   0.786  -4.684
   74    HD2  ARG   8           HD2      ARG   8  -9.929  -2.182  -5.153
   75    HD3  ARG   8           HD1      ARG   8 -11.133  -0.954  -5.520
   76   HH11  ARG   8          HH11      ARG   8 -10.839  -3.132  -6.857
   77   HH12  ARG   8          HH12      ARG   8 -10.554  -3.488  -8.500
   78   HH21  ARG   8          HH21      ARG   8  -8.563  -0.650  -9.184
   79   HH22  ARG   8          HH22      ARG   8  -9.250  -2.053  -9.840
   80    H    LYS   9           H        LYS   9  -6.099   0.850  -0.981
   81    HA   LYS   9           HA       LYS   9  -6.353   0.786   1.238
   82    HB2  LYS   9           HB2      LYS   9  -9.261   1.191   0.564
   83    HB3  LYS   9           HB1      LYS   9  -8.597   1.314   2.186
   84    HG2  LYS   9           HG2      LYS   9  -7.180   3.176   1.457
   85    HG3  LYS   9           HG1      LYS   9  -7.841   3.040  -0.173
   86    HD2  LYS   9           HD2      LYS   9  -8.932   4.850   1.031
   87    HD3  LYS   9           HD1      LYS   9 -10.080   3.550   0.720
   88    HE2  LYS   9           HE2      LYS   9 -10.322   4.431   2.976
   89    HE3  LYS   9           HE1      LYS   9  -9.803   2.748   3.018
   90    HZ1  LYS   9           HZ1      LYS   9  -8.606   4.029   4.604
   91    HZ2  LYS   9           HZ2      LYS   9  -8.127   5.164   3.465
   92    HZ3  LYS   9           HZ3      LYS   9  -7.516   3.570   3.407
   93    H    SER  10           H        SER  10  -6.713  -1.730  -0.428
   94    HA   SER  10           HA       SER  10  -7.258  -3.409   1.837
   95    HG   SER  10           HG       SER  10 -10.030  -2.986  -1.006
   96    HB2  SER  10           HB2      SER  10  -9.004  -4.754   0.609
   97    HB3  SER  10           HB1      SER  10  -9.540  -3.133   1.053
   98    H    THR  11           H        THR  11  -7.424  -3.900  -1.563
   99    HA   THR  11           HA       THR  11  -4.985  -4.828  -2.312
  100    HB   THR  11           HB       THR  11  -5.212  -6.659  -0.609
  101    HG1  THR  11           HG1      THR  11  -4.211  -7.050  -2.720
  102   HG21  THR  11          HG21      THR  11  -6.923  -8.421  -0.884
  103   HG22  THR  11          HG22      THR  11  -7.658  -7.492  -2.191
  104   HG23  THR  11          HG23      THR  11  -7.660  -6.852  -0.547
  105    H    GLY  12           H        GLY  12  -8.418  -4.697  -2.456
  106    HA2  GLY  12           HA2      GLY  12  -9.402  -3.974  -4.476
  107    HA3  GLY  12           HA1      GLY  12  -8.291  -5.035  -5.347
  108    H    GLY  13           H        GLY  13  -9.500  -6.502  -6.253
  109    HA2  GLY  13           HA2      GLY  13 -11.092  -8.223  -4.558
  110    HA3  GLY  13           HA1      GLY  13 -11.890  -7.453  -5.934
  111    H1   GLY 850           HT1      GLY 850   2.674  33.260  -9.173
  112    H2   GLY 850           HT2      GLY 850   1.595  34.550  -9.136
  113    H3   GLY 850           HT3      GLY 850   3.123  34.761  -9.802
  114    HA2  GLY 850           HA1      GLY 850   1.461  34.541 -11.528
  115    HA3  GLY 850           HA2      GLY 850   2.575  33.180 -11.546
  116    H    SER 851           H        SER 851   0.451  32.533 -12.753
  117    HA   SER 851           HA       SER 851  -1.551  31.540 -10.938
  118    HG   SER 851           HG       SER 851  -1.663  33.415 -12.613
  119    HB2  SER 851           HB2      SER 851  -1.311  31.202 -13.934
  120    HB3  SER 851           HB1      SER 851  -2.751  30.932 -12.953
  121    H    HIS 852           H        HIS 852  -1.241  29.557 -10.022
  122    HA   HIS 852           HA       HIS 852  -0.021  27.430 -11.553
  123    HD2  HIS 852           HD2      HIS 852   2.556  26.090 -11.763
  124    HE1  HIS 852           HE1      HIS 852   2.973  24.052  -8.070
  125    HE2  HIS 852           HE2      HIS 852   3.457  23.970 -10.562
  126    HB2  HIS 852           HB2      HIS 852   1.875  28.581 -10.357
  127    HB3  HIS 852           HB1      HIS 852   1.052  28.276  -8.834
  128    H    MET 853           H        MET 853  -0.593  25.385 -10.650
  129    HA   MET 853           HA       MET 853  -2.998  25.459  -9.103
  130    HB2  MET 853           HB2      MET 853  -2.782  23.834 -10.935
  131    HB3  MET 853           HB1      MET 853  -1.408  23.098 -10.133
  132    HG2  MET 853           HG2      MET 853  -3.471  21.790  -9.883
  133    HG3  MET 853           HG1      MET 853  -2.804  22.315  -8.338
  134    HE1  MET 853           HE1      MET 853  -6.697  22.246  -7.777
  135    HE2  MET 853           HE2      MET 853  -5.143  21.588  -7.266
  136    HE3  MET 853           HE3      MET 853  -5.796  21.183  -8.854
  137    H    ALA 854           H        ALA 854  -2.106  26.477  -7.330
  138    HA   ALA 854           HA       ALA 854  -0.515  24.775  -5.584
  139    HB1  ALA 854           HB1      ALA 854   0.395  27.023  -6.003
  140    HB2  ALA 854           HB2      ALA 854  -0.025  26.812  -4.305
  141    HB3  ALA 854           HB3      ALA 854  -1.083  27.737  -5.363
  142    H    MET 855           H        MET 855  -2.202  23.438  -5.050
  143    HA   MET 855           HA       MET 855  -4.046  24.549  -3.041
  144    HB2  MET 855           HB2      MET 855  -4.563  22.367  -5.082
  145    HB3  MET 855           HB1      MET 855  -5.604  22.666  -3.703
  146    HG2  MET 855           HG2      MET 855  -5.028  24.624  -5.916
  147    HG3  MET 855           HG1      MET 855  -6.471  23.622  -5.788
  148    HE1  MET 855           HE1      MET 855  -8.303  23.900  -3.846
  149    HE2  MET 855           HE2      MET 855  -8.181  25.103  -2.563
  150    HE3  MET 855           HE3      MET 855  -7.052  23.751  -2.607
  151    H    ALA 856           H        ALA 856  -1.384  23.517  -2.898
  152    HA   ALA 856           HA       ALA 856  -0.052  22.236  -1.686
  153    HB1  ALA 856           HB1      ALA 856  -2.538  21.113  -0.365
  154    HB2  ALA 856           HB2      ALA 856  -1.661  22.545   0.176
  155    HB3  ALA 856           HB3      ALA 856  -0.884  20.961   0.229
  156    H    TYR 857           H        TYR 857   0.351  19.800  -1.117
  157    HA   TYR 857           HA       TYR 857  -0.321  18.408  -3.569
  158    HD1  TYR 857           HD1      TYR 857   1.904  20.597  -3.519
  159    HD2  TYR 857           HD2      TYR 857   2.575  16.611  -4.827
  160    HE1  TYR 857           HE1      TYR 857   2.769  21.447  -5.654
  161    HE2  TYR 857           HE2      TYR 857   3.432  17.431  -6.943
  162    HH   TYR 857           HH       TYR 857   4.274  20.624  -7.560
  163    HB2  TYR 857           HB2      TYR 857   2.130  18.433  -1.902
  164    HB3  TYR 857           HB1      TYR 857   1.705  16.926  -2.719
  165    H    VAL 858           H        VAL 858  -1.318  18.515  -0.559
  166    HA   VAL 858           HA       VAL 858  -2.113  15.690  -0.615
  167    HB   VAL 858           HB       VAL 858  -2.411  17.634   1.693
  168   HG11  VAL 858          HG11      VAL 858  -2.926  15.623   3.009
  169   HG12  VAL 858          HG12      VAL 858  -2.828  14.652   1.541
  170   HG13  VAL 858          HG13      VAL 858  -4.081  15.877   1.704
  171   HG21  VAL 858          HG21      VAL 858  -0.058  17.155   1.309
  172   HG22  VAL 858          HG22      VAL 858  -0.409  15.426   1.305
  173   HG23  VAL 858          HG23      VAL 858  -0.623  16.363   2.785
  174    H    ILE 859           H        ILE 859  -3.927  15.536  -1.735
  175    HA   ILE 859           HA       ILE 859  -5.975  17.580  -1.269
  176    HB   ILE 859           HB       ILE 859  -7.035  16.897  -3.383
  177   HG12  ILE 859          HG12      ILE 859  -4.620  15.096  -3.777
  178   HG13  ILE 859          HG11      ILE 859  -6.261  14.564  -3.419
  179   HG21  ILE 859          HG21      ILE 859  -5.347  17.812  -4.945
  180   HG22  ILE 859          HG22      ILE 859  -4.129  17.644  -3.675
  181   HG23  ILE 859          HG23      ILE 859  -5.485  18.747  -3.454
  182   HD11  ILE 859          HD11      ILE 859  -5.430  16.046  -5.900
  183   HD12  ILE 859          HD12      ILE 859  -7.039  15.422  -5.539
  184   HD13  ILE 859          HD13      ILE 859  -5.694  14.308  -5.782
  185    H    ARG 860           H        ARG 860  -8.257  16.546  -1.462
  186    HA   ARG 860           HA       ARG 860  -8.029  14.218   0.276
  187    HE   ARG 860           HE       ARG 860 -12.647  17.814  -0.806
  188    HB2  ARG 860           HB2      ARG 860 -10.241  14.690   1.121
  189    HB3  ARG 860           HB1      ARG 860  -9.221  16.111   1.268
  190    HG2  ARG 860           HG2      ARG 860 -10.304  17.153  -0.588
  191    HG3  ARG 860           HG1      ARG 860 -11.214  15.680  -0.944
  192    HD2  ARG 860           HD2      ARG 860 -12.313  15.865   1.228
  193    HD3  ARG 860           HD1      ARG 860 -11.417  17.350   1.552
  194   HH11  ARG 860          HH11      ARG 860 -13.792  16.788   2.393
  195   HH12  ARG 860          HH12      ARG 860 -15.308  17.546   2.266
  196   HH21  ARG 860          HH21      ARG 860 -14.775  18.813  -1.009
  197   HH22  ARG 860          HH22      ARG 860 -15.885  18.710   0.288
  198    H    ASP 861           H        ASP 861  -9.093  12.455  -0.010
  199    HA   ASP 861           HA       ASP 861 -10.241  11.815  -2.604
  200    HB2  ASP 861           HB2      ASP 861  -8.816  10.150  -1.648
  201    HB3  ASP 861           HB1      ASP 861  -9.643  10.316  -0.084
  202    H    GLU 862           H        GLU 862 -12.359  10.544  -2.401
  203    HA   GLU 862           HA       GLU 862 -14.230  12.439  -1.366
  204    HB2  GLU 862           HB2      GLU 862 -15.985  10.991  -2.237
  205    HB3  GLU 862           HB1      GLU 862 -14.772  11.377  -3.443
  206    HG2  GLU 862           HG2      GLU 862 -13.794   9.174  -3.166
  207    HG3  GLU 862           HG1      GLU 862 -14.986   8.792  -1.920
  208    H    TRP 863           H        TRP 863 -12.988   9.398  -0.187
  209    HA   TRP 863           HA       TRP 863 -15.035   9.209   1.811
  210    HD1  TRP 863           HD       TRP 863 -16.162   7.306   0.964
  211    HE1  TRP 863           HE1      TRP 863 -16.521   5.614  -0.989
  212    HE3  TRP 863           HE3      TRP 863 -11.365   6.162   0.114
  213    HZ2  TRP 863           HZ2      TRP 863 -14.892   4.001  -2.656
  214    HZ3  TRP 863           HZ3      TRP 863 -10.778   4.526  -1.673
  215    HH2  TRP 863           HH       TRP 863 -12.523   3.480  -3.018
  216    HB2  TRP 863           HB2      TRP 863 -12.446   7.695   1.532
  217    HB3  TRP 863           HB1      TRP 863 -13.739   7.304   2.665
  218    H    GLY 864           H        GLY 864 -12.415  11.136   1.378
  219    HA2  GLY 864           HA2      GLY 864 -11.704  12.785   2.892
  220    HA3  GLY 864           HA1      GLY 864 -12.258  11.783   4.223
  221    H    ASN 865           H        ASN 865 -10.364  10.376   1.737
  222    HA   ASN 865           HA       ASN 865  -8.249   9.853   3.654
  223    HB2  ASN 865           HB2      ASN 865  -8.495   8.925   0.758
  224    HB3  ASN 865           HB1      ASN 865  -7.238   8.445   1.877
  225   HD21  ASN 865          HD21      ASN 865 -10.548   7.964   0.886
  226   HD22  ASN 865          HD22      ASN 865 -10.836   6.666   1.985
  227    H    GLN 866           H        GLN 866  -6.070  10.433   3.297
  228    HA   GLN 866           HA       GLN 866  -5.775  12.934   1.889
  229    HB2  GLN 866           HB2      GLN 866  -3.842  11.318   3.531
  230    HB3  GLN 866           HB1      GLN 866  -3.419  12.822   2.737
  231    HG2  GLN 866           HG2      GLN 866  -5.058  13.973   4.008
  232    HG3  GLN 866           HG1      GLN 866  -5.516  12.493   4.865
  233   HE21  GLN 866          HE21      GLN 866  -3.187  15.009   4.568
  234   HE22  GLN 866          HE22      GLN 866  -2.186  14.569   5.893
  235    H    ILE 867           H        ILE 867  -5.167  13.074  -0.074
  236    HA   ILE 867           HA       ILE 867  -3.794  10.798  -1.328
  237    HB   ILE 867           HB       ILE 867  -5.561  12.909  -2.582
  238   HG12  ILE 867          HG12      ILE 867  -6.880  11.282  -1.360
  239   HG13  ILE 867          HG11      ILE 867  -7.098  11.040  -3.087
  240   HG21  ILE 867          HG21      ILE 867  -5.339  11.653  -4.678
  241   HG22  ILE 867          HG22      ILE 867  -4.184  10.570  -3.901
  242   HG23  ILE 867          HG23      ILE 867  -3.786  12.273  -4.117
  243   HD11  ILE 867          HD11      ILE 867  -6.914   8.918  -1.945
  244   HD12  ILE 867          HD12      ILE 867  -5.366   9.414  -1.255
  245   HD13  ILE 867          HD13      ILE 867  -5.514   9.170  -2.998
  246    H    TRP 868           H        TRP 868  -1.757  11.190  -1.622
  247    HA   TRP 868           HA       TRP 868  -0.796  13.914  -1.770
  248    HD1  TRP 868           HD       TRP 868   2.115  14.366  -0.102
  249    HE1  TRP 868           HE1      TRP 868   1.884  14.412   2.465
  250    HE3  TRP 868           HE3      TRP 868  -1.202  10.524   0.508
  251    HZ2  TRP 868           HZ2      TRP 868   0.483  13.038   4.463
  252    HZ3  TRP 868           HZ3      TRP 868  -1.932   9.966   2.781
  253    HH2  TRP 868           HH       TRP 868  -1.103  11.205   4.715
  254    HB2  TRP 868           HB2      TRP 868   0.559  11.258  -1.459
  255    HB3  TRP 868           HB1      TRP 868   1.472  12.681  -1.935
  256    H    ILE 869           H        ILE 869   0.202  14.780  -3.450
  257    HA   ILE 869           HA       ILE 869  -0.131  13.467  -6.051
  258    HB   ILE 869           HB       ILE 869   0.645  16.340  -5.423
  259   HG12  ILE 869          HG12      ILE 869  -1.636  15.919  -4.615
  260   HG13  ILE 869          HG11      ILE 869  -1.649  16.999  -6.001
  261   HG21  ILE 869          HG21      ILE 869   0.067  16.805  -7.761
  262   HG22  ILE 869          HG22      ILE 869  -0.245  15.088  -8.016
  263   HG23  ILE 869          HG23      ILE 869   1.382  15.637  -7.618
  264   HD11  ILE 869          HD11      ILE 869  -3.455  15.413  -6.136
  265   HD12  ILE 869          HD12      ILE 869  -2.325  14.074  -5.988
  266   HD13  ILE 869          HD13      ILE 869  -2.292  15.095  -7.426
  267    H    CYS 870           H        CYS 870   1.662  12.745  -7.114
  268    HA   CYS 870           HA       CYS 870   4.219  12.914  -5.836
  269    HB2  CYS 870           HB2      CYS 870   3.470  10.882  -7.007
  270    HB3  CYS 870           HB1      CYS 870   3.318  11.785  -8.501
  271    HA   PRO 871           HA       PRO 871   5.070  16.796  -8.046
  272    HB2  PRO 871           HB2      PRO 871   7.815  16.369  -7.061
  273    HB3  PRO 871           HB1      PRO 871   6.734  17.736  -6.784
  274    HG2  PRO 871           HG2      PRO 871   7.301  16.004  -4.827
  275    HG3  PRO 871           HG1      PRO 871   5.690  16.719  -4.992
  276    HD2  PRO 871           HD2      PRO 871   6.629  13.984  -5.776
  277    HD3  PRO 871           HD1      PRO 871   5.109  14.489  -5.000
  278    H    GLY 872           H        GLY 872   6.411  13.713  -8.513
  279    HA2  GLY 872           HA2      GLY 872   8.359  14.378 -10.485
  280    HA3  GLY 872           HA1      GLY 872   7.727  12.777 -10.132
  281    H    CYS 873           H        CYS 873   5.105  12.911 -10.717
  282    HA   CYS 873           HA       CYS 873   5.147  13.369 -13.620
  283    HB2  CYS 873           HB2      CYS 873   3.271  11.706 -13.432
  284    HB3  CYS 873           HB1      CYS 873   4.876  11.123 -12.967
  285    H    ASN 874           H        ASN 874   3.617  14.178 -10.640
  286    HA   ASN 874           HA       ASN 874   2.124  15.661  -9.970
  287    HB2  ASN 874           HB2      ASN 874   2.572  17.067 -12.058
  288    HB3  ASN 874           HB1      ASN 874   1.276  16.189 -12.852
  289   HD21  ASN 874          HD21      ASN 874  -0.838  16.738 -12.378
  290   HD22  ASN 874          HD22      ASN 874  -1.268  18.087 -11.401
  291    H    LYS 875           H        LYS 875   1.819  12.778 -10.930
  292    HA   LYS 875           HA       LYS 875  -1.049  12.582 -11.073
  293    HB2  LYS 875           HB2      LYS 875   1.078  10.440 -10.948
  294    HB3  LYS 875           HB1      LYS 875  -0.648  10.140 -11.092
  295    HG2  LYS 875           HG2      LYS 875  -0.664  11.290 -13.260
  296    HG3  LYS 875           HG1      LYS 875   1.065  11.595 -13.103
  297    HD2  LYS 875           HD2      LYS 875   0.666   9.661 -14.540
  298    HD3  LYS 875           HD1      LYS 875   1.488   9.177 -13.057
  299    HE2  LYS 875           HE2      LYS 875  -0.679   8.449 -12.118
  300    HE3  LYS 875           HE1      LYS 875  -1.467   8.904 -13.629
  301    HZ1  LYS 875           HZ1      LYS 875  -0.135   7.240 -14.761
  302    HZ2  LYS 875           HZ2      LYS 875  -1.004   6.537 -13.526
  303    HZ3  LYS 875           HZ3      LYS 875   0.639   6.841 -13.322
  304    HA   PRO 876           HA       PRO 876  -1.528  12.181  -6.682
  305    HB2  PRO 876           HB2      PRO 876  -4.040  11.302  -6.635
  306    HB3  PRO 876           HB1      PRO 876  -3.662  12.937  -7.201
  307    HG2  PRO 876           HG2      PRO 876  -4.186  10.463  -8.801
  308    HG3  PRO 876           HG1      PRO 876  -4.839  12.100  -9.016
  309    HD2  PRO 876           HD2      PRO 876  -2.728  11.161 -10.465
  310    HD3  PRO 876           HD1      PRO 876  -2.933  12.871 -10.030
  311    H    ASP 877           H        ASP 877  -2.071  10.608  -5.066
  312    HA   ASP 877           HA       ASP 877  -1.177   7.972  -5.614
  313    HB2  ASP 877           HB2      ASP 877  -0.787   8.904  -3.401
  314    HB3  ASP 877           HB1      ASP 877  -2.516   9.091  -3.141
  315    H    ASP 878           H        ASP 878  -2.226   6.244  -5.900
  316    HA   ASP 878           HA       ASP 878  -5.184   6.346  -6.243
  317    HB2  ASP 878           HB2      ASP 878  -3.906   6.174  -8.370
  318    HB3  ASP 878           HB1      ASP 878  -3.122   4.722  -7.779
  319    H    GLY 879           H        GLY 879  -3.094   5.431  -4.086
  320    HA2  GLY 879           HA2      GLY 879  -3.163   3.760  -2.480
  321    HA3  GLY 879           HA1      GLY 879  -4.259   2.820  -3.516
  322    H    SER 880           H        SER 880  -1.243   4.424  -3.997
  323    HA   SER 880           HA       SER 880  -0.309   2.060  -5.406
  324    HG   SER 880           HG       SER 880  -0.373   5.477  -5.152
  325    HB2  SER 880           HB2      SER 880   0.991   3.838  -6.782
  326    HB3  SER 880           HB1      SER 880  -0.724   3.599  -7.097
  327    HA   PRO 881           HA       PRO 881   3.263   2.062  -2.816
  328    HB2  PRO 881           HB2      PRO 881   4.976   1.566  -5.159
  329    HB3  PRO 881           HB1      PRO 881   4.689   0.541  -3.756
  330    HG2  PRO 881           HG2      PRO 881   3.719  -0.088  -6.152
  331    HG3  PRO 881           HG1      PRO 881   2.802  -0.409  -4.674
  332    HD2  PRO 881           HD2      PRO 881   2.462   1.826  -6.643
  333    HD3  PRO 881           HD1      PRO 881   1.232   0.843  -5.819
  334    H    MET 882           H        MET 882   3.861   3.948  -2.106
  335    HA   MET 882           HA       MET 882   5.324   5.748  -3.919
  336    HB2  MET 882           HB2      MET 882   3.509   6.656  -1.673
  337    HB3  MET 882           HB1      MET 882   4.377   7.684  -2.800
  338    HG2  MET 882           HG2      MET 882   3.016   6.724  -4.632
  339    HG3  MET 882           HG1      MET 882   2.082   5.844  -3.428
  340    HE1  MET 882           HE1      MET 882   2.017  10.383  -4.133
  341    HE2  MET 882           HE2      MET 882   2.635   9.171  -5.250
  342    HE3  MET 882           HE3      MET 882   3.521   9.521  -3.749
  343    H    ILE 883           H        ILE 883   6.877   7.098  -2.835
  344    HA   ILE 883           HA       ILE 883   7.701   5.959  -0.292
  345    HB   ILE 883           HB       ILE 883   9.174   5.061  -2.077
  346   HG12  ILE 883          HG12      ILE 883  10.712   7.058  -0.424
  347   HG13  ILE 883          HG11      ILE 883  10.034   5.571   0.243
  348   HG21  ILE 883          HG21      ILE 883   9.018   6.910  -3.685
  349   HG22  ILE 883          HG22      ILE 883  10.705   6.555  -3.297
  350   HG23  ILE 883          HG23      ILE 883   9.912   7.949  -2.573
  351   HD11  ILE 883          HD11      ILE 883  12.402   5.342  -0.300
  352   HD12  ILE 883          HD12      ILE 883  12.058   5.756  -1.977
  353   HD13  ILE 883          HD13      ILE 883  11.410   4.269  -1.287
  354    H    GLY 884           H        GLY 884   8.071   7.327   1.207
  355    HA2  GLY 884           HA2      GLY 884   7.845  10.158   0.611
  356    HA3  GLY 884           HA1      GLY 884   7.712   9.407   2.200
  357    H    CYS 885           H        CYS 885   9.445  11.466   0.673
  358    HA   CYS 885           HA       CYS 885  12.132  10.588   1.126
  359    HB2  CYS 885           HB2      CYS 885  11.634  12.266  -0.545
  360    HB3  CYS 885           HB1      CYS 885  10.932  13.338   0.658
  361    H    ASP 886           H        ASP 886  13.443  11.101   2.833
  362    HA   ASP 886           HA       ASP 886  12.030  11.375   5.309
  363    HB2  ASP 886           HB2      ASP 886  14.908  10.961   4.630
  364    HB3  ASP 886           HB1      ASP 886  14.368  11.137   6.288
  365    H    ASP 887           H        ASP 887  13.586  13.521   3.174
  366    HA   ASP 887           HA       ASP 887  14.259  15.334   5.371
  367    HB2  ASP 887           HB2      ASP 887  15.872  14.964   3.466
  368    HB3  ASP 887           HB1      ASP 887  14.756  15.870   2.449
  369    H    CYS 888           H        CYS 888  12.496  15.595   2.295
  370    HA   CYS 888           HA       CYS 888  11.189  17.966   3.340
  371    HB2  CYS 888           HB2      CYS 888  10.083  18.094   1.085
  372    HB3  CYS 888           HB1      CYS 888  11.837  18.144   1.050
  373    H    ASP 889           H        ASP 889  10.529  14.661   3.169
  374    HA   ASP 889           HA       ASP 889   8.884  13.318   3.914
  375    HB2  ASP 889           HB2      ASP 889   8.730  14.973   5.838
  376    HB3  ASP 889           HB1      ASP 889   7.461  15.803   4.950
  377    H    ASP 890           H        ASP 890   8.901  14.651   1.324
  378    HA   ASP 890           HA       ASP 890   6.131  14.944   0.588
  379    HB2  ASP 890           HB2      ASP 890   8.272  16.219  -0.264
  380    HB3  ASP 890           HB1      ASP 890   8.390  14.840  -1.355
  381    H    TRP 891           H        TRP 891   5.467  13.714  -1.373
  382    HA   TRP 891           HA       TRP 891   6.336  10.934  -1.092
  383    HD1  TRP 891           HD       TRP 891   3.781  12.738   1.368
  384    HE1  TRP 891           HE1      TRP 891   3.980  11.419   3.564
  385    HE3  TRP 891           HE3      TRP 891   4.826   8.169  -0.568
  386    HZ2  TRP 891           HZ2      TRP 891   4.503   8.780   4.353
  387    HZ3  TRP 891           HZ3      TRP 891   5.184   6.281   0.985
  388    HH2  TRP 891           HH       TRP 891   5.016   6.601   3.382
  389    HB2  TRP 891           HB2      TRP 891   3.517  11.958  -1.162
  390    HB3  TRP 891           HB1      TRP 891   3.915  10.284  -1.537
  391    H    TYR 892           H        TYR 892   7.132  10.222  -2.842
  392    HA   TYR 892           HA       TYR 892   6.085  11.134  -5.440
  393    HD1  TYR 892           HD1      TYR 892   8.953  11.758  -2.921
  394    HD2  TYR 892           HD2      TYR 892   8.741  12.592  -7.079
  395    HE1  TYR 892           HE1      TYR 892  10.034  13.914  -2.532
  396    HE2  TYR 892           HE2      TYR 892   9.817  14.765  -6.706
  397    HH   TYR 892           HH       TYR 892  11.408  15.481  -3.829
  398    HB2  TYR 892           HB2      TYR 892   8.774   9.944  -4.741
  399    HB3  TYR 892           HB1      TYR 892   8.251  10.447  -6.334
  400    H    HIS 893           H        HIS 893   5.921   9.461  -6.995
  401    HA   HIS 893           HA       HIS 893   5.327   6.840  -5.864
  402    HD2  HIS 893           HD2      HIS 893   2.477   6.095  -6.590
  403    HE1  HIS 893           HE1      HIS 893   1.107   9.679  -8.361
  404    HE2  HIS 893           HE2      HIS 893   0.456   7.682  -6.978
  405    HB2  HIS 893           HB2      HIS 893   5.314   7.700  -8.767
  406    HB3  HIS 893           HB1      HIS 893   4.866   6.100  -8.216
  407    H    TRP 894           H        TRP 894   6.285   4.899  -6.731
  408    HA   TRP 894           HA       TRP 894   9.041   4.994  -6.421
  409    HD1  TRP 894           HD       TRP 894   8.104   4.783  -4.404
  410    HE1  TRP 894           HE1      TRP 894   7.717   3.473  -2.232
  411    HE3  TRP 894           HE3      TRP 894   7.652   0.128  -6.383
  412    HZ2  TRP 894           HZ2      TRP 894   7.251   0.779  -1.467
  413    HZ3  TRP 894           HZ3      TRP 894   7.249  -1.752  -4.907
  414    HH2  TRP 894           HH       TRP 894   7.048  -1.446  -2.479
  415    HB2  TRP 894           HB2      TRP 894   7.223   2.778  -7.301
  416    HB3  TRP 894           HB1      TRP 894   8.959   2.564  -7.130
  417    HA   PRO 895           HA       PRO 895   9.550   3.916 -11.111
  418    HB2  PRO 895           HB2      PRO 895   7.540   4.706 -12.805
  419    HB3  PRO 895           HB1      PRO 895   7.674   3.076 -12.136
  420    HG2  PRO 895           HG2      PRO 895   6.027   5.384 -11.159
  421    HG3  PRO 895           HG1      PRO 895   5.536   3.693 -11.379
  422    HD2  PRO 895           HD2      PRO 895   6.152   4.610  -8.966
  423    HD3  PRO 895           HD1      PRO 895   6.675   2.989  -9.477
  424    H    CYS 896           H        CYS 896   7.980   6.750  -9.930
  425    HA   CYS 896           HA       CYS 896   8.804   8.546 -11.938
  426    HB2  CYS 896           HB2      CYS 896   7.931   8.996  -9.099
  427    HB3  CYS 896           HB1      CYS 896   7.878  10.182 -10.416
  428    H    VAL 897           H        VAL 897  10.074   7.576  -8.781
  429    HA   VAL 897           HA       VAL 897  12.349   9.371  -9.183
  430    HB   VAL 897           HB       VAL 897  12.964   8.842  -6.817
  431   HG11  VAL 897          HG11      VAL 897  10.230  10.003  -7.336
  432   HG12  VAL 897          HG12      VAL 897  11.762  10.872  -7.394
  433   HG13  VAL 897          HG13      VAL 897  11.161  10.239  -5.862
  434   HG21  VAL 897          HG21      VAL 897  10.242   7.535  -6.777
  435   HG22  VAL 897          HG22      VAL 897  11.286   7.806  -5.372
  436   HG23  VAL 897          HG23      VAL 897  11.788   6.704  -6.654
  437    H    GLY 898           H        GLY 898  11.636   6.058  -9.393
  438    HA2  GLY 898           HA2      GLY 898  13.245   4.700 -10.586
  439    HA3  GLY 898           HA1      GLY 898  14.530   5.553  -9.740
  440    H    ILE 899           H        ILE 899  11.710   4.520  -8.061
  441    HA   ILE 899           HA       ILE 899  13.285   2.491  -6.633
  442    HB   ILE 899           HB       ILE 899  10.662   3.875  -5.964
  443   HG12  ILE 899          HG12      ILE 899  12.716   5.262  -5.698
  444   HG13  ILE 899          HG11      ILE 899  11.813   5.027  -4.204
  445   HG21  ILE 899          HG21      ILE 899  10.786   2.768  -3.757
  446   HG22  ILE 899          HG22      ILE 899  12.160   1.820  -4.325
  447   HG23  ILE 899          HG23      ILE 899  10.577   1.618  -5.072
  448   HD11  ILE 899          HD11      ILE 899  13.409   3.350  -3.531
  449   HD12  ILE 899          HD12      ILE 899  14.166   4.914  -3.838
  450   HD13  ILE 899          HD13      ILE 899  14.331   3.603  -5.022
  451    H    MET 900           H        MET 900  12.603   0.334  -6.748
  452    HA   MET 900           HA       MET 900  10.086  -0.124  -8.208
  453    HB2  MET 900           HB2      MET 900  10.968  -2.054  -9.335
  454    HB3  MET 900           HB1      MET 900  12.081  -0.723  -9.610
  455    HG2  MET 900           HG2      MET 900  13.602  -1.611  -7.966
  456    HG3  MET 900           HG1      MET 900  12.466  -2.898  -7.565
  457    HE1  MET 900           HE1      MET 900  15.396  -3.576  -8.159
  458    HE2  MET 900           HE2      MET 900  15.242  -4.927  -9.286
  459    HE3  MET 900           HE3      MET 900  14.154  -4.803  -7.905
  460    H    ALA 901           H        ALA 901  12.048  -0.853  -5.496
  461    HA   ALA 901           HA       ALA 901   9.956  -2.588  -4.476
  462    HB1  ALA 901           HB1      ALA 901  11.662  -4.037  -3.464
  463    HB2  ALA 901           HB2      ALA 901  12.924  -3.083  -4.233
  464    HB3  ALA 901           HB3      ALA 901  11.808  -4.025  -5.222
  465    H    ALA 902           H        ALA 902   9.955  -2.571  -2.121
  466    HA   ALA 902           HA       ALA 902  10.357   0.142  -1.263
  467    HB1  ALA 902           HB1      ALA 902   8.263  -1.006  -0.781
  468    HB2  ALA 902           HB2      ALA 902   9.092  -0.532   0.701
  469    HB3  ALA 902           HB3      ALA 902   9.138  -2.211   0.165
  470    HA   PRO 903           HA       PRO 903  13.980  -1.141   1.032
  471    HB2  PRO 903           HB2      PRO 903  14.753   1.333   1.843
  472    HB3  PRO 903           HB1      PRO 903  15.071   0.771   0.199
  473    HG2  PRO 903           HG2      PRO 903  12.939   2.577   1.211
  474    HG3  PRO 903           HG1      PRO 903  13.889   2.703  -0.284
  475    HD2  PRO 903           HD2      PRO 903  11.342   1.734  -0.134
  476    HD3  PRO 903           HD1      PRO 903  12.494   1.313  -1.409
  477    HA   PRO 904           HA       PRO 904  11.947  -1.320   4.946
  478    HB2  PRO 904           HB2      PRO 904  14.455  -0.593   6.332
  479    HB3  PRO 904           HB1      PRO 904  13.480  -2.057   6.484
  480    HG2  PRO 904           HG2      PRO 904  15.834  -2.062   5.225
  481    HG3  PRO 904           HG1      PRO 904  14.482  -3.076   4.681
  482    HD2  PRO 904           HD2      PRO 904  15.515  -0.513   3.539
  483    HD3  PRO 904           HD1      PRO 904  14.878  -1.945   2.702
  484    H    GLU 905           H        GLU 905  10.971   0.046   6.395
  485    HA   GLU 905           HA       GLU 905  11.148   2.826   5.907
  486    HB2  GLU 905           HB2      GLU 905   9.506   3.070   7.739
  487    HB3  GLU 905           HB1      GLU 905   9.024   1.895   6.522
  488    HG2  GLU 905           HG2      GLU 905   9.766   0.089   8.041
  489    HG3  GLU 905           HG1      GLU 905  10.156   1.305   9.248
  490    H    GLU 906           H        GLU 906  13.144   0.965   7.565
  491    HA   GLU 906           HA       GLU 906  13.881   2.818   9.690
  492    HB2  GLU 906           HB2      GLU 906  15.370   0.399   8.700
  493    HB3  GLU 906           HB1      GLU 906  15.530   1.191  10.260
  494    HG2  GLU 906           HG2      GLU 906  13.237   0.502  10.801
  495    HG3  GLU 906           HG1      GLU 906  13.170  -0.370   9.268
  496    H    MET 907           H        MET 907  14.590   2.120   6.403
  497    HA   MET 907           HA       MET 907  17.305   3.093   6.449
  498    HB2  MET 907           HB2      MET 907  16.745   1.183   5.053
  499    HB3  MET 907           HB1      MET 907  15.552   2.134   4.178
  500    HG2  MET 907           HG2      MET 907  17.371   3.586   3.367
  501    HG3  MET 907           HG1      MET 907  18.534   2.553   4.194
  502    HE1  MET 907           HE1      MET 907  19.859   2.312   1.959
  503    HE2  MET 907           HE2      MET 907  18.685   3.314   1.103
  504    HE3  MET 907           HE3      MET 907  19.166   1.755   0.436
  505    H    GLN 908           H        GLN 908  17.994   4.955   5.487
  506    HA   GLN 908           HA       GLN 908  16.021   7.037   5.257
  507    HB2  GLN 908           HB2      GLN 908  18.991   7.184   4.842
  508    HB3  GLN 908           HB1      GLN 908  17.899   8.536   4.993
  509    HG2  GLN 908           HG2      GLN 908  18.264   6.553   7.217
  510    HG3  GLN 908           HG1      GLN 908  19.310   7.942   6.983
  511   HE21  GLN 908          HE21      GLN 908  15.827   8.217   6.362
  512   HE22  GLN 908          HE22      GLN 908  15.514   9.127   7.769
  513    H    TRP 909           H        TRP 909  15.698   8.221   3.433
  514    HA   TRP 909           HA       TRP 909  17.077   7.743   0.986
  515    HD1  TRP 909           HD       TRP 909  16.446   5.700  -1.566
  516    HE1  TRP 909           HE1      TRP 909  15.549   6.537  -3.835
  517    HE3  TRP 909           HE3      TRP 909  12.862   8.908   0.124
  518    HZ2  TRP 909           HZ2      TRP 909  13.549   8.336  -4.773
  519    HZ3  TRP 909           HZ3      TRP 909  11.515  10.147  -1.494
  520    HH2  TRP 909           HH       TRP 909  11.851   9.868  -3.894
  521    HB2  TRP 909           HB2      TRP 909  15.481   5.848   0.914
  522    HB3  TRP 909           HB1      TRP 909  14.158   6.969   1.208
  523    H    PHE 910           H        PHE 910  16.867   9.469  -0.279
  524    HA   PHE 910           HA       PHE 910  14.955  11.506   0.500
  525    HD1  PHE 910           HD1      PHE 910  15.774  13.146   2.609
  526    HD2  PHE 910           HD2      PHE 910  19.122  10.820   1.421
  527    HE1  PHE 910           HE1      PHE 910  16.402  12.846   4.972
  528    HE2  PHE 910           HE2      PHE 910  19.751  10.501   3.766
  529    HZ   PHE 910           HZ       PHE 910  18.381  11.521   5.558
  530    HB2  PHE 910           HB2      PHE 910  17.882  11.998  -0.171
  531    HB3  PHE 910           HB1      PHE 910  16.692  13.211   0.287
  532    H    CYS 911           H        CYS 911  14.243  12.683  -1.235
  533    HA   CYS 911           HA       CYS 911  14.176  11.330  -3.730
  534    HB2  CYS 911           HB2      CYS 911  12.731  13.184  -4.431
  535    HB3  CYS 911           HB1      CYS 911  12.305  12.617  -2.834
  536    HA   PRO 912           HA       PRO 912  17.382  13.154  -6.263
  537    HB2  PRO 912           HB2      PRO 912  15.901  14.374  -8.303
  538    HB3  PRO 912           HB1      PRO 912  16.464  12.697  -8.281
  539    HG2  PRO 912           HG2      PRO 912  13.792  13.807  -7.509
  540    HG3  PRO 912           HG1      PRO 912  14.174  12.313  -8.391
  541    HD2  PRO 912           HD2      PRO 912  13.481  12.199  -5.855
  542    HD3  PRO 912           HD1      PRO 912  14.809  11.195  -6.455
  543    H    LYS 913           H        LYS 913  14.954  15.162  -4.910
  544    HA   LYS 913           HA       LYS 913  16.335  17.635  -5.576
  545    HB2  LYS 913           HB2      LYS 913  14.068  17.072  -3.649
  546    HB3  LYS 913           HB1      LYS 913  14.746  18.662  -3.933
  547    HG2  LYS 913           HG2      LYS 913  13.332  16.966  -5.981
  548    HG3  LYS 913           HG1      LYS 913  12.623  18.303  -5.078
  549    HD2  LYS 913           HD2      LYS 913  14.433  19.768  -6.065
  550    HD3  LYS 913           HD1      LYS 913  14.831  18.413  -7.123
  551    HE2  LYS 913           HE2      LYS 913  12.167  19.818  -6.945
  552    HE3  LYS 913           HE1      LYS 913  13.339  19.985  -8.247
  553    HZ1  LYS 913           HZ1      LYS 913  12.999  17.616  -8.756
  554    HZ2  LYS 913           HZ2      LYS 913  11.569  18.511  -8.838
  555    HZ3  LYS 913           HZ3      LYS 913  11.840  17.529  -7.519
  556    H    CYS 914           H        CYS 914  15.635  15.657  -2.765
  557    HA   CYS 914           HA       CYS 914  17.235  17.264  -1.072
  558    HB2  CYS 914           HB2      CYS 914  15.586  14.829  -0.635
  559    HB3  CYS 914           HB1      CYS 914  16.473  15.595   0.675
  560    H    ALA 915           H        ALA 915  17.623  14.007  -2.392
  561    HA   ALA 915           HA       ALA 915  19.887  13.423  -0.786
  562    HB1  ALA 915           HB1      ALA 915  19.163  12.265  -3.472
  563    HB2  ALA 915           HB2      ALA 915  18.491  11.730  -1.949
  564    HB3  ALA 915           HB3      ALA 915  20.224  11.522  -2.266
  565    H    ASN 916           H        ASN 916  19.355  15.006  -3.682
  566    HA   ASN 916           HA       ASN 916  22.072  14.878  -4.683
  567    HB2  ASN 916           HB2      ASN 916  20.099  14.752  -6.192
  568    HB3  ASN 916           HB1      ASN 916  19.704  16.402  -5.753
  569   HD21  ASN 916          HD21      ASN 916  19.858  17.085  -7.847
  570   HD22  ASN 916          HD22      ASN 916  21.364  17.279  -8.660
  571    H    LYS 917           H        LYS 917  20.068  17.090  -2.875
  572    HA   LYS 917           HA       LYS 917  21.777  19.337  -3.372
  573    HB2  LYS 917           HB2      LYS 917  20.445  20.572  -1.760
  574    HB3  LYS 917           HB1      LYS 917  19.335  19.613  -2.733
  575    HG2  LYS 917           HG2      LYS 917  19.469  17.886  -0.881
  576    HG3  LYS 917           HG1      LYS 917  20.272  19.140   0.055
  577    HD2  LYS 917           HD2      LYS 917  18.292  20.567  -0.161
  578    HD3  LYS 917           HD1      LYS 917  17.491  19.333  -1.136
  579    HE2  LYS 917           HE2      LYS 917  17.877  17.762   0.861
  580    HE3  LYS 917           HE1      LYS 917  18.254  19.214   1.777
  581    HZ1  LYS 917           HZ1      LYS 917  15.961  18.696   2.108
  582    HZ2  LYS 917           HZ2      LYS 917  15.690  18.475   0.504
  583    HZ3  LYS 917           HZ3      LYS 917  15.973  20.047   1.087
  584    H    ILE 918           H        ILE 918  21.801  16.736  -1.345
  585    HA   ILE 918           HA       ILE 918  23.708  17.772   0.518
  586    HB   ILE 918           HB       ILE 918  23.084  14.891  -0.212
  587   HG12  ILE 918          HG12      ILE 918  21.719  16.683   1.833
  588   HG13  ILE 918          HG11      ILE 918  21.040  16.015   0.347
  589   HG21  ILE 918          HG21      ILE 918  25.121  15.209   1.032
  590   HG22  ILE 918          HG22      ILE 918  23.915  14.378   2.020
  591   HG23  ILE 918          HG23      ILE 918  24.259  16.093   2.296
  592   HD11  ILE 918          HD11      ILE 918  21.143  13.789   1.236
  593   HD12  ILE 918          HD12      ILE 918  20.271  14.837   2.355
  594   HD13  ILE 918          HD13      ILE 918  21.939  14.372   2.698
  595    H    LYS 919           H        LYS 919  23.620  15.420  -2.029
  596    HA   LYS 919           HA       LYS 919  24.957  14.555  -3.541
  597    HB2  LYS 919           HB2      LYS 919  24.966  16.914  -4.357
  598    HB3  LYS 919           HB1      LYS 919  26.481  17.154  -3.499
  599    HG2  LYS 919           HG2      LYS 919  27.531  15.422  -4.872
  600    HG3  LYS 919           HG1      LYS 919  26.010  15.212  -5.742
  601    HD2  LYS 919           HD2      LYS 919  26.122  17.584  -6.419
  602    HD3  LYS 919           HD1      LYS 919  27.700  17.702  -5.642
  603    HE2  LYS 919           HE2      LYS 919  26.963  15.910  -7.962
  604    HE3  LYS 919           HE1      LYS 919  27.971  17.350  -8.030
  605    HZ1  LYS 919           HZ1      LYS 919  28.630  14.853  -6.551
  606    HZ2  LYS 919           HZ2      LYS 919  29.600  16.232  -6.627
  607    HZ3  LYS 919           HZ3      LYS 919  29.298  15.347  -8.011
  608    H    LYS 920           H        LYS 920  26.913  16.215  -1.170
  609    HA   LYS 920           HA       LYS 920  28.663  15.699   0.015
  610    HB2  LYS 920           HB2      LYS 920  27.870  12.988  -0.804
  611    HB3  LYS 920           HB1      LYS 920  29.403  13.193   0.078
  612    HG2  LYS 920           HG2      LYS 920  28.007  14.373   1.833
  613    HG3  LYS 920           HG1      LYS 920  26.596  13.823   0.918
  614    HD2  LYS 920           HD2      LYS 920  27.109  11.555   1.291
  615    HD3  LYS 920           HD1      LYS 920  28.723  11.937   1.890
  616    HE2  LYS 920           HE2      LYS 920  26.136  12.695   3.232
  617    HE3  LYS 920           HE1      LYS 920  27.163  11.344   3.704
  618    HZ1  LYS 920           HZ1      LYS 920  27.993  14.207   3.735
  619    HZ2  LYS 920           HZ2      LYS 920  28.935  12.910   4.237
  620    HZ3  LYS 920           HZ3      LYS 920  27.536  13.314   5.075
  621    H    ASP 921           H        ASP 921  30.140  16.781  -0.734
  622    HA   ASP 921           HA       ASP 921  31.615  16.041  -3.148
  623    HB2  ASP 921           HB2      ASP 921  30.807  18.419  -2.559
  624    HB3  ASP 921           HB1      ASP 921  32.011  18.415  -1.287
  625    H    LYS 922           H        LYS 922  34.173  16.966  -2.321
  626    HA   LYS 922           HA       LYS 922  34.962  14.730  -0.703
  627    HB2  LYS 922           HB2      LYS 922  36.366  15.367  -2.617
  628    HB3  LYS 922           HB1      LYS 922  36.602  16.966  -1.930
  629    HG2  LYS 922           HG2      LYS 922  38.557  15.511  -1.612
  630    HG3  LYS 922           HG1      LYS 922  37.852  16.032  -0.080
  631    HD2  LYS 922           HD2      LYS 922  36.701  13.877   0.113
  632    HD3  LYS 922           HD1      LYS 922  37.420  13.357  -1.413
  633    HE2  LYS 922           HE2      LYS 922  39.630  13.543  -0.447
  634    HE3  LYS 922           HE1      LYS 922  38.951  14.138   1.068
  635    HZ1  LYS 922           HZ1      LYS 922  38.472  11.468  -0.120
  636    HZ2  LYS 922           HZ2      LYS 922  37.809  12.019   1.322
  637    HZ3  LYS 922           HZ3      LYS 922  39.479  11.792   1.195
  638    H    LYS 923           H        LYS 923  34.468  14.935   1.364
  639    HA   LYS 923           HA       LYS 923  34.622  17.501   2.615
  640    HB2  LYS 923           HB2      LYS 923  32.713  16.062   3.120
  641    HB3  LYS 923           HB1      LYS 923  33.792  14.826   3.749
  642    HG2  LYS 923           HG2      LYS 923  32.719  16.088   5.540
  643    HG3  LYS 923           HG1      LYS 923  34.472  16.312   5.555
  644    HD2  LYS 923           HD2      LYS 923  34.182  18.460   4.375
  645    HD3  LYS 923           HD1      LYS 923  32.431  18.233   4.423
  646    HE2  LYS 923           HE2      LYS 923  32.521  18.238   6.872
  647    HE3  LYS 923           HE1      LYS 923  34.268  18.455   6.800
  648    HZ1  LYS 923           HZ1      LYS 923  32.251  20.351   5.745
  649    HZ2  LYS 923           HZ2      LYS 923  33.919  20.574   5.683
  650    HZ3  LYS 923           HZ3      LYS 923  33.128  20.552   7.164
  651    H    HIS 924           H        HIS 924  36.652  18.072   2.803
  652    HA   HIS 924           HA       HIS 924  38.064  17.211   5.052
  653    HD1  HIS 924           HD1      HIS 924  41.892  16.324   2.531
  654    HD2  HIS 924           HD2      HIS 924  40.131  16.492   6.286
  655    HE1  HIS 924           HE1      HIS 924  43.794  16.371   4.159
  656    HE2  HIS 924           HE2      HIS 924  42.683  16.785   6.384
  657    HB2  HIS 924           HB2      HIS 924  38.829  15.403   3.492
  658    HB3  HIS 924           HB1      HIS 924  39.418  16.639   2.391
  Start of MODEL   11
    1    HA   ALA   1           HA       ALA   1  12.498   6.487   2.653
    2    H1   ALA   1           HT1      ALA   1  14.251   6.853   4.177
    3    H2   ALA   1           HT2      ALA   1  14.036   5.336   4.872
    4    H3   ALA   1           HT3      ALA   1  12.871   6.530   5.099
    5    HB1  ALA   1           HB1      ALA   1  14.501   5.136   2.057
    6    HB2  ALA   1           HB2      ALA   1  12.996   4.353   1.570
    7    HB3  ALA   1           HB3      ALA   1  13.847   3.798   3.001
    8    H    ARG   2           H        ARG   2  10.520   6.598   3.551
    9    HA   ARG   2           HA       ARG   2   9.585   4.240   4.962
   10    HE   ARG   2           HE       ARG   2   6.971   7.963   5.642
   11    HB2  ARG   2           HB2      ARG   2   9.155   6.753   5.710
   12    HB3  ARG   2           HB1      ARG   2   7.979   6.703   4.440
   13    HG2  ARG   2           HG2      ARG   2   6.676   5.106   5.494
   14    HG3  ARG   2           HG1      ARG   2   8.047   4.676   6.530
   15    HD2  ARG   2           HD2      ARG   2   6.195   6.086   7.607
   16    HD3  ARG   2           HD1      ARG   2   7.878   6.564   7.839
   17   HH11  ARG   2          HH11      ARG   2   6.033   7.729   9.053
   18   HH12  ARG   2          HH12      ARG   2   5.637   9.348   9.253
   19   HH21  ARG   2          HH21      ARG   2   6.465  10.293   5.875
   20   HH22  ARG   2          HH22      ARG   2   5.885  10.854   7.367
   21    H    THR   3           H        THR   3   9.060   2.712   3.527
   22    HA   THR   3           HA       THR   3   7.592   3.530   1.173
   23    HB   THR   3           HB       THR   3   8.112   1.041   0.601
   24    HG1  THR   3           HG1      THR   3   9.093   0.306   2.421
   25   HG21  THR   3          HG21      THR   3   8.945   3.031  -0.563
   26   HG22  THR   3          HG22      THR   3  10.186   1.786  -0.436
   27   HG23  THR   3          HG23      THR   3  10.225   3.193   0.637
   28    HA   M3L   4           HA       M3L   4   4.307   1.144   2.679
   29    H    M3L   4           H        M3L   4   5.550   3.263   1.093
   30    HB2  M3L   4           HB2      M3L   4   4.011   3.494   3.640
   31    HB3  M3L   4           HB1      M3L   4   2.524   2.633   3.276
   32    HG2  M3L   4           HG2      M3L   4   2.942   3.928   0.936
   33    HG3  M3L   4           HG1      M3L   4   3.656   5.071   2.064
   34    HD2  M3L   4           HD2      M3L   4   0.955   4.787   1.404
   35    HD3  M3L   4           HD1      M3L   4   1.079   4.055   3.002
   36    HE2  M3L   4           HE2      M3L   4   1.350   5.999   3.995
   37    HE3  M3L   4           HE1      M3L   4   2.608   6.459   2.902
   38   HM11  M3L   4          HM11      M3L   4  -1.558   7.351   2.321
   39   HM12  M3L   4          HM12      M3L   4  -1.046   5.880   1.545
   40   HM13  M3L   4          HM13      M3L   4  -0.979   6.014   3.274
   41   HM21  M3L   4          HM21      M3L   4   1.677   8.883   2.893
   42   HM22  M3L   4          HM22      M3L   4   0.474   8.343   4.014
   43   HM23  M3L   4          HM23      M3L   4  -0.011   9.160   2.572
   44   HM31  M3L   4          HM31      M3L   4   2.034   7.220   0.597
   45   HM32  M3L   4          HM32      M3L   4   0.619   8.214   0.357
   46   HM33  M3L   4          HM33      M3L   4   0.508   6.508   0.152
   47    H    GLN   5           H        GLN   5   1.978   0.960   1.815
   48    HA   GLN   5           HA       GLN   5   1.686   1.627  -0.970
   49    HB2  GLN   5           HB2      GLN   5   2.685  -0.678  -0.918
   50    HB3  GLN   5           HB1      GLN   5   1.299  -1.196   0.038
   51    HG2  GLN   5           HG2      GLN   5  -0.203  -0.547  -1.815
   52    HG3  GLN   5           HG1      GLN   5   1.201  -0.051  -2.734
   53   HE21  GLN   5          HE21      GLN   5   0.617  -1.498  -4.354
   54   HE22  GLN   5          HE22      GLN   5   0.941  -3.176  -4.176
   55    H    THR   6           H        THR   6  -0.023   2.826  -0.788
   56    HA   THR   6           HA       THR   6  -1.915   2.719   1.239
   57    HB   THR   6           HB       THR   6  -2.228   3.736  -1.587
   58    HG1  THR   6           HG1      THR   6  -1.164   5.483  -0.996
   59   HG21  THR   6          HG21      THR   6  -3.497   4.636   1.015
   60   HG22  THR   6          HG22      THR   6  -4.312   3.738  -0.270
   61   HG23  THR   6          HG23      THR   6  -3.746   5.381  -0.565
   62    H    ALA   7           H        ALA   7  -1.924   1.577  -2.065
   63    HA   ALA   7           HA       ALA   7  -2.929  -0.004  -3.225
   64    HB1  ALA   7           HB1      ALA   7  -3.512  -2.096  -2.180
   65    HB2  ALA   7           HB2      ALA   7  -3.489  -1.338  -0.589
   66    HB3  ALA   7           HB3      ALA   7  -1.997  -1.490  -1.509
   67    H    ARG   8           H        ARG   8  -4.875  -0.972  -3.846
   68    HA   ARG   8           HA       ARG   8  -7.259  -0.175  -2.380
   69    HE   ARG   8           HE       ARG   8  -6.705  -0.326  -8.334
   70    HB2  ARG   8           HB2      ARG   8  -8.465   0.350  -4.462
   71    HB3  ARG   8           HB1      ARG   8  -7.067   1.388  -4.284
   72    HG2  ARG   8           HG2      ARG   8  -5.852   0.028  -5.888
   73    HG3  ARG   8           HG1      ARG   8  -7.263  -1.020  -6.078
   74    HD2  ARG   8           HD2      ARG   8  -8.565   0.988  -6.775
   75    HD3  ARG   8           HD1      ARG   8  -7.069   1.916  -6.711
   76   HH11  ARG   8          HH11      ARG   8  -8.177   2.892  -8.351
   77   HH12  ARG   8          HH12      ARG   8  -8.346   2.990 -10.035
   78   HH21  ARG   8          HH21      ARG   8  -6.904  -0.204 -10.692
   79   HH22  ARG   8          HH22      ARG   8  -7.625   1.162 -11.403
   80    H    LYS   9           H        LYS   9  -5.495  -2.428  -2.658
   81    HA   LYS   9           HA       LYS   9  -7.323  -4.510  -3.632
   82    HB2  LYS   9           HB2      LYS   9  -4.299  -4.523  -3.467
   83    HB3  LYS   9           HB1      LYS   9  -5.264  -5.934  -3.812
   84    HG2  LYS   9           HG2      LYS   9  -5.135  -3.477  -5.560
   85    HG3  LYS   9           HG1      LYS   9  -4.144  -4.917  -5.780
   86    HD2  LYS   9           HD2      LYS   9  -6.342  -6.205  -5.920
   87    HD3  LYS   9           HD1      LYS   9  -7.124  -4.631  -6.076
   88    HE2  LYS   9           HE2      LYS   9  -5.005  -5.776  -7.903
   89    HE3  LYS   9           HE1      LYS   9  -6.712  -5.625  -8.279
   90    HZ1  LYS   9           HZ1      LYS   9  -4.802  -3.384  -7.837
   91    HZ2  LYS   9           HZ2      LYS   9  -6.437  -3.180  -8.125
   92    HZ3  LYS   9           HZ3      LYS   9  -5.459  -3.849  -9.301
   93    H    SER  10           H        SER  10  -8.297  -4.408  -1.400
   94    HA   SER  10           HA       SER  10  -6.552  -5.366   0.682
   95    HG   SER  10           HG       SER  10 -10.062  -3.719   0.515
   96    HB2  SER  10           HB2      SER  10  -8.783  -5.441   1.978
   97    HB3  SER  10           HB1      SER  10  -8.238  -3.847   1.458
   98    H    THR  11           H        THR  11  -9.598  -6.544  -0.667
   99    HA   THR  11           HA       THR  11  -8.430  -9.232  -0.733
  100    HB   THR  11           HB       THR  11 -11.243  -8.385  -1.507
  101    HG1  THR  11           HG1      THR  11 -10.038  -8.795   0.967
  102   HG21  THR  11          HG21      THR  11 -10.104 -11.042  -0.613
  103   HG22  THR  11          HG22      THR  11 -10.530 -10.612  -2.267
  104   HG23  THR  11          HG23      THR  11 -11.789 -10.733  -1.036
  105    H    GLY  12           H        GLY  12  -9.808  -6.638  -2.615
  106    HA2  GLY  12           HA2      GLY  12  -8.132  -6.674  -4.754
  107    HA3  GLY  12           HA1      GLY  12  -9.439  -7.782  -5.182
  108    H    GLY  13           H        GLY  13 -11.546  -6.641  -3.938
  109    HA2  GLY  13           HA2      GLY  13 -12.444  -4.339  -3.766
  110    HA3  GLY  13           HA1      GLY  13 -11.846  -4.151  -5.416
  111    H1   GLY 850           HT1      GLY 850   1.408  31.459  -8.779
  112    H2   GLY 850           HT2      GLY 850   2.411  32.812  -8.724
  113    H3   GLY 850           HT3      GLY 850   0.776  32.938  -8.276
  114    HA2  GLY 850           HA1      GLY 850   2.245  32.900  -6.353
  115    HA3  GLY 850           HA2      GLY 850   1.171  31.496  -6.410
  116    H    SER 851           H        SER 851   3.688  31.631  -5.030
  117    HA   SER 851           HA       SER 851   5.727  30.360  -6.538
  118    HG   SER 851           HG       SER 851   5.654  32.272  -3.561
  119    HB2  SER 851           HB2      SER 851   5.281  30.273  -3.553
  120    HB3  SER 851           HB1      SER 851   6.806  30.048  -4.413
  121    H    HIS 852           H        HIS 852   3.076  29.276  -4.525
  122    HA   HIS 852           HA       HIS 852   3.899  26.548  -4.784
  123    HD2  HIS 852           HD2      HIS 852  -0.478  27.347  -4.485
  124    HE1  HIS 852           HE1      HIS 852  -0.322  30.253  -1.425
  125    HE2  HIS 852           HE2      HIS 852  -1.727  29.274  -3.239
  126    HB2  HIS 852           HB2      HIS 852   1.923  25.995  -3.357
  127    HB3  HIS 852           HB1      HIS 852   3.019  27.136  -2.606
  128    H    MET 853           H        MET 853   3.403  25.312  -6.348
  129    HA   MET 853           HA       MET 853   1.346  25.953  -8.282
  130    HB2  MET 853           HB2      MET 853   3.471  24.760  -8.878
  131    HB3  MET 853           HB1      MET 853   2.954  23.402  -7.893
  132    HG2  MET 853           HG2      MET 853   1.007  23.113  -9.380
  133    HG3  MET 853           HG1      MET 853   1.623  24.417 -10.396
  134    HE1  MET 853           HE1      MET 853   1.647  22.906 -12.555
  135    HE2  MET 853           HE2      MET 853   0.950  21.592 -11.607
  136    HE3  MET 853           HE3      MET 853   2.365  21.296 -12.616
  137    H    ALA 854           H        ALA 854   1.921  23.953  -5.562
  138    HA   ALA 854           HA       ALA 854  -0.910  23.543  -5.160
  139    HB1  ALA 854           HB1      ALA 854   1.241  21.408  -4.940
  140    HB2  ALA 854           HB2      ALA 854  -0.098  21.408  -6.083
  141    HB3  ALA 854           HB3      ALA 854  -0.413  21.228  -4.355
  142    H    MET 855           H        MET 855  -1.348  23.812  -2.958
  143    HA   MET 855           HA       MET 855   0.637  25.208  -1.463
  144    HB2  MET 855           HB2      MET 855  -2.018  24.098  -0.558
  145    HB3  MET 855           HB1      MET 855  -1.004  25.171   0.394
  146    HG2  MET 855           HG2      MET 855  -1.275  26.927  -1.264
  147    HG3  MET 855           HG1      MET 855  -2.242  25.845  -2.260
  148    HE1  MET 855           HE1      MET 855  -3.556  27.374   1.880
  149    HE2  MET 855           HE2      MET 855  -1.986  27.728   1.153
  150    HE3  MET 855           HE3      MET 855  -2.365  26.091   1.690
  151    H    ALA 856           H        ALA 856  -0.437  22.209  -1.690
  152    HA   ALA 856           HA       ALA 856   1.740  20.947  -0.356
  153    HB1  ALA 856           HB1      ALA 856  -1.052  20.658   0.769
  154    HB2  ALA 856           HB2      ALA 856   0.328  21.371   1.607
  155    HB3  ALA 856           HB3      ALA 856   0.324  19.649   1.207
  156    H    TYR 857           H        TYR 857   1.910  18.880  -1.233
  157    HA   TYR 857           HA       TYR 857   0.053  18.368  -3.355
  158    HD1  TYR 857           HD1      TYR 857   3.690  19.330  -2.920
  159    HD2  TYR 857           HD2      TYR 857   1.508  17.393  -6.006
  160    HE1  TYR 857           HE1      TYR 857   4.700  20.830  -4.555
  161    HE2  TYR 857           HE2      TYR 857   2.520  18.890  -7.669
  162    HH   TYR 857           HH       TYR 857   3.588  21.177  -7.717
  163    HB2  TYR 857           HB2      TYR 857   2.631  17.068  -2.574
  164    HB3  TYR 857           HB1      TYR 857   1.560  16.422  -3.813
  165    H    VAL 858           H        VAL 858  -1.434  18.208  -1.632
  166    HA   VAL 858           HA       VAL 858  -2.205  15.430  -1.132
  167    HB   VAL 858           HB       VAL 858  -2.354  17.502   1.100
  168   HG11  VAL 858          HG11      VAL 858  -3.075  14.579   1.111
  169   HG12  VAL 858          HG12      VAL 858  -4.193  15.936   1.155
  170   HG13  VAL 858          HG13      VAL 858  -3.110  15.642   2.514
  171   HG21  VAL 858          HG21      VAL 858  -0.050  16.793   0.916
  172   HG22  VAL 858          HG22      VAL 858  -0.543  15.095   0.937
  173   HG23  VAL 858          HG23      VAL 858  -0.777  16.100   2.369
  174    H    ILE 859           H        ILE 859  -4.241  15.303  -1.800
  175    HA   ILE 859           HA       ILE 859  -5.981  17.617  -1.357
  176    HB   ILE 859           HB       ILE 859  -7.273  17.047  -3.375
  177   HG12  ILE 859          HG12      ILE 859  -5.110  14.993  -3.959
  178   HG13  ILE 859          HG11      ILE 859  -6.752  14.640  -3.441
  179   HG21  ILE 859          HG21      ILE 859  -5.557  18.727  -3.627
  180   HG22  ILE 859          HG22      ILE 859  -5.694  17.782  -5.109
  181   HG23  ILE 859          HG23      ILE 859  -4.357  17.491  -3.999
  182   HD11  ILE 859          HD11      ILE 859  -5.986  15.970  -6.033
  183   HD12  ILE 859          HD12      ILE 859  -7.626  15.589  -5.510
  184   HD13  ILE 859          HD13      ILE 859  -6.477  14.290  -5.836
  185    H    ARG 860           H        ARG 860  -8.306  16.807  -1.254
  186    HA   ARG 860           HA       ARG 860  -8.298  14.132  -0.090
  187    HE   ARG 860           HE       ARG 860  -8.054  15.991   4.500
  188    HB2  ARG 860           HB2      ARG 860 -10.046  16.518   0.471
  189    HB3  ARG 860           HB1      ARG 860 -10.405  14.896   1.049
  190    HG2  ARG 860           HG2      ARG 860  -8.431  14.806   2.268
  191    HG3  ARG 860           HG1      ARG 860  -7.863  16.367   1.662
  192    HD2  ARG 860           HD2      ARG 860  -9.826  17.434   2.695
  193    HD3  ARG 860           HD1      ARG 860 -10.308  15.872   3.366
  194   HH11  ARG 860          HH11      ARG 860 -10.071  18.827   3.823
  195   HH12  ARG 860          HH12      ARG 860  -9.477  19.746   5.126
  196   HH21  ARG 860          HH21      ARG 860  -7.226  17.279   6.289
  197   HH22  ARG 860          HH22      ARG 860  -7.820  18.849   6.558
  198    H    ASP 861           H        ASP 861  -9.720  12.704  -0.835
  199    HA   ASP 861           HA       ASP 861 -11.059  13.479  -3.304
  200    HB2  ASP 861           HB2      ASP 861  -9.707  11.245  -2.837
  201    HB3  ASP 861           HB1      ASP 861 -11.239  10.710  -2.155
  202    H    GLU 862           H        GLU 862 -13.320  11.910  -3.283
  203    HA   GLU 862           HA       GLU 862 -15.116  13.509  -1.804
  204    HB2  GLU 862           HB2      GLU 862 -16.861  11.970  -2.597
  205    HB3  GLU 862           HB1      GLU 862 -15.762  12.408  -3.893
  206    HG2  GLU 862           HG2      GLU 862 -14.629  10.271  -3.682
  207    HG3  GLU 862           HG1      GLU 862 -15.671   9.839  -2.334
  208    H    TRP 863           H        TRP 863 -13.484  10.613  -1.093
  209    HA   TRP 863           HA       TRP 863 -15.160   9.678   1.030
  210    HD1  TRP 863           HD       TRP 863 -15.742   7.591  -0.342
  211    HE1  TRP 863           HE1      TRP 863 -15.643   6.560  -2.739
  212    HE3  TRP 863           HE3      TRP 863 -10.880   8.446  -1.311
  213    HZ2  TRP 863           HZ2      TRP 863 -13.681   6.173  -4.748
  214    HZ3  TRP 863           HZ3      TRP 863  -9.919   7.728  -3.478
  215    HH2  TRP 863           HH       TRP 863 -11.306   6.610  -5.152
  216    HB2  TRP 863           HB2      TRP 863 -12.293   8.916   0.501
  217    HB3  TRP 863           HB1      TRP 863 -13.495   7.980   1.385
  218    H    GLY 864           H        GLY 864 -12.895  12.188   0.805
  219    HA2  GLY 864           HA2      GLY 864 -12.357  13.684   2.476
  220    HA3  GLY 864           HA1      GLY 864 -12.975  12.546   3.669
  221    H    ASN 865           H        ASN 865 -11.155  10.786   1.761
  222    HA   ASN 865           HA       ASN 865  -8.986  10.627   3.634
  223    HB2  ASN 865           HB2      ASN 865  -9.510   9.129   1.059
  224    HB3  ASN 865           HB1      ASN 865  -8.126   8.827   2.105
  225   HD21  ASN 865          HD21      ASN 865 -10.286   7.010   1.329
  226   HD22  ASN 865          HD22      ASN 865 -11.028   6.526   2.800
  227    H    GLN 866           H        GLN 866  -6.893  11.071   3.289
  228    HA   GLN 866           HA       GLN 866  -6.338  13.216   1.508
  229    HB2  GLN 866           HB2      GLN 866  -4.552  11.605   3.318
  230    HB3  GLN 866           HB1      GLN 866  -4.029  13.001   2.398
  231    HG2  GLN 866           HG2      GLN 866  -5.495  14.404   3.574
  232    HG3  GLN 866           HG1      GLN 866  -6.202  13.043   4.462
  233   HE21  GLN 866          HE21      GLN 866  -3.563  15.238   4.215
  234   HE22  GLN 866          HE22      GLN 866  -2.685  14.691   5.588
  235    H    ILE 867           H        ILE 867  -5.603  13.104  -0.376
  236    HA   ILE 867           HA       ILE 867  -4.478  10.608  -1.431
  237    HB   ILE 867           HB       ILE 867  -5.727  12.923  -2.927
  238   HG12  ILE 867          HG12      ILE 867  -7.491  11.745  -1.715
  239   HG13  ILE 867          HG11      ILE 867  -7.627  11.434  -3.439
  240   HG21  ILE 867          HG21      ILE 867  -4.044  11.804  -4.220
  241   HG22  ILE 867          HG22      ILE 867  -5.638  11.466  -4.896
  242   HG23  ILE 867          HG23      ILE 867  -4.806  10.239  -3.935
  243   HD11  ILE 867          HD11      ILE 867  -8.079   9.443  -2.154
  244   HD12  ILE 867          HD12      ILE 867  -6.502   9.551  -1.369
  245   HD13  ILE 867          HD13      ILE 867  -6.607   9.226  -3.102
  246    H    TRP 868           H        TRP 868  -2.357  10.853  -1.379
  247    HA   TRP 868           HA       TRP 868  -1.165  13.448  -1.465
  248    HD1  TRP 868           HD       TRP 868   1.667  13.508   0.505
  249    HE1  TRP 868           HE1      TRP 868   1.130  13.456   3.037
  250    HE3  TRP 868           HE3      TRP 868  -2.084  10.012   0.498
  251    HZ2  TRP 868           HZ2      TRP 868  -0.631  12.133   4.771
  252    HZ3  TRP 868           HZ3      TRP 868  -3.137   9.424   2.635
  253    HH2  TRP 868           HH       TRP 868  -2.417  10.464   4.730
  254    HB2  TRP 868           HB2      TRP 868  -0.030  10.670  -1.236
  255    HB3  TRP 868           HB1      TRP 868   1.012  12.057  -1.530
  256    H    ILE 869           H        ILE 869  -0.186  14.386  -3.073
  257    HA   ILE 869           HA       ILE 869  -0.467  13.158  -5.716
  258    HB   ILE 869           HB       ILE 869   0.139  16.060  -5.026
  259   HG12  ILE 869          HG12      ILE 869  -2.105  15.510  -4.193
  260   HG13  ILE 869          HG11      ILE 869  -2.195  16.596  -5.571
  261   HG21  ILE 869          HG21      ILE 869  -0.717  14.804  -7.624
  262   HG22  ILE 869          HG22      ILE 869   0.886  15.423  -7.238
  263   HG23  ILE 869          HG23      ILE 869  -0.483  16.531  -7.346
  264   HD11  ILE 869          HD11      ILE 869  -2.723  13.637  -5.570
  265   HD12  ILE 869          HD12      ILE 869  -2.744  14.665  -7.000
  266   HD13  ILE 869          HD13      ILE 869  -3.920  14.922  -5.715
  267    H    CYS 870           H        CYS 870   1.368  12.596  -6.774
  268    HA   CYS 870           HA       CYS 870   3.825  12.762  -5.334
  269    HB2  CYS 870           HB2      CYS 870   3.222  10.765  -6.645
  270    HB3  CYS 870           HB1      CYS 870   3.164  11.732  -8.104
  271    HA   PRO 871           HA       PRO 871   4.650  16.780  -7.247
  272    HB2  PRO 871           HB2      PRO 871   7.209  16.539  -5.810
  273    HB3  PRO 871           HB1      PRO 871   5.965  17.783  -5.666
  274    HG2  PRO 871           HG2      PRO 871   6.369  15.977  -3.729
  275    HG3  PRO 871           HG1      PRO 871   4.743  16.562  -4.125
  276    HD2  PRO 871           HD2      PRO 871   6.083  14.000  -4.886
  277    HD3  PRO 871           HD1      PRO 871   4.417  14.303  -4.325
  278    H    GLY 872           H        GLY 872   6.060  13.834  -7.816
  279    HA2  GLY 872           HA2      GLY 872   8.231  14.805  -9.471
  280    HA3  GLY 872           HA1      GLY 872   7.765  13.123  -9.233
  281    H    CYS 873           H        CYS 873   4.982  13.458  -9.911
  282    HA   CYS 873           HA       CYS 873   5.307  13.802 -12.823
  283    HB2  CYS 873           HB2      CYS 873   3.572  12.016 -12.904
  284    HB3  CYS 873           HB1      CYS 873   5.133  11.523 -12.236
  285    H    ASN 874           H        ASN 874   3.529  14.698 -10.002
  286    HA   ASN 874           HA       ASN 874   1.829  16.090  -9.588
  287    HB2  ASN 874           HB2      ASN 874   2.599  17.542 -11.454
  288    HB3  ASN 874           HB1      ASN 874   1.743  16.544 -12.612
  289   HD21  ASN 874          HD21      ASN 874   1.470  19.011 -10.188
  290   HD22  ASN 874          HD22      ASN 874  -0.152  19.482 -10.585
  291    H    LYS 875           H        LYS 875   1.738  13.186 -10.455
  292    HA   LYS 875           HA       LYS 875  -1.123  12.944 -10.945
  293    HB2  LYS 875           HB2      LYS 875   1.052  10.837 -10.970
  294    HB3  LYS 875           HB1      LYS 875  -0.627  10.587 -11.427
  295    HG2  LYS 875           HG2      LYS 875  -0.381  12.067 -13.308
  296    HG3  LYS 875           HG1      LYS 875   1.264  12.457 -12.815
  297    HD2  LYS 875           HD2      LYS 875   1.839  10.042 -13.094
  298    HD3  LYS 875           HD1      LYS 875   0.221   9.779 -13.743
  299    HE2  LYS 875           HE2      LYS 875   2.316  11.615 -14.896
  300    HE3  LYS 875           HE1      LYS 875   1.884  10.032 -15.521
  301    HZ1  LYS 875           HZ1      LYS 875  -0.341  10.875 -15.981
  302    HZ2  LYS 875           HZ2      LYS 875   0.842  11.789 -16.761
  303    HZ3  LYS 875           HZ3      LYS 875   0.083  12.400 -15.404
  304    HA   PRO 876           HA       PRO 876  -1.705  12.025  -6.647
  305    HB2  PRO 876           HB2      PRO 876  -4.119  10.933  -6.742
  306    HB3  PRO 876           HB1      PRO 876  -3.884  12.631  -7.173
  307    HG2  PRO 876           HG2      PRO 876  -4.064  10.242  -8.937
  308    HG3  PRO 876           HG1      PRO 876  -4.954  11.787  -9.067
  309    HD2  PRO 876           HD2      PRO 876  -2.709  11.314 -10.559
  310    HD3  PRO 876           HD1      PRO 876  -3.095  12.916  -9.907
  311    H    ASP 877           H        ASP 877  -1.866  10.364  -5.187
  312    HA   ASP 877           HA       ASP 877  -0.922   7.786  -5.980
  313    HB2  ASP 877           HB2      ASP 877  -0.349   8.676  -3.723
  314    HB3  ASP 877           HB1      ASP 877  -2.050   8.689  -3.298
  315    H    ASP 878           H        ASP 878  -2.025   6.188  -6.542
  316    HA   ASP 878           HA       ASP 878  -4.968   6.385  -6.685
  317    HB2  ASP 878           HB2      ASP 878  -3.827   6.180  -8.820
  318    HB3  ASP 878           HB1      ASP 878  -2.966   4.756  -8.263
  319    H    GLY 879           H        GLY 879  -2.588   5.019  -4.920
  320    HA2  GLY 879           HA2      GLY 879  -3.269   3.469  -3.157
  321    HA3  GLY 879           HA1      GLY 879  -4.101   2.562  -4.417
  322    H    SER 880           H        SER 880  -0.988   4.144  -4.545
  323    HA   SER 880           HA       SER 880   0.085   1.681  -5.668
  324    HG   SER 880           HG       SER 880  -0.905   3.250  -7.144
  325    HB2  SER 880           HB2      SER 880   1.020   4.545  -5.806
  326    HB3  SER 880           HB1      SER 880   1.732   3.176  -6.663
  327    HA   PRO 881           HA       PRO 881   3.188   1.628  -2.327
  328    HB2  PRO 881           HB2      PRO 881   5.250   1.029  -4.362
  329    HB3  PRO 881           HB1      PRO 881   4.720   0.034  -3.002
  330    HG2  PRO 881           HG2      PRO 881   4.112  -0.679  -5.489
  331    HG3  PRO 881           HG1      PRO 881   2.939  -0.866  -4.181
  332    HD2  PRO 881           HD2      PRO 881   3.127   1.340  -6.209
  333    HD3  PRO 881           HD1      PRO 881   1.706   0.390  -5.718
  334    H    MET 882           H        MET 882   4.235   3.302  -1.519
  335    HA   MET 882           HA       MET 882   5.308   5.371  -3.332
  336    HB2  MET 882           HB2      MET 882   3.538   5.787  -0.923
  337    HB3  MET 882           HB1      MET 882   4.322   7.064  -1.843
  338    HG2  MET 882           HG2      MET 882   2.550   5.114  -3.194
  339    HG3  MET 882           HG1      MET 882   1.879   6.496  -2.315
  340    HE1  MET 882           HE1      MET 882   2.788   9.492  -4.391
  341    HE2  MET 882           HE2      MET 882   3.358   8.971  -2.802
  342    HE3  MET 882           HE3      MET 882   1.653   8.782  -3.245
  343    H    ILE 883           H        ILE 883   6.787   6.769  -2.295
  344    HA   ILE 883           HA       ILE 883   7.919   5.646   0.150
  345    HB   ILE 883           HB       ILE 883   9.344   4.885  -1.718
  346   HG12  ILE 883          HG12      ILE 883  10.794   7.021  -0.156
  347   HG13  ILE 883          HG11      ILE 883  10.311   5.477   0.537
  348   HG21  ILE 883          HG21      ILE 883   9.766   7.823  -2.271
  349   HG22  ILE 883          HG22      ILE 883   8.908   6.689  -3.312
  350   HG23  ILE 883          HG23      ILE 883  10.643   6.502  -3.038
  351   HD11  ILE 883          HD11      ILE 883  12.165   5.864  -1.798
  352   HD12  ILE 883          HD12      ILE 883  11.714   4.315  -1.076
  353   HD13  ILE 883          HD13      ILE 883  12.645   5.490  -0.148
  354    H    GLY 884           H        GLY 884   8.496   6.992   1.635
  355    HA2  GLY 884           HA2      GLY 884   7.902   9.821   1.282
  356    HA3  GLY 884           HA1      GLY 884   8.172   8.966   2.783
  357    H    CYS 885           H        CYS 885   9.491  11.195   0.876
  358    HA   CYS 885           HA       CYS 885  12.281  10.570   0.982
  359    HB2  CYS 885           HB2      CYS 885  11.256  12.306  -0.539
  360    HB3  CYS 885           HB1      CYS 885  10.870  13.233   0.885
  361    H    ASP 886           H        ASP 886  13.710  10.954   2.611
  362    HA   ASP 886           HA       ASP 886  12.594  11.324   5.193
  363    HB2  ASP 886           HB2      ASP 886  15.387  10.892   4.202
  364    HB3  ASP 886           HB1      ASP 886  15.084  11.284   5.889
  365    H    ASP 887           H        ASP 887  13.625  13.495   2.851
  366    HA   ASP 887           HA       ASP 887  14.045  15.506   4.961
  367    HB2  ASP 887           HB2      ASP 887  15.842  15.290   3.215
  368    HB3  ASP 887           HB1      ASP 887  14.683  15.921   2.059
  369    H    CYS 888           H        CYS 888  12.426  15.062   1.881
  370    HA   CYS 888           HA       CYS 888  10.828  17.419   2.046
  371    HB2  CYS 888           HB2      CYS 888   9.943  14.836   0.713
  372    HB3  CYS 888           HB1      CYS 888   9.153  16.379   0.586
  373    H    ASP 889           H        ASP 889  10.295  14.210   3.450
  374    HA   ASP 889           HA       ASP 889   8.681  13.332   4.798
  375    HB2  ASP 889           HB2      ASP 889   9.200  15.210   6.353
  376    HB3  ASP 889           HB1      ASP 889   8.186  16.287   5.422
  377    H    ASP 890           H        ASP 890   8.320  13.815   2.084
  378    HA   ASP 890           HA       ASP 890   5.425  14.266   1.848
  379    HB2  ASP 890           HB2      ASP 890   7.037  16.017   0.843
  380    HB3  ASP 890           HB1      ASP 890   7.462  14.777  -0.324
  381    H    TRP 891           H        TRP 891   4.709  13.165  -0.315
  382    HA   TRP 891           HA       TRP 891   5.906  10.488  -0.287
  383    HD1  TRP 891           HD       TRP 891   2.997  11.798   2.290
  384    HE1  TRP 891           HE1      TRP 891   3.553  10.450   4.420
  385    HE3  TRP 891           HE3      TRP 891   5.039   7.688   0.128
  386    HZ2  TRP 891           HZ2      TRP 891   4.713   7.975   5.083
  387    HZ3  TRP 891           HZ3      TRP 891   5.851   5.885   1.533
  388    HH2  TRP 891           HH       TRP 891   5.719   6.034   4.005
  389    HB2  TRP 891           HB2      TRP 891   2.980  11.196  -0.276
  390    HB3  TRP 891           HB1      TRP 891   3.564   9.594  -0.733
  391    H    TYR 892           H        TYR 892   6.728   9.870  -2.052
  392    HA   TYR 892           HA       TYR 892   5.767  10.992  -4.592
  393    HD1  TYR 892           HD1      TYR 892   8.388  11.682  -1.872
  394    HD2  TYR 892           HD2      TYR 892   8.272  12.747  -5.982
  395    HE1  TYR 892           HE1      TYR 892   9.063  13.970  -1.289
  396    HE2  TYR 892           HE2      TYR 892   8.923  15.037  -5.412
  397    HH   TYR 892           HH       TYR 892   9.914  15.953  -2.181
  398    HB2  TYR 892           HB2      TYR 892   8.498   9.968  -3.781
  399    HB3  TYR 892           HB1      TYR 892   8.059  10.504  -5.392
  400    H    HIS 893           H        HIS 893   5.642   9.534  -6.318
  401    HA   HIS 893           HA       HIS 893   4.986   6.816  -5.632
  402    HD2  HIS 893           HD2      HIS 893   2.369   6.249  -6.582
  403    HE1  HIS 893           HE1      HIS 893   0.968   9.460  -8.941
  404    HE2  HIS 893           HE2      HIS 893   0.319   7.366  -7.712
  405    HB2  HIS 893           HB2      HIS 893   5.369   8.116  -8.350
  406    HB3  HIS 893           HB1      HIS 893   5.000   6.422  -8.196
  407    H    TRP 894           H        TRP 894   6.146   4.974  -6.734
  408    HA   TRP 894           HA       TRP 894   8.903   5.099  -6.197
  409    HD1  TRP 894           HD       TRP 894   7.948   4.690  -4.237
  410    HE1  TRP 894           HE1      TRP 894   7.863   3.159  -2.166
  411    HE3  TRP 894           HE3      TRP 894   7.946   0.189  -6.593
  412    HZ2  TRP 894           HZ2      TRP 894   7.780   0.385  -1.621
  413    HZ3  TRP 894           HZ3      TRP 894   7.869  -1.852  -5.266
  414    HH2  TRP 894           HH       TRP 894   7.788  -1.763  -2.806
  415    HB2  TRP 894           HB2      TRP 894   7.107   2.947  -7.234
  416    HB3  TRP 894           HB1      TRP 894   8.848   2.729  -7.215
  417    HA   PRO 895           HA       PRO 895   9.696   4.421 -10.932
  418    HB2  PRO 895           HB2      PRO 895   7.744   5.229 -12.675
  419    HB3  PRO 895           HB1      PRO 895   7.892   3.569 -12.092
  420    HG2  PRO 895           HG2      PRO 895   6.131   5.776 -11.085
  421    HG3  PRO 895           HG1      PRO 895   5.694   4.092 -11.421
  422    HD2  PRO 895           HD2      PRO 895   6.164   4.917  -8.941
  423    HD3  PRO 895           HD1      PRO 895   6.726   3.319  -9.479
  424    H    CYS 896           H        CYS 896   7.960   7.070  -9.628
  425    HA   CYS 896           HA       CYS 896   8.852   9.039 -11.466
  426    HB2  CYS 896           HB2      CYS 896   7.635   9.308  -8.731
  427    HB3  CYS 896           HB1      CYS 896   7.688  10.555  -9.990
  428    H    VAL 897           H        VAL 897  10.051   7.654  -8.507
  429    HA   VAL 897           HA       VAL 897  12.123   9.732  -8.448
  430    HB   VAL 897           HB       VAL 897  12.545   9.097  -6.131
  431   HG11  VAL 897          HG11      VAL 897   9.746  10.023  -6.799
  432   HG12  VAL 897          HG12      VAL 897  11.174  11.046  -6.641
  433   HG13  VAL 897          HG13      VAL 897  10.506  10.237  -5.225
  434   HG21  VAL 897          HG21      VAL 897  10.861   7.818  -4.888
  435   HG22  VAL 897          HG22      VAL 897  11.644   6.866  -6.148
  436   HG23  VAL 897          HG23      VAL 897  10.013   7.486  -6.401
  437    H    GLY 898           H        GLY 898  11.656   6.480  -9.092
  438    HA2  GLY 898           HA2      GLY 898  13.416   5.240 -10.108
  439    HA3  GLY 898           HA1      GLY 898  14.566   6.181  -9.161
  440    H    ILE 899           H        ILE 899  11.681   4.769  -7.836
  441    HA   ILE 899           HA       ILE 899  13.353   2.778  -6.474
  442    HB   ILE 899           HB       ILE 899  10.636   3.869  -5.647
  443   HG12  ILE 899          HG12      ILE 899  12.534   5.424  -5.266
  444   HG13  ILE 899          HG11      ILE 899  11.769   4.893  -3.769
  445   HG21  ILE 899          HG21      ILE 899  12.381   1.858  -4.224
  446   HG22  ILE 899          HG22      ILE 899  10.841   1.528  -5.019
  447   HG23  ILE 899          HG23      ILE 899  10.891   2.560  -3.590
  448   HD11  ILE 899          HD11      ILE 899  13.583   3.312  -3.442
  449   HD12  ILE 899          HD12      ILE 899  14.149   4.980  -3.554
  450   HD13  ILE 899          HD13      ILE 899  14.350   3.887  -4.931
  451    H    MET 900           H        MET 900  13.115   0.756  -7.011
  452    HA   MET 900           HA       MET 900  10.780  -0.025  -8.612
  453    HB2  MET 900           HB2      MET 900  13.493  -1.329  -8.328
  454    HB3  MET 900           HB1      MET 900  12.186  -1.903  -9.340
  455    HG2  MET 900           HG2      MET 900  13.814  -0.817 -10.691
  456    HG3  MET 900           HG1      MET 900  12.353   0.186 -10.679
  457    HE1  MET 900           HE1      MET 900  16.323   1.177  -8.507
  458    HE2  MET 900           HE2      MET 900  16.094  -0.225  -9.551
  459    HE3  MET 900           HE3      MET 900  15.269  -0.140  -7.995
  460    H    ALA 901           H        ALA 901  12.665  -0.733  -5.800
  461    HA   ALA 901           HA       ALA 901  10.529  -2.440  -4.808
  462    HB1  ALA 901           HB1      ALA 901  13.465  -3.126  -4.724
  463    HB2  ALA 901           HB2      ALA 901  12.238  -3.953  -5.685
  464    HB3  ALA 901           HB3      ALA 901  12.178  -4.026  -3.922
  465    H    ALA 902           H        ALA 902  10.363  -2.369  -2.581
  466    HA   ALA 902           HA       ALA 902  10.917   0.106  -1.444
  467    HB1  ALA 902           HB1      ALA 902   9.919  -0.799   0.579
  468    HB2  ALA 902           HB2      ALA 902  10.026  -2.430  -0.089
  469    HB3  ALA 902           HB3      ALA 902   8.977  -1.226  -0.847
  470    HA   PRO 903           HA       PRO 903  14.976  -1.003   0.272
  471    HB2  PRO 903           HB2      PRO 903  15.227   1.707   1.154
  472    HB3  PRO 903           HB1      PRO 903  16.055   0.956  -0.202
  473    HG2  PRO 903           HG2      PRO 903  14.177   2.963  -0.437
  474    HG3  PRO 903           HG1      PRO 903  14.591   1.826  -1.727
  475    HD2  PRO 903           HD2      PRO 903  12.280   1.826   0.143
  476    HD3  PRO 903           HD1      PRO 903  12.360   1.377  -1.573
  477    HA   PRO 904           HA       PRO 904  13.948  -1.461   4.524
  478    HB2  PRO 904           HB2      PRO 904  16.206  -0.541   5.845
  479    HB3  PRO 904           HB1      PRO 904  16.025  -2.161   5.175
  480    HG2  PRO 904           HG2      PRO 904  17.423   0.210   4.062
  481    HG3  PRO 904           HG1      PRO 904  17.864  -1.505   3.945
  482    HD2  PRO 904           HD2      PRO 904  16.753  -0.108   1.914
  483    HD3  PRO 904           HD1      PRO 904  16.461  -1.840   2.129
  484    H    GLU 905           H        GLU 905  12.758  -0.328   5.920
  485    HA   GLU 905           HA       GLU 905  12.461   2.467   5.522
  486    HB2  GLU 905           HB2      GLU 905  10.779   2.363   7.344
  487    HB3  GLU 905           HB1      GLU 905  10.509   1.152   6.104
  488    HG2  GLU 905           HG2      GLU 905  11.520  -0.535   7.553
  489    HG3  GLU 905           HG1      GLU 905  11.764   0.690   8.797
  490    H    GLU 906           H        GLU 906  14.418   0.613   7.516
  491    HA   GLU 906           HA       GLU 906  14.969   2.715   9.413
  492    HB2  GLU 906           HB2      GLU 906  16.705   1.073  10.262
  493    HB3  GLU 906           HB1      GLU 906  15.030   0.569  10.379
  494    HG2  GLU 906           HG2      GLU 906  15.319  -0.792   8.358
  495    HG3  GLU 906           HG1      GLU 906  17.011  -0.304   8.283
  496    H    MET 907           H        MET 907  15.782   2.343   6.310
  497    HA   MET 907           HA       MET 907  18.420   3.595   6.644
  498    HB2  MET 907           HB2      MET 907  18.384   1.618   5.200
  499    HB3  MET 907           HB1      MET 907  17.162   2.370   4.168
  500    HG2  MET 907           HG2      MET 907  18.878   4.209   3.781
  501    HG3  MET 907           HG1      MET 907  20.044   3.142   4.557
  502    HE1  MET 907           HE1      MET 907  17.846   3.878   1.470
  503    HE2  MET 907           HE2      MET 907  17.060   2.415   2.070
  504    HE3  MET 907           HE3      MET 907  17.937   2.383   0.541
  505    H    GLN 908           H        GLN 908  18.734   5.592   5.606
  506    HA   GLN 908           HA       GLN 908  16.286   7.058   5.119
  507    HB2  GLN 908           HB2      GLN 908  19.135   8.071   5.107
  508    HB3  GLN 908           HB1      GLN 908  17.683   9.057   5.005
  509    HG2  GLN 908           HG2      GLN 908  17.020   8.213   7.246
  510    HG3  GLN 908           HG1      GLN 908  18.575   7.391   7.344
  511   HE21  GLN 908          HE21      GLN 908  18.082  10.544   5.912
  512   HE22  GLN 908          HE22      GLN 908  18.952  11.427   7.110
  513    H    TRP 909           H        TRP 909  16.025   8.406   3.276
  514    HA   TRP 909           HA       TRP 909  17.493   7.882   0.862
  515    HD1  TRP 909           HD       TRP 909  16.733   5.753  -1.696
  516    HE1  TRP 909           HE1      TRP 909  15.584   6.561  -3.918
  517    HE3  TRP 909           HE3      TRP 909  13.174   8.846   0.253
  518    HZ2  TRP 909           HZ2      TRP 909  13.520   8.244  -4.665
  519    HZ3  TRP 909           HZ3      TRP 909  11.646  10.016  -1.274
  520    HH2  TRP 909           HH       TRP 909  11.818   9.719  -3.679
  521    HB2  TRP 909           HB2      TRP 909  16.008   5.935   0.848
  522    HB3  TRP 909           HB1      TRP 909  14.629   6.959   1.236
  523    H    PHE 910           H        PHE 910  17.091   9.540  -0.597
  524    HA   PHE 910           HA       PHE 910  15.124  11.536   0.201
  525    HD1  PHE 910           HD1      PHE 910  16.035  13.451   2.142
  526    HD2  PHE 910           HD2      PHE 910  19.302  11.035   0.895
  527    HE1  PHE 910           HE1      PHE 910  16.829  13.319   4.469
  528    HE2  PHE 910           HE2      PHE 910  20.096  10.897   3.203
  529    HZ   PHE 910           HZ       PHE 910  18.860  12.022   4.991
  530    HB2  PHE 910           HB2      PHE 910  17.965  12.127  -0.687
  531    HB3  PHE 910           HB1      PHE 910  16.748  13.310  -0.234
  532    H    CYS 911           H        CYS 911  14.210  12.564  -1.547
  533    HA   CYS 911           HA       CYS 911  14.001  11.160  -3.978
  534    HB2  CYS 911           HB2      CYS 911  12.655  13.074  -4.722
  535    HB3  CYS 911           HB1      CYS 911  12.290  12.700  -3.048
  536    HA   PRO 912           HA       PRO 912  17.273  12.637  -6.656
  537    HB2  PRO 912           HB2      PRO 912  15.869  13.627  -8.840
  538    HB3  PRO 912           HB1      PRO 912  16.290  11.932  -8.589
  539    HG2  PRO 912           HG2      PRO 912  13.747  13.367  -7.931
  540    HG3  PRO 912           HG1      PRO 912  13.960  11.772  -8.687
  541    HD2  PRO 912           HD2      PRO 912  13.311  11.938  -6.144
  542    HD3  PRO 912           HD1      PRO 912  14.546  10.776  -6.659
  543    H    LYS 913           H        LYS 913  15.050  14.790  -5.326
  544    HA   LYS 913           HA       LYS 913  16.486  17.168  -6.282
  545    HB2  LYS 913           HB2      LYS 913  14.121  16.969  -4.417
  546    HB3  LYS 913           HB1      LYS 913  14.822  18.465  -5.019
  547    HG2  LYS 913           HG2      LYS 913  14.175  17.766  -7.303
  548    HG3  LYS 913           HG1      LYS 913  13.390  16.353  -6.598
  549    HD2  LYS 913           HD2      LYS 913  12.704  19.239  -6.038
  550    HD3  LYS 913           HD1      LYS 913  11.762  18.114  -7.008
  551    HE2  LYS 913           HE2      LYS 913  12.295  17.941  -4.031
  552    HE3  LYS 913           HE1      LYS 913  10.768  18.323  -4.810
  553    HZ1  LYS 913           HZ1      LYS 913  12.174  15.706  -4.767
  554    HZ2  LYS 913           HZ2      LYS 913  10.931  16.055  -5.857
  555    HZ3  LYS 913           HZ3      LYS 913  10.623  16.091  -4.208
  556    H    CYS 914           H        CYS 914  15.555  15.501  -3.306
  557    HA   CYS 914           HA       CYS 914  17.149  17.178  -1.692
  558    HB2  CYS 914           HB2      CYS 914  15.453  14.796  -1.177
  559    HB3  CYS 914           HB1      CYS 914  16.424  15.414   0.142
  560    H    ALA 915           H        ALA 915  17.632  13.938  -2.983
  561    HA   ALA 915           HA       ALA 915  20.017  13.571  -1.476
  562    HB1  ALA 915           HB1      ALA 915  18.711  11.698  -2.416
  563    HB2  ALA 915           HB2      ALA 915  20.399  11.638  -2.921
  564    HB3  ALA 915           HB3      ALA 915  19.153  12.227  -4.036
  565    H    ASN 916           H        ASN 916  19.145  15.204  -4.195
  566    HA   ASN 916           HA       ASN 916  21.600  15.216  -5.714
  567    HB2  ASN 916           HB2      ASN 916  19.309  15.563  -6.693
  568    HB3  ASN 916           HB1      ASN 916  19.250  17.113  -5.879
  569   HD21  ASN 916          HD21      ASN 916  19.017  16.514  -8.659
  570   HD22  ASN 916          HD22      ASN 916  20.261  17.376  -9.495
  571    H    LYS 917           H        LYS 917  19.899  17.428  -3.575
  572    HA   LYS 917           HA       LYS 917  21.781  19.548  -3.771
  573    HB2  LYS 917           HB2      LYS 917  20.487  20.630  -2.059
  574    HB3  LYS 917           HB1      LYS 917  19.374  19.810  -3.144
  575    HG2  LYS 917           HG2      LYS 917  19.385  17.904  -1.482
  576    HG3  LYS 917           HG1      LYS 917  20.224  19.018  -0.402
  577    HD2  LYS 917           HD2      LYS 917  18.323  20.575  -0.564
  578    HD3  LYS 917           HD1      LYS 917  17.488  19.436  -1.623
  579    HE2  LYS 917           HE2      LYS 917  17.717  17.736   0.258
  580    HE3  LYS 917           HE1      LYS 917  18.213  19.077   1.278
  581    HZ1  LYS 917           HZ1      LYS 917  15.868  18.764   1.573
  582    HZ2  LYS 917           HZ2      LYS 917  15.610  18.630  -0.029
  583    HZ3  LYS 917           HZ3      LYS 917  16.023  20.157   0.619
  584    H    ILE 918           H        ILE 918  21.882  16.621  -2.095
  585    HA   ILE 918           HA       ILE 918  23.713  17.614  -0.047
  586    HB   ILE 918           HB       ILE 918  22.823  14.744  -0.481
  587   HG12  ILE 918          HG12      ILE 918  21.566  16.900   1.255
  588   HG13  ILE 918          HG11      ILE 918  20.869  16.117  -0.166
  589   HG21  ILE 918          HG21      ILE 918  23.971  16.172   1.928
  590   HG22  ILE 918          HG22      ILE 918  24.827  15.025   0.899
  591   HG23  ILE 918          HG23      ILE 918  23.469  14.482   1.886
  592   HD11  ILE 918          HD11      ILE 918  20.765  14.002   1.012
  593   HD12  ILE 918          HD12      ILE 918  19.915  15.260   1.912
  594   HD13  ILE 918          HD13      ILE 918  21.516  14.735   2.429
  595    H    LYS 919           H        LYS 919  23.679  15.710  -2.997
  596    HA   LYS 919           HA       LYS 919  26.458  14.946  -2.704
  597    HB2  LYS 919           HB2      LYS 919  24.680  14.671  -5.155
  598    HB3  LYS 919           HB1      LYS 919  26.217  13.865  -4.894
  599    HG2  LYS 919           HG2      LYS 919  23.661  13.372  -3.351
  600    HG3  LYS 919           HG1      LYS 919  24.357  12.320  -4.577
  601    HD2  LYS 919           HD2      LYS 919  26.259  11.855  -3.153
  602    HD3  LYS 919           HD1      LYS 919  25.710  13.040  -1.967
  603    HE2  LYS 919           HE2      LYS 919  25.155  10.787  -1.208
  604    HE3  LYS 919           HE1      LYS 919  23.687  11.685  -1.563
  605    HZ1  LYS 919           HZ1      LYS 919  23.585  10.498  -3.720
  606    HZ2  LYS 919           HZ2      LYS 919  23.529   9.443  -2.424
  607    HZ3  LYS 919           HZ3      LYS 919  24.954   9.620  -3.286
  608    H    LYS 920           H        LYS 920  24.485  17.192  -4.455
  609    HA   LYS 920           HA       LYS 920  24.743  19.115  -5.300
  610    HB2  LYS 920           HB2      LYS 920  27.332  19.166  -3.862
  611    HB3  LYS 920           HB1      LYS 920  26.774  20.534  -4.830
  612    HG2  LYS 920           HG2      LYS 920  24.658  20.417  -3.418
  613    HG3  LYS 920           HG1      LYS 920  25.571  19.354  -2.349
  614    HD2  LYS 920           HD2      LYS 920  27.292  21.141  -2.133
  615    HD3  LYS 920           HD1      LYS 920  26.268  22.183  -3.116
  616    HE2  LYS 920           HE2      LYS 920  25.562  20.981  -0.453
  617    HE3  LYS 920           HE1      LYS 920  25.980  22.663  -0.762
  618    HZ1  LYS 920           HZ1      LYS 920  23.571  21.208  -1.724
  619    HZ2  LYS 920           HZ2      LYS 920  23.960  22.783  -2.204
  620    HZ3  LYS 920           HZ3      LYS 920  23.631  22.447  -0.588
  621    H    ASP 921           H        ASP 921  24.860  19.833  -7.104
  622    HA   ASP 921           HA       ASP 921  26.720  18.773  -9.081
  623    HB2  ASP 921           HB2      ASP 921  24.226  18.925  -9.513
  624    HB3  ASP 921           HB1      ASP 921  24.362  20.670  -9.382
  625    H    LYS 922           H        LYS 922  27.636  20.604 -10.605
  626    HA   LYS 922           HA       LYS 922  29.058  22.384  -8.899
  627    HB2  LYS 922           HB2      LYS 922  28.968  22.490 -11.928
  628    HB3  LYS 922           HB1      LYS 922  30.192  23.176 -10.885
  629    HG2  LYS 922           HG2      LYS 922  29.657  20.246 -11.332
  630    HG3  LYS 922           HG1      LYS 922  31.016  21.172 -11.955
  631    HD2  LYS 922           HD2      LYS 922  30.426  20.598  -9.045
  632    HD3  LYS 922           HD1      LYS 922  31.663  19.812 -10.020
  633    HE2  LYS 922           HE2      LYS 922  32.758  22.008 -10.316
  634    HE3  LYS 922           HE1      LYS 922  31.555  22.730  -9.254
  635    HZ1  LYS 922           HZ1      LYS 922  33.485  20.611  -8.525
  636    HZ2  LYS 922           HZ2      LYS 922  32.301  21.198  -7.496
  637    HZ3  LYS 922           HZ3      LYS 922  33.546  22.213  -8.005
  638    H    LYS 923           H        LYS 923  27.380  23.421 -11.852
  639    HA   LYS 923           HA       LYS 923  25.317  24.775 -10.741
  640    HB2  LYS 923           HB2      LYS 923  25.954  27.180 -10.890
  641    HB3  LYS 923           HB1      LYS 923  26.820  26.336  -9.630
  642    HG2  LYS 923           HG2      LYS 923  28.808  26.252 -11.066
  643    HG3  LYS 923           HG1      LYS 923  27.922  27.114 -12.328
  644    HD2  LYS 923           HD2      LYS 923  27.531  28.956 -10.675
  645    HD3  LYS 923           HD1      LYS 923  28.614  28.116  -9.567
  646    HE2  LYS 923           HE2      LYS 923  29.306  29.202 -12.293
  647    HE3  LYS 923           HE1      LYS 923  29.803  29.869 -10.745
  648    HZ1  LYS 923           HZ1      LYS 923  31.578  28.611 -11.679
  649    HZ2  LYS 923           HZ2      LYS 923  30.622  27.254 -11.892
  650    HZ3  LYS 923           HZ3      LYS 923  31.018  27.754 -10.344
  651    H    HIS 924           H        HIS 924  24.292  23.961 -12.385
  652    HA   HIS 924           HA       HIS 924  24.273  25.496 -14.777
  653    HD1  HIS 924           HD1      HIS 924  23.368  21.799 -16.839
  654    HD2  HIS 924           HD2      HIS 924  25.398  25.325 -17.671
  655    HE1  HIS 924           HE1      HIS 924  22.879  22.306 -19.250
  656    HE2  HIS 924           HE2      HIS 924  24.297  24.295 -19.781
  657    HB2  HIS 924           HB2      HIS 924  26.035  23.777 -15.302
  658    HB3  HIS 924           HB1      HIS 924  24.861  22.514 -14.952
  Start of MODEL   12
    1    HA   ALA   1           HA       ALA   1  12.329   6.570   2.877
    2    H1   ALA   1           HT1      ALA   1  13.904   5.183   4.969
    3    H2   ALA   1           HT2      ALA   1  12.656   6.259   5.250
    4    H3   ALA   1           HT3      ALA   1  14.024   6.811   4.445
    5    HB1  ALA   1           HB1      ALA   1  13.963   4.027   2.739
    6    HB2  ALA   1           HB2      ALA   1  14.467   5.588   2.102
    7    HB3  ALA   1           HB3      ALA   1  13.052   4.764   1.422
    8    H    ARG   2           H        ARG   2  10.420   6.343   3.979
    9    HA   ARG   2           HA       ARG   2   9.625   3.702   4.812
   10    HE   ARG   2           HE       ARG   2   5.774   3.611   7.605
   11    HB2  ARG   2           HB2      ARG   2   9.040   5.914   6.001
   12    HB3  ARG   2           HB1      ARG   2   7.907   6.155   4.684
   13    HG2  ARG   2           HG2      ARG   2   6.828   4.051   5.227
   14    HG3  ARG   2           HG1      ARG   2   7.988   3.862   6.552
   15    HD2  ARG   2           HD2      ARG   2   7.156   5.898   7.593
   16    HD3  ARG   2           HD1      ARG   2   6.028   6.122   6.257
   17   HH11  ARG   2          HH11      ARG   2   4.764   7.016   7.676
   18   HH12  ARG   2          HH12      ARG   2   3.279   6.700   8.449
   19   HH21  ARG   2          HH21      ARG   2   3.783   3.185   8.667
   20   HH22  ARG   2          HH22      ARG   2   2.721   4.454   9.057
   21    H    THR   3           H        THR   3   8.086   2.451   3.738
   22    HA   THR   3           HA       THR   3   7.090   3.570   1.251
   23    HB   THR   3           HB       THR   3   7.321   1.223   0.309
   24    HG1  THR   3           HG1      THR   3   9.141   0.916   2.476
   25   HG21  THR   3          HG21      THR   3   9.879   2.649   1.072
   26   HG22  THR   3          HG22      THR   3   8.876   3.023  -0.328
   27   HG23  THR   3          HG23      THR   3   9.717   1.476  -0.232
   28    HA   M3L   4           HA       M3L   4   3.590   0.994   2.212
   29    H    M3L   4           H        M3L   4   4.985   2.985   0.725
   30    HB2  M3L   4           HB2      M3L   4   3.236   2.645   3.881
   31    HB3  M3L   4           HB1      M3L   4   1.796   2.727   2.877
   32    HG2  M3L   4           HG2      M3L   4   3.551   4.534   1.729
   33    HG3  M3L   4           HG1      M3L   4   3.779   4.742   3.462
   34    HD2  M3L   4           HD2      M3L   4   1.150   4.718   3.480
   35    HD3  M3L   4           HD1      M3L   4   2.060   6.183   3.134
   36    HE2  M3L   4           HE2      M3L   4   1.894   5.266   0.643
   37    HE3  M3L   4           HE1      M3L   4   0.537   4.402   1.288
   38   HM11  M3L   4          HM11      M3L   4  -1.214   5.532   0.130
   39   HM12  M3L   4          HM12      M3L   4  -1.395   7.245   0.092
   40   HM13  M3L   4          HM13      M3L   4  -0.151   6.490  -0.837
   41   HM21  M3L   4          HM21      M3L   4  -0.919   5.809   2.950
   42   HM22  M3L   4          HM22      M3L   4  -1.387   7.407   2.446
   43   HM23  M3L   4          HM23      M3L   4   0.055   7.175   3.394
   44   HM31  M3L   4          HM31      M3L   4   1.517   7.872   0.091
   45   HM32  M3L   4          HM32      M3L   4   2.102   7.712   1.721
   46   HM33  M3L   4          HM33      M3L   4   0.719   8.708   1.387
   47    H    GLN   5           H        GLN   5   1.513   0.619   1.293
   48    HA   GLN   5           HA       GLN   5   0.558   2.220  -0.795
   49    HB2  GLN   5           HB2      GLN   5   0.619   0.342  -2.494
   50    HB3  GLN   5           HB1      GLN   5   2.076   1.252  -2.283
   51    HG2  GLN   5           HG2      GLN   5   2.814  -0.910  -2.475
   52    HG3  GLN   5           HG1      GLN   5   2.772  -0.704  -0.733
   53   HE21  GLN   5          HE21      GLN   5   1.194  -1.984  -3.478
   54   HE22  GLN   5          HE22      GLN   5   0.274  -3.187  -2.681
   55    H    THR   6           H        THR   6  -1.299   1.078  -1.903
   56    HA   THR   6           HA       THR   6  -2.795  -0.247   0.213
   57    HB   THR   6           HB       THR   6  -3.713   1.255  -2.237
   58    HG1  THR   6           HG1      THR   6  -2.768   2.192  -0.056
   59   HG21  THR   6          HG21      THR   6  -5.311   0.100   0.070
   60   HG22  THR   6          HG22      THR   6  -5.273  -0.512  -1.582
   61   HG23  THR   6          HG23      THR   6  -5.966   1.079  -1.254
   62    H    ALA   7           H        ALA   7  -2.191  -0.285  -3.321
   63    HA   ALA   7           HA       ALA   7  -2.631  -3.137  -3.280
   64    HB1  ALA   7           HB1      ALA   7  -4.847  -2.222  -3.690
   65    HB2  ALA   7           HB2      ALA   7  -4.209  -3.006  -5.145
   66    HB3  ALA   7           HB3      ALA   7  -4.206  -1.254  -5.019
   67    H    ARG   8           H        ARG   8  -2.358  -3.920  -5.515
   68    HA   ARG   8           HA       ARG   8  -0.636  -2.362  -7.269
   69    HE   ARG   8           HE       ARG   8   3.168  -3.765  -7.224
   70    HB2  ARG   8           HB2      ARG   8  -0.140  -5.294  -6.586
   71    HB3  ARG   8           HB1      ARG   8   0.804  -4.315  -7.694
   72    HG2  ARG   8           HG2      ARG   8   1.528  -2.933  -5.764
   73    HG3  ARG   8           HG1      ARG   8   0.662  -4.039  -4.700
   74    HD2  ARG   8           HD2      ARG   8   2.918  -4.733  -4.671
   75    HD3  ARG   8           HD1      ARG   8   2.066  -5.888  -5.694
   76   HH11  ARG   8          HH11      ARG   8   3.982  -6.871  -5.728
   77   HH12  ARG   8          HH12      ARG   8   5.463  -7.018  -6.536
   78   HH21  ARG   8          HH21      ARG   8   5.178  -3.986  -8.344
   79   HH22  ARG   8          HH22      ARG   8   6.170  -5.345  -8.082
   80    H    LYS   9           H        LYS   9  -1.667  -2.444  -9.195
   81    HA   LYS   9           HA       LYS   9  -3.975  -4.116  -9.320
   82    HB2  LYS   9           HB2      LYS   9  -2.907  -2.200 -11.403
   83    HB3  LYS   9           HB1      LYS   9  -4.486  -2.971 -11.423
   84    HG2  LYS   9           HG2      LYS   9  -5.077  -1.826  -9.343
   85    HG3  LYS   9           HG1      LYS   9  -3.497  -1.051  -9.329
   86    HD2  LYS   9           HD2      LYS   9  -4.040   0.035 -11.467
   87    HD3  LYS   9           HD1      LYS   9  -5.643  -0.710 -11.422
   88    HE2  LYS   9           HE2      LYS   9  -6.083   0.421  -9.280
   89    HE3  LYS   9           HE1      LYS   9  -4.502   1.187  -9.382
   90    HZ1  LYS   9           HZ1      LYS   9  -6.224   2.666 -10.113
   91    HZ2  LYS   9           HZ2      LYS   9  -6.747   1.579 -11.273
   92    HZ3  LYS   9           HZ3      LYS   9  -5.240   2.305 -11.423
   93    H    SER  10           H        SER  10  -3.318  -6.115  -9.405
   94    HA   SER  10           HA       SER  10  -1.387  -7.001 -11.320
   95    HG   SER  10           HG       SER  10  -0.641  -9.458 -10.521
   96    HB2  SER  10           HB2      SER  10  -1.388  -7.982  -9.084
   97    HB3  SER  10           HB1      SER  10  -3.040  -8.549  -9.317
   98    H    THR  11           H        THR  11  -1.895  -7.475 -13.303
   99    HA   THR  11           HA       THR  11  -4.624  -8.312 -13.995
  100    HB   THR  11           HB       THR  11  -2.445  -7.274 -15.843
  101    HG1  THR  11           HG1      THR  11  -3.904  -6.011 -13.921
  102   HG21  THR  11          HG21      THR  11  -4.424  -8.365 -16.869
  103   HG22  THR  11          HG22      THR  11  -4.348  -6.643 -17.238
  104   HG23  THR  11          HG23      THR  11  -5.473  -7.234 -16.011
  105    H    GLY  12           H        GLY  12  -2.753 -10.003 -12.765
  106    HA2  GLY  12           HA2      GLY  12  -2.626 -12.383 -13.503
  107    HA3  GLY  12           HA1      GLY  12  -1.793 -11.738 -14.926
  108    H    GLY  13           H        GLY  13   0.001 -10.215 -14.380
  109    HA2  GLY  13           HA2      GLY  13   1.631 -11.432 -12.285
  110    HA3  GLY  13           HA1      GLY  13   2.233 -10.499 -13.659
  111    H1   GLY 850           HT1      GLY 850   4.206  16.098   5.225
  112    H2   GLY 850           HT2      GLY 850   3.375  16.963   4.021
  113    H3   GLY 850           HT3      GLY 850   2.512  16.070   5.185
  114    HA2  GLY 850           HA1      GLY 850   3.454  17.510   6.901
  115    HA3  GLY 850           HA2      GLY 850   4.141  18.482   5.609
  116    H    SER 851           H        SER 851   1.713  18.406   7.709
  117    HA   SER 851           HA       SER 851   0.211  20.297   6.203
  118    HG   SER 851           HG       SER 851  -2.004  20.212   6.147
  119    HB2  SER 851           HB2      SER 851  -0.858  18.107   5.599
  120    HB3  SER 851           HB1      SER 851  -1.152  17.827   7.315
  121    H    HIS 852           H        HIS 852   0.777  21.763   7.691
  122    HA   HIS 852           HA       HIS 852  -0.040  21.234  10.466
  123    HD2  HIS 852           HD2      HIS 852   3.451  20.905   8.588
  124    HE1  HIS 852           HE1      HIS 852   4.463  19.916  12.583
  125    HE2  HIS 852           HE2      HIS 852   4.591  19.203  10.181
  126    HB2  HIS 852           HB2      HIS 852   1.976  23.225   9.405
  127    HB3  HIS 852           HB1      HIS 852   1.440  23.196  11.078
  128    H    MET 853           H        MET 853   0.269  24.148   8.424
  129    HA   MET 853           HA       MET 853  -2.452  24.894   9.281
  130    HB2  MET 853           HB2      MET 853  -0.120  26.719   8.617
  131    HB3  MET 853           HB1      MET 853  -1.753  27.251   8.992
  132    HG2  MET 853           HG2      MET 853  -1.540  26.304  11.236
  133    HG3  MET 853           HG1      MET 853   0.102  25.791  10.862
  134    HE1  MET 853           HE1      MET 853  -2.308  28.800  11.523
  135    HE2  MET 853           HE2      MET 853  -1.756  29.175   9.887
  136    HE3  MET 853           HE3      MET 853  -1.264  30.193  11.241
  137    H    ALA 854           H        ALA 854  -1.134  23.430   6.989
  138    HA   ALA 854           HA       ALA 854  -2.779  24.417   4.896
  139    HB1  ALA 854           HB1      ALA 854  -0.847  25.889   4.567
  140    HB2  ALA 854           HB2      ALA 854  -0.871  24.668   3.295
  141    HB3  ALA 854           HB3      ALA 854   0.244  24.506   4.649
  142    H    MET 855           H        MET 855  -2.203  22.868   2.963
  143    HA   MET 855           HA       MET 855  -1.263  20.324   4.032
  144    HB2  MET 855           HB2      MET 855  -2.957  19.136   2.612
  145    HB3  MET 855           HB1      MET 855  -3.672  20.084   3.899
  146    HG2  MET 855           HG2      MET 855  -4.255  21.828   2.287
  147    HG3  MET 855           HG1      MET 855  -3.513  20.882   0.998
  148    HE1  MET 855           HE1      MET 855  -5.763  21.064  -0.417
  149    HE2  MET 855           HE2      MET 855  -6.499  22.012   0.877
  150    HE3  MET 855           HE3      MET 855  -7.351  20.621   0.212
  151    H    ALA 856           H        ALA 856   0.598  19.930   3.096
  152    HA   ALA 856           HA       ALA 856   1.095  21.009   0.448
  153    HB1  ALA 856           HB1      ALA 856   2.730  21.422   2.212
  154    HB2  ALA 856           HB2      ALA 856   3.401  20.433   0.898
  155    HB3  ALA 856           HB3      ALA 856   2.901  19.671   2.412
  156    H    TYR 857           H        TYR 857   0.514  19.751  -1.168
  157    HA   TYR 857           HA       TYR 857   0.371  18.080  -2.579
  158    HD1  TYR 857           HD2      TYR 857   3.406  19.579  -1.627
  159    HD2  TYR 857           HD1      TYR 857   2.580  16.575  -4.513
  160    HE1  TYR 857           HE2      TYR 857   4.566  20.911  -3.337
  161    HE2  TYR 857           HE1      TYR 857   3.713  17.887  -6.225
  162    HH   TYR 857           HH       TYR 857   4.293  20.242  -6.637
  163    HB2  TYR 857           HB2      TYR 857   2.710  17.212  -0.990
  164    HB3  TYR 857           HB1      TYR 857   2.042  16.160  -2.254
  165    H    VAL 858           H        VAL 858  -0.670  17.832   0.281
  166    HA   VAL 858           HA       VAL 858  -1.879  15.174  -0.129
  167    HB   VAL 858           HB       VAL 858  -2.090  16.953   2.325
  168   HG11  VAL 858          HG11      VAL 858  -2.929  14.931   3.437
  169   HG12  VAL 858          HG12      VAL 858  -2.864  14.079   1.891
  170   HG13  VAL 858          HG13      VAL 858  -3.956  15.446   2.099
  171   HG21  VAL 858          HG21      VAL 858  -0.546  15.409   3.422
  172   HG22  VAL 858          HG22      VAL 858   0.215  16.200   2.037
  173   HG23  VAL 858          HG23      VAL 858  -0.345  14.530   1.908
  174    H    ILE 859           H        ILE 859  -3.875  15.180  -1.021
  175    HA   ILE 859           HA       ILE 859  -5.553  17.545  -0.542
  176    HB   ILE 859           HB       ILE 859  -6.604  17.287  -2.733
  177   HG12  ILE 859          HG12      ILE 859  -4.601  15.085  -3.326
  178   HG13  ILE 859          HG11      ILE 859  -6.290  14.814  -2.909
  179   HG21  ILE 859          HG21      ILE 859  -4.747  17.917  -4.213
  180   HG22  ILE 859          HG22      ILE 859  -3.603  17.397  -2.976
  181   HG23  ILE 859          HG23      ILE 859  -4.688  18.751  -2.659
  182   HD11  ILE 859          HD11      ILE 859  -6.997  15.973  -4.914
  183   HD12  ILE 859          HD12      ILE 859  -5.888  14.664  -5.323
  184   HD13  ILE 859          HD13      ILE 859  -5.323  16.335  -5.318
  185    H    ARG 860           H        ARG 860  -7.935  16.893  -0.847
  186    HA   ARG 860           HA       ARG 860  -8.226  14.184   0.183
  187    HE   ARG 860           HE       ARG 860  -8.213  16.185   4.586
  188    HB2  ARG 860           HB2      ARG 860  -9.939  16.613   0.582
  189    HB3  ARG 860           HB1      ARG 860 -10.460  14.991   1.019
  190    HG2  ARG 860           HG2      ARG 860  -8.605  14.776   2.504
  191    HG3  ARG 860           HG1      ARG 860  -8.034  16.401   2.094
  192    HD2  ARG 860           HD2      ARG 860 -10.178  17.302   2.918
  193    HD3  ARG 860           HD1      ARG 860 -10.651  15.673   3.404
  194   HH11  ARG 860          HH11      ARG 860 -11.495  17.464   4.777
  195   HH12  ARG 860          HH12      ARG 860 -11.288  18.125   6.345
  196   HH21  ARG 860          HH21      ARG 860  -7.948  17.039   6.697
  197   HH22  ARG 860          HH22      ARG 860  -9.226  17.875   7.474
  198    H    ASP 861           H        ASP 861  -9.837  12.902  -0.583
  199    HA   ASP 861           HA       ASP 861 -10.600  13.493  -3.329
  200    HB2  ASP 861           HB2      ASP 861 -11.049  11.191  -3.578
  201    HB3  ASP 861           HB1      ASP 861  -9.692  11.207  -2.463
  202    H    GLU 862           H        GLU 862 -13.002  12.194  -3.530
  203    HA   GLU 862           HA       GLU 862 -14.788  14.201  -2.696
  204    HB2  GLU 862           HB2      GLU 862 -16.493  12.849  -3.727
  205    HB3  GLU 862           HB1      GLU 862 -15.062  12.847  -4.736
  206    HG2  GLU 862           HG2      GLU 862 -14.432  10.651  -3.758
  207    HG3  GLU 862           HG1      GLU 862 -15.968  10.651  -2.903
  208    H    TRP 863           H        TRP 863 -13.888  11.084  -1.316
  209    HA   TRP 863           HA       TRP 863 -16.035  11.100   0.586
  210    HD1  TRP 863           HD       TRP 863 -13.396   7.600  -1.213
  211    HE1  TRP 863           HE1      TRP 863 -15.039   6.493  -2.870
  212    HE3  TRP 863           HE3      TRP 863 -17.588  10.012   0.160
  213    HZ2  TRP 863           HZ2      TRP 863 -17.788   6.647  -3.500
  214    HZ3  TRP 863           HZ3      TRP 863 -19.732   9.501  -1.006
  215    HH2  TRP 863           HH       TRP 863 -19.803   7.854  -2.801
  216    HB2  TRP 863           HB2      TRP 863 -13.522   9.421   0.551
  217    HB3  TRP 863           HB1      TRP 863 -14.960   9.122   1.509
  218    H    GLY 864           H        GLY 864 -12.674  11.974   0.490
  219    HA2  GLY 864           HA2      GLY 864 -12.072  13.893   1.915
  220    HA3  GLY 864           HA1      GLY 864 -13.027  13.125   3.173
  221    H    ASN 865           H        ASN 865 -11.010  11.177   1.156
  222    HA   ASN 865           HA       ASN 865  -9.355  10.505   3.452
  223    HB2  ASN 865           HB2      ASN 865  -9.300   9.403   0.624
  224    HB3  ASN 865           HB1      ASN 865  -8.448   8.745   2.008
  225   HD21  ASN 865          HD21      ASN 865 -11.445   9.069   0.394
  226   HD22  ASN 865          HD22      ASN 865 -12.310   7.837   1.255
  227    H    GLN 866           H        GLN 866  -7.003  10.419   3.027
  228    HA   GLN 866           HA       GLN 866  -6.245  12.866   1.707
  229    HB2  GLN 866           HB2      GLN 866  -4.829  11.058   3.633
  230    HB3  GLN 866           HB1      GLN 866  -4.033  12.399   2.825
  231    HG2  GLN 866           HG2      GLN 866  -5.545  13.962   3.791
  232    HG3  GLN 866           HG1      GLN 866  -6.497  12.673   4.526
  233   HE21  GLN 866          HE21      GLN 866  -3.019  12.631   4.417
  234   HE22  GLN 866          HE22      GLN 866  -2.776  12.903   6.097
  235    H    ILE 867           H        ILE 867  -5.531  12.904  -0.189
  236    HA   ILE 867           HA       ILE 867  -4.304  10.508  -1.364
  237    HB   ILE 867           HB       ILE 867  -5.572  12.879  -2.763
  238   HG12  ILE 867          HG12      ILE 867  -7.317  11.600  -1.620
  239   HG13  ILE 867          HG11      ILE 867  -7.438  11.369  -3.356
  240   HG21  ILE 867          HG21      ILE 867  -4.595  10.251  -3.864
  241   HG22  ILE 867          HG22      ILE 867  -3.842  11.830  -4.081
  242   HG23  ILE 867          HG23      ILE 867  -5.425  11.506  -4.788
  243   HD11  ILE 867          HD11      ILE 867  -6.252   9.443  -1.375
  244   HD12  ILE 867          HD12      ILE 867  -6.337   9.191  -3.122
  245   HD13  ILE 867          HD13      ILE 867  -7.825   9.296  -2.170
  246    H    TRP 868           H        TRP 868  -2.188  10.710  -1.566
  247    HA   TRP 868           HA       TRP 868  -0.946  13.302  -1.343
  248    HD1  TRP 868           HD       TRP 868   1.996  13.092   0.493
  249    HE1  TRP 868           HE1      TRP 868   1.599  12.890   3.032
  250    HE3  TRP 868           HE3      TRP 868  -1.981   9.863   0.465
  251    HZ2  TRP 868           HZ2      TRP 868  -0.162  11.572   4.778
  252    HZ3  TRP 868           HZ3      TRP 868  -2.958   9.200   2.617
  253    HH2  TRP 868           HH       TRP 868  -2.063  10.035   4.725
  254    HB2  TRP 868           HB2      TRP 868   0.090  10.486  -1.331
  255    HB3  TRP 868           HB1      TRP 868   1.183  11.840  -1.579
  256    H    ILE 869           H        ILE 869   0.016  14.352  -2.887
  257    HA   ILE 869           HA       ILE 869  -0.180  13.376  -5.638
  258    HB   ILE 869           HB       ILE 869   0.638  16.106  -4.594
  259   HG12  ILE 869          HG12      ILE 869  -1.692  15.688  -3.980
  260   HG13  ILE 869          HG11      ILE 869  -1.604  16.907  -5.236
  261   HG21  ILE 869          HG21      ILE 869   1.496  15.674  -6.818
  262   HG22  ILE 869          HG22      ILE 869   0.227  16.895  -6.889
  263   HG23  ILE 869          HG23      ILE 869  -0.118  15.238  -7.382
  264   HD11  ILE 869          HD11      ILE 869  -3.435  15.425  -5.662
  265   HD12  ILE 869          HD12      ILE 869  -2.376  14.027  -5.563
  266   HD13  ILE 869          HD13      ILE 869  -2.201  15.167  -6.897
  267    H    CYS 870           H        CYS 870   1.618  12.674  -6.650
  268    HA   CYS 870           HA       CYS 870   4.141  12.663  -5.260
  269    HB2  CYS 870           HB2      CYS 870   3.410  10.675  -6.468
  270    HB3  CYS 870           HB1      CYS 870   3.241  11.601  -7.943
  271    HA   PRO 871           HA       PRO 871   5.269  16.441  -7.493
  272    HB2  PRO 871           HB2      PRO 871   7.851  16.108  -6.124
  273    HB3  PRO 871           HB1      PRO 871   6.700  17.442  -6.028
  274    HG2  PRO 871           HG2      PRO 871   7.075  15.747  -3.970
  275    HG3  PRO 871           HG1      PRO 871   5.487  16.456  -4.327
  276    HD2  PRO 871           HD2      PRO 871   6.528  13.718  -4.971
  277    HD3  PRO 871           HD1      PRO 871   4.936  14.218  -4.351
  278    H    GLY 872           H        GLY 872   6.331  13.294  -7.823
  279    HA2  GLY 872           HA2      GLY 872   8.558  13.839  -9.577
  280    HA3  GLY 872           HA1      GLY 872   7.896  12.262  -9.171
  281    H    CYS 873           H        CYS 873   5.211  12.628  -9.877
  282    HA   CYS 873           HA       CYS 873   5.476  12.807 -12.789
  283    HB2  CYS 873           HB2      CYS 873   3.405  11.426 -12.730
  284    HB3  CYS 873           HB1      CYS 873   4.812  10.662 -11.991
  285    H    ASN 874           H        ASN 874   3.888  14.094 -10.008
  286    HA   ASN 874           HA       ASN 874   2.580  15.833  -9.591
  287    HB2  ASN 874           HB2      ASN 874   3.522  17.044 -11.595
  288    HB3  ASN 874           HB1      ASN 874   2.318  16.264 -12.605
  289   HD21  ASN 874          HD21      ASN 874   1.786  17.655  -9.381
  290   HD22  ASN 874          HD22      ASN 874   0.699  18.882  -9.933
  291    H    LYS 875           H        LYS 875   1.835  12.939 -10.193
  292    HA   LYS 875           HA       LYS 875  -0.987  13.343 -10.764
  293    HB2  LYS 875           HB2      LYS 875   0.765  10.873 -10.841
  294    HB3  LYS 875           HB1      LYS 875  -0.978  10.864 -11.040
  295    HG2  LYS 875           HG2      LYS 875  -0.789  12.135 -13.087
  296    HG3  LYS 875           HG1      LYS 875   0.953  12.295 -12.860
  297    HD2  LYS 875           HD2      LYS 875   0.397  10.528 -14.490
  298    HD3  LYS 875           HD1      LYS 875   1.229   9.890 -13.069
  299    HE2  LYS 875           HE2      LYS 875  -0.882   9.123 -12.150
  300    HE3  LYS 875           HE1      LYS 875  -1.772   9.816 -13.507
  301    HZ1  LYS 875           HZ1      LYS 875  -1.428   7.400 -13.652
  302    HZ2  LYS 875           HZ2      LYS 875   0.237   7.619 -13.711
  303    HZ3  LYS 875           HZ3      LYS 875  -0.738   8.205 -14.955
  304    HA   PRO 876           HA       PRO 876  -1.737  12.361  -6.502
  305    HB2  PRO 876           HB2      PRO 876  -4.203  11.251  -6.691
  306    HB3  PRO 876           HB1      PRO 876  -3.940  12.992  -6.844
  307    HG2  PRO 876           HG2      PRO 876  -4.320  10.930  -8.951
  308    HG3  PRO 876           HG1      PRO 876  -5.003  12.573  -8.845
  309    HD2  PRO 876           HD2      PRO 876  -2.869  11.964 -10.418
  310    HD3  PRO 876           HD1      PRO 876  -3.075  13.553  -9.652
  311    H    ASP 877           H        ASP 877  -2.244  10.493  -5.163
  312    HA   ASP 877           HA       ASP 877  -0.898   8.229  -6.209
  313    HB2  ASP 877           HB2      ASP 877  -0.405   8.853  -3.935
  314    HB3  ASP 877           HB1      ASP 877  -2.098   8.651  -3.476
  315    H    ASP 878           H        ASP 878  -1.642   6.271  -6.639
  316    HA   ASP 878           HA       ASP 878  -4.546   6.011  -7.092
  317    HB2  ASP 878           HB2      ASP 878  -2.340   4.196  -8.112
  318    HB3  ASP 878           HB1      ASP 878  -4.005   4.241  -8.650
  319    H    GLY 879           H        GLY 879  -2.406   5.380  -4.757
  320    HA2  GLY 879           HA2      GLY 879  -2.730   4.051  -2.870
  321    HA3  GLY 879           HA1      GLY 879  -3.781   2.989  -3.818
  322    H    SER 880           H        SER 880  -0.678   4.182  -4.832
  323    HA   SER 880           HA       SER 880   0.114   1.387  -5.212
  324    HG   SER 880           HG       SER 880  -0.559   3.418  -8.116
  325    HB2  SER 880           HB2      SER 880   1.003   3.848  -6.703
  326    HB3  SER 880           HB1      SER 880   1.392   2.190  -7.112
  327    HA   PRO 881           HA       PRO 881   3.854   1.637  -2.732
  328    HB2  PRO 881           HB2      PRO 881   5.363   1.394  -5.281
  329    HB3  PRO 881           HB1      PRO 881   5.560   0.507  -3.772
  330    HG2  PRO 881           HG2      PRO 881   4.366  -0.637  -5.818
  331    HG3  PRO 881           HG1      PRO 881   3.760  -0.888  -4.182
  332    HD2  PRO 881           HD2      PRO 881   2.620   0.752  -6.373
  333    HD3  PRO 881           HD1      PRO 881   1.773  -0.048  -5.073
  334    H    MET 882           H        MET 882   4.132   3.559  -1.910
  335    HA   MET 882           HA       MET 882   5.495   5.585  -3.553
  336    HB2  MET 882           HB2      MET 882   3.948   6.104  -1.011
  337    HB3  MET 882           HB1      MET 882   4.592   7.291  -2.130
  338    HG2  MET 882           HG2      MET 882   2.979   6.393  -3.829
  339    HG3  MET 882           HG1      MET 882   2.272   5.443  -2.523
  340    HE1  MET 882           HE1      MET 882   2.176  10.009  -2.952
  341    HE2  MET 882           HE2      MET 882   2.494   8.855  -4.245
  342    HE3  MET 882           HE3      MET 882   3.672   9.050  -2.928
  343    H    ILE 883           H        ILE 883   7.110   6.801  -2.451
  344    HA   ILE 883           HA       ILE 883   8.184   5.486  -0.072
  345    HB   ILE 883           HB       ILE 883   9.569   4.930  -2.098
  346   HG12  ILE 883          HG12      ILE 883  11.099   6.782  -0.278
  347   HG13  ILE 883          HG11      ILE 883  10.578   5.165   0.212
  348   HG21  ILE 883          HG21      ILE 883  10.067   7.911  -2.200
  349   HG22  ILE 883          HG22      ILE 883   9.163   6.982  -3.391
  350   HG23  ILE 883          HG23      ILE 883  10.895   6.705  -3.178
  351   HD11  ILE 883          HD11      ILE 883  12.394   5.853  -2.081
  352   HD12  ILE 883          HD12      ILE 883  11.918   4.224  -1.602
  353   HD13  ILE 883          HD13      ILE 883  12.903   5.215  -0.524
  354    H    GLY 884           H        GLY 884   8.919   6.838   1.479
  355    HA2  GLY 884           HA2      GLY 884   8.099   9.619   1.158
  356    HA3  GLY 884           HA1      GLY 884   8.349   8.781   2.684
  357    H    CYS 885           H        CYS 885   9.452  11.222   1.201
  358    HA   CYS 885           HA       CYS 885  12.270  10.787   1.084
  359    HB2  CYS 885           HB2      CYS 885  11.079  12.542  -0.182
  360    HB3  CYS 885           HB1      CYS 885  10.637  13.298   1.324
  361    H    ASP 886           H        ASP 886  13.733  11.058   2.675
  362    HA   ASP 886           HA       ASP 886  12.697  11.313   5.349
  363    HB2  ASP 886           HB2      ASP 886  15.384  10.593   4.245
  364    HB3  ASP 886           HB1      ASP 886  15.137  10.826   5.962
  365    H    ASP 887           H        ASP 887  13.623  13.465   3.075
  366    HA   ASP 887           HA       ASP 887  14.642  15.262   5.181
  367    HB2  ASP 887           HB2      ASP 887  16.092  14.927   3.093
  368    HB3  ASP 887           HB1      ASP 887  14.874  15.878   2.251
  369    H    CYS 888           H        CYS 888  12.504  15.047   2.412
  370    HA   CYS 888           HA       CYS 888  11.108  17.479   3.057
  371    HB2  CYS 888           HB2      CYS 888  10.046  15.108   1.465
  372    HB3  CYS 888           HB1      CYS 888   9.190  16.608   1.684
  373    H    ASP 889           H        ASP 889   9.508  14.407   2.995
  374    HA   ASP 889           HA       ASP 889   8.482  13.493   5.163
  375    HB2  ASP 889           HB2      ASP 889   8.194  15.834   6.132
  376    HB3  ASP 889           HB1      ASP 889   7.032  16.168   4.860
  377    H    ASP 890           H        ASP 890   8.184  14.698   2.070
  378    HA   ASP 890           HA       ASP 890   5.416  14.106   1.638
  379    HB2  ASP 890           HB2      ASP 890   7.554  15.204  -0.196
  380    HB3  ASP 890           HB1      ASP 890   5.883  14.918  -0.670
  381    H    TRP 891           H        TRP 891   4.944  12.966  -0.421
  382    HA   TRP 891           HA       TRP 891   6.453  10.487  -0.341
  383    HD1  TRP 891           HD       TRP 891   3.500  11.718   2.135
  384    HE1  TRP 891           HE1      TRP 891   3.869  10.383   4.308
  385    HE3  TRP 891           HE3      TRP 891   5.421   7.516   0.102
  386    HZ2  TRP 891           HZ2      TRP 891   4.883   7.811   5.036
  387    HZ3  TRP 891           HZ3      TRP 891   6.059   5.688   1.492
  388    HH2  TRP 891           HH       TRP 891   5.818   5.809   3.977
  389    HB2  TRP 891           HB2      TRP 891   3.474  10.937  -0.456
  390    HB3  TRP 891           HB1      TRP 891   4.220   9.388  -0.831
  391    H    TYR 892           H        TYR 892   7.124   9.726  -2.247
  392    HA   TYR 892           HA       TYR 892   6.009  10.839  -4.742
  393    HD1  TYR 892           HD2      TYR 892   8.598  11.855  -2.366
  394    HD2  TYR 892           HD1      TYR 892   8.713  12.230  -6.591
  395    HE1  TYR 892           HE2      TYR 892   9.437  14.149  -2.131
  396    HE2  TYR 892           HE1      TYR 892   9.564  14.517  -6.380
  397    HH   TYR 892           HH       TYR 892  10.861  15.681  -3.583
  398    HB2  TYR 892           HB2      TYR 892   8.783   9.837  -4.071
  399    HB3  TYR 892           HB1      TYR 892   8.233  10.183  -5.695
  400    H    HIS 893           H        HIS 893   5.889   9.270  -6.443
  401    HA   HIS 893           HA       HIS 893   5.379   6.574  -5.455
  402    HD2  HIS 893           HD2      HIS 893   2.560   6.047  -5.846
  403    HE1  HIS 893           HE1      HIS 893   1.076   9.574  -7.726
  404    HE2  HIS 893           HE2      HIS 893   0.644   7.707  -5.914
  405    HB2  HIS 893           HB2      HIS 893   5.212   7.606  -8.297
  406    HB3  HIS 893           HB1      HIS 893   4.775   5.987  -7.785
  407    H    TRP 894           H        TRP 894   6.346   4.705  -6.355
  408    HA   TRP 894           HA       TRP 894   9.121   4.816  -6.358
  409    HD1  TRP 894           HD       TRP 894   8.215   4.495  -4.260
  410    HE1  TRP 894           HE1      TRP 894   8.204   3.062  -2.136
  411    HE3  TRP 894           HE3      TRP 894   8.148  -0.108  -6.431
  412    HZ2  TRP 894           HZ2      TRP 894   8.159   0.296  -1.474
  413    HZ3  TRP 894           HZ3      TRP 894   8.117  -2.091  -5.006
  414    HH2  TRP 894           HH       TRP 894   8.127  -1.893  -2.571
  415    HB2  TRP 894           HB2      TRP 894   7.227   2.621  -7.116
  416    HB3  TRP 894           HB1      TRP 894   8.969   2.416  -7.194
  417    HA   PRO 895           HA       PRO 895   9.071   3.859 -11.120
  418    HB2  PRO 895           HB2      PRO 895   6.872   4.777 -12.512
  419    HB3  PRO 895           HB1      PRO 895   7.084   3.106 -11.985
  420    HG2  PRO 895           HG2      PRO 895   5.564   5.325 -10.671
  421    HG3  PRO 895           HG1      PRO 895   5.078   3.635 -10.924
  422    HD2  PRO 895           HD2      PRO 895   5.972   4.439  -8.554
  423    HD3  PRO 895           HD1      PRO 895   6.454   2.861  -9.210
  424    H    CYS 896           H        CYS 896   7.757   6.649  -9.651
  425    HA   CYS 896           HA       CYS 896   8.436   8.486 -11.706
  426    HB2  CYS 896           HB2      CYS 896   7.660   8.868  -8.839
  427    HB3  CYS 896           HB1      CYS 896   7.565  10.088 -10.134
  428    H    VAL 897           H        VAL 897   9.767   7.569  -8.584
  429    HA   VAL 897           HA       VAL 897  12.007   9.351  -9.066
  430    HB   VAL 897           HB       VAL 897  12.752   8.779  -6.788
  431   HG11  VAL 897          HG11      VAL 897   9.885   9.668  -7.078
  432   HG12  VAL 897          HG12      VAL 897  11.314  10.701  -7.134
  433   HG13  VAL 897          HG13      VAL 897  10.852   9.897  -5.631
  434   HG21  VAL 897          HG21      VAL 897  11.809   6.512  -6.676
  435   HG22  VAL 897          HG22      VAL 897  10.184   7.195  -6.636
  436   HG23  VAL 897          HG23      VAL 897  11.302   7.493  -5.307
  437    H    GLY 898           H        GLY 898  11.284   6.075  -9.488
  438    HA2  GLY 898           HA2      GLY 898  12.735   4.778 -10.889
  439    HA3  GLY 898           HA1      GLY 898  14.105   5.625 -10.195
  440    H    ILE 899           H        ILE 899  11.739   4.691  -7.969
  441    HA   ILE 899           HA       ILE 899  13.533   2.722  -6.836
  442    HB   ILE 899           HB       ILE 899  10.912   3.913  -5.864
  443   HG12  ILE 899          HG12      ILE 899  13.005   5.300  -5.725
  444   HG13  ILE 899          HG11      ILE 899  12.182   5.041  -4.190
  445   HG21  ILE 899          HG21      ILE 899  10.984   1.593  -5.096
  446   HG22  ILE 899          HG22      ILE 899  11.235   2.695  -3.740
  447   HG23  ILE 899          HG23      ILE 899  12.607   1.843  -4.448
  448   HD11  ILE 899          HD11      ILE 899  14.575   4.920  -3.990
  449   HD12  ILE 899          HD12      ILE 899  14.635   3.589  -5.162
  450   HD13  ILE 899          HD13      ILE 899  13.810   3.385  -3.602
  451    H    MET 900           H        MET 900  13.249   0.575  -7.025
  452    HA   MET 900           HA       MET 900  10.840  -0.334  -8.452
  453    HB2  MET 900           HB2      MET 900  13.603  -1.556  -8.468
  454    HB3  MET 900           HB1      MET 900  12.201  -2.197  -9.311
  455    HG2  MET 900           HG2      MET 900  12.095  -0.168 -10.674
  456    HG3  MET 900           HG1      MET 900  13.507   0.464  -9.831
  457    HE1  MET 900           HE1      MET 900  14.766   0.894 -12.081
  458    HE2  MET 900           HE2      MET 900  13.367   0.312 -12.985
  459    HE3  MET 900           HE3      MET 900  14.976  -0.320 -13.342
  460    H    ALA 901           H        ALA 901  12.897  -0.784  -5.707
  461    HA   ALA 901           HA       ALA 901  10.949  -2.634  -4.619
  462    HB1  ALA 901           HB1      ALA 901  13.938  -3.041  -4.518
  463    HB2  ALA 901           HB2      ALA 901  12.795  -4.018  -5.446
  464    HB3  ALA 901           HB3      ALA 901  12.732  -4.019  -3.681
  465    H    ALA 902           H        ALA 902  10.794  -2.488  -2.397
  466    HA   ALA 902           HA       ALA 902  11.234   0.088  -1.384
  467    HB1  ALA 902           HB1      ALA 902   9.348  -1.330  -0.717
  468    HB2  ALA 902           HB2      ALA 902  10.255  -0.720   0.662
  469    HB3  ALA 902           HB3      ALA 902  10.465  -2.391   0.142
  470    HA   PRO 903           HA       PRO 903  15.166  -0.803   0.626
  471    HB2  PRO 903           HB2      PRO 903  15.432   1.884   1.447
  472    HB3  PRO 903           HB1      PRO 903  16.148   1.182   0.000
  473    HG2  PRO 903           HG2      PRO 903  14.112   3.139   0.134
  474    HG3  PRO 903           HG1      PRO 903  14.696   2.316  -1.314
  475    HD2  PRO 903           HD2      PRO 903  12.258   1.829   0.276
  476    HD3  PRO 903           HD1      PRO 903  12.612   1.454  -1.425
  477    HA   PRO 904           HA       PRO 904  13.699  -0.996   4.814
  478    HB2  PRO 904           HB2      PRO 904  15.925  -0.285   6.279
  479    HB3  PRO 904           HB1      PRO 904  15.678  -1.893   5.598
  480    HG2  PRO 904           HG2      PRO 904  17.347   0.353   4.602
  481    HG3  PRO 904           HG1      PRO 904  17.653  -1.390   4.533
  482    HD2  PRO 904           HD2      PRO 904  16.787   0.079   2.402
  483    HD3  PRO 904           HD1      PRO 904  16.414  -1.641   2.608
  484    H    GLU 905           H        GLU 905  12.722   0.379   6.256
  485    HA   GLU 905           HA       GLU 905  12.624   3.059   5.490
  486    HB2  GLU 905           HB2      GLU 905  11.235   3.353   7.668
  487    HB3  GLU 905           HB1      GLU 905  10.596   2.447   6.322
  488    HG2  GLU 905           HG2      GLU 905  10.147   1.439   8.505
  489    HG3  GLU 905           HG1      GLU 905  11.017   0.368   7.417
  490    H    GLU 906           H        GLU 906  14.537   1.517   7.857
  491    HA   GLU 906           HA       GLU 906  15.363   3.868   9.215
  492    HB2  GLU 906           HB2      GLU 906  17.140   2.432  10.160
  493    HB3  GLU 906           HB1      GLU 906  15.533   1.747  10.329
  494    HG2  GLU 906           HG2      GLU 906  15.972   0.291   8.409
  495    HG3  GLU 906           HG1      GLU 906  17.602   0.955   8.296
  496    H    MET 907           H        MET 907  16.174   2.634   6.152
  497    HA   MET 907           HA       MET 907  18.695   4.101   6.076
  498    HB2  MET 907           HB2      MET 907  18.709   2.013   4.808
  499    HB3  MET 907           HB1      MET 907  17.232   2.493   3.974
  500    HG2  MET 907           HG2      MET 907  19.230   2.711   2.542
  501    HG3  MET 907           HG1      MET 907  18.402   4.241   2.795
  502    HE1  MET 907           HE1      MET 907  21.580   2.094   3.536
  503    HE2  MET 907           HE2      MET 907  20.908   2.270   5.157
  504    HE3  MET 907           HE3      MET 907  22.426   3.065   4.740
  505    H    GLN 908           H        GLN 908  18.900   5.984   5.014
  506    HA   GLN 908           HA       GLN 908  16.333   7.252   4.651
  507    HB2  GLN 908           HB2      GLN 908  19.013   8.573   4.854
  508    HB3  GLN 908           HB1      GLN 908  17.461   9.381   4.767
  509    HG2  GLN 908           HG2      GLN 908  16.815   8.160   6.881
  510    HG3  GLN 908           HG1      GLN 908  18.502   7.678   7.015
  511   HE21  GLN 908          HE21      GLN 908  17.377  10.755   5.817
  512   HE22  GLN 908          HE22      GLN 908  17.977  11.714   7.109
  513    H    TRP 909           H        TRP 909  15.797   8.401   3.000
  514    HA   TRP 909           HA       TRP 909  17.304   8.208   0.517
  515    HD1  TRP 909           HD       TRP 909  16.537   6.290  -2.125
  516    HE1  TRP 909           HE1      TRP 909  15.317   7.159  -4.237
  517    HE3  TRP 909           HE3      TRP 909  12.917   9.086   0.123
  518    HZ2  TRP 909           HZ2      TRP 909  13.099   8.809  -4.837
  519    HZ3  TRP 909           HZ3      TRP 909  11.296  10.287  -1.268
  520    HH2  TRP 909           HH       TRP 909  11.386  10.155  -3.695
  521    HB2  TRP 909           HB2      TRP 909  15.829   6.248   0.458
  522    HB3  TRP 909           HB1      TRP 909  14.462   7.246   0.937
  523    H    PHE 910           H        PHE 910  16.775   9.873  -0.862
  524    HA   PHE 910           HA       PHE 910  14.940  11.860   0.176
  525    HD1  PHE 910           HD2      PHE 910  15.812  13.137   2.256
  526    HD2  PHE 910           HD1      PHE 910  19.371  11.612   0.514
  527    HE1  PHE 910           HE2      PHE 910  16.729  12.742   4.491
  528    HE2  PHE 910           HE1      PHE 910  20.289  11.192   2.750
  529    HZ   PHE 910           HZ       PHE 910  18.944  11.746   4.748
  530    HB2  PHE 910           HB2      PHE 910  17.735  12.476  -0.841
  531    HB3  PHE 910           HB1      PHE 910  16.575  13.627  -0.186
  532    H    CYS 911           H        CYS 911  13.947  12.978  -1.447
  533    HA   CYS 911           HA       CYS 911  13.549  11.675  -3.898
  534    HB2  CYS 911           HB2      CYS 911  12.152  13.629  -4.364
  535    HB3  CYS 911           HB1      CYS 911  11.894  12.992  -2.756
  536    HA   PRO 912           HA       PRO 912  16.411  13.518  -6.822
  537    HB2  PRO 912           HB2      PRO 912  14.730  14.644  -8.725
  538    HB3  PRO 912           HB1      PRO 912  15.223  12.949  -8.688
  539    HG2  PRO 912           HG2      PRO 912  12.729  14.217  -7.620
  540    HG3  PRO 912           HG1      PRO 912  12.904  12.704  -8.530
  541    HD2  PRO 912           HD2      PRO 912  12.555  12.621  -5.920
  542    HD3  PRO 912           HD1      PRO 912  13.746  11.555  -6.679
  543    H    LYS 913           H        LYS 913  14.286  15.410  -5.047
  544    HA   LYS 913           HA       LYS 913  15.490  17.949  -5.853
  545    HB2  LYS 913           HB2      LYS 913  13.269  17.272  -3.906
  546    HB3  LYS 913           HB1      LYS 913  13.900  18.893  -4.160
  547    HG2  LYS 913           HG2      LYS 913  13.096  18.948  -6.393
  548    HG3  LYS 913           HG1      LYS 913  12.679  17.236  -6.349
  549    HD2  LYS 913           HD2      LYS 913  10.693  18.708  -6.107
  550    HD3  LYS 913           HD1      LYS 913  10.931  17.643  -4.730
  551    HE2  LYS 913           HE2      LYS 913  10.289  19.870  -3.989
  552    HE3  LYS 913           HE1      LYS 913  11.928  19.508  -3.468
  553    HZ1  LYS 913           HZ1      LYS 913  11.205  21.195  -5.817
  554    HZ2  LYS 913           HZ2      LYS 913  12.766  20.899  -5.270
  555    HZ3  LYS 913           HZ3      LYS 913  11.689  21.744  -4.305
  556    H    CYS 914           H        CYS 914  14.941  15.977  -2.950
  557    HA   CYS 914           HA       CYS 914  16.776  17.525  -1.444
  558    HB2  CYS 914           HB2      CYS 914  15.105  15.166  -0.845
  559    HB3  CYS 914           HB1      CYS 914  16.259  15.721   0.354
  560    H    ALA 915           H        ALA 915  17.039  14.471  -3.065
  561    HA   ALA 915           HA       ALA 915  19.557  13.912  -1.823
  562    HB1  ALA 915           HB1      ALA 915  18.143  12.125  -2.716
  563    HB2  ALA 915           HB2      ALA 915  19.754  12.112  -3.445
  564    HB3  ALA 915           HB3      ALA 915  18.373  12.759  -4.345
  565    H    ASN 916           H        ASN 916  18.349  15.666  -4.437
  566    HA   ASN 916           HA       ASN 916  20.565  15.890  -6.163
  567    HB2  ASN 916           HB2      ASN 916  18.121  16.563  -6.510
  568    HB3  ASN 916           HB1      ASN 916  18.509  18.016  -5.613
  569   HD21  ASN 916          HD21      ASN 916  17.583  17.630  -8.283
  570   HD22  ASN 916          HD22      ASN 916  18.694  18.393  -9.349
  571    H    LYS 917           H        LYS 917  19.447  17.839  -3.444
  572    HA   LYS 917           HA       LYS 917  21.621  19.678  -3.556
  573    HB2  LYS 917           HB2      LYS 917  20.693  20.623  -1.530
  574    HB3  LYS 917           HB1      LYS 917  19.401  20.268  -2.673
  575    HG2  LYS 917           HG2      LYS 917  18.979  18.159  -1.439
  576    HG3  LYS 917           HG1      LYS 917  20.172  18.696  -0.258
  577    HD2  LYS 917           HD2      LYS 917  18.806  20.672   0.222
  578    HD3  LYS 917           HD1      LYS 917  17.614  20.145  -0.967
  579    HE2  LYS 917           HE2      LYS 917  17.346  18.030   0.380
  580    HE3  LYS 917           HE1      LYS 917  18.400  18.749   1.582
  581    HZ1  LYS 917           HZ1      LYS 917  15.794  19.849   0.712
  582    HZ2  LYS 917           HZ2      LYS 917  16.801  20.538   1.875
  583    HZ3  LYS 917           HZ3      LYS 917  16.092  19.023   2.148
  584    H    ILE 918           H        ILE 918  21.499  16.500  -2.456
  585    HA   ILE 918           HA       ILE 918  23.401  16.788  -0.337
  586    HB   ILE 918           HB       ILE 918  22.566  14.339  -1.910
  587   HG12  ILE 918          HG12      ILE 918  20.737  15.408  -0.678
  588   HG13  ILE 918          HG11      ILE 918  21.094  13.809  -0.071
  589   HG21  ILE 918          HG21      ILE 918  24.735  13.971  -0.882
  590   HG22  ILE 918          HG22      ILE 918  23.505  13.012  -0.059
  591   HG23  ILE 918          HG23      ILE 918  24.108  14.496   0.681
  592   HD11  ILE 918          HD11      ILE 918  21.882  16.445   1.184
  593   HD12  ILE 918          HD12      ILE 918  22.317  14.856   1.814
  594   HD13  ILE 918          HD13      ILE 918  20.622  15.344   1.742
  595    H    LYS 919           H        LYS 919  23.500  15.761  -3.718
  596    HA   LYS 919           HA       LYS 919  26.354  15.606  -3.446
  597    HB2  LYS 919           HB2      LYS 919  26.553  14.711  -5.776
  598    HB3  LYS 919           HB1      LYS 919  25.600  13.719  -4.705
  599    HG2  LYS 919           HG2      LYS 919  24.429  15.567  -6.794
  600    HG3  LYS 919           HG1      LYS 919  24.782  13.859  -7.059
  601    HD2  LYS 919           HD2      LYS 919  23.251  13.354  -5.129
  602    HD3  LYS 919           HD1      LYS 919  22.825  15.057  -5.112
  603    HE2  LYS 919           HE2      LYS 919  21.128  13.909  -6.321
  604    HE3  LYS 919           HE1      LYS 919  22.087  14.830  -7.481
  605    HZ1  LYS 919           HZ1      LYS 919  21.599  12.610  -8.298
  606    HZ2  LYS 919           HZ2      LYS 919  22.294  11.916  -6.948
  607    HZ3  LYS 919           HZ3      LYS 919  23.255  12.758  -8.037
  608    H    LYS 920           H        LYS 920  26.681  17.570  -2.928
  609    HA   LYS 920           HA       LYS 920  27.746  19.138  -5.037
  610    HB2  LYS 920           HB2      LYS 920  26.722  21.243  -4.266
  611    HB3  LYS 920           HB1      LYS 920  25.500  20.143  -4.875
  612    HG2  LYS 920           HG2      LYS 920  24.922  19.527  -2.592
  613    HG3  LYS 920           HG1      LYS 920  26.142  20.641  -1.984
  614    HD2  LYS 920           HD2      LYS 920  23.986  21.517  -3.813
  615    HD3  LYS 920           HD1      LYS 920  23.665  21.415  -2.073
  616    HE2  LYS 920           HE2      LYS 920  24.235  23.680  -2.402
  617    HE3  LYS 920           HE1      LYS 920  25.748  22.965  -1.879
  618    HZ1  LYS 920           HZ1      LYS 920  26.513  22.964  -4.180
  619    HZ2  LYS 920           HZ2      LYS 920  25.982  24.504  -3.747
  620    HZ3  LYS 920           HZ3      LYS 920  25.005  23.527  -4.696
  621    H    ASP 921           H        ASP 921  28.848  21.095  -3.627
  622    HA   ASP 921           HA       ASP 921  30.182  19.629  -1.491
  623    HB2  ASP 921           HB2      ASP 921  31.431  20.931  -3.335
  624    HB3  ASP 921           HB1      ASP 921  30.905  22.392  -2.506
  625    H    LYS 922           H        LYS 922  30.941  21.837   0.133
  626    HA   LYS 922           HA       LYS 922  28.601  22.074   1.744
  627    HB2  LYS 922           HB2      LYS 922  31.351  23.313   1.968
  628    HB3  LYS 922           HB1      LYS 922  30.105  23.490   3.184
  629    HG2  LYS 922           HG2      LYS 922  31.330  20.873   2.318
  630    HG3  LYS 922           HG1      LYS 922  31.785  21.778   3.761
  631    HD2  LYS 922           HD2      LYS 922  29.467  21.541   4.592
  632    HD3  LYS 922           HD1      LYS 922  29.079  20.558   3.177
  633    HE2  LYS 922           HE2      LYS 922  30.758  18.919   3.856
  634    HE3  LYS 922           HE1      LYS 922  31.173  19.913   5.250
  635    HZ1  LYS 922           HZ1      LYS 922  28.524  18.642   4.771
  636    HZ2  LYS 922           HZ2      LYS 922  28.929  19.556   6.124
  637    HZ3  LYS 922           HZ3      LYS 922  29.680  18.094   5.841
  638    H    LYS 923           H        LYS 923  27.413  23.912   2.137
  639    HA   LYS 923           HA       LYS 923  27.706  25.919   0.044
  640    HB2  LYS 923           HB2      LYS 923  25.212  26.150   0.142
  641    HB3  LYS 923           HB1      LYS 923  25.808  24.635  -0.517
  642    HG2  LYS 923           HG2      LYS 923  25.379  23.553   1.638
  643    HG3  LYS 923           HG1      LYS 923  24.759  25.086   2.257
  644    HD2  LYS 923           HD2      LYS 923  22.971  25.053   0.625
  645    HD3  LYS 923           HD1      LYS 923  23.623  23.574  -0.085
  646    HE2  LYS 923           HE2      LYS 923  21.749  23.069   1.394
  647    HE3  LYS 923           HE1      LYS 923  23.253  22.394   2.015
  648    HZ1  LYS 923           HZ1      LYS 923  22.003  24.907   2.980
  649    HZ2  LYS 923           HZ2      LYS 923  23.408  24.201   3.585
  650    HZ3  LYS 923           HZ3      LYS 923  21.947  23.420   3.761
  651    H    HIS 924           H        HIS 924  27.832  27.911   0.569
  652    HA   HIS 924           HA       HIS 924  26.497  29.203   2.649
  653    HD1  HIS 924           HD1      HIS 924  30.036  31.250   3.844
  654    HD2  HIS 924           HD2      HIS 924  26.750  29.582   5.740
  655    HE1  HIS 924           HE1      HIS 924  29.534  32.773   5.777
  656    HE2  HIS 924           HE2      HIS 924  27.811  31.491   7.090
  657    HB2  HIS 924           HB2      HIS 924  28.350  27.999   3.963
  658    HB3  HIS 924           HB1      HIS 924  29.505  28.931   3.022
  Start of MODEL   13
    1    HA   ALA   1           HA       ALA   1  12.185   6.382   2.491
    2    H1   ALA   1           HT1      ALA   1  13.903   6.726   4.062
    3    H2   ALA   1           HT2      ALA   1  13.590   5.275   4.827
    4    H3   ALA   1           HT3      ALA   1  12.496   6.527   4.951
    5    HB1  ALA   1           HB1      ALA   1  12.730   4.240   1.472
    6    HB2  ALA   1           HB2      ALA   1  13.501   3.708   2.968
    7    HB3  ALA   1           HB3      ALA   1  14.208   5.019   2.045
    8    H    ARG   2           H        ARG   2  10.246   6.619   3.706
    9    HA   ARG   2           HA       ARG   2   9.007   4.324   4.925
   10    HE   ARG   2           HE       ARG   2   5.052   5.167   7.265
   11    HB2  ARG   2           HB2      ARG   2   8.549   7.078   4.997
   12    HB3  ARG   2           HB1      ARG   2   7.292   6.500   3.949
   13    HG2  ARG   2           HG2      ARG   2   7.752   5.734   6.816
   14    HG3  ARG   2           HG1      ARG   2   6.410   6.640   6.130
   15    HD2  ARG   2           HD2      ARG   2   5.869   4.520   4.800
   16    HD3  ARG   2           HD1      ARG   2   7.044   3.727   5.827
   17   HH11  ARG   2          HH11      ARG   2   6.012   2.028   5.911
   18   HH12  ARG   2          HH12      ARG   2   4.784   1.156   6.693
   19   HH21  ARG   2          HH21      ARG   2   3.324   3.961   8.295
   20   HH22  ARG   2          HH22      ARG   2   3.169   2.281   8.029
   21    H    THR   3           H        THR   3   7.725   2.838   3.799
   22    HA   THR   3           HA       THR   3   7.112   3.558   1.035
   23    HB   THR   3           HB       THR   3   7.325   1.096   0.514
   24    HG1  THR   3           HG1      THR   3   7.928   1.074   3.147
   25   HG21  THR   3          HG21      THR   3   9.843   2.546   1.345
   26   HG22  THR   3          HG22      THR   3   8.994   2.753  -0.184
   27   HG23  THR   3          HG23      THR   3   9.745   1.202   0.202
   28    HA   M3L   4           HA       M3L   4   3.420   1.598   2.143
   29    H    M3L   4           H        M3L   4   5.118   3.106   0.338
   30    HB2  M3L   4           HB2      M3L   4   3.239   4.192   2.354
   31    HB3  M3L   4           HB1      M3L   4   1.770   3.237   2.256
   32    HG2  M3L   4           HG2      M3L   4   2.058   3.746  -0.333
   33    HG3  M3L   4           HG1      M3L   4   2.935   5.142   0.300
   34    HD2  M3L   4           HD2      M3L   4   0.519   5.572  -0.091
   35    HD3  M3L   4           HD1      M3L   4   0.145   4.353   1.125
   36    HE2  M3L   4           HE2      M3L   4   0.717   5.664   2.839
   37    HE3  M3L   4           HE1      M3L   4   2.111   6.293   2.015
   38   HM11  M3L   4          HM11      M3L   4  -0.058   9.278   2.667
   39   HM12  M3L   4          HM12      M3L   4   0.686   8.047   3.638
   40   HM13  M3L   4          HM13      M3L   4   1.615   8.885   2.440
   41   HM21  M3L   4          HM21      M3L   4  -0.119   7.580  -0.535
   42   HM22  M3L   4          HM22      M3L   4   1.563   7.601  -0.131
   43   HM23  M3L   4          HM23      M3L   4   0.578   9.003   0.163
   44   HM31  M3L   4          HM31      M3L   4  -1.508   6.729   2.688
   45   HM32  M3L   4          HM32      M3L   4  -1.528   6.336   1.004
   46   HM33  M3L   4          HM33      M3L   4  -1.847   7.965   1.507
   47    H    GLN   5           H        GLN   5   1.614   0.754   1.146
   48    HA   GLN   5           HA       GLN   5   1.013   1.021  -1.571
   49    HB2  GLN   5           HB2      GLN   5   3.026  -0.440  -1.805
   50    HB3  GLN   5           HB1      GLN   5   2.220  -1.623  -0.774
   51    HG2  GLN   5           HG2      GLN   5   0.347  -1.672  -2.385
   52    HG3  GLN   5           HG1      GLN   5   1.269  -0.623  -3.429
   53   HE21  GLN   5          HE21      GLN   5   1.180  -2.197  -5.044
   54   HE22  GLN   5          HE22      GLN   5   2.273  -3.527  -4.990
   55    H    THR   6           H        THR   6  -0.895   1.427  -0.706
   56    HA   THR   6           HA       THR   6  -2.271  -0.333   1.044
   57    HB   THR   6           HB       THR   6  -3.376   1.803  -0.790
   58    HG1  THR   6           HG1      THR   6  -3.083   3.162   1.095
   59   HG21  THR   6          HG21      THR   6  -4.334   0.775   1.885
   60   HG22  THR   6          HG22      THR   6  -5.011   0.326   0.324
   61   HG23  THR   6          HG23      THR   6  -5.123   1.995   0.882
   62    H    ALA   7           H        ALA   7  -2.097   0.344  -2.370
   63    HA   ALA   7           HA       ALA   7  -2.975  -0.420  -4.217
   64    HB1  ALA   7           HB1      ALA   7  -3.125  -2.869  -4.524
   65    HB2  ALA   7           HB2      ALA   7  -2.932  -3.087  -2.779
   66    HB3  ALA   7           HB3      ALA   7  -1.628  -2.391  -3.731
   67    H    ARG   8           H        ARG   8  -4.762   0.837  -4.029
   68    HA   ARG   8           HA       ARG   8  -7.119   0.030  -2.690
   69    HE   ARG   8           HE       ARG   8  -8.019   3.564  -5.842
   70    HB2  ARG   8           HB2      ARG   8  -6.572   2.396  -3.184
   71    HB3  ARG   8           HB1      ARG   8  -6.746   2.075  -4.900
   72    HG2  ARG   8           HG2      ARG   8  -9.108   1.670  -4.629
   73    HG3  ARG   8           HG1      ARG   8  -8.960   1.806  -2.876
   74    HD2  ARG   8           HD2      ARG   8  -9.867   3.859  -3.857
   75    HD3  ARG   8           HD1      ARG   8  -8.309   4.144  -3.090
   76   HH11  ARG   8          HH11      ARG   8  -9.049   6.220  -3.697
   77   HH12  ARG   8          HH12      ARG   8  -8.532   7.439  -4.763
   78   HH21  ARG   8          HH21      ARG   8  -7.332   5.315  -7.298
   79   HH22  ARG   8          HH22      ARG   8  -7.548   6.916  -6.800
   80    H    LYS   9           H        LYS   9  -5.861  -0.390  -5.920
   81    HA   LYS   9           HA       LYS   9  -8.180  -2.043  -6.436
   82    HB2  LYS   9           HB2      LYS   9  -7.588  -2.012  -8.831
   83    HB3  LYS   9           HB1      LYS   9  -7.779  -0.386  -8.229
   84    HG2  LYS   9           HG2      LYS   9  -5.948  -0.220  -9.653
   85    HG3  LYS   9           HG1      LYS   9  -5.174  -0.399  -8.083
   86    HD2  LYS   9           HD2      LYS   9  -4.918  -2.819  -8.527
   87    HD3  LYS   9           HD1      LYS   9  -5.631  -2.572 -10.118
   88    HE2  LYS   9           HE2      LYS   9  -3.795  -1.119 -10.749
   89    HE3  LYS   9           HE1      LYS   9  -3.097  -1.269  -9.135
   90    HZ1  LYS   9           HZ1      LYS   9  -2.820  -3.638  -9.522
   91    HZ2  LYS   9           HZ2      LYS   9  -2.015  -2.784 -10.728
   92    HZ3  LYS   9           HZ3      LYS   9  -3.497  -3.506 -11.040
   93    H    SER  10           H        SER  10  -8.008  -4.068  -6.073
   94    HA   SER  10           HA       SER  10  -5.415  -5.396  -6.434
   95    HG   SER  10           HG       SER  10  -5.559  -3.958  -4.476
   96    HB2  SER  10           HB2      SER  10  -7.308  -5.784  -4.119
   97    HB3  SER  10           HB1      SER  10  -5.813  -6.683  -4.373
   98    H    THR  11           H        THR  11  -8.655  -5.258  -7.144
   99    HA   THR  11           HA       THR  11  -8.741  -8.057  -7.963
  100    HB   THR  11           HB       THR  11 -11.031  -6.164  -7.365
  101    HG1  THR  11           HG1      THR  11 -10.762  -6.683  -5.411
  102   HG21  THR  11          HG21      THR  11 -11.006  -9.156  -7.846
  103   HG22  THR  11          HG22      THR  11 -11.616  -7.938  -8.966
  104   HG23  THR  11          HG23      THR  11 -12.423  -8.197  -7.419
  105    H    GLY  12           H        GLY  12  -9.279  -8.386 -10.152
  106    HA2  GLY  12           HA2      GLY  12  -9.139  -6.093 -11.909
  107    HA3  GLY  12           HA1      GLY  12  -9.290  -7.786 -12.390
  108    H    GLY  13           H        GLY  13 -11.147  -5.257 -10.717
  109    HA2  GLY  13           HA2      GLY  13 -13.340  -5.190 -12.277
  110    HA3  GLY  13           HA1      GLY  13 -13.631  -6.505 -11.126
  111    H1   GLY 850           HT1      GLY 850   9.832  30.794   2.310
  112    H2   GLY 850           HT2      GLY 850   8.554  31.836   1.905
  113    H3   GLY 850           HT3      GLY 850   8.896  30.488   0.955
  114    HA2  GLY 850           HA1      GLY 850   8.243  28.991   2.649
  115    HA3  GLY 850           HA2      GLY 850   7.986  30.336   3.751
  116    H    SER 851           H        SER 851   6.261  28.184   2.347
  117    HA   SER 851           HA       SER 851   4.171  27.909   1.770
  118    HG   SER 851           HG       SER 851   3.920  28.297   4.000
  119    HB2  SER 851           HB2      SER 851   3.743  30.761   2.687
  120    HB3  SER 851           HB1      SER 851   2.475  29.568   2.419
  121    H    HIS 852           H        HIS 852   4.428  31.316   0.797
  122    HA   HIS 852           HA       HIS 852   3.855  32.440  -1.063
  123    HD2  HIS 852           HD2      HIS 852   7.011  29.654  -1.233
  124    HE1  HIS 852           HE1      HIS 852   8.598  33.233  -2.837
  125    HE2  HIS 852           HE2      HIS 852   9.151  30.971  -1.861
  126    HB2  HIS 852           HB2      HIS 852   4.604  29.886  -2.537
  127    HB3  HIS 852           HB1      HIS 852   4.276  31.426  -3.315
  128    H    MET 853           H        MET 853   2.809  29.259  -2.098
  129    HA   MET 853           HA       MET 853   0.055  30.246  -2.149
  130    HB2  MET 853           HB2      MET 853   0.887  29.725  -4.402
  131    HB3  MET 853           HB1      MET 853   1.400  28.135  -3.862
  132    HG2  MET 853           HG2      MET 853  -0.936  27.530  -3.446
  133    HG3  MET 853           HG1      MET 853  -1.445  29.122  -3.995
  134    HE1  MET 853           HE1      MET 853  -2.612  26.404  -5.129
  135    HE2  MET 853           HE2      MET 853  -2.639  26.741  -6.859
  136    HE3  MET 853           HE3      MET 853  -3.117  27.989  -5.711
  137    H    ALA 854           H        ALA 854  -1.344  29.070  -0.941
  138    HA   ALA 854           HA       ALA 854  -0.271  26.998   0.703
  139    HB1  ALA 854           HB1      ALA 854  -1.941  28.532   1.615
  140    HB2  ALA 854           HB2      ALA 854  -2.514  26.859   1.639
  141    HB3  ALA 854           HB3      ALA 854  -3.112  27.975   0.416
  142    H    MET 855           H        MET 855   0.334  25.464  -0.666
  143    HA   MET 855           HA       MET 855  -1.755  23.709  -1.593
  144    HB2  MET 855           HB2      MET 855  -1.322  25.132  -3.564
  145    HB3  MET 855           HB1      MET 855   0.386  24.732  -3.461
  146    HG2  MET 855           HG2      MET 855  -0.157  22.365  -3.871
  147    HG3  MET 855           HG1      MET 855  -1.855  22.792  -4.021
  148    HE1  MET 855           HE1      MET 855   1.453  24.127  -6.969
  149    HE2  MET 855           HE2      MET 855   1.739  23.111  -5.556
  150    HE3  MET 855           HE3      MET 855   1.300  24.804  -5.351
  151    H    ALA 856           H        ALA 856  -1.112  22.208  -0.210
  152    HA   ALA 856           HA       ALA 856   1.636  21.292  -0.200
  153    HB1  ALA 856           HB1      ALA 856   0.380  21.320   1.915
  154    HB2  ALA 856           HB2      ALA 856   0.816  19.672   1.462
  155    HB3  ALA 856           HB3      ALA 856  -0.827  20.245   1.208
  156    H    TYR 857           H        TYR 857   1.704  18.730  -0.336
  157    HA   TYR 857           HA       TYR 857   0.558  18.095  -2.920
  158    HD1  TYR 857           HD1      TYR 857   2.208  17.153  -4.871
  159    HD2  TYR 857           HD2      TYR 857   4.346  18.383  -1.403
  160    HE1  TYR 857           HE1      TYR 857   3.783  18.385  -6.289
  161    HE2  TYR 857           HE2      TYR 857   5.925  19.619  -2.805
  162    HH   TYR 857           HH       TYR 857   6.722  19.602  -5.102
  163    HB2  TYR 857           HB2      TYR 857   2.621  16.740  -1.218
  164    HB3  TYR 857           HB1      TYR 857   1.911  15.997  -2.653
  165    H    VAL 858           H        VAL 858  -0.640  18.063  -0.170
  166    HA   VAL 858           HA       VAL 858  -1.995  15.445  -0.225
  167    HB   VAL 858           HB       VAL 858  -2.126  17.588   1.910
  168   HG11  VAL 858          HG11      VAL 858  -4.067  16.133   1.880
  169   HG12  VAL 858          HG12      VAL 858  -3.076  15.871   3.311
  170   HG13  VAL 858          HG13      VAL 858  -3.018  14.713   1.979
  171   HG21  VAL 858          HG21      VAL 858  -0.500  15.064   1.858
  172   HG22  VAL 858          HG22      VAL 858  -0.676  16.135   3.247
  173   HG23  VAL 858          HG23      VAL 858   0.134  16.710   1.784
  174    H    ILE 859           H        ILE 859  -3.872  15.475  -1.332
  175    HA   ILE 859           HA       ILE 859  -5.566  17.870  -1.070
  176    HB   ILE 859           HB       ILE 859  -6.639  17.352  -3.202
  177   HG12  ILE 859          HG12      ILE 859  -4.659  15.070  -3.491
  178   HG13  ILE 859          HG11      ILE 859  -6.363  14.886  -3.079
  179   HG21  ILE 859          HG21      ILE 859  -4.794  17.819  -4.757
  180   HG22  ILE 859          HG22      ILE 859  -3.637  17.413  -3.488
  181   HG23  ILE 859          HG23      ILE 859  -4.697  18.806  -3.300
  182   HD11  ILE 859          HD11      ILE 859  -6.996  15.792  -5.230
  183   HD12  ILE 859          HD12      ILE 859  -5.923  14.406  -5.436
  184   HD13  ILE 859          HD13      ILE 859  -5.302  16.044  -5.646
  185    H    ARG 860           H        ARG 860  -7.940  17.335  -1.117
  186    HA   ARG 860           HA       ARG 860  -8.253  14.928   0.425
  187    HE   ARG 860           HE       ARG 860  -8.704  17.476   4.366
  188    HB2  ARG 860           HB2      ARG 860  -9.965  17.352   0.190
  189    HB3  ARG 860           HB1      ARG 860 -10.619  15.831   0.789
  190    HG2  ARG 860           HG2      ARG 860  -8.903  15.734   2.447
  191    HG3  ARG 860           HG1      ARG 860  -8.273  17.310   1.934
  192    HD2  ARG 860           HD2      ARG 860 -10.368  18.361   2.542
  193    HD3  ARG 860           HD1      ARG 860 -11.081  16.786   2.901
  194   HH11  ARG 860          HH11      ARG 860 -12.243  17.578   4.372
  195   HH12  ARG 860          HH12      ARG 860 -12.396  17.489   6.063
  196   HH21  ARG 860          HH21      ARG 860  -8.886  17.320   6.684
  197   HH22  ARG 860          HH22      ARG 860 -10.419  17.288   7.420
  198    H    ASP 861           H        ASP 861  -9.472  13.390   0.126
  199    HA   ASP 861           HA       ASP 861 -10.452  12.717  -2.505
  200    HB2  ASP 861           HB2      ASP 861  -9.391  10.936  -1.505
  201    HB3  ASP 861           HB1      ASP 861  -9.988  11.357   0.107
  202    H    GLU 862           H        GLU 862 -12.614  11.612  -2.479
  203    HA   GLU 862           HA       GLU 862 -14.592  13.577  -2.034
  204    HB2  GLU 862           HB2      GLU 862 -16.190  11.918  -2.850
  205    HB3  GLU 862           HB1      GLU 862 -14.758  11.994  -3.867
  206    HG2  GLU 862           HG2      GLU 862 -13.892   9.979  -2.766
  207    HG3  GLU 862           HG1      GLU 862 -15.352   9.905  -1.786
  208    H    TRP 863           H        TRP 863 -13.676  10.707  -0.154
  209    HA   TRP 863           HA       TRP 863 -15.902  11.125   1.624
  210    HD1  TRP 863           HD       TRP 863 -17.311   9.309   0.788
  211    HE1  TRP 863           HE1      TRP 863 -17.751   7.461  -1.057
  212    HE3  TRP 863           HE3      TRP 863 -12.710   7.364   0.594
  213    HZ2  TRP 863           HZ2      TRP 863 -16.229   5.470  -2.367
  214    HZ3  TRP 863           HZ3      TRP 863 -12.219   5.485  -0.948
  215    HH2  TRP 863           HH       TRP 863 -13.953   4.574  -2.394
  216    HB2  TRP 863           HB2      TRP 863 -13.664   9.111   1.774
  217    HB3  TRP 863           HB1      TRP 863 -15.134   9.111   2.746
  218    H    GLY 864           H        GLY 864 -13.017  12.600   1.218
  219    HA2  GLY 864           HA2      GLY 864 -12.202  14.235   2.685
  220    HA3  GLY 864           HA1      GLY 864 -12.970  13.396   4.027
  221    H    ASN 865           H        ASN 865 -11.251  11.415   1.878
  222    HA   ASN 865           HA       ASN 865  -9.221  10.891   3.871
  223    HB2  ASN 865           HB2      ASN 865  -9.520   9.714   1.072
  224    HB3  ASN 865           HB1      ASN 865  -8.330   9.226   2.258
  225   HD21  ASN 865          HD21      ASN 865 -11.633   9.019   1.253
  226   HD22  ASN 865          HD22      ASN 865 -12.076   7.809   2.403
  227    H    GLN 866           H        GLN 866  -6.886  10.624   2.836
  228    HA   GLN 866           HA       GLN 866  -6.345  13.216   1.605
  229    HB2  GLN 866           HB2      GLN 866  -4.713  11.553   3.503
  230    HB3  GLN 866           HB1      GLN 866  -4.102  12.970   2.667
  231    HG2  GLN 866           HG2      GLN 866  -5.614  14.378   3.747
  232    HG3  GLN 866           HG1      GLN 866  -6.501  13.027   4.474
  233   HE21  GLN 866          HE21      GLN 866  -3.655  14.975   4.597
  234   HE22  GLN 866          HE22      GLN 866  -3.090  14.419   6.121
  235    H    ILE 867           H        ILE 867  -5.376  13.252  -0.239
  236    HA   ILE 867           HA       ILE 867  -4.211  10.764  -1.311
  237    HB   ILE 867           HB       ILE 867  -5.498  13.033  -2.870
  238   HG12  ILE 867          HG12      ILE 867  -7.231  11.818  -1.647
  239   HG13  ILE 867          HG11      ILE 867  -7.351  11.479  -3.368
  240   HG21  ILE 867          HG21      ILE 867  -3.771  11.896  -4.135
  241   HG22  ILE 867          HG22      ILE 867  -5.364  11.525  -4.797
  242   HG23  ILE 867          HG23      ILE 867  -4.526  10.337  -3.800
  243   HD11  ILE 867          HD11      ILE 867  -6.155   9.684  -1.274
  244   HD12  ILE 867          HD12      ILE 867  -6.235   9.328  -3.001
  245   HD13  ILE 867          HD13      ILE 867  -7.723   9.474  -2.058
  246    H    TRP 868           H        TRP 868  -2.140  10.924  -1.968
  247    HA   TRP 868           HA       TRP 868  -0.877  13.536  -1.703
  248    HD1  TRP 868           HD       TRP 868   1.897  13.594   0.193
  249    HE1  TRP 868           HE1      TRP 868   1.398  13.728   2.744
  250    HE3  TRP 868           HE3      TRP 868  -1.959  10.302   0.413
  251    HZ2  TRP 868           HZ2      TRP 868  -0.414  12.584   4.566
  252    HZ3  TRP 868           HZ3      TRP 868  -3.033   9.875   2.580
  253    HH2  TRP 868           HH       TRP 868  -2.266  10.998   4.614
  254    HB2  TRP 868           HB2      TRP 868   0.115  10.748  -1.322
  255    HB3  TRP 868           HB1      TRP 868   1.241  12.050  -1.681
  256    H    ILE 869           H        ILE 869   0.064  14.462  -3.288
  257    HA   ILE 869           HA       ILE 869   0.145  13.180  -5.893
  258    HB   ILE 869           HB       ILE 869   0.325  16.055  -4.982
  259   HG12  ILE 869          HG12      ILE 869  -1.439  16.412  -6.678
  260   HG13  ILE 869          HG11      ILE 869  -1.399  14.695  -7.052
  261   HG21  ILE 869          HG21      ILE 869   2.144  15.805  -6.582
  262   HG22  ILE 869          HG22      ILE 869   0.842  16.791  -7.252
  263   HG23  ILE 869          HG23      ILE 869   1.023  15.111  -7.755
  264   HD11  ILE 869          HD11      ILE 869  -2.158  14.224  -4.763
  265   HD12  ILE 869          HD12      ILE 869  -3.288  15.198  -5.688
  266   HD13  ILE 869          HD13      ILE 869  -2.264  15.963  -4.459
  267    H    CYS 870           H        CYS 870   1.875  12.416  -6.745
  268    HA   CYS 870           HA       CYS 870   4.377  12.362  -5.420
  269    HB2  CYS 870           HB2      CYS 870   3.596  10.517  -6.825
  270    HB3  CYS 870           HB1      CYS 870   3.463  11.589  -8.202
  271    HA   PRO 871           HA       PRO 871   5.515  16.358  -7.273
  272    HB2  PRO 871           HB2      PRO 871   8.075  15.921  -5.887
  273    HB3  PRO 871           HB1      PRO 871   6.923  17.242  -5.700
  274    HG2  PRO 871           HG2      PRO 871   7.245  15.387  -3.786
  275    HG3  PRO 871           HG1      PRO 871   5.661  16.101  -4.134
  276    HD2  PRO 871           HD2      PRO 871   6.768  13.444  -4.986
  277    HD3  PRO 871           HD1      PRO 871   5.152  13.857  -4.357
  278    H    GLY 872           H        GLY 872   6.504  13.317  -7.991
  279    HA2  GLY 872           HA2      GLY 872   8.772  13.982  -9.626
  280    HA3  GLY 872           HA1      GLY 872   7.947  12.425  -9.545
  281    H    CYS 873           H        CYS 873   5.497  12.766 -10.280
  282    HA   CYS 873           HA       CYS 873   5.720  13.698 -13.033
  283    HB2  CYS 873           HB2      CYS 873   3.659  12.231 -13.173
  284    HB3  CYS 873           HB1      CYS 873   5.195  11.425 -12.816
  285    H    ASN 874           H        ASN 874   4.173  14.297 -10.020
  286    HA   ASN 874           HA       ASN 874   2.796  15.814  -9.225
  287    HB2  ASN 874           HB2      ASN 874   2.507  16.849 -12.072
  288    HB3  ASN 874           HB1      ASN 874   1.625  17.532 -10.712
  289   HD21  ASN 874          HD21      ASN 874   4.700  17.192 -12.239
  290   HD22  ASN 874          HD22      ASN 874   5.541  18.390 -11.315
  291    H    LYS 875           H        LYS 875   2.196  13.154 -10.275
  292    HA   LYS 875           HA       LYS 875  -0.688  13.360 -10.640
  293    HB2  LYS 875           HB2      LYS 875   1.223  11.052 -10.973
  294    HB3  LYS 875           HB1      LYS 875  -0.521  10.933 -11.161
  295    HG2  LYS 875           HG2      LYS 875  -0.464  12.468 -13.011
  296    HG3  LYS 875           HG1      LYS 875   1.271  12.707 -12.796
  297    HD2  LYS 875           HD2      LYS 875   1.705  10.416 -13.355
  298    HD3  LYS 875           HD1      LYS 875  -0.019  10.050 -13.408
  299    HE2  LYS 875           HE2      LYS 875   1.449  11.955 -15.220
  300    HE3  LYS 875           HE1      LYS 875   0.921  10.331 -15.657
  301    HZ1  LYS 875           HZ1      LYS 875  -1.355  11.028 -15.305
  302    HZ2  LYS 875           HZ2      LYS 875  -0.606  11.992 -16.469
  303    HZ3  LYS 875           HZ3      LYS 875  -0.861  12.599 -14.925
  304    HA   PRO 876           HA       PRO 876  -1.349  12.149  -6.393
  305    HB2  PRO 876           HB2      PRO 876  -3.904  11.276  -6.624
  306    HB3  PRO 876           HB1      PRO 876  -3.462  12.985  -6.584
  307    HG2  PRO 876           HG2      PRO 876  -4.173  11.260  -8.898
  308    HG3  PRO 876           HG1      PRO 876  -4.554  12.967  -8.565
  309    HD2  PRO 876           HD2      PRO 876  -2.552  12.173 -10.295
  310    HD3  PRO 876           HD1      PRO 876  -2.571  13.714  -9.420
  311    H    ASP 877           H        ASP 877  -2.237  10.288  -5.123
  312    HA   ASP 877           HA       ASP 877  -1.104   7.854  -6.211
  313    HB2  ASP 877           HB2      ASP 877  -0.881   7.054  -4.021
  314    HB3  ASP 877           HB1      ASP 877  -0.482   8.753  -3.911
  315    H    ASP 878           H        ASP 878  -2.116   5.892  -6.076
  316    HA   ASP 878           HA       ASP 878  -5.045   5.868  -5.681
  317    HB2  ASP 878           HB2      ASP 878  -3.361   4.125  -7.521
  318    HB3  ASP 878           HB1      ASP 878  -5.077   3.906  -7.243
  319    H    GLY 879           H        GLY 879  -2.856   5.581  -3.763
  320    HA2  GLY 879           HA2      GLY 879  -2.264   4.205  -2.035
  321    HA3  GLY 879           HA1      GLY 879  -3.452   3.046  -2.619
  322    H    SER 880           H        SER 880  -1.110   4.198  -4.800
  323    HA   SER 880           HA       SER 880  -0.146   1.620  -5.485
  324    HG   SER 880           HG       SER 880  -1.210   2.948  -7.342
  325    HB2  SER 880           HB2      SER 880   0.987   4.322  -6.185
  326    HB3  SER 880           HB1      SER 880   1.056   2.838  -7.140
  327    HA   PRO 881           HA       PRO 881   3.613   1.348  -3.008
  328    HB2  PRO 881           HB2      PRO 881   5.294   1.066  -5.412
  329    HB3  PRO 881           HB1      PRO 881   5.079  -0.053  -4.073
  330    HG2  PRO 881           HG2      PRO 881   4.080  -0.567  -6.471
  331    HG3  PRO 881           HG1      PRO 881   3.246  -1.037  -4.992
  332    HD2  PRO 881           HD2      PRO 881   2.645   1.261  -6.821
  333    HD3  PRO 881           HD1      PRO 881   1.520   0.208  -5.937
  334    H    MET 882           H        MET 882   4.112   3.176  -2.210
  335    HA   MET 882           HA       MET 882   5.511   5.174  -3.901
  336    HB2  MET 882           HB2      MET 882   3.728   5.854  -1.562
  337    HB3  MET 882           HB1      MET 882   4.531   6.982  -2.642
  338    HG2  MET 882           HG2      MET 882   3.161   6.099  -4.490
  339    HG3  MET 882           HG1      MET 882   2.315   5.088  -3.313
  340    HE1  MET 882           HE1      MET 882   3.576   8.845  -3.420
  341    HE2  MET 882           HE2      MET 882   2.028   9.661  -3.662
  342    HE3  MET 882           HE3      MET 882   2.660   8.585  -4.909
  343    H    ILE 883           H        ILE 883   6.971   6.554  -2.775
  344    HA   ILE 883           HA       ILE 883   7.922   5.432  -0.269
  345    HB   ILE 883           HB       ILE 883   9.392   4.647  -2.133
  346   HG12  ILE 883          HG12      ILE 883  10.893   6.677  -0.488
  347   HG13  ILE 883          HG11      ILE 883  10.299   5.155   0.191
  348   HG21  ILE 883          HG21      ILE 883  10.802   6.245  -3.351
  349   HG22  ILE 883          HG22      ILE 883   9.974   7.577  -2.558
  350   HG23  ILE 883          HG23      ILE 883   9.087   6.535  -3.670
  351   HD11  ILE 883          HD11      ILE 883  11.695   3.940  -1.401
  352   HD12  ILE 883          HD12      ILE 883  12.661   5.065  -0.441
  353   HD13  ILE 883          HD13      ILE 883  12.229   5.467  -2.098
  354    H    GLY 884           H        GLY 884   8.438   6.882   1.207
  355    HA2  GLY 884           HA2      GLY 884   7.870   9.680   0.557
  356    HA3  GLY 884           HA1      GLY 884   7.817   8.954   2.160
  357    H    CYS 885           H        CYS 885   9.420  11.105   0.530
  358    HA   CYS 885           HA       CYS 885  12.137  10.392   0.951
  359    HB2  CYS 885           HB2      CYS 885  11.419  12.081  -0.686
  360    HB3  CYS 885           HB1      CYS 885  10.805  13.086   0.603
  361    H    ASP 886           H        ASP 886  13.454  10.935   2.642
  362    HA   ASP 886           HA       ASP 886  12.113  11.274   5.149
  363    HB2  ASP 886           HB2      ASP 886  14.976  10.835   4.380
  364    HB3  ASP 886           HB1      ASP 886  14.520  11.219   6.033
  365    H    ASP 887           H        ASP 887  13.435  13.380   2.863
  366    HA   ASP 887           HA       ASP 887  14.082  15.364   4.920
  367    HB2  ASP 887           HB2      ASP 887  15.603  15.049   2.943
  368    HB3  ASP 887           HB1      ASP 887  14.327  15.719   1.933
  369    H    CYS 888           H        CYS 888  12.093  15.181   1.990
  370    HA   CYS 888           HA       CYS 888  10.729  17.597   2.817
  371    HB2  CYS 888           HB2      CYS 888   9.433  17.388   0.691
  372    HB3  CYS 888           HB1      CYS 888  11.169  17.473   0.466
  373    H    ASP 889           H        ASP 889  10.149  14.229   2.877
  374    HA   ASP 889           HA       ASP 889   8.619  12.898   3.812
  375    HB2  ASP 889           HB2      ASP 889   8.548  14.668   5.687
  376    HB3  ASP 889           HB1      ASP 889   7.131  15.328   4.886
  377    H    ASP 890           H        ASP 890   8.377  14.349   1.166
  378    HA   ASP 890           HA       ASP 890   5.529  14.018   0.836
  379    HB2  ASP 890           HB2      ASP 890   7.574  15.326  -0.967
  380    HB3  ASP 890           HB1      ASP 890   5.955  14.931  -1.525
  381    H    TRP 891           H        TRP 891   4.708  12.801  -0.822
  382    HA   TRP 891           HA       TRP 891   6.177  10.292  -0.894
  383    HD1  TRP 891           HD       TRP 891   3.326  11.779   1.472
  384    HE1  TRP 891           HE1      TRP 891   3.602  10.504   3.687
  385    HE3  TRP 891           HE3      TRP 891   4.996   7.349  -0.375
  386    HZ2  TRP 891           HZ2      TRP 891   4.416   7.945   4.534
  387    HZ3  TRP 891           HZ3      TRP 891   5.500   5.534   1.167
  388    HH2  TRP 891           HH       TRP 891   5.225   5.836   3.601
  389    HB2  TRP 891           HB2      TRP 891   3.241  10.903  -1.081
  390    HB3  TRP 891           HB1      TRP 891   3.918   9.308  -1.398
  391    H    TYR 892           H        TYR 892   7.065   9.641  -2.633
  392    HA   TYR 892           HA       TYR 892   6.139  10.633  -5.235
  393    HD1  TYR 892           HD2      TYR 892   8.753  11.536  -2.702
  394    HD2  TYR 892           HD1      TYR 892   8.807  11.841  -6.938
  395    HE1  TYR 892           HE2      TYR 892   9.670  13.794  -2.521
  396    HE2  TYR 892           HE1      TYR 892   9.737  14.094  -6.775
  397    HH   TYR 892           HH       TYR 892  11.159  15.208  -4.078
  398    HB2  TYR 892           HB2      TYR 892   8.771   9.510  -4.298
  399    HB3  TYR 892           HB1      TYR 892   8.374   9.794  -5.980
  400    H    HIS 893           H        HIS 893   6.037   9.089  -6.882
  401    HA   HIS 893           HA       HIS 893   5.392   6.396  -5.980
  402    HD2  HIS 893           HD2      HIS 893   2.583   6.149  -6.484
  403    HE1  HIS 893           HE1      HIS 893   1.286   9.523  -8.686
  404    HE2  HIS 893           HE2      HIS 893   0.683   7.922  -6.893
  405    HB2  HIS 893           HB2      HIS 893   5.487   7.464  -8.826
  406    HB3  HIS 893           HB1      HIS 893   4.921   5.873  -8.364
  407    H    TRP 894           H        TRP 894   6.462   4.525  -6.789
  408    HA   TRP 894           HA       TRP 894   9.216   4.674  -6.490
  409    HD1  TRP 894           HD       TRP 894   8.336   4.354  -4.467
  410    HE1  TRP 894           HE1      TRP 894   8.069   2.928  -2.334
  411    HE3  TRP 894           HE3      TRP 894   8.003  -0.248  -6.617
  412    HZ2  TRP 894           HZ2      TRP 894   7.761   0.205  -1.669
  413    HZ3  TRP 894           HZ3      TRP 894   7.715  -2.195  -5.191
  414    HH2  TRP 894           HH       TRP 894   7.611  -1.978  -2.752
  415    HB2  TRP 894           HB2      TRP 894   7.434   2.452  -7.419
  416    HB3  TRP 894           HB1      TRP 894   9.179   2.258  -7.319
  417    HA   PRO 895           HA       PRO 895   9.686   3.817 -11.270
  418    HB2  PRO 895           HB2      PRO 895   7.658   4.928 -12.787
  419    HB3  PRO 895           HB1      PRO 895   7.816   3.211 -12.404
  420    HG2  PRO 895           HG2      PRO 895   6.160   5.306 -11.055
  421    HG3  PRO 895           HG1      PRO 895   5.715   3.645 -11.486
  422    HD2  PRO 895           HD2      PRO 895   6.360   4.252  -8.990
  423    HD3  PRO 895           HD1      PRO 895   6.930   2.738  -9.721
  424    H    CYS 896           H        CYS 896   8.196   6.604  -9.867
  425    HA   CYS 896           HA       CYS 896   9.119   8.501 -11.756
  426    HB2  CYS 896           HB2      CYS 896   8.023   8.775  -8.983
  427    HB3  CYS 896           HB1      CYS 896   8.106  10.070 -10.203
  428    H    VAL 897           H        VAL 897  10.347   7.104  -8.825
  429    HA   VAL 897           HA       VAL 897  12.540   9.054  -8.882
  430    HB   VAL 897           HB       VAL 897  13.002   8.395  -6.549
  431   HG11  VAL 897          HG11      VAL 897  10.303   9.566  -7.223
  432   HG12  VAL 897          HG12      VAL 897  11.810  10.460  -7.041
  433   HG13  VAL 897          HG13      VAL 897  11.041   9.711  -5.639
  434   HG21  VAL 897          HG21      VAL 897  11.839   6.250  -6.560
  435   HG22  VAL 897          HG22      VAL 897  10.285   7.086  -6.697
  436   HG23  VAL 897          HG23      VAL 897  11.281   7.287  -5.253
  437    H    GLY 898           H        GLY 898  11.889   5.869  -9.575
  438    HA2  GLY 898           HA2      GLY 898  13.476   4.479 -10.577
  439    HA3  GLY 898           HA1      GLY 898  14.754   5.405  -9.791
  440    H    ILE 899           H        ILE 899  11.914   4.145  -8.253
  441    HA   ILE 899           HA       ILE 899  13.620   2.256  -6.807
  442    HB   ILE 899           HB       ILE 899  10.942   3.480  -6.037
  443   HG12  ILE 899          HG12      ILE 899  12.982   4.916  -5.740
  444   HG13  ILE 899          HG11      ILE 899  12.067   4.632  -4.262
  445   HG21  ILE 899          HG21      ILE 899  11.125   2.283  -3.893
  446   HG22  ILE 899          HG22      ILE 899  12.548   1.437  -4.502
  447   HG23  ILE 899          HG23      ILE 899  10.979   1.180  -5.259
  448   HD11  ILE 899          HD11      ILE 899  13.738   2.951  -3.629
  449   HD12  ILE 899          HD12      ILE 899  14.397   4.568  -3.837
  450   HD13  ILE 899          HD13      ILE 899  14.659   3.344  -5.093
  451    H    MET 900           H        MET 900  13.140   0.069  -7.099
  452    HA   MET 900           HA       MET 900  10.630  -0.515  -8.511
  453    HB2  MET 900           HB2      MET 900  11.679  -2.438  -9.607
  454    HB3  MET 900           HB1      MET 900  12.535  -0.959  -9.996
  455    HG2  MET 900           HG2      MET 900  14.292  -1.546  -8.424
  456    HG3  MET 900           HG1      MET 900  13.411  -3.008  -7.967
  457    HE1  MET 900           HE1      MET 900  16.447  -3.038  -8.908
  458    HE2  MET 900           HE2      MET 900  16.454  -4.434  -9.986
  459    HE3  MET 900           HE3      MET 900  15.555  -4.495  -8.470
  460    H    ALA 901           H        ALA 901  12.622  -1.216  -5.822
  461    HA   ALA 901           HA       ALA 901  10.570  -2.987  -4.794
  462    HB1  ALA 901           HB1      ALA 901  13.542  -3.517  -4.613
  463    HB2  ALA 901           HB2      ALA 901  12.389  -4.446  -5.575
  464    HB3  ALA 901           HB3      ALA 901  12.276  -4.454  -3.815
  465    H    ALA 902           H        ALA 902  10.518  -2.928  -2.484
  466    HA   ALA 902           HA       ALA 902  10.927  -0.277  -1.583
  467    HB1  ALA 902           HB1      ALA 902   9.964  -2.687  -0.062
  468    HB2  ALA 902           HB2      ALA 902   8.961  -1.579  -1.004
  469    HB3  ALA 902           HB3      ALA 902   9.808  -0.996   0.426
  470    HA   PRO 903           HA       PRO 903  14.779  -1.204   0.658
  471    HB2  PRO 903           HB2      PRO 903  15.357   1.326   1.340
  472    HB3  PRO 903           HB1      PRO 903  15.561   0.797  -0.331
  473    HG2  PRO 903           HG2      PRO 903  13.387   2.408   0.899
  474    HG3  PRO 903           HG1      PRO 903  14.143   2.587  -0.694
  475    HD2  PRO 903           HD2      PRO 903  11.716   1.360  -0.193
  476    HD3  PRO 903           HD1      PRO 903  12.707   1.114  -1.642
  477    HA   PRO 904           HA       PRO 904  13.312  -1.266   4.820
  478    HB2  PRO 904           HB2      PRO 904  15.687   0.085   5.886
  479    HB3  PRO 904           HB1      PRO 904  15.095  -1.543   6.205
  480    HG2  PRO 904           HG2      PRO 904  17.272  -1.036   4.738
  481    HG3  PRO 904           HG1      PRO 904  16.215  -2.443   4.454
  482    HD2  PRO 904           HD2      PRO 904  16.467   0.115   2.939
  483    HD3  PRO 904           HD1      PRO 904  16.114  -1.518   2.337
  484    H    GLU 905           H        GLU 905  12.103  -0.047   6.035
  485    HA   GLU 905           HA       GLU 905  11.886   2.772   5.485
  486    HB2  GLU 905           HB2      GLU 905  10.310   1.046   7.397
  487    HB3  GLU 905           HB1      GLU 905   9.857   2.644   6.803
  488    HG2  GLU 905           HG2      GLU 905   9.817   1.746   4.517
  489    HG3  GLU 905           HG1      GLU 905  10.159   0.150   5.171
  490    H    GLU 906           H        GLU 906  13.740   0.970   7.391
  491    HA   GLU 906           HA       GLU 906  13.930   2.996   9.484
  492    HB2  GLU 906           HB2      GLU 906  15.205   1.220  10.725
  493    HB3  GLU 906           HB1      GLU 906  13.514   0.844  10.434
  494    HG2  GLU 906           HG2      GLU 906  14.296  -0.493   8.439
  495    HG3  GLU 906           HG1      GLU 906  15.927  -0.280   9.062
  496    H    MET 907           H        MET 907  14.924   2.804   6.643
  497    HA   MET 907           HA       MET 907  17.656   3.668   7.194
  498    HB2  MET 907           HB2      MET 907  17.602   1.468   6.028
  499    HB3  MET 907           HB1      MET 907  16.674   2.199   4.735
  500    HG2  MET 907           HG2      MET 907  19.000   2.015   4.092
  501    HG3  MET 907           HG1      MET 907  18.525   3.710   4.265
  502    HE1  MET 907           HE1      MET 907  19.408   1.103   7.136
  503    HE2  MET 907           HE2      MET 907  21.132   1.417   7.328
  504    HE3  MET 907           HE3      MET 907  20.525   0.714   5.829
  505    H    GLN 908           H        GLN 908  18.185   5.476   5.952
  506    HA   GLN 908           HA       GLN 908  15.787   6.883   5.140
  507    HB2  GLN 908           HB2      GLN 908  18.519   8.051   5.652
  508    HB3  GLN 908           HB1      GLN 908  17.092   8.954   5.186
  509    HG2  GLN 908           HG2      GLN 908  15.923   8.093   7.189
  510    HG3  GLN 908           HG1      GLN 908  17.441   7.384   7.722
  511   HE21  GLN 908          HE21      GLN 908  15.680  10.225   7.181
  512   HE22  GLN 908          HE22      GLN 908  16.646  11.324   8.086
  513    H    TRP 909           H        TRP 909  15.606   8.183   3.387
  514    HA   TRP 909           HA       TRP 909  17.289   7.732   1.061
  515    HD1  TRP 909           HD       TRP 909  16.696   5.635  -1.558
  516    HE1  TRP 909           HE1      TRP 909  15.683   6.370  -3.820
  517    HE3  TRP 909           HE3      TRP 909  12.990   8.691   0.157
  518    HZ2  TRP 909           HZ2      TRP 909  13.600   8.028  -4.733
  519    HZ3  TRP 909           HZ3      TRP 909  11.533   9.818  -1.466
  520    HH2  TRP 909           HH       TRP 909  11.835   9.499  -3.849
  521    HB2  TRP 909           HB2      TRP 909  15.790   5.805   0.941
  522    HB3  TRP 909           HB1      TRP 909  14.398   6.843   1.243
  523    H    PHE 910           H        PHE 910  16.929   9.372  -0.489
  524    HA   PHE 910           HA       PHE 910  15.033  11.441   0.285
  525    HD1  PHE 910           HD2      PHE 910  15.728  13.204   2.251
  526    HD2  PHE 910           HD1      PHE 910  19.158  10.879   1.331
  527    HE1  PHE 910           HE2      PHE 910  16.241  13.010   4.651
  528    HE2  PHE 910           HE1      PHE 910  19.668  10.667   3.719
  529    HZ   PHE 910           HZ       PHE 910  18.207  11.734   5.388
  530    HB2  PHE 910           HB2      PHE 910  17.950  11.927  -0.403
  531    HB3  PHE 910           HB1      PHE 910  16.754  13.177  -0.052
  532    H    CYS 911           H        CYS 911  14.158  12.517  -1.397
  533    HA   CYS 911           HA       CYS 911  14.104  11.144  -3.899
  534    HB2  CYS 911           HB2      CYS 911  12.414  12.774  -4.543
  535    HB3  CYS 911           HB1      CYS 911  12.146  12.272  -2.889
  536    HA   PRO 912           HA       PRO 912  17.049  13.244  -6.522
  537    HB2  PRO 912           HB2      PRO 912  15.396  14.140  -8.592
  538    HB3  PRO 912           HB1      PRO 912  16.162  12.552  -8.501
  539    HG2  PRO 912           HG2      PRO 912  13.381  13.359  -7.739
  540    HG3  PRO 912           HG1      PRO 912  13.939  11.875  -8.532
  541    HD2  PRO 912           HD2      PRO 912  13.287  11.835  -5.986
  542    HD3  PRO 912           HD1      PRO 912  14.711  10.956  -6.557
  543    H    LYS 913           H        LYS 913  14.302  15.006  -5.344
  544    HA   LYS 913           HA       LYS 913  15.487  17.518  -6.187
  545    HB2  LYS 913           HB2      LYS 913  12.937  16.989  -4.649
  546    HB3  LYS 913           HB1      LYS 913  13.543  18.595  -5.019
  547    HG2  LYS 913           HG2      LYS 913  13.413  18.013  -7.446
  548    HG3  LYS 913           HG1      LYS 913  12.642  16.496  -6.981
  549    HD2  LYS 913           HD2      LYS 913  10.815  17.712  -5.935
  550    HD3  LYS 913           HD1      LYS 913  11.613  19.245  -6.283
  551    HE2  LYS 913           HE2      LYS 913  11.429  18.737  -8.704
  552    HE3  LYS 913           HE1      LYS 913  10.541  17.271  -8.298
  553    HZ1  LYS 913           HZ1      LYS 913   9.685  20.052  -7.715
  554    HZ2  LYS 913           HZ2      LYS 913   8.852  18.689  -7.226
  555    HZ3  LYS 913           HZ3      LYS 913   9.008  19.013  -8.861
  556    H    CYS 914           H        CYS 914  14.809  15.780  -3.205
  557    HA   CYS 914           HA       CYS 914  16.099  17.792  -1.648
  558    HB2  CYS 914           HB2      CYS 914  15.036  15.084  -0.972
  559    HB3  CYS 914           HB1      CYS 914  15.825  16.117   0.212
  560    H    ALA 915           H        ALA 915  17.088  14.708  -2.972
  561    HA   ALA 915           HA       ALA 915  19.492  14.652  -1.468
  562    HB1  ALA 915           HB1      ALA 915  18.462  12.640  -2.358
  563    HB2  ALA 915           HB2      ALA 915  20.138  12.790  -2.907
  564    HB3  ALA 915           HB3      ALA 915  18.801  13.175  -4.004
  565    H    ASN 916           H        ASN 916  18.475  16.334  -4.156
  566    HA   ASN 916           HA       ASN 916  20.925  16.741  -5.505
  567    HB2  ASN 916           HB2      ASN 916  18.851  17.142  -6.657
  568    HB3  ASN 916           HB1      ASN 916  18.377  18.351  -5.473
  569   HD21  ASN 916          HD21      ASN 916  19.113  20.423  -5.690
  570   HD22  ASN 916          HD22      ASN 916  20.052  20.963  -7.017
  571    H    LYS 917           H        LYS 917  19.382  18.335  -2.806
  572    HA   LYS 917           HA       LYS 917  21.259  20.560  -2.840
  573    HB2  LYS 917           HB2      LYS 917  19.953  21.393  -0.894
  574    HB3  LYS 917           HB1      LYS 917  18.908  20.965  -2.247
  575    HG2  LYS 917           HG2      LYS 917  18.517  18.812  -1.129
  576    HG3  LYS 917           HG1      LYS 917  19.460  19.421   0.230
  577    HD2  LYS 917           HD2      LYS 917  17.886  21.225   0.543
  578    HD3  LYS 917           HD1      LYS 917  16.959  20.697  -0.866
  579    HE2  LYS 917           HE2      LYS 917  15.819  19.817   1.019
  580    HE3  LYS 917           HE1      LYS 917  16.738  18.503   0.262
  581    HZ1  LYS 917           HZ1      LYS 917  16.943  18.465   2.685
  582    HZ2  LYS 917           HZ2      LYS 917  17.609  20.001   2.655
  583    HZ3  LYS 917           HZ3      LYS 917  18.442  18.731   1.959
  584    H    ILE 918           H        ILE 918  21.335  17.437  -1.727
  585    HA   ILE 918           HA       ILE 918  22.911  17.852   0.663
  586    HB   ILE 918           HB       ILE 918  22.448  15.342  -0.994
  587   HG12  ILE 918          HG12      ILE 918  20.338  16.282  -0.241
  588   HG13  ILE 918          HG11      ILE 918  20.676  14.788   0.616
  589   HG21  ILE 918          HG21      ILE 918  23.040  14.103   1.039
  590   HG22  ILE 918          HG22      ILE 918  23.365  15.623   1.871
  591   HG23  ILE 918          HG23      ILE 918  24.371  15.135   0.507
  592   HD11  ILE 918          HD11      ILE 918  21.020  17.592   1.669
  593   HD12  ILE 918          HD12      ILE 918  21.389  16.115   2.561
  594   HD13  ILE 918          HD13      ILE 918  19.727  16.467   2.081
  595    H    LYS 919           H        LYS 919  23.324  17.770  -2.688
  596    HA   LYS 919           HA       LYS 919  26.216  17.465  -2.527
  597    HB2  LYS 919           HB2      LYS 919  24.969  15.685  -3.811
  598    HB3  LYS 919           HB1      LYS 919  24.246  16.946  -4.785
  599    HG2  LYS 919           HG2      LYS 919  26.453  17.528  -5.666
  600    HG3  LYS 919           HG1      LYS 919  27.173  16.248  -4.685
  601    HD2  LYS 919           HD2      LYS 919  25.838  14.585  -5.852
  602    HD3  LYS 919           HD1      LYS 919  25.066  15.854  -6.803
  603    HE2  LYS 919           HE2      LYS 919  28.003  15.197  -6.804
  604    HE3  LYS 919           HE1      LYS 919  26.843  14.729  -8.050
  605    HZ1  LYS 919           HZ1      LYS 919  27.651  17.491  -7.323
  606    HZ2  LYS 919           HZ2      LYS 919  26.452  17.123  -8.443
  607    HZ3  LYS 919           HZ3      LYS 919  28.044  16.679  -8.738
  608    H    LYS 920           H        LYS 920  27.096  18.962  -4.372
  609    HA   LYS 920           HA       LYS 920  27.372  20.886  -5.442
  610    HB2  LYS 920           HB2      LYS 920  25.643  21.877  -6.752
  611    HB3  LYS 920           HB1      LYS 920  25.420  20.130  -6.698
  612    HG2  LYS 920           HG2      LYS 920  23.576  20.321  -5.218
  613    HG3  LYS 920           HG1      LYS 920  23.846  22.049  -5.014
  614    HD2  LYS 920           HD2      LYS 920  23.327  20.783  -7.638
  615    HD3  LYS 920           HD1      LYS 920  21.994  21.344  -6.604
  616    HE2  LYS 920           HE2      LYS 920  24.256  23.019  -7.727
  617    HE3  LYS 920           HE1      LYS 920  22.594  23.030  -8.293
  618    HZ1  LYS 920           HZ1      LYS 920  23.044  24.879  -6.839
  619    HZ2  LYS 920           HZ2      LYS 920  23.494  23.873  -5.575
  620    HZ3  LYS 920           HZ3      LYS 920  21.895  23.868  -6.124
  621    H    ASP 921           H        ASP 921  25.199  21.161  -2.791
  622    HA   ASP 921           HA       ASP 921  24.951  22.644  -1.122
  623    HB2  ASP 921           HB2      ASP 921  27.514  22.836  -1.241
  624    HB3  ASP 921           HB1      ASP 921  27.289  24.228  -2.287
  625    H    LYS 922           H        LYS 922  25.064  25.507  -1.242
  626    HA   LYS 922           HA       LYS 922  23.139  25.939  -3.408
  627    HB2  LYS 922           HB2      LYS 922  23.108  27.261  -0.683
  628    HB3  LYS 922           HB1      LYS 922  21.960  27.536  -1.974
  629    HG2  LYS 922           HG2      LYS 922  21.182  25.225  -1.790
  630    HG3  LYS 922           HG1      LYS 922  22.359  24.938  -0.503
  631    HD2  LYS 922           HD2      LYS 922  21.285  26.745   0.805
  632    HD3  LYS 922           HD1      LYS 922  20.053  26.877  -0.447
  633    HE2  LYS 922           HE2      LYS 922  19.383  24.563  -0.054
  634    HE3  LYS 922           HE1      LYS 922  20.648  24.391   1.158
  635    HZ1  LYS 922           HZ1      LYS 922  18.296  26.209   1.336
  636    HZ2  LYS 922           HZ2      LYS 922  19.554  26.162   2.433
  637    HZ3  LYS 922           HZ3      LYS 922  18.563  24.813   2.257
  638    H    LYS 923           H        LYS 923  24.851  26.577  -4.710
  639    HA   LYS 923           HA       LYS 923  25.685  29.318  -4.226
  640    HB2  LYS 923           HB2      LYS 923  27.628  27.974  -3.676
  641    HB3  LYS 923           HB1      LYS 923  27.445  27.033  -5.146
  642    HG2  LYS 923           HG2      LYS 923  29.284  28.612  -5.358
  643    HG3  LYS 923           HG1      LYS 923  27.986  29.007  -6.482
  644    HD2  LYS 923           HD2      LYS 923  27.207  30.760  -4.936
  645    HD3  LYS 923           HD1      LYS 923  28.531  30.369  -3.839
  646    HE2  LYS 923           HE2      LYS 923  29.078  32.324  -5.204
  647    HE3  LYS 923           HE1      LYS 923  30.148  30.977  -5.574
  648    HZ1  LYS 923           HZ1      LYS 923  27.752  31.697  -7.197
  649    HZ2  LYS 923           HZ2      LYS 923  28.889  30.530  -7.559
  650    HZ3  LYS 923           HZ3      LYS 923  29.321  32.157  -7.572
  651    H    HIS 924           H        HIS 924  24.625  30.355  -5.625
  652    HA   HIS 924           HA       HIS 924  24.179  29.299  -8.255
  653    HD1  HIS 924           HD1      HIS 924  21.780  32.023  -5.400
  654    HD2  HIS 924           HD2      HIS 924  24.828  33.662  -7.708
  655    HE1  HIS 924           HE1      HIS 924  22.304  34.244  -4.357
  656    HE2  HIS 924           HE2      HIS 924  24.196  35.174  -5.697
  657    HB2  HIS 924           HB2      HIS 924  22.946  31.442  -8.698
  658    HB3  HIS 924           HB1      HIS 924  22.373  30.540  -7.300
  Start of MODEL   14
    1    HA   ALA   1           HA       ALA   1  12.521   6.203   2.905
    2    H1   ALA   1           HT1      ALA   1  12.969   5.792   5.324
    3    H2   ALA   1           HT2      ALA   1  14.218   6.235   4.388
    4    H3   ALA   1           HT3      ALA   1  14.081   4.602   4.860
    5    HB1  ALA   1           HB1      ALA   1  12.840   4.250   1.443
    6    HB2  ALA   1           HB2      ALA   1  13.692   3.410   2.729
    7    HB3  ALA   1           HB3      ALA   1  14.395   4.859   2.011
    8    H    ARG   2           H        ARG   2  10.497   6.259   3.506
    9    HA   ARG   2           HA       ARG   2   9.379   3.991   4.934
   10    HE   ARG   2           HE       ARG   2   5.436   5.134   7.508
   11    HB2  ARG   2           HB2      ARG   2   9.035   6.597   5.401
   12    HB3  ARG   2           HB1      ARG   2   7.844   6.412   4.141
   13    HG2  ARG   2           HG2      ARG   2   6.683   4.735   5.401
   14    HG3  ARG   2           HG1      ARG   2   7.964   4.810   6.627
   15    HD2  ARG   2           HD2      ARG   2   7.430   7.138   7.081
   16    HD3  ARG   2           HD1      ARG   2   6.181   7.104   5.848
   17   HH11  ARG   2          HH11      ARG   2   6.265   8.543   8.046
   18   HH12  ARG   2          HH12      ARG   2   5.290   8.722   9.421
   19   HH21  ARG   2          HH21      ARG   2   4.006   5.424   9.429
   20   HH22  ARG   2          HH22      ARG   2   4.005   6.950  10.196
   21    H    THR   3           H        THR   3   8.517   2.405   3.683
   22    HA   THR   3           HA       THR   3   7.381   3.271   1.164
   23    HB   THR   3           HB       THR   3   7.806   0.791   0.495
   24    HG1  THR   3           HG1      THR   3   8.567  -0.150   2.239
   25   HG21  THR   3          HG21      THR   3   8.910   2.738  -0.506
   26   HG22  THR   3          HG22      THR   3  10.034   1.387  -0.331
   27   HG23  THR   3          HG23      THR   3  10.091   2.741   0.802
   28    HA   M3L   4           HA       M3L   4   3.826   1.373   2.725
   29    H    M3L   4           H        M3L   4   5.373   3.210   1.029
   30    HB2  M3L   4           HB2      M3L   4   3.624   3.868   3.220
   31    HB3  M3L   4           HB1      M3L   4   2.108   3.062   2.853
   32    HG2  M3L   4           HG2      M3L   4   2.820   3.898   0.379
   33    HG3  M3L   4           HG1      M3L   4   3.550   5.169   1.359
   34    HD2  M3L   4           HD2      M3L   4   1.151   5.506   0.529
   35    HD3  M3L   4           HD1      M3L   4   0.695   4.321   1.752
   36    HE2  M3L   4           HE2      M3L   4   1.156   5.684   3.469
   37    HE3  M3L   4           HE1      M3L   4   2.496   6.454   2.687
   38   HM11  M3L   4          HM11      M3L   4   0.698   8.970   0.735
   39   HM12  M3L   4          HM12      M3L   4   2.029   7.847   0.650
   40   HM13  M3L   4          HM13      M3L   4   0.486   7.418  -0.005
   41   HM21  M3L   4          HM21      M3L   4  -1.524   7.601   1.621
   42   HM22  M3L   4          HM22      M3L   4  -1.307   6.726   3.107
   43   HM23  M3L   4          HM23      M3L   4  -0.988   5.948   1.593
   44   HM31  M3L   4          HM31      M3L   4   0.693   7.964   4.253
   45   HM32  M3L   4          HM32      M3L   4  -0.048   9.152   3.219
   46   HM33  M3L   4          HM33      M3L   4   1.679   8.913   3.187
   47    H    GLN   5           H        GLN   5   1.580   1.048   1.693
   48    HA   GLN   5           HA       GLN   5   1.390   1.332  -1.172
   49    HB2  GLN   5           HB2      GLN   5   2.688  -0.758  -0.866
   50    HB3  GLN   5           HB1      GLN   5   1.373  -1.386   0.116
   51    HG2  GLN   5           HG2      GLN   5  -0.139  -1.206  -1.763
   52    HG3  GLN   5           HG1      GLN   5   1.157  -0.531  -2.749
   53   HE21  GLN   5          HE21      GLN   5  -0.404  -2.926  -3.179
   54   HE22  GLN   5          HE22      GLN   5   0.781  -4.165  -3.194
   55    H    THR   6           H        THR   6  -0.721   1.448  -1.729
   56    HA   THR   6           HA       THR   6  -2.581   1.203   0.450
   57    HB   THR   6           HB       THR   6  -3.083   2.071  -2.399
   58    HG1  THR   6           HG1      THR   6  -2.372   4.112  -1.760
   59   HG21  THR   6          HG21      THR   6  -5.099   1.419  -1.191
   60   HG22  THR   6          HG22      THR   6  -5.079   3.165  -1.436
   61   HG23  THR   6          HG23      THR   6  -4.673   2.487   0.144
   62    H    ALA   7           H        ALA   7  -2.417  -0.068  -2.944
   63    HA   ALA   7           HA       ALA   7  -2.893  -2.742  -2.120
   64    HB1  ALA   7           HB1      ALA   7  -5.210  -1.987  -1.863
   65    HB2  ALA   7           HB2      ALA   7  -4.968  -3.118  -3.226
   66    HB3  ALA   7           HB3      ALA   7  -5.152  -1.402  -3.545
   67    H    ARG   8           H        ARG   8  -3.813  -0.746  -4.837
   68    HA   ARG   8           HA       ARG   8  -3.160  -2.733  -6.695
   69    HE   ARG   8           HE       ARG   8  -5.526   1.305  -8.015
   70    HB2  ARG   8           HB2      ARG   8  -3.915   0.129  -7.092
   71    HB3  ARG   8           HB1      ARG   8  -3.489  -0.937  -8.430
   72    HG2  ARG   8           HG2      ARG   8  -5.267  -2.465  -7.795
   73    HG3  ARG   8           HG1      ARG   8  -5.703  -1.405  -6.455
   74    HD2  ARG   8           HD2      ARG   8  -5.729  -0.630  -9.360
   75    HD3  ARG   8           HD1      ARG   8  -7.147  -1.111  -8.433
   76   HH11  ARG   8          HH11      ARG   8  -8.618  -0.438  -7.701
   77   HH12  ARG   8          HH12      ARG   8  -9.423   0.865  -6.958
   78   HH21  ARG   8          HH21      ARG   8  -6.643   3.044  -6.935
   79   HH22  ARG   8          HH22      ARG   8  -8.277   2.879  -6.495
   80    H    LYS   9           H        LYS   9  -1.375  -3.371  -6.644
   81    HA   LYS   9           HA       LYS   9   1.021  -1.738  -7.097
   82    HB2  LYS   9           HB2      LYS   9   2.250  -3.693  -6.563
   83    HB3  LYS   9           HB1      LYS   9   0.840  -3.798  -5.521
   84    HG2  LYS   9           HG2      LYS   9  -0.135  -5.201  -7.537
   85    HG3  LYS   9           HG1      LYS   9   1.564  -5.421  -7.915
   86    HD2  LYS   9           HD2      LYS   9   0.967  -7.278  -6.613
   87    HD3  LYS   9           HD1      LYS   9   1.825  -6.206  -5.503
   88    HE2  LYS   9           HE2      LYS   9  -0.259  -5.396  -4.590
   89    HE3  LYS   9           HE1      LYS   9  -1.176  -6.304  -5.790
   90    HZ1  LYS   9           HZ1      LYS   9  -0.259  -8.345  -4.802
   91    HZ2  LYS   9           HZ2      LYS   9  -1.225  -7.478  -3.753
   92    HZ3  LYS   9           HZ3      LYS   9   0.456  -7.422  -3.581
   93    H    SER  10           H        SER  10   2.394  -2.290  -9.010
   94    HA   SER  10           HA       SER  10   0.829  -3.048 -11.311
   95    HG   SER  10           HG       SER  10   1.556  -0.857 -10.794
   96    HB2  SER  10           HB2      SER  10   3.742  -2.245 -11.088
   97    HB3  SER  10           HB1      SER  10   2.822  -2.403 -12.587
   98    H    THR  11           H        THR  11   0.578  -5.177 -11.644
   99    HA   THR  11           HA       THR  11   2.915  -6.850 -11.185
  100    HB   THR  11           HB       THR  11   1.283  -7.380  -9.473
  101    HG1  THR  11           HG1      THR  11   0.915  -9.643 -11.108
  102   HG21  THR  11          HG21      THR  11  -0.672  -7.947 -11.707
  103   HG22  THR  11          HG22      THR  11  -0.765  -6.612 -10.557
  104   HG23  THR  11          HG23      THR  11  -0.961  -8.272  -9.999
  105    H    GLY  12           H        GLY  12   3.694  -7.873 -12.871
  106    HA2  GLY  12           HA2      GLY  12   2.020  -8.013 -15.284
  107    HA3  GLY  12           HA1      GLY  12   3.782  -7.918 -15.275
  108    H    GLY  13           H        GLY  13   1.603  -9.876 -13.333
  109    HA2  GLY  13           HA2      GLY  13   1.725 -12.249 -14.547
  110    HA3  GLY  13           HA1      GLY  13   3.218 -12.148 -13.596
  111    H1   GLY 850           HT1      GLY 850   6.578  31.474   4.999
  112    H2   GLY 850           HT2      GLY 850   7.888  30.443   5.270
  113    H3   GLY 850           HT3      GLY 850   7.748  31.877   6.140
  114    HA2  GLY 850           HA1      GLY 850   7.135  29.974   7.481
  115    HA3  GLY 850           HA2      GLY 850   5.797  31.096   7.264
  116    H    SER 851           H        SER 851   4.379  30.579   5.324
  117    HA   SER 851           HA       SER 851   4.061  27.679   5.062
  118    HG   SER 851           HG       SER 851   3.192  28.320   7.158
  119    HB2  SER 851           HB2      SER 851   1.899  29.792   5.217
  120    HB3  SER 851           HB1      SER 851   1.660  28.049   5.099
  121    H    HIS 852           H        HIS 852   3.388  27.013   2.961
  122    HA   HIS 852           HA       HIS 852   4.056  28.801   0.833
  123    HD2  HIS 852           HD2      HIS 852   4.589  24.565   1.963
  124    HE1  HIS 852           HE1      HIS 852   7.826  25.786  -0.475
  125    HE2  HIS 852           HE2      HIS 852   6.957  23.996   1.055
  126    HB2  HIS 852           HB2      HIS 852   2.717  26.079   0.721
  127    HB3  HIS 852           HB1      HIS 852   3.248  26.982  -0.684
  128    H    MET 853           H        MET 853   1.101  27.495   2.186
  129    HA   MET 853           HA       MET 853  -1.032  28.146   2.243
  130    HB2  MET 853           HB2      MET 853   0.000  30.454   2.601
  131    HB3  MET 853           HB1      MET 853  -0.248  30.743   0.887
  132    HG2  MET 853           HG2      MET 853  -2.030  31.749   2.166
  133    HG3  MET 853           HG1      MET 853  -2.663  30.418   1.195
  134    HE1  MET 853           HE1      MET 853  -4.883  30.293   2.630
  135    HE2  MET 853           HE2      MET 853  -4.311  31.656   3.592
  136    HE3  MET 853           HE3      MET 853  -4.909  30.201   4.391
  137    H    ALA 854           H        ALA 854   0.517  27.336  -0.355
  138    HA   ALA 854           HA       ALA 854  -1.738  26.648  -1.901
  139    HB1  ALA 854           HB1      ALA 854  -1.455  28.955  -2.741
  140    HB2  ALA 854           HB2      ALA 854  -0.941  27.794  -3.964
  141    HB3  ALA 854           HB3      ALA 854   0.264  28.651  -3.002
  142    H    MET 855           H        MET 855  -0.462  25.788  -4.138
  143    HA   MET 855           HA       MET 855   0.726  24.007  -4.858
  144    HB2  MET 855           HB2      MET 855   2.920  25.334  -3.254
  145    HB3  MET 855           HB1      MET 855   3.184  24.078  -4.450
  146    HG2  MET 855           HG2      MET 855   2.297  25.570  -6.187
  147    HG3  MET 855           HG1      MET 855   2.073  26.825  -4.970
  148    HE1  MET 855           HE1      MET 855   4.106  27.929  -3.611
  149    HE2  MET 855           HE2      MET 855   5.804  27.547  -3.913
  150    HE3  MET 855           HE3      MET 855   4.756  26.346  -3.168
  151    H    ALA 856           H        ALA 856  -0.628  22.635  -3.535
  152    HA   ALA 856           HA       ALA 856   0.894  21.428  -1.341
  153    HB1  ALA 856           HB1      ALA 856  -1.133  22.526  -0.541
  154    HB2  ALA 856           HB2      ALA 856  -1.251  20.773  -0.348
  155    HB3  ALA 856           HB3      ALA 856  -2.097  21.573  -1.669
  156    H    TYR 857           H        TYR 857   1.377  19.357  -1.499
  157    HA   TYR 857           HA       TYR 857   0.407  17.913  -3.822
  158    HD1  TYR 857           HD1      TYR 857   2.184  16.820  -5.594
  159    HD2  TYR 857           HD2      TYR 857   4.150  19.230  -2.695
  160    HE1  TYR 857           HE1      TYR 857   3.526  17.848  -7.374
  161    HE2  TYR 857           HE2      TYR 857   5.489  20.275  -4.469
  162    HH   TYR 857           HH       TYR 857   4.779  20.019  -7.733
  163    HB2  TYR 857           HB2      TYR 857   2.724  17.458  -1.970
  164    HB3  TYR 857           HB1      TYR 857   2.144  16.244  -3.110
  165    H    VAL 858           H        VAL 858  -0.715  18.374  -1.040
  166    HA   VAL 858           HA       VAL 858  -1.806  15.649  -0.746
  167    HB   VAL 858           HB       VAL 858  -1.778  17.844   1.365
  168   HG11  VAL 858          HG11      VAL 858  -3.703  16.364   1.565
  169   HG12  VAL 858          HG12      VAL 858  -2.572  16.110   2.897
  170   HG13  VAL 858          HG13      VAL 858  -2.638  14.955   1.573
  171   HG21  VAL 858          HG21      VAL 858  -0.184  16.439   2.590
  172   HG22  VAL 858          HG22      VAL 858   0.477  16.964   1.038
  173   HG23  VAL 858          HG23      VAL 858  -0.132  15.318   1.232
  174    H    ILE 859           H        ILE 859  -3.885  15.498  -1.388
  175    HA   ILE 859           HA       ILE 859  -5.548  17.915  -1.239
  176    HB   ILE 859           HB       ILE 859  -6.731  17.306  -3.291
  177   HG12  ILE 859          HG12      ILE 859  -4.732  15.046  -3.631
  178   HG13  ILE 859          HG11      ILE 859  -6.411  14.857  -3.121
  179   HG21  ILE 859          HG21      ILE 859  -3.757  17.411  -3.749
  180   HG22  ILE 859          HG22      ILE 859  -4.845  18.783  -3.546
  181   HG23  ILE 859          HG23      ILE 859  -4.994  17.740  -4.963
  182   HD11  ILE 859          HD11      ILE 859  -5.519  15.963  -5.780
  183   HD12  ILE 859          HD12      ILE 859  -7.181  15.689  -5.262
  184   HD13  ILE 859          HD13      ILE 859  -6.092  14.321  -5.489
  185    H    ARG 860           H        ARG 860  -7.927  17.256  -1.279
  186    HA   ARG 860           HA       ARG 860  -8.202  14.664   0.034
  187    HE   ARG 860           HE       ARG 860  -8.073  16.726   4.312
  188    HB2  ARG 860           HB2      ARG 860  -9.887  17.139   0.304
  189    HB3  ARG 860           HB1      ARG 860 -10.404  15.561   0.880
  190    HG2  ARG 860           HG2      ARG 860  -8.387  15.464   2.281
  191    HG3  ARG 860           HG1      ARG 860  -7.994  17.103   1.772
  192    HD2  ARG 860           HD2      ARG 860 -10.072  17.927   2.720
  193    HD3  ARG 860           HD1      ARG 860 -10.525  16.287   3.192
  194   HH11  ARG 860          HH11      ARG 860 -11.301  18.181   4.650
  195   HH12  ARG 860          HH12      ARG 860 -10.998  18.758   6.206
  196   HH21  ARG 860          HH21      ARG 860  -7.711  17.488   6.421
  197   HH22  ARG 860          HH22      ARG 860  -8.901  18.383   7.253
  198    H    ASP 861           H        ASP 861  -9.773  13.292  -0.547
  199    HA   ASP 861           HA       ASP 861 -10.673  13.516  -3.310
  200    HB2  ASP 861           HB2      ASP 861 -11.123  11.210  -3.195
  201    HB3  ASP 861           HB1      ASP 861  -9.722  11.390  -2.151
  202    H    GLU 862           H        GLU 862 -13.100  12.157  -3.217
  203    HA   GLU 862           HA       GLU 862 -14.853  14.263  -2.633
  204    HB2  GLU 862           HB2      GLU 862 -16.640  12.665  -3.198
  205    HB3  GLU 862           HB1      GLU 862 -15.357  12.679  -4.393
  206    HG2  GLU 862           HG2      GLU 862 -14.420  10.639  -3.237
  207    HG3  GLU 862           HG1      GLU 862 -15.915  10.591  -2.308
  208    H    TRP 863           H        TRP 863 -13.877  11.479  -0.745
  209    HA   TRP 863           HA       TRP 863 -15.990  11.957   1.156
  210    HD1  TRP 863           HD       TRP 863 -17.436  10.291   0.579
  211    HE1  TRP 863           HE1      TRP 863 -18.118   8.426  -1.114
  212    HE3  TRP 863           HE3      TRP 863 -13.000   7.995   0.238
  213    HZ2  TRP 863           HZ2      TRP 863 -16.846   6.239  -2.381
  214    HZ3  TRP 863           HZ3      TRP 863 -12.750   6.006  -1.226
  215    HH2  TRP 863           HH       TRP 863 -14.651   5.160  -2.504
  216    HB2  TRP 863           HB2      TRP 863 -13.728   9.975   1.265
  217    HB3  TRP 863           HB1      TRP 863 -15.082  10.035   2.400
  218    H    GLY 864           H        GLY 864 -12.627  12.657   0.835
  219    HA2  GLY 864           HA2      GLY 864 -11.949  14.743   1.976
  220    HA3  GLY 864           HA1      GLY 864 -12.852  14.170   3.370
  221    H    ASN 865           H        ASN 865 -10.841  12.100   1.437
  222    HA   ASN 865           HA       ASN 865  -9.146  11.604   3.758
  223    HB2  ASN 865           HB2      ASN 865  -9.348  10.159   1.101
  224    HB3  ASN 865           HB1      ASN 865  -8.389   9.639   2.478
  225   HD21  ASN 865          HD21      ASN 865 -11.560   9.945   1.148
  226   HD22  ASN 865          HD22      ASN 865 -12.362   8.928   2.302
  227    H    GLN 866           H        GLN 866  -6.885  11.722   3.556
  228    HA   GLN 866           HA       GLN 866  -5.948  13.774   1.791
  229    HB2  GLN 866           HB2      GLN 866  -4.469  12.002   3.732
  230    HB3  GLN 866           HB1      GLN 866  -3.714  13.270   2.788
  231    HG2  GLN 866           HG2      GLN 866  -5.038  14.901   3.798
  232    HG3  GLN 866           HG1      GLN 866  -5.944  13.708   4.740
  233   HE21  GLN 866          HE21      GLN 866  -2.999  15.516   4.496
  234   HE22  GLN 866          HE22      GLN 866  -2.322  15.012   5.998
  235    H    ILE 867           H        ILE 867  -5.425  13.460  -0.116
  236    HA   ILE 867           HA       ILE 867  -4.409  10.842  -0.990
  237    HB   ILE 867           HB       ILE 867  -5.671  13.029  -2.670
  238   HG12  ILE 867          HG12      ILE 867  -7.370  11.963  -1.269
  239   HG13  ILE 867          HG11      ILE 867  -7.594  11.503  -2.953
  240   HG21  ILE 867          HG21      ILE 867  -4.039  11.762  -3.932
  241   HG22  ILE 867          HG22      ILE 867  -5.665  11.389  -4.502
  242   HG23  ILE 867          HG23      ILE 867  -4.813  10.247  -3.460
  243   HD11  ILE 867          HD11      ILE 867  -7.952   9.614  -1.472
  244   HD12  ILE 867          HD12      ILE 867  -6.338   9.825  -0.790
  245   HD13  ILE 867          HD13      ILE 867  -6.523   9.342  -2.474
  246    H    TRP 868           H        TRP 868  -2.328  10.835  -1.392
  247    HA   TRP 868           HA       TRP 868  -0.955  13.343  -1.551
  248    HD1  TRP 868           HD       TRP 868   2.022  13.464  -0.085
  249    HE1  TRP 868           HE1      TRP 868   1.830  13.865   2.443
  250    HE3  TRP 868           HE3      TRP 868  -1.850  10.306   0.921
  251    HZ2  TRP 868           HZ2      TRP 868   0.227  12.952   4.597
  252    HZ3  TRP 868           HZ3      TRP 868  -2.663  10.128   3.230
  253    HH2  TRP 868           HH       TRP 868  -1.647  11.425   5.032
  254    HB2  TRP 868           HB2      TRP 868  -0.083  10.538  -1.099
  255    HB3  TRP 868           HB1      TRP 868   1.091  11.696  -1.715
  256    H    ILE 869           H        ILE 869  -0.032  14.189  -3.139
  257    HA   ILE 869           HA       ILE 869  -0.288  13.044  -5.812
  258    HB   ILE 869           HB       ILE 869   0.475  15.829  -4.887
  259   HG12  ILE 869          HG12      ILE 869  -1.846  15.386  -4.263
  260   HG13  ILE 869          HG11      ILE 869  -1.770  16.570  -5.557
  261   HG21  ILE 869          HG21      ILE 869  -0.254  14.854  -7.639
  262   HG22  ILE 869          HG22      ILE 869   1.350  15.317  -7.080
  263   HG23  ILE 869          HG23      ILE 869   0.072  16.529  -7.191
  264   HD11  ILE 869          HD11      ILE 869  -2.463  13.663  -5.825
  265   HD12  ILE 869          HD12      ILE 869  -2.354  14.812  -7.162
  266   HD13  ILE 869          HD13      ILE 869  -3.582  15.024  -5.910
  267    H    CYS 870           H        CYS 870   1.542  12.241  -6.691
  268    HA   CYS 870           HA       CYS 870   4.005  12.190  -5.297
  269    HB2  CYS 870           HB2      CYS 870   3.264  10.402  -6.811
  270    HB3  CYS 870           HB1      CYS 870   3.291  11.515  -8.160
  271    HA   PRO 871           HA       PRO 871   5.246  16.214  -6.960
  272    HB2  PRO 871           HB2      PRO 871   7.796  15.686  -5.594
  273    HB3  PRO 871           HB1      PRO 871   6.643  16.998  -5.328
  274    HG2  PRO 871           HG2      PRO 871   6.981  15.023  -3.538
  275    HG3  PRO 871           HG1      PRO 871   5.394  15.760  -3.825
  276    HD2  PRO 871           HD2      PRO 871   6.495  13.170  -4.862
  277    HD3  PRO 871           HD1      PRO 871   4.883  13.536  -4.196
  278    H    GLY 872           H        GLY 872   6.224  13.202  -7.803
  279    HA2  GLY 872           HA2      GLY 872   8.478  14.011  -9.442
  280    HA3  GLY 872           HA1      GLY 872   7.816  12.384  -9.291
  281    H    CYS 873           H        CYS 873   5.239  12.574  -9.971
  282    HA   CYS 873           HA       CYS 873   5.416  13.318 -12.805
  283    HB2  CYS 873           HB2      CYS 873   3.528  11.709 -12.963
  284    HB3  CYS 873           HB1      CYS 873   5.032  11.009 -12.364
  285    H    ASN 874           H        ASN 874   3.822  14.042  -9.844
  286    HA   ASN 874           HA       ASN 874   2.312  15.493  -9.171
  287    HB2  ASN 874           HB2      ASN 874   2.111  16.406 -12.063
  288    HB3  ASN 874           HB1      ASN 874   1.221  17.150 -10.743
  289   HD21  ASN 874          HD21      ASN 874   3.192  18.282 -12.533
  290   HD22  ASN 874          HD22      ASN 874   4.449  18.913 -11.543
  291    H    LYS 875           H        LYS 875   1.806  12.762 -10.170
  292    HA   LYS 875           HA       LYS 875  -1.068  12.923 -10.650
  293    HB2  LYS 875           HB2      LYS 875   0.870  10.607 -10.818
  294    HB3  LYS 875           HB1      LYS 875  -0.858  10.484 -11.110
  295    HG2  LYS 875           HG2      LYS 875  -0.675  11.917 -13.037
  296    HG3  LYS 875           HG1      LYS 875   1.037  12.189 -12.708
  297    HD2  LYS 875           HD2      LYS 875   1.499   9.822 -13.056
  298    HD3  LYS 875           HD1      LYS 875  -0.212   9.511 -13.324
  299    HE2  LYS 875           HE2      LYS 875   1.507  11.323 -15.016
  300    HE3  LYS 875           HE1      LYS 875   1.083   9.659 -15.422
  301    HZ1  LYS 875           HZ1      LYS 875  -1.232  10.297 -15.498
  302    HZ2  LYS 875           HZ2      LYS 875  -0.353  11.294 -16.525
  303    HZ3  LYS 875           HZ3      LYS 875  -0.866  11.871 -15.041
  304    HA   PRO 876           HA       PRO 876  -1.810  11.814  -6.397
  305    HB2  PRO 876           HB2      PRO 876  -4.278  10.764  -6.618
  306    HB3  PRO 876           HB1      PRO 876  -3.998  12.495  -6.829
  307    HG2  PRO 876           HG2      PRO 876  -4.259  10.356  -8.895
  308    HG3  PRO 876           HG1      PRO 876  -5.057  11.947  -8.843
  309    HD2  PRO 876           HD2      PRO 876  -2.864  11.511 -10.360
  310    HD3  PRO 876           HD1      PRO 876  -3.133  13.061  -9.536
  311    H    ASP 877           H        ASP 877  -2.278   9.962  -5.075
  312    HA   ASP 877           HA       ASP 877  -1.078   7.589  -6.105
  313    HB2  ASP 877           HB2      ASP 877  -0.648   8.088  -3.772
  314    HB3  ASP 877           HB1      ASP 877  -2.375   8.071  -3.420
  315    H    ASP 878           H        ASP 878  -1.933   6.210  -7.225
  316    HA   ASP 878           HA       ASP 878  -4.763   5.840  -7.615
  317    HB2  ASP 878           HB2      ASP 878  -3.187   5.294  -9.415
  318    HB3  ASP 878           HB1      ASP 878  -2.411   4.087  -8.405
  319    H    GLY 879           H        GLY 879  -2.315   4.556  -5.618
  320    HA2  GLY 879           HA2      GLY 879  -3.164   3.572  -3.564
  321    HA3  GLY 879           HA1      GLY 879  -4.086   2.465  -4.594
  322    H    SER 880           H        SER 880  -0.817   3.727  -4.895
  323    HA   SER 880           HA       SER 880   0.059   0.993  -5.551
  324    HG   SER 880           HG       SER 880   1.600   2.030  -8.305
  325    HB2  SER 880           HB2      SER 880  -0.033   2.823  -7.348
  326    HB3  SER 880           HB1      SER 880   1.210   3.653  -6.414
  327    HA   PRO 881           HA       PRO 881   3.177   1.367  -2.263
  328    HB2  PRO 881           HB2      PRO 881   5.268   0.720  -4.264
  329    HB3  PRO 881           HB1      PRO 881   4.879  -0.103  -2.754
  330    HG2  PRO 881           HG2      PRO 881   4.267  -1.174  -5.113
  331    HG3  PRO 881           HG1      PRO 881   3.200  -1.360  -3.714
  332    HD2  PRO 881           HD2      PRO 881   2.927   0.453  -6.065
  333    HD3  PRO 881           HD1      PRO 881   1.655  -0.397  -5.193
  334    H    MET 882           H        MET 882   4.051   3.168  -1.544
  335    HA   MET 882           HA       MET 882   5.255   5.038  -3.483
  336    HB2  MET 882           HB2      MET 882   3.660   5.863  -1.041
  337    HB3  MET 882           HB1      MET 882   4.367   6.934  -2.239
  338    HG2  MET 882           HG2      MET 882   2.831   5.926  -3.919
  339    HG3  MET 882           HG1      MET 882   2.066   5.038  -2.605
  340    HE1  MET 882           HE1      MET 882   1.877   9.588  -3.294
  341    HE2  MET 882           HE2      MET 882   2.330   8.390  -4.498
  342    HE3  MET 882           HE3      MET 882   3.412   8.719  -3.132
  343    H    ILE 883           H        ILE 883   6.877   6.458  -2.537
  344    HA   ILE 883           HA       ILE 883   8.009   5.300  -0.113
  345    HB   ILE 883           HB       ILE 883   9.397   4.623  -2.077
  346   HG12  ILE 883          HG12      ILE 883  10.909   6.630  -0.407
  347   HG13  ILE 883          HG11      ILE 883  10.393   5.059   0.215
  348   HG21  ILE 883          HG21      ILE 883   9.890   7.586  -2.415
  349   HG22  ILE 883          HG22      ILE 883   8.969   6.564  -3.520
  350   HG23  ILE 883          HG23      ILE 883  10.702   6.299  -3.305
  351   HD11  ILE 883          HD11      ILE 883  11.761   3.977  -1.494
  352   HD12  ILE 883          HD12      ILE 883  12.722   5.070  -0.490
  353   HD13  ILE 883          HD13      ILE 883  12.239   5.561  -2.108
  354    H    GLY 884           H        GLY 884   8.474   6.598   1.427
  355    HA2  GLY 884           HA2      GLY 884   8.014   9.452   1.065
  356    HA3  GLY 884           HA1      GLY 884   8.047   8.566   2.583
  357    H    CYS 885           H        CYS 885   9.592  10.812   1.104
  358    HA   CYS 885           HA       CYS 885  12.320  10.021   1.207
  359    HB2  CYS 885           HB2      CYS 885  11.596  11.826  -0.207
  360    HB3  CYS 885           HB1      CYS 885  11.003  12.749   1.171
  361    H    ASP 886           H        ASP 886  13.882  10.639   2.740
  362    HA   ASP 886           HA       ASP 886  12.783  10.561   5.406
  363    HB2  ASP 886           HB2      ASP 886  15.512  10.154   4.285
  364    HB3  ASP 886           HB1      ASP 886  15.317  10.492   5.996
  365    H    ASP 887           H        ASP 887  14.149  12.900   3.301
  366    HA   ASP 887           HA       ASP 887  14.886  14.567   5.574
  367    HB2  ASP 887           HB2      ASP 887  16.390  14.581   3.612
  368    HB3  ASP 887           HB1      ASP 887  15.097  15.283   2.641
  369    H    CYS 888           H        CYS 888  13.102  15.424   2.638
  370    HA   CYS 888           HA       CYS 888  11.725  17.484   4.000
  371    HB2  CYS 888           HB2      CYS 888  10.421  17.755   1.935
  372    HB3  CYS 888           HB1      CYS 888  12.146  17.671   1.626
  373    H    ASP 889           H        ASP 889  10.929  14.255   3.155
  374    HA   ASP 889           HA       ASP 889   9.390  12.806   3.839
  375    HB2  ASP 889           HB2      ASP 889   9.648  13.583   6.148
  376    HB3  ASP 889           HB1      ASP 889   8.607  14.958   5.837
  377    H    ASP 890           H        ASP 890   8.919  13.487   1.607
  378    HA   ASP 890           HA       ASP 890   6.049  14.118   1.408
  379    HB2  ASP 890           HB2      ASP 890   8.249  14.612  -0.641
  380    HB3  ASP 890           HB1      ASP 890   6.561  14.539  -1.092
  381    H    TRP 891           H        TRP 891   5.116  12.941  -0.598
  382    HA   TRP 891           HA       TRP 891   6.176  10.209  -0.517
  383    HD1  TRP 891           HD       TRP 891   3.331  11.782   2.044
  384    HE1  TRP 891           HE1      TRP 891   3.749  10.417   4.197
  385    HE3  TRP 891           HE3      TRP 891   5.144   7.517  -0.041
  386    HZ2  TRP 891           HZ2      TRP 891   4.697   7.881   4.890
  387    HZ3  TRP 891           HZ3      TRP 891   5.801   5.668   1.408
  388    HH2  TRP 891           HH       TRP 891   5.599   5.853   3.859
  389    HB2  TRP 891           HB2      TRP 891   3.323  11.150  -0.505
  390    HB3  TRP 891           HB1      TRP 891   3.764   9.501  -0.939
  391    H    TYR 892           H        TYR 892   7.014   9.601  -2.334
  392    HA   TYR 892           HA       TYR 892   5.898  10.570  -4.881
  393    HD1  TYR 892           HD1      TYR 892   8.767  11.401  -2.581
  394    HD2  TYR 892           HD2      TYR 892   8.460  11.688  -6.798
  395    HE1  TYR 892           HE1      TYR 892   9.829  13.610  -2.504
  396    HE2  TYR 892           HE2      TYR 892   9.506  13.893  -6.744
  397    HH   TYR 892           HH       TYR 892  11.066  15.027  -3.953
  398    HB2  TYR 892           HB2      TYR 892   8.568   9.381  -4.149
  399    HB3  TYR 892           HB1      TYR 892   8.041   9.673  -5.792
  400    H    HIS 893           H        HIS 893   5.804   8.961  -6.532
  401    HA   HIS 893           HA       HIS 893   5.130   6.300  -5.543
  402    HD2  HIS 893           HD2      HIS 893   2.377   5.866  -6.035
  403    HE1  HIS 893           HE1      HIS 893   0.967   9.350  -7.997
  404    HE2  HIS 893           HE2      HIS 893   0.567   7.690  -6.119
  405    HB2  HIS 893           HB2      HIS 893   5.157   7.372  -8.373
  406    HB3  HIS 893           HB1      HIS 893   4.660   5.745  -7.968
  407    H    TRP 894           H        TRP 894   6.068   4.426  -6.804
  408    HA   TRP 894           HA       TRP 894   8.851   4.535  -6.381
  409    HD1  TRP 894           HD       TRP 894   7.953   4.183  -4.362
  410    HE1  TRP 894           HE1      TRP 894   8.008   2.724  -2.237
  411    HE3  TRP 894           HE3      TRP 894   7.966  -0.417  -6.548
  412    HZ2  TRP 894           HZ2      TRP 894   8.033  -0.015  -1.583
  413    HZ3  TRP 894           HZ3      TRP 894   8.016  -2.409  -5.114
  414    HH2  TRP 894           HH       TRP 894   8.049  -2.205  -2.671
  415    HB2  TRP 894           HB2      TRP 894   7.000   2.352  -7.255
  416    HB3  TRP 894           HB1      TRP 894   8.739   2.126  -7.331
  417    HA   PRO 895           HA       PRO 895   9.354   3.712 -11.169
  418    HB2  PRO 895           HB2      PRO 895   7.323   4.633 -12.763
  419    HB3  PRO 895           HB1      PRO 895   7.427   2.964 -12.193
  420    HG2  PRO 895           HG2      PRO 895   5.878   5.258 -11.029
  421    HG3  PRO 895           HG1      PRO 895   5.298   3.618 -11.360
  422    HD2  PRO 895           HD2      PRO 895   5.984   4.306  -8.917
  423    HD3  PRO 895           HD1      PRO 895   6.481   2.717  -9.551
  424    H    CYS 896           H        CYS 896   7.801   6.440  -9.807
  425    HA   CYS 896           HA       CYS 896   8.488   8.381 -11.739
  426    HB2  CYS 896           HB2      CYS 896   7.686   8.691  -8.866
  427    HB3  CYS 896           HB1      CYS 896   7.499   9.885 -10.161
  428    H    VAL 897           H        VAL 897   9.890   7.261  -8.728
  429    HA   VAL 897           HA       VAL 897  12.046   9.204  -9.047
  430    HB   VAL 897           HB       VAL 897  12.766   8.547  -6.757
  431   HG11  VAL 897          HG11      VAL 897  11.388  10.495  -7.061
  432   HG12  VAL 897          HG12      VAL 897  10.818   9.637  -5.618
  433   HG13  VAL 897          HG13      VAL 897   9.944   9.497  -7.130
  434   HG21  VAL 897          HG21      VAL 897  11.272   7.238  -5.352
  435   HG22  VAL 897          HG22      VAL 897  11.771   6.290  -6.761
  436   HG23  VAL 897          HG23      VAL 897  10.170   7.012  -6.710
  437    H    GLY 898           H        GLY 898  11.397   5.895  -9.453
  438    HA2  GLY 898           HA2      GLY 898  12.983   4.713 -10.880
  439    HA3  GLY 898           HA1      GLY 898  14.274   5.477  -9.963
  440    H    ILE 899           H        ILE 899  11.810   4.623  -7.918
  441    HA   ILE 899           HA       ILE 899  13.396   2.463  -6.823
  442    HB   ILE 899           HB       ILE 899  10.772   3.715  -5.922
  443   HG12  ILE 899          HG12      ILE 899  12.849   5.089  -5.640
  444   HG13  ILE 899          HG11      ILE 899  12.007   4.730  -4.135
  445   HG21  ILE 899          HG21      ILE 899  10.790   1.369  -5.243
  446   HG22  ILE 899          HG22      ILE 899  10.996   2.411  -3.835
  447   HG23  ILE 899          HG23      ILE 899  12.390   1.578  -4.528
  448   HD11  ILE 899          HD11      ILE 899  14.385   4.595  -3.882
  449   HD12  ILE 899          HD12      ILE 899  14.485   3.384  -5.177
  450   HD13  ILE 899          HD13      ILE 899  13.632   3.013  -3.662
  451    H    MET 900           H        MET 900  13.037   0.402  -7.264
  452    HA   MET 900           HA       MET 900  10.479  -0.279  -8.532
  453    HB2  MET 900           HB2      MET 900  13.202  -1.433  -9.156
  454    HB3  MET 900           HB1      MET 900  11.681  -1.994  -9.853
  455    HG2  MET 900           HG2      MET 900  11.328   0.198 -10.862
  456    HG3  MET 900           HG1      MET 900  12.821   0.781 -10.145
  457    HE1  MET 900           HE1      MET 900  12.075  -2.718 -11.822
  458    HE2  MET 900           HE2      MET 900  12.566  -2.387 -13.481
  459    HE3  MET 900           HE3      MET 900  11.175  -1.554 -12.797
  460    H    ALA 901           H        ALA 901  12.707  -0.911  -6.077
  461    HA   ALA 901           HA       ALA 901  10.955  -2.963  -5.017
  462    HB1  ALA 901           HB1      ALA 901  12.853  -4.158  -5.980
  463    HB2  ALA 901           HB2      ALA 901  12.900  -4.219  -4.216
  464    HB3  ALA 901           HB3      ALA 901  13.971  -3.118  -5.091
  465    H    ALA 902           H        ALA 902  10.839  -2.846  -2.772
  466    HA   ALA 902           HA       ALA 902  11.277  -0.268  -1.726
  467    HB1  ALA 902           HB1      ALA 902   9.404  -1.640  -1.006
  468    HB2  ALA 902           HB2      ALA 902  10.392  -1.157   0.367
  469    HB3  ALA 902           HB3      ALA 902  10.515  -2.802  -0.273
  470    HA   PRO 903           HA       PRO 903  15.450  -1.080  -0.197
  471    HB2  PRO 903           HB2      PRO 903  15.289   1.518   1.100
  472    HB3  PRO 903           HB1      PRO 903  16.299   1.055  -0.264
  473    HG2  PRO 903           HG2      PRO 903  14.246   2.794  -0.406
  474    HG3  PRO 903           HG1      PRO 903  14.791   1.827  -1.792
  475    HD2  PRO 903           HD2      PRO 903  12.432   1.437   0.001
  476    HD3  PRO 903           HD1      PRO 903  12.599   1.146  -1.743
  477    HA   PRO 904           HA       PRO 904  14.721  -2.244   4.003
  478    HB2  PRO 904           HB2      PRO 904  17.005  -0.774   5.075
  479    HB3  PRO 904           HB1      PRO 904  16.764  -2.514   4.968
  480    HG2  PRO 904           HG2      PRO 904  18.511  -1.035   3.460
  481    HG3  PRO 904           HG1      PRO 904  17.929  -2.662   3.049
  482    HD2  PRO 904           HD2      PRO 904  17.231  -0.045   1.845
  483    HD3  PRO 904           HD1      PRO 904  17.036  -1.677   1.191
  484    H    GLU 905           H        GLU 905  13.768  -1.428   5.870
  485    HA   GLU 905           HA       GLU 905  12.899   1.287   5.658
  486    HB2  GLU 905           HB2      GLU 905  11.532   0.785   7.677
  487    HB3  GLU 905           HB1      GLU 905  11.261  -0.341   6.361
  488    HG2  GLU 905           HG2      GLU 905  12.665  -1.990   7.486
  489    HG3  GLU 905           HG1      GLU 905  12.949  -0.849   8.803
  490    H    GLU 906           H        GLU 906  15.517  -0.239   7.032
  491    HA   GLU 906           HA       GLU 906  15.938   1.810   9.070
  492    HB2  GLU 906           HB2      GLU 906  17.649  -0.534   8.243
  493    HB3  GLU 906           HB1      GLU 906  17.979   0.537   9.598
  494    HG2  GLU 906           HG2      GLU 906  15.541  -1.135   9.272
  495    HG3  GLU 906           HG1      GLU 906  16.938  -1.605  10.263
  496    H    MET 907           H        MET 907  16.306   1.498   5.899
  497    HA   MET 907           HA       MET 907  18.822   2.983   5.616
  498    HB2  MET 907           HB2      MET 907  18.504   1.137   4.073
  499    HB3  MET 907           HB1      MET 907  16.946   1.793   3.578
  500    HG2  MET 907           HG2      MET 907  18.142   3.772   2.669
  501    HG3  MET 907           HG1      MET 907  19.666   2.983   3.056
  502    HE1  MET 907           HE1      MET 907  18.798   4.079   0.143
  503    HE2  MET 907           HE2      MET 907  19.413   2.776  -0.874
  504    HE3  MET 907           HE3      MET 907  20.371   3.359   0.486
  505    H    GLN 908           H        GLN 908  18.855   5.030   4.974
  506    HA   GLN 908           HA       GLN 908  16.289   6.388   4.830
  507    HB2  GLN 908           HB2      GLN 908  19.059   7.568   5.039
  508    HB3  GLN 908           HB1      GLN 908  17.564   8.485   5.027
  509    HG2  GLN 908           HG2      GLN 908  16.872   7.311   7.099
  510    HG3  GLN 908           HG1      GLN 908  18.452   6.534   7.146
  511   HE21  GLN 908          HE21      GLN 908  17.883   9.854   6.151
  512   HE22  GLN 908          HE22      GLN 908  18.683  10.579   7.493
  513    H    TRP 909           H        TRP 909  15.878   7.840   3.169
  514    HA   TRP 909           HA       TRP 909  17.396   7.522   0.704
  515    HD1  TRP 909           HD       TRP 909  16.670   5.656  -1.873
  516    HE1  TRP 909           HE1      TRP 909  15.646   6.507  -4.077
  517    HE3  TRP 909           HE3      TRP 909  13.065   8.673   0.043
  518    HZ2  TRP 909           HZ2      TRP 909  13.552   8.263  -4.892
  519    HZ3  TRP 909           HZ3      TRP 909  11.599   9.907  -1.483
  520    HH2  TRP 909           HH       TRP 909  11.837   9.703  -3.898
  521    HB2  TRP 909           HB2      TRP 909  15.755   5.702   0.638
  522    HB3  TRP 909           HB1      TRP 909  14.459   6.828   1.020
  523    H    PHE 910           H        PHE 910  17.029   9.270  -0.695
  524    HA   PHE 910           HA       PHE 910  15.400  11.416   0.397
  525    HD1  PHE 910           HD2      PHE 910  16.412  12.796   2.445
  526    HD2  PHE 910           HD1      PHE 910  19.641  10.562   0.828
  527    HE1  PHE 910           HE2      PHE 910  17.203  12.304   4.717
  528    HE2  PHE 910           HE1      PHE 910  20.438  10.052   3.092
  529    HZ   PHE 910           HZ       PHE 910  19.214  10.911   5.040
  530    HB2  PHE 910           HB2      PHE 910  18.234  11.707  -0.586
  531    HB3  PHE 910           HB1      PHE 910  17.224  13.027   0.013
  532    H    CYS 911           H        CYS 911  14.339  12.447  -1.090
  533    HA   CYS 911           HA       CYS 911  14.155  11.356  -3.706
  534    HB2  CYS 911           HB2      CYS 911  12.319  12.924  -3.984
  535    HB3  CYS 911           HB1      CYS 911  12.264  12.252  -2.372
  536    HA   PRO 912           HA       PRO 912  16.593  14.018  -6.345
  537    HB2  PRO 912           HB2      PRO 912  14.563  15.083  -7.984
  538    HB3  PRO 912           HB1      PRO 912  15.496  13.615  -8.284
  539    HG2  PRO 912           HG2      PRO 912  12.784  13.920  -7.067
  540    HG3  PRO 912           HG1      PRO 912  13.401  12.635  -8.123
  541    HD2  PRO 912           HD2      PRO 912  13.100  12.220  -5.531
  542    HD3  PRO 912           HD1      PRO 912  14.501  11.569  -6.398
  543    H    LYS 913           H        LYS 913  13.998  15.410  -4.463
  544    HA   LYS 913           HA       LYS 913  14.668  18.181  -5.010
  545    HB2  LYS 913           HB2      LYS 913  13.336  16.899  -2.604
  546    HB3  LYS 913           HB1      LYS 913  13.562  18.619  -2.811
  547    HG2  LYS 913           HG2      LYS 913  11.938  18.720  -4.504
  548    HG3  LYS 913           HG1      LYS 913  11.947  16.964  -4.718
  549    HD2  LYS 913           HD2      LYS 913   9.954  17.701  -3.452
  550    HD3  LYS 913           HD1      LYS 913  10.988  16.653  -2.492
  551    HE2  LYS 913           HE2      LYS 913  11.972  18.766  -1.501
  552    HE3  LYS 913           HE1      LYS 913  10.657  19.644  -2.285
  553    HZ1  LYS 913           HZ1      LYS 913   9.085  18.171  -0.995
  554    HZ2  LYS 913           HZ2      LYS 913  10.048  19.141  -0.027
  555    HZ3  LYS 913           HZ3      LYS 913  10.412  17.516  -0.215
  556    H    CYS 914           H        CYS 914  15.238  15.842  -2.504
  557    HA   CYS 914           HA       CYS 914  16.792  17.623  -0.960
  558    HB2  CYS 914           HB2      CYS 914  16.054  14.762  -0.562
  559    HB3  CYS 914           HB1      CYS 914  16.869  15.759   0.646
  560    H    ALA 915           H        ALA 915  17.526  14.663  -2.724
  561    HA   ALA 915           HA       ALA 915  20.166  14.647  -1.769
  562    HB1  ALA 915           HB1      ALA 915  20.602  12.891  -3.423
  563    HB2  ALA 915           HB2      ALA 915  19.079  13.277  -4.231
  564    HB3  ALA 915           HB3      ALA 915  19.068  12.627  -2.590
  565    H    ASN 916           H        ASN 916  18.630  16.322  -4.276
  566    HA   ASN 916           HA       ASN 916  21.033  16.984  -5.760
  567    HB2  ASN 916           HB2      ASN 916  18.798  16.629  -6.840
  568    HB3  ASN 916           HB1      ASN 916  18.214  18.047  -6.015
  569   HD21  ASN 916          HD21      ASN 916  18.471  17.337  -8.836
  570   HD22  ASN 916          HD22      ASN 916  19.319  18.649  -9.579
  571    H    LYS 917           H        LYS 917  18.873  18.465  -3.371
  572    HA   LYS 917           HA       LYS 917  19.952  21.098  -3.623
  573    HB2  LYS 917           HB2      LYS 917  18.574  21.710  -1.784
  574    HB3  LYS 917           HB1      LYS 917  17.658  20.503  -2.675
  575    HG2  LYS 917           HG2      LYS 917  18.598  18.805  -1.062
  576    HG3  LYS 917           HG1      LYS 917  19.150  20.175  -0.112
  577    HD2  LYS 917           HD2      LYS 917  16.853  20.971   0.087
  578    HD3  LYS 917           HD1      LYS 917  16.288  19.608  -0.879
  579    HE2  LYS 917           HE2      LYS 917  17.441  18.118   0.841
  580    HE3  LYS 917           HE1      LYS 917  17.571  19.557   1.839
  581    HZ1  LYS 917           HZ1      LYS 917  15.580  18.393   2.464
  582    HZ2  LYS 917           HZ2      LYS 917  15.102  18.246   0.892
  583    HZ3  LYS 917           HZ3      LYS 917  15.083  19.774   1.610
  584    H    ILE 918           H        ILE 918  21.013  18.274  -2.056
  585    HA   ILE 918           HA       ILE 918  22.578  19.279   0.048
  586    HB   ILE 918           HB       ILE 918  23.256  16.990  -1.829
  587   HG12  ILE 918          HG12      ILE 918  21.069  16.643  -0.794
  588   HG13  ILE 918          HG11      ILE 918  22.239  15.491  -0.176
  589   HG21  ILE 918          HG21      ILE 918  24.635  16.115  -0.019
  590   HG22  ILE 918          HG22      ILE 918  24.265  17.541   0.950
  591   HG23  ILE 918          HG23      ILE 918  25.177  17.709  -0.551
  592   HD11  ILE 918          HD11      ILE 918  22.443  16.865   1.867
  593   HD12  ILE 918          HD12      ILE 918  20.798  16.294   1.584
  594   HD13  ILE 918          HD13      ILE 918  21.226  17.961   1.207
  595    H    LYS 919           H        LYS 919  23.417  18.473  -3.241
  596    HA   LYS 919           HA       LYS 919  25.207  18.789  -4.502
  597    HB2  LYS 919           HB2      LYS 919  23.729  20.662  -5.030
  598    HB3  LYS 919           HB1      LYS 919  24.585  21.663  -3.858
  599    HG2  LYS 919           HG2      LYS 919  26.588  21.569  -5.152
  600    HG3  LYS 919           HG1      LYS 919  25.874  20.396  -6.262
  601    HD2  LYS 919           HD2      LYS 919  24.187  22.118  -6.876
  602    HD3  LYS 919           HD1      LYS 919  25.070  23.277  -5.879
  603    HE2  LYS 919           HE2      LYS 919  25.657  23.421  -8.282
  604    HE3  LYS 919           HE1      LYS 919  27.033  23.042  -7.251
  605    HZ1  LYS 919           HZ1      LYS 919  25.466  20.981  -8.711
  606    HZ2  LYS 919           HZ2      LYS 919  26.934  20.757  -7.915
  607    HZ3  LYS 919           HZ3      LYS 919  26.872  21.655  -9.319
  608    H    LYS 920           H        LYS 920  26.595  17.782  -3.124
  609    HA   LYS 920           HA       LYS 920  28.759  19.467  -2.197
  610    HB2  LYS 920           HB2      LYS 920  27.395  17.433  -0.435
  611    HB3  LYS 920           HB1      LYS 920  28.972  18.118  -0.084
  612    HG2  LYS 920           HG2      LYS 920  27.978  20.334   0.097
  613    HG3  LYS 920           HG1      LYS 920  26.394  19.666  -0.298
  614    HD2  LYS 920           HD2      LYS 920  26.515  18.253   1.706
  615    HD3  LYS 920           HD1      LYS 920  28.080  18.972   2.106
  616    HE2  LYS 920           HE2      LYS 920  27.006  21.173   2.234
  617    HE3  LYS 920           HE1      LYS 920  25.453  20.428   1.863
  618    HZ1  LYS 920           HZ1      LYS 920  25.768  20.824   4.218
  619    HZ2  LYS 920           HZ2      LYS 920  27.111  19.791   4.242
  620    HZ3  LYS 920           HZ3      LYS 920  25.558  19.186   3.889
  621    H    ASP 921           H        ASP 921  30.035  18.755  -3.715
  622    HA   ASP 921           HA       ASP 921  30.394  15.963  -4.319
  623    HB2  ASP 921           HB2      ASP 921  32.060  16.672  -5.890
  624    HB3  ASP 921           HB1      ASP 921  30.797  17.891  -5.972
  625    H    LYS 922           H        LYS 922  32.513  14.939  -4.000
  626    HA   LYS 922           HA       LYS 922  34.120  16.142  -1.957
  627    HB2  LYS 922           HB2      LYS 922  34.206  13.947  -0.681
  628    HB3  LYS 922           HB1      LYS 922  32.732  14.876  -0.522
  629    HG2  LYS 922           HG2      LYS 922  32.136  12.576  -0.673
  630    HG3  LYS 922           HG1      LYS 922  31.675  13.338  -2.188
  631    HD2  LYS 922           HD2      LYS 922  33.647  12.411  -3.274
  632    HD3  LYS 922           HD1      LYS 922  34.184  11.723  -1.745
  633    HE2  LYS 922           HE2      LYS 922  31.613  11.022  -3.153
  634    HE3  LYS 922           HE1      LYS 922  33.083  10.059  -3.211
  635    HZ1  LYS 922           HZ1      LYS 922  31.578   9.185  -1.582
  636    HZ2  LYS 922           HZ2      LYS 922  31.469  10.659  -0.798
  637    HZ3  LYS 922           HZ3      LYS 922  32.928   9.808  -0.789
  638    H    LYS 923           H        LYS 923  36.126  14.812  -1.596
  639    HA   LYS 923           HA       LYS 923  36.955  13.627  -4.142
  640    HB2  LYS 923           HB2      LYS 923  39.121  14.688  -3.913
  641    HB3  LYS 923           HB1      LYS 923  37.867  15.916  -3.921
  642    HG2  LYS 923           HG2      LYS 923  38.054  16.156  -1.522
  643    HG3  LYS 923           HG1      LYS 923  39.234  14.851  -1.459
  644    HD2  LYS 923           HD2      LYS 923  39.641  17.403  -3.010
  645    HD3  LYS 923           HD1      LYS 923  40.159  17.215  -1.341
  646    HE2  LYS 923           HE2      LYS 923  42.092  16.845  -2.700
  647    HE3  LYS 923           HE1      LYS 923  41.585  15.266  -2.135
  648    HZ1  LYS 923           HZ1      LYS 923  40.707  14.761  -4.307
  649    HZ2  LYS 923           HZ2      LYS 923  42.257  15.373  -4.500
  650    HZ3  LYS 923           HZ3      LYS 923  40.932  16.349  -4.824
  651    H    HIS 924           H        HIS 924  39.133  12.453  -3.735
  652    HA   HIS 924           HA       HIS 924  38.807  10.849  -1.327
  653    HD1  HIS 924           HD1      HIS 924  42.499   9.085  -3.072
  654    HD2  HIS 924           HD2      HIS 924  39.014   7.832  -1.163
  655    HE1  HIS 924           HE1      HIS 924  43.157   7.121  -1.709
  656    HE2  HIS 924           HE2      HIS 924  41.163   6.770  -0.240
  657    HB2  HIS 924           HB2      HIS 924  38.880   9.616  -3.456
  658    HB3  HIS 924           HB1      HIS 924  40.426  10.351  -3.854
  Start of MODEL   15
    1    HA   ALA   1           HA       ALA   1  12.659   6.869   2.527
    2    H1   ALA   1           HT1      ALA   1  13.087   6.938   4.889
    3    H2   ALA   1           HT2      ALA   1  14.436   7.049   4.014
    4    H3   ALA   1           HT3      ALA   1  14.049   5.564   4.819
    5    HB1  ALA   1           HB1      ALA   1  12.954   4.705   1.384
    6    HB2  ALA   1           HB2      ALA   1  13.792   4.068   2.788
    7    HB3  ALA   1           HB3      ALA   1  14.520   5.371   1.853
    8    H    ARG   2           H        ARG   2  10.648   7.105   3.329
    9    HA   ARG   2           HA       ARG   2   9.561   4.973   4.946
   10    HE   ARG   2           HE       ARG   2   5.917   6.160   7.628
   11    HB2  ARG   2           HB2      ARG   2   9.111   7.639   5.066
   12    HB3  ARG   2           HB1      ARG   2   7.887   7.185   3.915
   13    HG2  ARG   2           HG2      ARG   2   6.873   5.678   5.431
   14    HG3  ARG   2           HG1      ARG   2   8.209   5.900   6.565
   15    HD2  ARG   2           HD2      ARG   2   7.630   8.229   6.846
   16    HD3  ARG   2           HD1      ARG   2   6.310   8.070   5.690
   17   HH11  ARG   2          HH11      ARG   2   5.963   9.709   7.453
   18   HH12  ARG   2          HH12      ARG   2   4.977   9.930   8.807
   19   HH21  ARG   2          HH21      ARG   2   4.511   6.470   9.453
   20   HH22  ARG   2          HH22      ARG   2   4.126   8.041   9.974
   21    H    THR   3           H        THR   3   8.784   3.233   3.894
   22    HA   THR   3           HA       THR   3   7.551   3.797   1.338
   23    HB   THR   3           HB       THR   3   7.992   1.325   0.907
   24    HG1  THR   3           HG1      THR   3  10.209   1.340   2.537
   25   HG21  THR   3          HG21      THR   3  10.250   1.758   0.156
   26   HG22  THR   3          HG22      THR   3  10.342   3.199   1.174
   27   HG23  THR   3          HG23      THR   3   9.218   3.144  -0.188
   28    HA   M3L   4           HA       M3L   4   4.274   1.288   2.843
   29    H    M3L   4           H        M3L   4   5.591   2.913   0.873
   30    HB2  M3L   4           HB2      M3L   4   3.863   3.544   3.701
   31    HB3  M3L   4           HB1      M3L   4   2.378   2.872   3.043
   32    HG2  M3L   4           HG2      M3L   4   3.399   4.137   0.881
   33    HG3  M3L   4           HG1      M3L   4   3.944   5.186   2.188
   34    HD2  M3L   4           HD2      M3L   4   1.113   4.354   1.602
   35    HD3  M3L   4           HD1      M3L   4   1.629   5.294   3.009
   36    HE2  M3L   4           HE2      M3L   4   2.507   7.019   1.613
   37    HE3  M3L   4           HE1      M3L   4   2.201   6.074   0.176
   38   HM11  M3L   4          HM11      M3L   4  -0.492   8.668   0.203
   39   HM12  M3L   4          HM12      M3L   4   1.175   8.900   0.679
   40   HM13  M3L   4          HM13      M3L   4   0.790   7.993  -0.757
   41   HM21  M3L   4          HM21      M3L   4  -0.068   5.435  -0.467
   42   HM22  M3L   4          HM22      M3L   4  -1.413   6.400  -0.031
   43   HM23  M3L   4          HM23      M3L   4  -0.889   5.137   1.038
   44   HM31  M3L   4          HM31      M3L   4  -0.996   7.824   2.473
   45   HM32  M3L   4          HM32      M3L   4   0.636   7.731   3.077
   46   HM33  M3L   4          HM33      M3L   4  -0.339   6.309   3.008
   47    H    GLN   5           H        GLN   5   2.106   0.793   2.061
   48    HA   GLN   5           HA       GLN   5   1.318   1.267  -0.632
   49    HB2  GLN   5           HB2      GLN   5   3.112  -0.525  -0.838
   50    HB3  GLN   5           HB1      GLN   5   2.043  -1.554   0.113
   51    HG2  GLN   5           HG2      GLN   5   0.256  -1.018  -1.579
   52    HG3  GLN   5           HG1      GLN   5   1.539  -0.344  -2.569
   53   HE21  GLN   5          HE21      GLN   5  -0.164  -2.478  -3.134
   54   HE22  GLN   5          HE22      GLN   5   0.788  -3.899  -3.321
   55    H    THR   6           H        THR   6  -0.762   1.547  -0.160
   56    HA   THR   6           HA       THR   6  -1.981   0.395   2.094
   57    HB   THR   6           HB       THR   6  -3.294   1.553  -0.368
   58    HG1  THR   6           HG1      THR   6  -2.454   3.005   1.944
   59   HG21  THR   6          HG21      THR   6  -4.119   1.482   2.547
   60   HG22  THR   6          HG22      THR   6  -4.805   0.497   1.256
   61   HG23  THR   6          HG23      THR   6  -5.026   2.248   1.240
   62    H    ALA   7           H        ALA   7  -2.199  -0.172  -1.424
   63    HA   ALA   7           HA       ALA   7  -2.513  -2.958  -1.241
   64    HB1  ALA   7           HB1      ALA   7  -4.755  -2.321  -0.406
   65    HB2  ALA   7           HB2      ALA   7  -4.855  -3.093  -1.983
   66    HB3  ALA   7           HB3      ALA   7  -5.010  -1.339  -1.854
   67    H    ARG   8           H        ARG   8  -4.257  -2.871  -3.646
   68    HA   ARG   8           HA       ARG   8  -4.268  -2.682  -5.769
   69    HE   ARG   8           HE       ARG   8  -2.655   0.404  -9.592
   70    HB2  ARG   8           HB2      ARG   8  -4.395  -0.280  -5.499
   71    HB3  ARG   8           HB1      ARG   8  -2.642  -0.164  -5.415
   72    HG2  ARG   8           HG2      ARG   8  -2.442  -0.926  -7.666
   73    HG3  ARG   8           HG1      ARG   8  -4.177  -1.163  -7.795
   74    HD2  ARG   8           HD2      ARG   8  -4.574   1.218  -7.568
   75    HD3  ARG   8           HD1      ARG   8  -2.853   1.512  -7.295
   76   HH11  ARG   8          HH11      ARG   8  -5.266   2.672  -8.718
   77   HH12  ARG   8          HH12      ARG   8  -5.474   3.217 -10.316
   78   HH21  ARG   8          HH21      ARG   8  -2.981   1.202 -11.766
   79   HH22  ARG   8          HH22      ARG   8  -4.170   2.359 -12.085
   80    H    LYS   9           H        LYS   9  -3.348  -4.590  -5.976
   81    HA   LYS   9           HA       LYS   9  -0.961  -4.358  -7.575
   82    HB2  LYS   9           HB2      LYS   9  -0.285  -5.542  -5.510
   83    HB3  LYS   9           HB1      LYS   9  -1.611  -6.676  -5.706
   84    HG2  LYS   9           HG2      LYS   9   0.536  -7.661  -6.369
   85    HG3  LYS   9           HG1      LYS   9  -0.585  -7.569  -7.728
   86    HD2  LYS   9           HD2      LYS   9   0.555  -5.490  -8.470
   87    HD3  LYS   9           HD1      LYS   9   1.711  -5.687  -7.154
   88    HE2  LYS   9           HE2      LYS   9   1.251  -7.693  -9.359
   89    HE3  LYS   9           HE1      LYS   9   2.546  -6.500  -9.341
   90    HZ1  LYS   9           HZ1      LYS   9   2.184  -8.629  -7.290
   91    HZ2  LYS   9           HZ2      LYS   9   3.460  -7.516  -7.411
   92    HZ3  LYS   9           HZ3      LYS   9   3.256  -8.674  -8.595
   93    H    SER  10           H        SER  10  -2.363  -4.038  -9.243
   94    HA   SER  10           HA       SER  10  -4.330  -6.087  -9.791
   95    HG   SER  10           HG       SER  10  -5.038  -4.090  -8.828
   96    HB2  SER  10           HB2      SER  10  -3.831  -3.480 -11.213
   97    HB3  SER  10           HB1      SER  10  -5.264  -4.502 -11.339
   98    H    THR  11           H        THR  11  -3.092  -7.742 -10.510
   99    HA   THR  11           HA       THR  11  -1.177  -7.294 -12.622
  100    HB   THR  11           HB       THR  11  -2.002  -9.948 -11.406
  101    HG1  THR  11           HG1      THR  11  -1.144  -9.197  -9.629
  102   HG21  THR  11          HG21      THR  11  -0.618 -10.018 -13.463
  103   HG22  THR  11          HG22      THR  11   0.262 -10.626 -12.061
  104   HG23  THR  11          HG23      THR  11   0.585  -9.003 -12.670
  105    H    GLY  12           H        GLY  12  -2.783  -6.554 -14.144
  106    HA2  GLY  12           HA2      GLY  12  -4.329  -8.773 -15.327
  107    HA3  GLY  12           HA1      GLY  12  -4.914  -7.116 -15.289
  108    H    GLY  13           H        GLY  13  -2.499  -5.798 -15.975
  109    HA2  GLY  13           HA2      GLY  13  -1.025  -6.725 -18.011
  110    HA3  GLY  13           HA1      GLY  13  -2.528  -6.174 -18.759
  111    H1   GLY 850           HT1      GLY 850   0.969  28.524 -14.469
  112    H2   GLY 850           HT2      GLY 850   1.420  26.911 -14.366
  113    H3   GLY 850           HT3      GLY 850   1.632  27.749 -15.816
  114    HA2  GLY 850           HA1      GLY 850   3.719  27.488 -14.662
  115    HA3  GLY 850           HA2      GLY 850   3.247  29.181 -14.743
  116    H    SER 851           H        SER 851   3.822  26.459 -12.751
  117    HA   SER 851           HA       SER 851   4.109  26.101 -10.597
  118    HG   SER 851           HG       SER 851   4.566  28.689  -8.190
  119    HB2  SER 851           HB2      SER 851   5.326  28.315 -10.560
  120    HB3  SER 851           HB1      SER 851   3.805  29.085 -10.125
  121    H    HIS 852           H        HIS 852   2.904  25.665  -8.750
  122    HA   HIS 852           HA       HIS 852   0.050  26.121  -9.206
  123    HD2  HIS 852           HD2      HIS 852   2.814  22.978  -9.524
  124    HE1  HIS 852           HE1      HIS 852  -0.596  21.707 -11.658
  125    HE2  HIS 852           HE2      HIS 852   1.903  21.977 -11.698
  126    HB2  HIS 852           HB2      HIS 852   1.339  24.049  -7.393
  127    HB3  HIS 852           HB1      HIS 852  -0.376  24.236  -7.690
  128    H    MET 853           H        MET 853   2.323  25.941  -6.502
  129    HA   MET 853           HA       MET 853   2.282  26.768  -4.409
  130    HB2  MET 853           HB2      MET 853   2.914  28.828  -5.676
  131    HB3  MET 853           HB1      MET 853   1.211  29.268  -5.739
  132    HG2  MET 853           HG2      MET 853   1.169  29.342  -3.268
  133    HG3  MET 853           HG1      MET 853   2.892  28.996  -3.247
  134    HE1  MET 853           HE1      MET 853   0.999  32.879  -4.879
  135    HE2  MET 853           HE2      MET 853   0.088  31.563  -4.142
  136    HE3  MET 853           HE3      MET 853   0.852  31.336  -5.717
  137    H    ALA 854           H        ALA 854   0.682  25.319  -3.820
  138    HA   ALA 854           HA       ALA 854  -1.981  26.516  -3.430
  139    HB1  ALA 854           HB1      ALA 854  -1.947  24.564  -4.981
  140    HB2  ALA 854           HB2      ALA 854  -2.936  24.335  -3.529
  141    HB3  ALA 854           HB3      ALA 854  -1.345  23.598  -3.620
  142    H    MET 855           H        MET 855  -0.122  24.012  -2.236
  143    HA   MET 855           HA       MET 855  -0.136  24.611   0.520
  144    HB2  MET 855           HB2      MET 855  -1.902  22.969   1.224
  145    HB3  MET 855           HB1      MET 855  -2.572  24.299   0.300
  146    HG2  MET 855           HG2      MET 855  -2.523  22.829  -1.727
  147    HG3  MET 855           HG1      MET 855  -2.038  21.503  -0.685
  148    HE1  MET 855           HE1      MET 855  -5.206  20.978   1.546
  149    HE2  MET 855           HE2      MET 855  -3.803  21.964   1.938
  150    HE3  MET 855           HE3      MET 855  -3.584  20.400   1.147
  151    H    ALA 856           H        ALA 856  -0.419  21.826   1.295
  152    HA   ALA 856           HA       ALA 856   2.110  20.830   0.385
  153    HB1  ALA 856           HB1      ALA 856   0.060  19.541   2.200
  154    HB2  ALA 856           HB2      ALA 856   1.374  20.575   2.738
  155    HB3  ALA 856           HB3      ALA 856   1.733  19.020   1.983
  156    H    TYR 857           H        TYR 857   2.022  18.328  -0.130
  157    HA   TYR 857           HA       TYR 857   0.275  18.134  -2.421
  158    HD1  TYR 857           HD1      TYR 857   1.425  17.751  -4.803
  159    HD2  TYR 857           HD2      TYR 857   4.420  17.775  -1.795
  160    HE1  TYR 857           HE1      TYR 857   2.845  19.089  -6.260
  161    HE2  TYR 857           HE2      TYR 857   5.869  19.133  -3.240
  162    HH   TYR 857           HH       TYR 857   6.158  19.662  -5.596
  163    HB2  TYR 857           HB2      TYR 857   2.543  16.386  -1.517
  164    HB3  TYR 857           HB1      TYR 857   1.470  16.048  -2.877
  165    H    VAL 858           H        VAL 858  -1.287  18.119  -0.609
  166    HA   VAL 858           HA       VAL 858  -2.377  15.405  -0.362
  167    HB   VAL 858           HB       VAL 858  -2.567  17.430   1.905
  168   HG11  VAL 858          HG11      VAL 858  -4.494  15.969   1.786
  169   HG12  VAL 858          HG12      VAL 858  -3.536  15.577   3.214
  170   HG13  VAL 858          HG13      VAL 858  -3.457  14.546   1.794
  171   HG21  VAL 858          HG21      VAL 858  -0.288  16.584   1.845
  172   HG22  VAL 858          HG22      VAL 858  -0.893  14.924   1.805
  173   HG23  VAL 858          HG23      VAL 858  -1.152  15.923   3.235
  174    H    ILE 859           H        ILE 859  -4.415  15.370  -1.001
  175    HA   ILE 859           HA       ILE 859  -6.117  17.734  -0.752
  176    HB   ILE 859           HB       ILE 859  -7.216  17.222  -2.909
  177   HG12  ILE 859          HG12      ILE 859  -4.997  15.211  -3.380
  178   HG13  ILE 859          HG11      ILE 859  -6.668  14.822  -2.972
  179   HG21  ILE 859          HG21      ILE 859  -5.500  18.905  -2.964
  180   HG22  ILE 859          HG22      ILE 859  -5.512  17.991  -4.474
  181   HG23  ILE 859          HG23      ILE 859  -4.271  17.673  -3.262
  182   HD11  ILE 859          HD11      ILE 859  -5.761  16.248  -5.458
  183   HD12  ILE 859          HD12      ILE 859  -7.423  15.801  -5.061
  184   HD13  ILE 859          HD13      ILE 859  -6.217  14.546  -5.353
  185    H    ARG 860           H        ARG 860  -8.473  16.870  -0.985
  186    HA   ARG 860           HA       ARG 860  -8.423  14.111  -0.019
  187    HE   ARG 860           HE       ARG 860 -13.334  17.665   0.192
  188    HB2  ARG 860           HB2      ARG 860 -10.476  14.424   1.143
  189    HB3  ARG 860           HB1      ARG 860  -9.522  15.843   1.536
  190    HG2  ARG 860           HG2      ARG 860 -10.782  17.193   0.060
  191    HG3  ARG 860           HG1      ARG 860 -11.601  15.790  -0.629
  192    HD2  ARG 860           HD2      ARG 860 -12.467  15.332   1.712
  193    HD3  ARG 860           HD1      ARG 860 -11.907  16.950   2.132
  194   HH11  ARG 860          HH11      ARG 860 -14.151  14.993   2.408
  195   HH12  ARG 860          HH12      ARG 860 -15.796  14.953   2.040
  196   HH21  ARG 860          HH21      ARG 860 -15.666  17.649  -0.322
  197   HH22  ARG 860          HH22      ARG 860 -16.696  16.538   0.440
  198    H    ASP 861           H        ASP 861  -9.929  12.685  -0.998
  199    HA   ASP 861           HA       ASP 861 -10.624  13.545  -3.698
  200    HB2  ASP 861           HB2      ASP 861 -10.921  11.216  -4.200
  201    HB3  ASP 861           HB1      ASP 861  -9.434  11.350  -3.269
  202    H    GLU 862           H        GLU 862 -12.753  12.027  -4.245
  203    HA   GLU 862           HA       GLU 862 -14.866  13.532  -3.166
  204    HB2  GLU 862           HB2      GLU 862 -16.297  12.057  -4.553
  205    HB3  GLU 862           HB1      GLU 862 -14.969  12.797  -5.432
  206    HG2  GLU 862           HG2      GLU 862 -13.704  10.683  -5.213
  207    HG3  GLU 862           HG1      GLU 862 -15.117   9.963  -4.442
  208    H    TRP 863           H        TRP 863 -13.528  10.378  -2.265
  209    HA   TRP 863           HA       TRP 863 -15.868   9.687  -0.769
  210    HD1  TRP 863           HD       TRP 863 -16.709   7.983  -2.148
  211    HE1  TRP 863           HE1      TRP 863 -16.633   6.763  -4.457
  212    HE3  TRP 863           HE3      TRP 863 -11.764   7.262  -2.419
  213    HZ2  TRP 863           HZ2      TRP 863 -14.649   5.654  -6.139
  214    HZ3  TRP 863           HZ3      TRP 863 -10.789   6.114  -4.384
  215    HH2  TRP 863           HH       TRP 863 -12.211   5.338  -6.201
  216    HB2  TRP 863           HB2      TRP 863 -13.162   8.381  -0.902
  217    HB3  TRP 863           HB1      TRP 863 -14.585   7.697  -0.114
  218    H    GLY 864           H        GLY 864 -12.843  11.206  -0.296
  219    HA2  GLY 864           HA2      GLY 864 -12.691  12.816   1.506
  220    HA3  GLY 864           HA1      GLY 864 -13.665  11.732   2.483
  221    H    ASN 865           H        ASN 865 -10.895  10.762   0.523
  222    HA   ASN 865           HA       ASN 865  -9.523   9.966   2.987
  223    HB2  ASN 865           HB2      ASN 865  -8.852   9.237   0.121
  224    HB3  ASN 865           HB1      ASN 865  -8.192   8.512   1.576
  225   HD21  ASN 865          HD21      ASN 865 -10.834   8.651  -0.602
  226   HD22  ASN 865          HD22      ASN 865 -11.683   7.256  -0.020
  227    H    GLN 866           H        GLN 866  -7.228  10.500   3.123
  228    HA   GLN 866           HA       GLN 866  -6.607  12.985   1.807
  229    HB2  GLN 866           HB2      GLN 866  -5.109  11.357   3.856
  230    HB3  GLN 866           HB1      GLN 866  -4.356  12.694   3.006
  231    HG2  GLN 866           HG2      GLN 866  -6.025  14.208   3.849
  232    HG3  GLN 866           HG1      GLN 866  -6.829  12.887   4.700
  233   HE21  GLN 866          HE21      GLN 866  -3.346  13.226   4.467
  234   HE22  GLN 866          HE22      GLN 866  -3.088  13.610   6.124
  235    H    ILE 867           H        ILE 867  -5.923  13.015  -0.089
  236    HA   ILE 867           HA       ILE 867  -4.513  10.701  -1.158
  237    HB   ILE 867           HB       ILE 867  -5.763  13.051  -2.574
  238   HG12  ILE 867          HG12      ILE 867  -7.530  11.713  -1.562
  239   HG13  ILE 867          HG11      ILE 867  -7.502  11.501  -3.310
  240   HG21  ILE 867          HG21      ILE 867  -5.481  11.735  -4.608
  241   HG22  ILE 867          HG22      ILE 867  -4.659  10.484  -3.671
  242   HG23  ILE 867          HG23      ILE 867  -3.941  12.089  -3.819
  243   HD11  ILE 867          HD11      ILE 867  -7.936   9.401  -2.163
  244   HD12  ILE 867          HD12      ILE 867  -6.409   9.554  -1.291
  245   HD13  ILE 867          HD13      ILE 867  -6.407   9.346  -3.043
  246    H    TRP 868           H        TRP 868  -2.408  10.932  -1.213
  247    HA   TRP 868           HA       TRP 868  -1.237  13.556  -1.138
  248    HD1  TRP 868           HD       TRP 868   1.686  13.640   0.607
  249    HE1  TRP 868           HE1      TRP 868   1.335  13.611   3.153
  250    HE3  TRP 868           HE3      TRP 868  -2.028  10.144   0.862
  251    HZ2  TRP 868           HZ2      TRP 868  -0.317  12.275   5.032
  252    HZ3  TRP 868           HZ3      TRP 868  -2.943   9.552   3.068
  253    HH2  TRP 868           HH       TRP 868  -2.105  10.600   5.104
  254    HB2  TRP 868           HB2      TRP 868  -0.104  10.781  -0.984
  255    HB3  TRP 868           HB1      TRP 868   0.943  12.149  -1.345
  256    H    ILE 869           H        ILE 869   0.153  14.307  -2.689
  257    HA   ILE 869           HA       ILE 869  -0.387  13.277  -5.394
  258    HB   ILE 869           HB       ILE 869   0.354  16.093  -4.531
  259   HG12  ILE 869          HG12      ILE 869  -1.949  15.585  -3.848
  260   HG13  ILE 869          HG11      ILE 869  -1.927  16.771  -5.142
  261   HG21  ILE 869          HG21      ILE 869  -0.142  16.759  -6.837
  262   HG22  ILE 869          HG22      ILE 869  -0.403  15.064  -7.253
  263   HG23  ILE 869          HG23      ILE 869   1.192  15.610  -6.735
  264   HD11  ILE 869          HD11      ILE 869  -2.586  13.843  -5.395
  265   HD12  ILE 869          HD12      ILE 869  -2.508  14.967  -6.742
  266   HD13  ILE 869          HD13      ILE 869  -3.719  15.185  -5.483
  267    H    CYS 870           H        CYS 870   1.392  12.564  -6.487
  268    HA   CYS 870           HA       CYS 870   3.931  12.490  -5.226
  269    HB2  CYS 870           HB2      CYS 870   3.179  10.730  -6.754
  270    HB3  CYS 870           HB1      CYS 870   3.052  11.889  -8.059
  271    HA   PRO 871           HA       PRO 871   5.031  16.590  -6.755
  272    HB2  PRO 871           HB2      PRO 871   7.709  15.918  -5.714
  273    HB3  PRO 871           HB1      PRO 871   6.648  17.259  -5.272
  274    HG2  PRO 871           HG2      PRO 871   7.073  15.200  -3.599
  275    HG3  PRO 871           HG1      PRO 871   5.501  16.014  -3.707
  276    HD2  PRO 871           HD2      PRO 871   6.371  13.411  -4.901
  277    HD3  PRO 871           HD1      PRO 871   4.840  13.846  -4.104
  278    H    GLY 872           H        GLY 872   6.139  13.545  -7.689
  279    HA2  GLY 872           HA2      GLY 872   8.191  14.400  -9.498
  280    HA3  GLY 872           HA1      GLY 872   7.479  12.796  -9.393
  281    H    CYS 873           H        CYS 873   4.874  13.086  -9.970
  282    HA   CYS 873           HA       CYS 873   4.999  13.981 -12.761
  283    HB2  CYS 873           HB2      CYS 873   3.065  12.394 -12.891
  284    HB3  CYS 873           HB1      CYS 873   4.623  11.669 -12.458
  285    H    ASN 874           H        ASN 874   3.516  14.540  -9.719
  286    HA   ASN 874           HA       ASN 874   2.033  15.920  -8.887
  287    HB2  ASN 874           HB2      ASN 874   2.733  17.607 -10.664
  288    HB3  ASN 874           HB1      ASN 874   1.463  16.974 -11.696
  289   HD21  ASN 874          HD21      ASN 874  -0.619  17.666 -11.355
  290   HD22  ASN 874          HD22      ASN 874  -1.075  18.866 -10.194
  291    H    LYS 875           H        LYS 875   1.594  13.212 -10.081
  292    HA   LYS 875           HA       LYS 875  -1.289  13.280 -10.356
  293    HB2  LYS 875           HB2      LYS 875   0.713  11.061 -10.773
  294    HB3  LYS 875           HB1      LYS 875  -1.024  10.847 -10.916
  295    HG2  LYS 875           HG2      LYS 875  -1.044  12.512 -12.730
  296    HG3  LYS 875           HG1      LYS 875   0.715  12.622 -12.612
  297    HD2  LYS 875           HD2      LYS 875   0.917  10.284 -13.097
  298    HD3  LYS 875           HD1      LYS 875  -0.839  10.109 -13.201
  299    HE2  LYS 875           HE2      LYS 875  -0.792  11.791 -15.066
  300    HE3  LYS 875           HE1      LYS 875   0.966  11.715 -15.012
  301    HZ1  LYS 875           HZ1      LYS 875  -0.854   9.440 -15.581
  302    HZ2  LYS 875           HZ2      LYS 875   0.830   9.341 -15.515
  303    HZ3  LYS 875           HZ3      LYS 875   0.103  10.249 -16.712
  304    HA   PRO 876           HA       PRO 876  -1.891  12.135  -6.194
  305    HB2  PRO 876           HB2      PRO 876  -4.313  11.080  -6.288
  306    HB3  PRO 876           HB1      PRO 876  -4.036  12.782  -6.694
  307    HG2  PRO 876           HG2      PRO 876  -4.332  10.428  -8.498
  308    HG3  PRO 876           HG1      PRO 876  -5.125  12.024  -8.587
  309    HD2  PRO 876           HD2      PRO 876  -2.914  11.406 -10.074
  310    HD3  PRO 876           HD1      PRO 876  -3.259  13.040  -9.471
  311    H    ASP 877           H        ASP 877  -2.207  10.599  -4.732
  312    HA   ASP 877           HA       ASP 877  -1.168   7.982  -5.115
  313    HB2  ASP 877           HB2      ASP 877  -0.725   8.938  -3.017
  314    HB3  ASP 877           HB1      ASP 877  -2.381   9.485  -2.811
  315    H    ASP 878           H        ASP 878  -2.213   6.046  -5.100
  316    HA   ASP 878           HA       ASP 878  -5.153   6.094  -5.061
  317    HB2  ASP 878           HB2      ASP 878  -4.068   5.912  -7.400
  318    HB3  ASP 878           HB1      ASP 878  -3.590   4.290  -6.903
  319    H    GLY 879           H        GLY 879  -2.848   5.361  -3.175
  320    HA2  GLY 879           HA2      GLY 879  -2.827   3.897  -1.409
  321    HA3  GLY 879           HA1      GLY 879  -3.978   2.859  -2.256
  322    H    SER 880           H        SER 880  -1.195   4.134  -3.748
  323    HA   SER 880           HA       SER 880  -0.377   1.438  -4.506
  324    HG   SER 880           HG       SER 880  -1.832   2.874  -5.730
  325    HB2  SER 880           HB2      SER 880   0.509   4.130  -5.553
  326    HB3  SER 880           HB1      SER 880   0.727   2.558  -6.331
  327    HA   PRO 881           HA       PRO 881   3.522   1.642  -2.233
  328    HB2  PRO 881           HB2      PRO 881   5.077   1.152  -4.690
  329    HB3  PRO 881           HB1      PRO 881   4.976   0.175  -3.227
  330    HG2  PRO 881           HG2      PRO 881   3.875  -0.587  -5.542
  331    HG3  PRO 881           HG1      PRO 881   3.165  -0.995  -3.977
  332    HD2  PRO 881           HD2      PRO 881   2.303   1.069  -5.953
  333    HD3  PRO 881           HD1      PRO 881   1.324   0.070  -4.865
  334    H    MET 882           H        MET 882   4.264   3.539  -1.633
  335    HA   MET 882           HA       MET 882   5.428   5.345  -3.648
  336    HB2  MET 882           HB2      MET 882   3.795   6.299  -1.278
  337    HB3  MET 882           HB1      MET 882   4.516   7.294  -2.529
  338    HG2  MET 882           HG2      MET 882   3.004   6.176  -4.175
  339    HG3  MET 882           HG1      MET 882   2.266   5.364  -2.790
  340    HE1  MET 882           HE1      MET 882   2.699   8.755  -4.732
  341    HE2  MET 882           HE2      MET 882   3.549   9.076  -3.223
  342    HE3  MET 882           HE3      MET 882   2.037   9.913  -3.572
  343    H    ILE 883           H        ILE 883   6.926   6.930  -2.610
  344    HA   ILE 883           HA       ILE 883   8.029   5.821  -0.162
  345    HB   ILE 883           HB       ILE 883   9.427   5.027  -2.053
  346   HG12  ILE 883          HG12      ILE 883  10.937   7.100  -0.467
  347   HG13  ILE 883          HG11      ILE 883  10.402   5.562   0.211
  348   HG21  ILE 883          HG21      ILE 883   9.058   6.866  -3.628
  349   HG22  ILE 883          HG22      ILE 883  10.789   6.634  -3.341
  350   HG23  ILE 883          HG23      ILE 883   9.940   7.961  -2.561
  351   HD11  ILE 883          HD11      ILE 883  11.769   4.382  -1.433
  352   HD12  ILE 883          HD12      ILE 883  12.739   5.503  -0.474
  353   HD13  ILE 883          HD13      ILE 883  12.272   5.927  -2.115
  354    H    GLY 884           H        GLY 884   8.507   7.175   1.321
  355    HA2  GLY 884           HA2      GLY 884   7.947  10.006   0.958
  356    HA3  GLY 884           HA1      GLY 884   8.156   9.126   2.449
  357    H    CYS 885           H        CYS 885   9.615  11.292   0.545
  358    HA   CYS 885           HA       CYS 885  12.376  10.677   0.717
  359    HB2  CYS 885           HB2      CYS 885  11.503  12.422  -0.741
  360    HB3  CYS 885           HB1      CYS 885  10.862  13.297   0.632
  361    H    ASP 886           H        ASP 886  13.794  10.885   2.380
  362    HA   ASP 886           HA       ASP 886  12.763  11.192   5.000
  363    HB2  ASP 886           HB2      ASP 886  15.538  10.934   3.910
  364    HB3  ASP 886           HB1      ASP 886  15.252  11.196   5.629
  365    H    ASP 887           H        ASP 887  13.620  13.442   2.684
  366    HA   ASP 887           HA       ASP 887  14.159  15.438   4.773
  367    HB2  ASP 887           HB2      ASP 887  15.843  15.364   2.978
  368    HB3  ASP 887           HB1      ASP 887  14.582  15.737   1.803
  369    H    CYS 888           H        CYS 888  12.472  15.225   1.670
  370    HA   CYS 888           HA       CYS 888  10.753  17.461   2.165
  371    HB2  CYS 888           HB2      CYS 888  10.166  15.092   0.362
  372    HB3  CYS 888           HB1      CYS 888   9.290  16.605   0.380
  373    H    ASP 889           H        ASP 889  10.484  14.067   2.935
  374    HA   ASP 889           HA       ASP 889   9.093  12.808   4.120
  375    HB2  ASP 889           HB2      ASP 889   9.436  14.596   5.874
  376    HB3  ASP 889           HB1      ASP 889   8.002  15.407   5.263
  377    H    ASP 890           H        ASP 890   8.412  14.090   1.538
  378    HA   ASP 890           HA       ASP 890   5.492  13.964   1.642
  379    HB2  ASP 890           HB2      ASP 890   7.005  15.923   0.542
  380    HB3  ASP 890           HB1      ASP 890   6.834  14.851  -0.844
  381    H    TRP 891           H        TRP 891   4.682  13.113  -0.627
  382    HA   TRP 891           HA       TRP 891   5.963  10.477  -0.715
  383    HD1  TRP 891           HD       TRP 891   2.898  11.796   1.707
  384    HE1  TRP 891           HE1      TRP 891   3.408  10.524   3.884
  385    HE3  TRP 891           HE3      TRP 891   5.218   7.753  -0.247
  386    HZ2  TRP 891           HZ2      TRP 891   4.613   8.150   4.667
  387    HZ3  TRP 891           HZ3      TRP 891   6.033   6.020   1.236
  388    HH2  TRP 891           HH       TRP 891   5.769   6.219   3.695
  389    HB2  TRP 891           HB2      TRP 891   3.036  11.141  -0.828
  390    HB3  TRP 891           HB1      TRP 891   3.691   9.546  -1.213
  391    H    TYR 892           H        TYR 892   6.995  10.107  -2.446
  392    HA   TYR 892           HA       TYR 892   6.018  11.057  -5.051
  393    HD1  TYR 892           HD1      TYR 892   9.156  11.564  -2.529
  394    HD2  TYR 892           HD2      TYR 892   8.428  12.466  -6.619
  395    HE1  TYR 892           HE1      TYR 892  10.324  13.716  -2.261
  396    HE2  TYR 892           HE2      TYR 892   9.582  14.624  -6.361
  397    HH   TYR 892           HH       TYR 892  11.587  15.268  -3.847
  398    HB2  TYR 892           HB2      TYR 892   8.627   9.805  -4.180
  399    HB3  TYR 892           HB1      TYR 892   8.225  10.211  -5.830
  400    H    HIS 893           H        HIS 893   5.733   9.497  -6.704
  401    HA   HIS 893           HA       HIS 893   5.167   6.795  -5.778
  402    HD2  HIS 893           HD2      HIS 893   2.339   6.273  -6.219
  403    HE1  HIS 893           HE1      HIS 893   0.762   9.683  -8.173
  404    HE2  HIS 893           HE2      HIS 893   0.194   7.638  -6.866
  405    HB2  HIS 893           HB2      HIS 893   5.036   7.903  -8.601
  406    HB3  HIS 893           HB1      HIS 893   4.612   6.263  -8.162
  407    H    TRP 894           H        TRP 894   6.075   4.925  -6.850
  408    HA   TRP 894           HA       TRP 894   8.857   4.996  -6.690
  409    HD1  TRP 894           HD       TRP 894   7.941   4.776  -4.650
  410    HE1  TRP 894           HE1      TRP 894   7.915   3.417  -2.462
  411    HE3  TRP 894           HE3      TRP 894   7.774   0.077  -6.625
  412    HZ2  TRP 894           HZ2      TRP 894   7.825   0.722  -1.694
  413    HZ3  TRP 894           HZ3      TRP 894   7.717  -1.840  -5.103
  414    HH2  TRP 894           HH       TRP 894   7.745  -1.528  -2.681
  415    HB2  TRP 894           HB2      TRP 894   6.933   2.833  -7.457
  416    HB3  TRP 894           HB1      TRP 894   8.670   2.577  -7.510
  417    HA   PRO 895           HA       PRO 895   9.022   4.168 -11.481
  418    HB2  PRO 895           HB2      PRO 895   6.887   5.091 -12.944
  419    HB3  PRO 895           HB1      PRO 895   7.059   3.412 -12.418
  420    HG2  PRO 895           HG2      PRO 895   5.501   5.642 -11.164
  421    HG3  PRO 895           HG1      PRO 895   5.004   3.966 -11.447
  422    HD2  PRO 895           HD2      PRO 895   5.803   4.754  -9.036
  423    HD3  PRO 895           HD1      PRO 895   6.268   3.160  -9.664
  424    H    CYS 896           H        CYS 896   7.671   6.909  -9.951
  425    HA   CYS 896           HA       CYS 896   8.346   8.818 -11.955
  426    HB2  CYS 896           HB2      CYS 896   7.538   9.159  -9.086
  427    HB3  CYS 896           HB1      CYS 896   7.454  10.390 -10.359
  428    H    VAL 897           H        VAL 897   9.712   7.687  -8.904
  429    HA   VAL 897           HA       VAL 897  11.881   9.604  -9.271
  430    HB   VAL 897           HB       VAL 897  12.601   9.048  -6.987
  431   HG11  VAL 897          HG11      VAL 897   9.772   9.960  -7.393
  432   HG12  VAL 897          HG12      VAL 897  11.220  10.972  -7.320
  433   HG13  VAL 897          HG13      VAL 897  10.634  10.143  -5.878
  434   HG21  VAL 897          HG21      VAL 897  11.690   6.778  -6.848
  435   HG22  VAL 897          HG22      VAL 897  10.048   7.424  -6.863
  436   HG23  VAL 897          HG23      VAL 897  11.131   7.772  -5.511
  437    H    GLY 898           H        GLY 898  11.296   6.237  -9.482
  438    HA2  GLY 898           HA2      GLY 898  12.911   4.969 -10.774
  439    HA3  GLY 898           HA1      GLY 898  14.174   5.915 -10.000
  440    H    ILE 899           H        ILE 899  11.487   4.686  -8.202
  441    HA   ILE 899           HA       ILE 899  13.320   2.863  -6.822
  442    HB   ILE 899           HB       ILE 899  10.679   4.099  -5.985
  443   HG12  ILE 899          HG12      ILE 899  12.705   5.499  -5.727
  444   HG13  ILE 899          HG11      ILE 899  11.911   5.139  -4.199
  445   HG21  ILE 899          HG21      ILE 899  12.264   2.009  -4.468
  446   HG22  ILE 899          HG22      ILE 899  10.675   1.782  -5.195
  447   HG23  ILE 899          HG23      ILE 899  10.870   2.891  -3.844
  448   HD11  ILE 899          HD11      ILE 899  13.593   3.459  -3.733
  449   HD12  ILE 899          HD12      ILE 899  14.294   5.056  -4.012
  450   HD13  ILE 899          HD13      ILE 899  14.384   3.819  -5.276
  451    H    MET 900           H        MET 900  13.067   0.724  -7.102
  452    HA   MET 900           HA       MET 900  10.637  -0.194  -8.469
  453    HB2  MET 900           HB2      MET 900  13.397  -1.405  -8.403
  454    HB3  MET 900           HB1      MET 900  12.013  -2.114  -9.214
  455    HG2  MET 900           HG2      MET 900  13.246   0.550  -9.854
  456    HG3  MET 900           HG1      MET 900  13.504  -0.936 -10.756
  457    HE1  MET 900           HE1      MET 900  10.575  -2.231 -10.767
  458    HE2  MET 900           HE2      MET 900  11.606  -2.129 -12.194
  459    HE3  MET 900           HE3      MET 900   9.933  -1.574 -12.271
  460    H    ALA 901           H        ALA 901  12.613  -0.549  -5.653
  461    HA   ALA 901           HA       ALA 901  10.649  -2.385  -4.562
  462    HB1  ALA 901           HB1      ALA 901  12.518  -3.786  -5.289
  463    HB2  ALA 901           HB2      ALA 901  12.405  -3.738  -3.529
  464    HB3  ALA 901           HB3      ALA 901  13.640  -2.787  -4.360
  465    H    ALA 902           H        ALA 902  10.444  -2.204  -2.348
  466    HA   ALA 902           HA       ALA 902  10.818   0.437  -1.374
  467    HB1  ALA 902           HB1      ALA 902   8.821  -0.893  -0.893
  468    HB2  ALA 902           HB2      ALA 902   9.617  -0.344   0.581
  469    HB3  ALA 902           HB3      ALA 902   9.800  -2.011   0.054
  470    HA   PRO 903           HA       PRO 903  14.545  -0.752   0.830
  471    HB2  PRO 903           HB2      PRO 903  15.507   1.772   1.226
  472    HB3  PRO 903           HB1      PRO 903  15.781   0.857  -0.255
  473    HG2  PRO 903           HG2      PRO 903  14.029   3.142   0.250
  474    HG3  PRO 903           HG1      PRO 903  14.699   2.576  -1.288
  475    HD2  PRO 903           HD2      PRO 903  12.081   2.199  -0.271
  476    HD3  PRO 903           HD1      PRO 903  12.754   1.530  -1.761
  477    HA   PRO 904           HA       PRO 904  12.868  -0.114   4.809
  478    HB2  PRO 904           HB2      PRO 904  15.199  -0.122   6.338
  479    HB3  PRO 904           HB1      PRO 904  14.301  -1.553   5.851
  480    HG2  PRO 904           HG2      PRO 904  16.832  -0.508   4.840
  481    HG3  PRO 904           HG1      PRO 904  16.144  -2.126   4.694
  482    HD2  PRO 904           HD2      PRO 904  16.267  -0.171   2.662
  483    HD3  PRO 904           HD1      PRO 904  15.342  -1.678   2.625
  484    H    GLU 905           H        GLU 905  12.641   1.388   6.478
  485    HA   GLU 905           HA       GLU 905  12.880   4.057   5.815
  486    HB2  GLU 905           HB2      GLU 905  12.362   4.536   8.210
  487    HB3  GLU 905           HB1      GLU 905  11.296   3.339   7.487
  488    HG2  GLU 905           HG2      GLU 905  12.533   1.550   8.577
  489    HG3  GLU 905           HG1      GLU 905  13.651   2.723   9.259
  490    H    GLU 906           H        GLU 906  14.997   2.097   7.758
  491    HA   GLU 906           HA       GLU 906  16.720   4.184   8.588
  492    HB2  GLU 906           HB2      GLU 906  18.097   2.302   9.488
  493    HB3  GLU 906           HB1      GLU 906  16.433   2.349  10.048
  494    HG2  GLU 906           HG2      GLU 906  15.874   0.614   8.359
  495    HG3  GLU 906           HG1      GLU 906  17.587   0.507   7.965
  496    H    MET 907           H        MET 907  16.582   2.418   5.676
  497    HA   MET 907           HA       MET 907  19.395   2.595   5.099
  498    HB2  MET 907           HB2      MET 907  18.156   0.821   4.000
  499    HB3  MET 907           HB1      MET 907  17.019   1.982   3.334
  500    HG2  MET 907           HG2      MET 907  18.788   2.901   1.948
  501    HG3  MET 907           HG1      MET 907  19.924   1.711   2.585
  502    HE1  MET 907           HE1      MET 907  20.472   1.063   0.039
  503    HE2  MET 907           HE2      MET 907  19.260   2.194  -0.563
  504    HE3  MET 907           HE3      MET 907  19.261   0.521  -1.120
  505    H    GLN 908           H        GLN 908  16.870   4.326   4.922
  506    HA   GLN 908           HA       GLN 908  16.123   6.352   4.258
  507    HB2  GLN 908           HB2      GLN 908  19.015   7.026   4.536
  508    HB3  GLN 908           HB1      GLN 908  17.702   8.193   4.344
  509    HG2  GLN 908           HG2      GLN 908  16.639   7.280   6.378
  510    HG3  GLN 908           HG1      GLN 908  18.048   6.251   6.609
  511   HE21  GLN 908          HE21      GLN 908  16.811   9.440   6.694
  512   HE22  GLN 908          HE22      GLN 908  18.114  10.168   7.561
  513    H    TRP 909           H        TRP 909  16.121   8.109   2.720
  514    HA   TRP 909           HA       TRP 909  17.368   7.790   0.208
  515    HD1  TRP 909           HD       TRP 909  16.758   5.957  -2.419
  516    HE1  TRP 909           HE1      TRP 909  15.746   6.900  -4.616
  517    HE3  TRP 909           HE3      TRP 909  13.092   8.868  -0.432
  518    HZ2  TRP 909           HZ2      TRP 909  13.670   8.615  -5.361
  519    HZ3  TRP 909           HZ3      TRP 909  11.646  10.145  -1.922
  520    HH2  TRP 909           HH       TRP 909  11.921  10.034  -4.341
  521    HB2  TRP 909           HB2      TRP 909  15.825   5.874   0.054
  522    HB3  TRP 909           HB1      TRP 909  14.479   6.927   0.457
  523    H    PHE 910           H        PHE 910  17.074   9.579  -0.941
  524    HA   PHE 910           HA       PHE 910  15.127  11.540  -0.060
  525    HD1  PHE 910           HD2      PHE 910  19.047  10.579   0.871
  526    HD2  PHE 910           HD1      PHE 910  16.253  13.573   2.011
  527    HE1  PHE 910           HE2      PHE 910  19.730  10.303   3.205
  528    HE2  PHE 910           HE1      PHE 910  16.940  13.305   4.362
  529    HZ   PHE 910           HZ       PHE 910  18.677  11.643   4.954
  530    HB2  PHE 910           HB2      PHE 910  18.043  12.081  -0.759
  531    HB3  PHE 910           HB1      PHE 910  16.846  13.281  -0.294
  532    H    CYS 911           H        CYS 911  14.358  12.707  -1.856
  533    HA   CYS 911           HA       CYS 911  14.314  11.362  -4.293
  534    HB2  CYS 911           HB2      CYS 911  13.224  13.492  -5.112
  535    HB3  CYS 911           HB1      CYS 911  12.499  12.786  -3.677
  536    HA   PRO 912           HA       PRO 912  17.814  12.652  -6.755
  537    HB2  PRO 912           HB2      PRO 912  16.529  13.851  -8.943
  538    HB3  PRO 912           HB1      PRO 912  16.940  12.142  -8.791
  539    HG2  PRO 912           HG2      PRO 912  14.341  13.522  -8.245
  540    HG3  PRO 912           HG1      PRO 912  14.639  11.931  -8.967
  541    HD2  PRO 912           HD2      PRO 912  13.805  12.151  -6.461
  542    HD3  PRO 912           HD1      PRO 912  15.024  10.942  -6.893
  543    H    LYS 913           H        LYS 913  15.601  14.894  -5.601
  544    HA   LYS 913           HA       LYS 913  17.197  17.220  -6.345
  545    HB2  LYS 913           HB2      LYS 913  14.551  16.984  -4.895
  546    HB3  LYS 913           HB1      LYS 913  15.356  18.500  -5.281
  547    HG2  LYS 913           HG2      LYS 913  15.114  18.086  -7.648
  548    HG3  LYS 913           HG1      LYS 913  14.463  16.482  -7.337
  549    HD2  LYS 913           HD2      LYS 913  12.689  18.064  -7.908
  550    HD3  LYS 913           HD1      LYS 913  12.506  17.482  -6.258
  551    HE2  LYS 913           HE2      LYS 913  12.072  19.870  -6.341
  552    HE3  LYS 913           HE1      LYS 913  13.539  19.544  -5.439
  553    HZ1  LYS 913           HZ1      LYS 913  14.842  20.182  -7.384
  554    HZ2  LYS 913           HZ2      LYS 913  13.808  21.418  -6.911
  555    HZ3  LYS 913           HZ3      LYS 913  13.420  20.478  -8.249
  556    H    CYS 914           H        CYS 914  15.905  15.583  -3.430
  557    HA   CYS 914           HA       CYS 914  17.436  17.208  -1.706
  558    HB2  CYS 914           HB2      CYS 914  15.620  14.900  -1.299
  559    HB3  CYS 914           HB1      CYS 914  16.565  15.410   0.076
  560    H    ALA 915           H        ALA 915  17.989  14.043  -3.058
  561    HA   ALA 915           HA       ALA 915  20.188  13.548  -1.314
  562    HB1  ALA 915           HB1      ALA 915  18.960  11.709  -2.381
  563    HB2  ALA 915           HB2      ALA 915  20.675  11.640  -2.796
  564    HB3  ALA 915           HB3      ALA 915  19.504  12.276  -3.952
  565    H    ASN 916           H        ASN 916  19.680  15.295  -4.096
  566    HA   ASN 916           HA       ASN 916  22.292  15.310  -5.291
  567    HB2  ASN 916           HB2      ASN 916  20.322  15.835  -6.622
  568    HB3  ASN 916           HB1      ASN 916  19.937  17.187  -5.569
  569   HD21  ASN 916          HD21      ASN 916  20.020  18.762  -7.067
  570   HD22  ASN 916          HD22      ASN 916  21.448  19.258  -7.878
  571    H    LYS 917           H        LYS 917  20.403  17.578  -3.360
  572    HA   LYS 917           HA       LYS 917  22.290  19.658  -3.251
  573    HB2  LYS 917           HB2      LYS 917  20.866  20.662  -1.579
  574    HB3  LYS 917           HB1      LYS 917  19.871  19.940  -2.836
  575    HG2  LYS 917           HG2      LYS 917  19.583  17.955  -1.356
  576    HG3  LYS 917           HG1      LYS 917  20.436  18.858  -0.105
  577    HD2  LYS 917           HD2      LYS 917  18.690  20.603  -0.218
  578    HD3  LYS 917           HD1      LYS 917  17.830  19.648  -1.425
  579    HE2  LYS 917           HE2      LYS 917  17.722  17.776   0.243
  580    HE3  LYS 917           HE1      LYS 917  18.402  18.873   1.430
  581    HZ1  LYS 917           HZ1      LYS 917  15.835  19.228  -0.003
  582    HZ2  LYS 917           HZ2      LYS 917  16.438  20.339   1.104
  583    HZ3  LYS 917           HZ3      LYS 917  15.973  18.799   1.601
  584    H    ILE 918           H        ILE 918  22.228  16.727  -1.529
  585    HA   ILE 918           HA       ILE 918  23.665  17.664   0.783
  586    HB   ILE 918           HB       ILE 918  23.370  14.795  -0.179
  587   HG12  ILE 918          HG12      ILE 918  21.557  16.387   1.663
  588   HG13  ILE 918          HG11      ILE 918  21.177  15.833   0.034
  589   HG21  ILE 918          HG21      ILE 918  23.711  14.222   2.198
  590   HG22  ILE 918          HG22      ILE 918  23.910  15.932   2.576
  591   HG23  ILE 918          HG23      ILE 918  25.087  15.118   1.549
  592   HD11  ILE 918          HD11      ILE 918  20.116  14.432   1.716
  593   HD12  ILE 918          HD12      ILE 918  21.690  14.059   2.412
  594   HD13  ILE 918          HD13      ILE 918  21.299  13.514   0.781
  595    H    LYS 919           H        LYS 919  24.469  16.638  -2.401
  596    HA   LYS 919           HA       LYS 919  27.317  16.238  -1.657
  597    HB2  LYS 919           HB2      LYS 919  25.897  15.309  -4.147
  598    HB3  LYS 919           HB1      LYS 919  27.535  14.913  -3.657
  599    HG2  LYS 919           HG2      LYS 919  26.661  13.601  -1.806
  600    HG3  LYS 919           HG1      LYS 919  25.011  14.052  -2.256
  601    HD2  LYS 919           HD2      LYS 919  25.403  13.033  -4.491
  602    HD3  LYS 919           HD1      LYS 919  26.971  12.472  -3.916
  603    HE2  LYS 919           HE2      LYS 919  25.319  10.700  -3.784
  604    HE3  LYS 919           HE1      LYS 919  25.853  11.166  -2.170
  605    HZ1  LYS 919           HZ1      LYS 919  23.346  12.125  -3.455
  606    HZ2  LYS 919           HZ2      LYS 919  23.830  12.399  -1.856
  607    HZ3  LYS 919           HZ3      LYS 919  23.450  10.847  -2.361
  608    H    LYS 920           H        LYS 920  25.064  17.709  -3.935
  609    HA   LYS 920           HA       LYS 920  27.197  19.342  -5.101
  610    HB2  LYS 920           HB2      LYS 920  24.973  17.908  -6.575
  611    HB3  LYS 920           HB1      LYS 920  26.245  18.874  -7.298
  612    HG2  LYS 920           HG2      LYS 920  27.908  17.263  -6.687
  613    HG3  LYS 920           HG1      LYS 920  26.750  16.363  -5.725
  614    HD2  LYS 920           HD2      LYS 920  27.085  15.181  -7.765
  615    HD3  LYS 920           HD1      LYS 920  25.487  15.911  -7.841
  616    HE2  LYS 920           HE2      LYS 920  26.286  17.636  -9.283
  617    HE3  LYS 920           HE1      LYS 920  27.955  17.114  -9.056
  618    HZ1  LYS 920           HZ1      LYS 920  27.293  14.964 -10.065
  619    HZ2  LYS 920           HZ2      LYS 920  27.290  16.267 -11.084
  620    HZ3  LYS 920           HZ3      LYS 920  25.803  15.660 -10.507
  621    H    ASP 921           H        ASP 921  25.855  20.902  -6.643
  622    HA   ASP 921           HA       ASP 921  23.560  21.896  -5.112
  623    HB2  ASP 921           HB2      ASP 921  25.374  23.327  -7.086
  624    HB3  ASP 921           HB1      ASP 921  23.875  24.023  -6.480
  625    H    LYS 922           H        LYS 922  24.700  21.594  -8.455
  626    HA   LYS 922           HA       LYS 922  22.652  19.915  -9.212
  627    HB2  LYS 922           HB2      LYS 922  21.518  21.388 -10.905
  628    HB3  LYS 922           HB1      LYS 922  21.145  21.808  -9.250
  629    HG2  LYS 922           HG2      LYS 922  22.644  23.706  -9.374
  630    HG3  LYS 922           HG1      LYS 922  23.101  23.262 -11.025
  631    HD2  LYS 922           HD2      LYS 922  20.800  23.572 -11.762
  632    HD3  LYS 922           HD1      LYS 922  20.299  23.928 -10.114
  633    HE2  LYS 922           HE2      LYS 922  22.243  25.554 -11.743
  634    HE3  LYS 922           HE1      LYS 922  20.552  25.958 -11.483
  635    HZ1  LYS 922           HZ1      LYS 922  22.628  25.757  -9.367
  636    HZ2  LYS 922           HZ2      LYS 922  21.003  26.068  -9.100
  637    HZ3  LYS 922           HZ3      LYS 922  21.936  27.185  -9.941
  638    H    LYS 923           H        LYS 923  22.646  20.172 -11.896
  639    HA   LYS 923           HA       LYS 923  23.812  19.879 -13.806
  640    HB2  LYS 923           HB2      LYS 923  26.225  21.020 -12.356
  641    HB3  LYS 923           HB1      LYS 923  26.111  20.745 -14.078
  642    HG2  LYS 923           HG2      LYS 923  24.522  22.750 -12.483
  643    HG3  LYS 923           HG1      LYS 923  25.902  23.106 -13.510
  644    HD2  LYS 923           HD2      LYS 923  23.226  22.022 -14.403
  645    HD3  LYS 923           HD1      LYS 923  23.821  23.661 -14.641
  646    HE2  LYS 923           HE2      LYS 923  24.893  21.121 -15.867
  647    HE3  LYS 923           HE1      LYS 923  24.079  22.445 -16.690
  648    HZ1  LYS 923           HZ1      LYS 923  25.982  23.891 -16.118
  649    HZ2  LYS 923           HZ2      LYS 923  26.416  22.584 -17.059
  650    HZ3  LYS 923           HZ3      LYS 923  26.783  22.569 -15.431
  651    H    HIS 924           H        HIS 924  26.147  18.750 -14.467
  652    HA   HIS 924           HA       HIS 924  26.175  16.426 -12.738
  653    HD1  HIS 924           HD1      HIS 924  29.049  16.063 -15.946
  654    HD2  HIS 924           HD2      HIS 924  25.311  17.294 -17.246
  655    HE1  HIS 924           HE1      HIS 924  29.418  16.967 -18.268
  656    HE2  HIS 924           HE2      HIS 924  27.147  17.820 -18.993
  657    HB2  HIS 924           HB2      HIS 924  26.979  15.048 -14.641
  658    HB3  HIS 924           HB1      HIS 924  25.419  15.764 -14.968
  Start of MODEL   16
    1    HA   ALA   1           HA       ALA   1  12.533   6.032   3.030
    2    H1   ALA   1           HT1      ALA   1  13.320   4.224   5.199
    3    H2   ALA   1           HT2      ALA   1  13.040   5.888   5.277
    4    H3   ALA   1           HT3      ALA   1  14.397   5.280   4.458
    5    HB1  ALA   1           HB1      ALA   1  14.207   4.481   2.160
    6    HB2  ALA   1           HB2      ALA   1  12.612   4.059   1.549
    7    HB3  ALA   1           HB3      ALA   1  13.345   3.106   2.848
    8    H    ARG   2           H        ARG   2  10.542   6.458   3.739
    9    HA   ARG   2           HA       ARG   2   9.096   4.344   5.041
   10    HE   ARG   2           HE       ARG   2   5.158   7.341   6.331
   11    HB2  ARG   2           HB2      ARG   2   9.042   7.072   5.398
   12    HB3  ARG   2           HB1      ARG   2   7.707   6.835   4.317
   13    HG2  ARG   2           HG2      ARG   2   6.537   5.458   5.812
   14    HG3  ARG   2           HG1      ARG   2   7.979   5.177   6.782
   15    HD2  ARG   2           HD2      ARG   2   6.770   6.664   8.089
   16    HD3  ARG   2           HD1      ARG   2   7.909   7.701   7.246
   17   HH11  ARG   2          HH11      ARG   2   7.853   9.514   7.038
   18   HH12  ARG   2          HH12      ARG   2   6.969  10.945   6.957
   19   HH21  ARG   2          HH21      ARG   2   3.834   9.322   6.329
   20   HH22  ARG   2          HH22      ARG   2   4.599  10.823   6.575
   21    H    THR   3           H        THR   3   8.565   2.845   3.642
   22    HA   THR   3           HA       THR   3   7.258   3.635   1.181
   23    HB   THR   3           HB       THR   3   7.711   1.146   0.696
   24    HG1  THR   3           HG1      THR   3   9.668   0.480   1.985
   25   HG21  THR   3          HG21      THR   3  10.022   3.073   0.984
   26   HG22  THR   3          HG22      THR   3   8.869   3.073  -0.339
   27   HG23  THR   3          HG23      THR   3   9.954   1.693  -0.120
   28    HA   M3L   4           HA       M3L   4   3.964   1.165   2.584
   29    H    M3L   4           H        M3L   4   5.168   3.229   0.979
   30    HB2  M3L   4           HB2      M3L   4   3.573   2.993   4.062
   31    HB3  M3L   4           HB1      M3L   4   2.072   2.765   3.187
   32    HG2  M3L   4           HG2      M3L   4   3.755   4.623   1.808
   33    HG3  M3L   4           HG1      M3L   4   3.598   5.106   3.495
   34    HD2  M3L   4           HD2      M3L   4   1.130   4.269   2.080
   35    HD3  M3L   4           HD1      M3L   4   1.365   5.521   3.300
   36    HE2  M3L   4           HE2      M3L   4   2.828   6.553   1.318
   37    HE3  M3L   4           HE1      M3L   4   1.742   5.563   0.369
   38   HM11  M3L   4          HM11      M3L   4   1.905   8.871   0.716
   39   HM12  M3L   4          HM12      M3L   4   1.122   7.953  -0.543
   40   HM13  M3L   4          HM13      M3L   4   0.188   9.010   0.452
   41   HM21  M3L   4          HM21      M3L   4  -0.675   5.523   1.411
   42   HM22  M3L   4          HM22      M3L   4  -0.880   6.653   0.099
   43   HM23  M3L   4          HM23      M3L   4  -1.422   7.063   1.687
   44   HM31  M3L   4          HM31      M3L   4   0.442   8.781   2.909
   45   HM32  M3L   4          HM32      M3L   4   1.759   7.711   3.308
   46   HM33  M3L   4          HM33      M3L   4   0.115   7.193   3.530
   47    H    GLN   5           H        GLN   5   1.992   0.508   1.791
   48    HA   GLN   5           HA       GLN   5   1.155   1.611  -0.764
   49    HB2  GLN   5           HB2      GLN   5   2.598  -0.418  -1.111
   50    HB3  GLN   5           HB1      GLN   5   1.426  -1.335  -0.175
   51    HG2  GLN   5           HG2      GLN   5  -0.310  -0.659  -1.799
   52    HG3  GLN   5           HG1      GLN   5   0.939   0.121  -2.734
   53   HE21  GLN   5          HE21      GLN   5   0.468  -1.191  -4.482
   54   HE22  GLN   5          HE22      GLN   5   1.070  -2.800  -4.550
   55    H    THR   6           H        THR   6  -0.858   2.201  -0.429
   56    HA   THR   6           HA       THR   6  -2.426   0.889   1.677
   57    HB   THR   6           HB       THR   6  -2.913   3.573   0.340
   58    HG1  THR   6           HG1      THR   6  -1.618   3.321   2.834
   59   HG21  THR   6          HG21      THR   6  -3.690   2.498   3.068
   60   HG22  THR   6          HG22      THR   6  -4.773   2.675   1.686
   61   HG23  THR   6          HG23      THR   6  -4.072   4.104   2.445
   62    H    ALA   7           H        ALA   7  -1.998  -0.168  -0.888
   63    HA   ALA   7           HA       ALA   7  -4.167   0.488  -2.638
   64    HB1  ALA   7           HB1      ALA   7  -2.034  -1.599  -2.825
   65    HB2  ALA   7           HB2      ALA   7  -1.959   0.029  -3.495
   66    HB3  ALA   7           HB3      ALA   7  -3.129  -1.137  -4.131
   67    H    ARG   8           H        ARG   8  -5.903  -0.672  -3.013
   68    HA   ARG   8           HA       ARG   8  -6.492  -3.023  -1.402
   69    HE   ARG   8           HE       ARG   8 -10.027  -3.273  -3.851
   70    HB2  ARG   8           HB2      ARG   8  -8.717  -2.923  -2.484
   71    HB3  ARG   8           HB1      ARG   8  -8.292  -1.406  -1.710
   72    HG2  ARG   8           HG2      ARG   8  -7.899  -0.340  -3.777
   73    HG3  ARG   8           HG1      ARG   8  -7.858  -1.873  -4.645
   74    HD2  ARG   8           HD2      ARG   8 -10.275  -0.735  -3.265
   75    HD3  ARG   8           HD1      ARG   8  -9.949  -0.588  -4.998
   76   HH11  ARG   8          HH11      ARG   8 -11.747  -0.836  -5.780
   77   HH12  ARG   8          HH12      ARG   8 -12.777  -1.963  -6.516
   78   HH21  ARG   8          HH21      ARG   8 -11.432  -4.762  -4.799
   79   HH22  ARG   8          HH22      ARG   8 -12.629  -4.276  -5.923
   80    H    LYS   9           H        LYS   9  -5.235  -2.138  -4.386
   81    HA   LYS   9           HA       LYS   9  -5.525  -4.845  -5.459
   82    HB2  LYS   9           HB2      LYS   9  -7.043  -3.334  -6.615
   83    HB3  LYS   9           HB1      LYS   9  -5.738  -2.201  -6.896
   84    HG2  LYS   9           HG2      LYS   9  -4.616  -3.912  -8.285
   85    HG3  LYS   9           HG1      LYS   9  -6.035  -4.942  -8.082
   86    HD2  LYS   9           HD2      LYS   9  -7.438  -3.241  -9.116
   87    HD3  LYS   9           HD1      LYS   9  -6.044  -2.172  -9.277
   88    HE2  LYS   9           HE2      LYS   9  -6.478  -3.249 -11.381
   89    HE3  LYS   9           HE1      LYS   9  -4.967  -3.859 -10.714
   90    HZ1  LYS   9           HZ1      LYS   9  -6.200  -5.824  -9.913
   91    HZ2  LYS   9           HZ2      LYS   9  -6.282  -5.676 -11.581
   92    HZ3  LYS   9           HZ3      LYS   9  -7.596  -5.233 -10.637
   93    H    SER  10           H        SER  10  -3.510  -5.658  -5.481
   94    HA   SER  10           HA       SER  10  -1.169  -4.003  -5.608
   95    HG   SER  10           HG       SER  10  -2.163  -5.913  -3.956
   96    HB2  SER  10           HB2      SER  10  -1.413  -7.010  -5.997
   97    HB3  SER  10           HB1      SER  10   0.061  -6.112  -5.630
   98    H    THR  11           H        THR  11  -0.951  -2.904  -7.471
   99    HA   THR  11           HA       THR  11  -1.737  -4.228  -9.934
  100    HB   THR  11           HB       THR  11  -1.015  -1.321  -9.586
  101    HG1  THR  11           HG1      THR  11  -2.874  -2.388  -8.282
  102   HG21  THR  11          HG21      THR  11  -1.114  -2.199 -11.902
  103   HG22  THR  11          HG22      THR  11  -2.415  -1.052 -11.587
  104   HG23  THR  11          HG23      THR  11  -2.750  -2.784 -11.599
  105    H    GLY  12           H        GLY  12   0.081  -5.534 -10.248
  106    HA2  GLY  12           HA2      GLY  12   2.641  -4.228 -10.660
  107    HA3  GLY  12           HA1      GLY  12   2.277  -5.943 -10.910
  108    H    GLY  13           H        GLY  13   0.049  -5.757 -12.431
  109    HA2  GLY  13           HA2      GLY  13   0.227  -4.073 -14.635
  110    HA3  GLY  13           HA1      GLY  13   0.858  -5.695 -14.994
  111    H1   GLY 850           HT1      GLY 850  -2.757  29.382   8.610
  112    H2   GLY 850           HT2      GLY 850  -4.053  30.444   8.642
  113    H3   GLY 850           HT3      GLY 850  -4.279  28.850   9.126
  114    HA2  GLY 850           HA1      GLY 850  -2.646  30.896  10.498
  115    HA3  GLY 850           HA2      GLY 850  -4.192  30.273  11.050
  116    H    SER 851           H        SER 851  -0.899  29.408  10.290
  117    HA   SER 851           HA       SER 851   0.545  27.938  11.016
  118    HG   SER 851           HG       SER 851   1.061  29.402  12.892
  119    HB2  SER 851           HB2      SER 851  -1.180  27.772  13.495
  120    HB3  SER 851           HB1      SER 851   0.507  27.262  13.365
  121    H    HIS 852           H        HIS 852   0.061  26.520   9.362
  122    HA   HIS 852           HA       HIS 852  -1.785  24.366   9.904
  123    HD2  HIS 852           HD2      HIS 852   1.307  23.583   6.504
  124    HE1  HIS 852           HE1      HIS 852   1.573  27.741   5.724
  125    HE2  HIS 852           HE2      HIS 852   2.805  25.547   5.672
  126    HB2  HIS 852           HB2      HIS 852  -1.264  23.689   7.529
  127    HB3  HIS 852           HB1      HIS 852  -1.979  25.285   7.690
  128    H    MET 853           H        MET 853  -1.218  22.325  10.399
  129    HA   MET 853           HA       MET 853   1.609  21.819  10.830
  130    HB2  MET 853           HB2      MET 853  -0.067  21.256  12.603
  131    HB3  MET 853           HB1      MET 853  -0.781  20.077  11.509
  132    HG2  MET 853           HG2      MET 853   0.666  19.002  13.143
  133    HG3  MET 853           HG1      MET 853   1.305  18.803  11.512
  134    HE1  MET 853           HE1      MET 853   3.712  18.130  12.389
  135    HE2  MET 853           HE2      MET 853   3.108  18.231  14.044
  136    HE3  MET 853           HE3      MET 853   4.603  19.050  13.601
  137    H    ALA 854           H        ALA 854  -0.692  21.391   8.487
  138    HA   ALA 854           HA       ALA 854   0.419  18.957   7.318
  139    HB1  ALA 854           HB1      ALA 854  -1.276  19.261   5.606
  140    HB2  ALA 854           HB2      ALA 854  -1.704  20.811   6.272
  141    HB3  ALA 854           HB3      ALA 854  -2.040  19.333   7.206
  142    H    MET 855           H        MET 855   0.290  19.429   4.705
  143    HA   MET 855           HA       MET 855   1.653  21.870   4.061
  144    HB2  MET 855           HB2      MET 855   3.334  20.743   2.736
  145    HB3  MET 855           HB1      MET 855   3.416  20.056   4.350
  146    HG2  MET 855           HG2      MET 855   2.181  18.099   3.584
  147    HG3  MET 855           HG1      MET 855   2.052  18.800   1.975
  148    HE1  MET 855           HE1      MET 855   4.549  15.987   1.169
  149    HE2  MET 855           HE2      MET 855   3.076  16.832   0.706
  150    HE3  MET 855           HE3      MET 855   3.124  15.908   2.206
  151    H    ALA 856           H        ALA 856   1.533  22.045   1.710
  152    HA   ALA 856           HA       ALA 856  -1.084  21.454   0.736
  153    HB1  ALA 856           HB1      ALA 856  -0.390  22.602  -1.280
  154    HB2  ALA 856           HB2      ALA 856   1.285  22.555  -0.731
  155    HB3  ALA 856           HB3      ALA 856   0.093  23.525   0.154
  156    H    TYR 857           H        TYR 857  -0.918  20.786  -1.838
  157    HA   TYR 857           HA       TYR 857  -0.849  19.082  -3.285
  158    HD1  TYR 857           HD2      TYR 857   1.407  21.134  -3.081
  159    HD2  TYR 857           HD1      TYR 857   2.247  17.388  -4.916
  160    HE1  TYR 857           HE2      TYR 857   2.446  22.290  -4.983
  161    HE2  TYR 857           HE1      TYR 857   3.271  18.521  -6.806
  162    HH   TYR 857           HH       TYR 857   4.188  21.696  -6.765
  163    HB2  TYR 857           HB2      TYR 857   1.685  18.645  -1.816
  164    HB3  TYR 857           HB1      TYR 857   1.087  17.381  -2.892
  165    H    VAL 858           H        VAL 858  -1.708  18.825  -0.324
  166    HA   VAL 858           HA       VAL 858  -2.320  15.950  -0.422
  167    HB   VAL 858           HB       VAL 858  -2.600  17.785   1.966
  168   HG11  VAL 858          HG11      VAL 858  -2.619  14.777   1.751
  169   HG12  VAL 858          HG12      VAL 858  -4.005  15.819   2.076
  170   HG13  VAL 858          HG13      VAL 858  -2.692  15.701   3.249
  171   HG21  VAL 858          HG21      VAL 858  -0.349  15.916   1.293
  172   HG22  VAL 858          HG22      VAL 858  -0.563  16.746   2.841
  173   HG23  VAL 858          HG23      VAL 858  -0.270  17.683   1.361
  174    H    ILE 859           H        ILE 859  -4.145  15.766  -1.457
  175    HA   ILE 859           HA       ILE 859  -6.325  17.610  -0.747
  176    HB   ILE 859           HB       ILE 859  -7.345  17.179  -2.951
  177   HG12  ILE 859          HG12      ILE 859  -4.778  15.695  -3.619
  178   HG13  ILE 859          HG11      ILE 859  -6.342  14.937  -3.343
  179   HG21  ILE 859          HG21      ILE 859  -4.514  18.204  -3.104
  180   HG22  ILE 859          HG22      ILE 859  -5.950  19.136  -2.684
  181   HG23  ILE 859          HG23      ILE 859  -5.767  18.485  -4.313
  182   HD11  ILE 859          HD11      ILE 859  -5.677  16.857  -5.567
  183   HD12  ILE 859          HD12      ILE 859  -7.243  16.091  -5.297
  184   HD13  ILE 859          HD13      ILE 859  -5.839  15.106  -5.714
  185    H    ARG 860           H        ARG 860  -8.507  16.561  -1.069
  186    HA   ARG 860           HA       ARG 860  -8.345  13.801  -0.157
  187    HE   ARG 860           HE       ARG 860  -9.333  15.502   4.317
  188    HB2  ARG 860           HB2      ARG 860 -10.530  15.851   0.116
  189    HB3  ARG 860           HB1      ARG 860 -10.793  14.145   0.426
  190    HG2  ARG 860           HG2      ARG 860  -8.999  14.248   2.142
  191    HG3  ARG 860           HG1      ARG 860  -8.932  15.994   1.888
  192    HD2  ARG 860           HD2      ARG 860 -11.205  16.249   2.587
  193    HD3  ARG 860           HD1      ARG 860 -11.435  14.503   2.652
  194   HH11  ARG 860          HH11      ARG 860 -12.828  14.816   4.194
  195   HH12  ARG 860          HH12      ARG 860 -12.960  14.591   5.878
  196   HH21  ARG 860          HH21      ARG 860  -9.573  15.158   6.627
  197   HH22  ARG 860          HH22      ARG 860 -11.110  14.787   7.269
  198    H    ASP 861           H        ASP 861  -9.477  12.222  -1.139
  199    HA   ASP 861           HA       ASP 861 -10.263  12.742  -3.902
  200    HB2  ASP 861           HB2      ASP 861 -10.163  10.356  -4.199
  201    HB3  ASP 861           HB1      ASP 861  -8.733  10.795  -3.285
  202    H    GLU 862           H        GLU 862 -12.120  10.889  -4.318
  203    HA   GLU 862           HA       GLU 862 -14.488  12.027  -3.412
  204    HB2  GLU 862           HB2      GLU 862 -15.573  10.133  -4.496
  205    HB3  GLU 862           HB1      GLU 862 -14.300  10.817  -5.493
  206    HG2  GLU 862           HG2      GLU 862 -12.794   9.005  -4.651
  207    HG3  GLU 862           HG1      GLU 862 -14.210   8.271  -3.906
  208    H    TRP 863           H        TRP 863 -12.599   9.353  -2.024
  209    HA   TRP 863           HA       TRP 863 -14.728   8.647  -0.264
  210    HD1  TRP 863           HD       TRP 863 -11.336   5.978  -2.169
  211    HE1  TRP 863           HE1      TRP 863 -12.711   4.547  -3.824
  212    HE3  TRP 863           HE3      TRP 863 -15.965   7.280  -0.668
  213    HZ2  TRP 863           HZ2      TRP 863 -15.420   4.042  -4.404
  214    HZ3  TRP 863           HZ3      TRP 863 -17.952   6.285  -1.807
  215    HH2  TRP 863           HH       TRP 863 -17.648   4.702  -3.654
  216    HB2  TRP 863           HB2      TRP 863 -11.865   7.711  -0.372
  217    HB3  TRP 863           HB1      TRP 863 -13.129   7.011   0.627
  218    H    GLY 864           H        GLY 864 -11.962  10.682  -0.224
  219    HA2  GLY 864           HA2      GLY 864 -11.843  12.483   1.327
  220    HA3  GLY 864           HA1      GLY 864 -12.760  11.514   2.472
  221    H    ASN 865           H        ASN 865 -10.031  10.358   0.640
  222    HA   ASN 865           HA       ASN 865  -8.552   9.808   3.112
  223    HB2  ASN 865           HB2      ASN 865  -7.869   9.191   0.217
  224    HB3  ASN 865           HB1      ASN 865  -6.987   8.622   1.621
  225   HD21  ASN 865          HD21      ASN 865  -9.826   8.289  -0.324
  226   HD22  ASN 865          HD22      ASN 865 -10.296   6.742   0.291
  227    H    GLN 866           H        GLN 866  -6.226  10.466   3.121
  228    HA   GLN 866           HA       GLN 866  -5.885  13.043   1.885
  229    HB2  GLN 866           HB2      GLN 866  -4.217  11.463   3.834
  230    HB3  GLN 866           HB1      GLN 866  -3.534  12.826   2.971
  231    HG2  GLN 866           HG2      GLN 866  -5.094  14.316   3.895
  232    HG3  GLN 866           HG1      GLN 866  -6.009  13.007   4.665
  233   HE21  GLN 866          HE21      GLN 866  -3.168  14.983   4.752
  234   HE22  GLN 866          HE22      GLN 866  -2.667  14.548   6.348
  235    H    ILE 867           H        ILE 867  -5.327  13.160  -0.056
  236    HA   ILE 867           HA       ILE 867  -3.784  11.014  -1.284
  237    HB   ILE 867           HB       ILE 867  -5.473  13.205  -2.493
  238   HG12  ILE 867          HG12      ILE 867  -6.901  11.562  -1.456
  239   HG13  ILE 867          HG11      ILE 867  -6.945  11.386  -3.211
  240   HG21  ILE 867          HG21      ILE 867  -5.174  12.069  -4.630
  241   HG22  ILE 867          HG22      ILE 867  -4.052  10.940  -3.870
  242   HG23  ILE 867          HG23      ILE 867  -3.645  12.653  -3.971
  243   HD11  ILE 867          HD11      ILE 867  -6.924   9.218  -2.098
  244   HD12  ILE 867          HD12      ILE 867  -5.403   9.629  -1.308
  245   HD13  ILE 867          HD13      ILE 867  -5.464   9.452  -3.062
  246    H    TRP 868           H        TRP 868  -1.741  11.443  -1.393
  247    HA   TRP 868           HA       TRP 868  -0.794  14.166  -1.413
  248    HD1  TRP 868           HD       TRP 868   1.975  14.547   0.478
  249    HE1  TRP 868           HE1      TRP 868   1.600  14.400   3.036
  250    HE3  TRP 868           HE3      TRP 868  -1.211  10.551   0.627
  251    HZ2  TRP 868           HZ2      TRP 868   0.169  12.821   4.835
  252    HZ3  TRP 868           HZ3      TRP 868  -2.030   9.788   2.809
  253    HH2  TRP 868           HH       TRP 868  -1.356  10.905   4.873
  254    HB2  TRP 868           HB2      TRP 868   0.575  11.496  -1.191
  255    HB3  TRP 868           HB1      TRP 868   1.489  12.961  -1.512
  256    H    ILE 869           H        ILE 869  -0.088  15.178  -3.133
  257    HA   ILE 869           HA       ILE 869  -0.227  13.827  -5.690
  258    HB   ILE 869           HB       ILE 869   0.444  16.712  -5.035
  259   HG12  ILE 869          HG12      ILE 869  -1.860  16.233  -4.397
  260   HG13  ILE 869          HG11      ILE 869  -1.830  17.269  -5.814
  261   HG21  ILE 869          HG21      ILE 869  -0.209  15.454  -7.693
  262   HG22  ILE 869          HG22      ILE 869   1.372  16.029  -7.169
  263   HG23  ILE 869          HG23      ILE 869   0.053  17.177  -7.405
  264   HD11  ILE 869          HD11      ILE 869  -2.308  15.300  -7.218
  265   HD12  ILE 869          HD12      ILE 869  -3.558  15.610  -6.016
  266   HD13  ILE 869          HD13      ILE 869  -2.395  14.315  -5.756
  267    H    CYS 870           H        CYS 870   1.506  12.846  -6.479
  268    HA   CYS 870           HA       CYS 870   4.041  12.895  -5.298
  269    HB2  CYS 870           HB2      CYS 870   3.211  10.999  -6.584
  270    HB3  CYS 870           HB1      CYS 870   3.095  11.991  -8.026
  271    HA   PRO 871           HA       PRO 871   5.361  16.656  -7.431
  272    HB2  PRO 871           HB2      PRO 871   7.987  16.254  -6.257
  273    HB3  PRO 871           HB1      PRO 871   6.806  17.514  -5.900
  274    HG2  PRO 871           HG2      PRO 871   7.463  15.526  -4.148
  275    HG3  PRO 871           HG1      PRO 871   5.895  16.347  -4.162
  276    HD2  PRO 871           HD2      PRO 871   6.648  13.669  -5.246
  277    HD3  PRO 871           HD1      PRO 871   5.166  14.199  -4.413
  278    H    GLY 872           H        GLY 872   6.302  13.489  -7.874
  279    HA2  GLY 872           HA2      GLY 872   8.522  13.938  -9.632
  280    HA3  GLY 872           HA1      GLY 872   7.660  12.421  -9.381
  281    H    CYS 873           H        CYS 873   5.171  12.862 -10.085
  282    HA   CYS 873           HA       CYS 873   5.380  13.467 -12.955
  283    HB2  CYS 873           HB2      CYS 873   3.336  12.025 -12.999
  284    HB3  CYS 873           HB1      CYS 873   4.813  11.226 -12.450
  285    H    ASN 874           H        ASN 874   3.749  14.254 -10.004
  286    HA   ASN 874           HA       ASN 874   2.343  15.805  -9.327
  287    HB2  ASN 874           HB2      ASN 874   2.219  16.744 -12.206
  288    HB3  ASN 874           HB1      ASN 874   1.262  17.469 -10.925
  289   HD21  ASN 874          HD21      ASN 874   2.215  19.447 -11.139
  290   HD22  ASN 874          HD22      ASN 874   3.829  19.795 -10.669
  291    H    LYS 875           H        LYS 875   1.760  13.112 -10.334
  292    HA   LYS 875           HA       LYS 875  -1.100  13.392 -10.781
  293    HB2  LYS 875           HB2      LYS 875   0.731  10.991 -11.018
  294    HB3  LYS 875           HB1      LYS 875  -0.995  10.976 -11.351
  295    HG2  LYS 875           HG2      LYS 875  -0.683  12.527 -13.188
  296    HG3  LYS 875           HG1      LYS 875   1.041  12.629 -12.829
  297    HD2  LYS 875           HD2      LYS 875   1.261  10.228 -13.294
  298    HD3  LYS 875           HD1      LYS 875  -0.464  10.160 -13.670
  299    HE2  LYS 875           HE2      LYS 875  -0.108  11.754 -15.506
  300    HE3  LYS 875           HE1      LYS 875   1.611  11.796 -15.128
  301    HZ1  LYS 875           HZ1      LYS 875   1.768   9.455 -15.674
  302    HZ2  LYS 875           HZ2      LYS 875   1.082  10.295 -16.966
  303    HZ3  LYS 875           HZ3      LYS 875   0.108   9.381 -15.955
  304    HA   PRO 876           HA       PRO 876  -1.823  12.475  -6.561
  305    HB2  PRO 876           HB2      PRO 876  -4.331  11.555  -6.640
  306    HB3  PRO 876           HB1      PRO 876  -3.941  13.237  -7.016
  307    HG2  PRO 876           HG2      PRO 876  -4.357  10.932  -8.833
  308    HG3  PRO 876           HG1      PRO 876  -5.088  12.558  -8.935
  309    HD2  PRO 876           HD2      PRO 876  -2.924  11.887 -10.452
  310    HD3  PRO 876           HD1      PRO 876  -3.118  13.509  -9.759
  311    H    ASP 877           H        ASP 877  -2.114  10.989  -5.068
  312    HA   ASP 877           HA       ASP 877  -1.238   8.296  -5.521
  313    HB2  ASP 877           HB2      ASP 877  -0.457   9.363  -3.534
  314    HB3  ASP 877           HB1      ASP 877  -2.078   9.854  -3.073
  315    H    ASP 878           H        ASP 878  -2.395   6.453  -5.175
  316    HA   ASP 878           HA       ASP 878  -5.344   6.753  -4.817
  317    HB2  ASP 878           HB2      ASP 878  -5.894   5.113  -6.463
  318    HB3  ASP 878           HB1      ASP 878  -4.688   6.128  -7.236
  319    H    GLY 879           H        GLY 879  -2.796   5.901  -3.309
  320    HA2  GLY 879           HA2      GLY 879  -2.712   4.554  -1.409
  321    HA3  GLY 879           HA1      GLY 879  -3.821   3.404  -2.184
  322    H    SER 880           H        SER 880  -1.194   5.069  -3.678
  323    HA   SER 880           HA       SER 880  -0.368   2.703  -5.050
  324    HG   SER 880           HG       SER 880  -1.410   4.668  -6.391
  325    HB2  SER 880           HB2      SER 880   0.960   5.391  -4.953
  326    HB3  SER 880           HB1      SER 880   0.953   4.233  -6.282
  327    HA   PRO 881           HA       PRO 881   3.153   1.961  -2.280
  328    HB2  PRO 881           HB2      PRO 881   4.902   1.296  -4.514
  329    HB3  PRO 881           HB1      PRO 881   4.269   0.215  -3.273
  330    HG2  PRO 881           HG2      PRO 881   3.540   0.086  -5.860
  331    HG3  PRO 881           HG1      PRO 881   2.491  -0.406  -4.534
  332    HD2  PRO 881           HD2      PRO 881   2.403   2.134  -6.132
  333    HD3  PRO 881           HD1      PRO 881   1.059   1.196  -5.456
  334    H    MET 882           H        MET 882   3.874   3.807  -1.608
  335    HA   MET 882           HA       MET 882   5.375   5.505  -3.506
  336    HB2  MET 882           HB2      MET 882   3.790   6.537  -1.142
  337    HB3  MET 882           HB1      MET 882   4.623   7.501  -2.349
  338    HG2  MET 882           HG2      MET 882   3.073   6.599  -4.056
  339    HG3  MET 882           HG1      MET 882   2.191   5.779  -2.771
  340    HE1  MET 882           HE1      MET 882   3.735   9.405  -3.388
  341    HE2  MET 882           HE2      MET 882   2.209  10.285  -3.623
  342    HE3  MET 882           HE3      MET 882   2.669   9.010  -4.748
  343    H    ILE 883           H        ILE 883   6.991   6.901  -2.467
  344    HA   ILE 883           HA       ILE 883   8.005   5.677  -0.035
  345    HB   ILE 883           HB       ILE 883   9.328   4.864  -1.990
  346   HG12  ILE 883          HG12      ILE 883  11.013   6.760  -0.357
  347   HG13  ILE 883          HG11      ILE 883  10.357   5.260   0.306
  348   HG21  ILE 883          HG21      ILE 883   9.062   6.800  -3.466
  349   HG22  ILE 883          HG22      ILE 883  10.772   6.422  -3.231
  350   HG23  ILE 883          HG23      ILE 883  10.046   7.771  -2.368
  351   HD11  ILE 883          HD11      ILE 883  12.669   5.009  -0.399
  352   HD12  ILE 883          HD12      ILE 883  12.239   5.518  -2.032
  353   HD13  ILE 883          HD13      ILE 883  11.606   4.006  -1.384
  354    H    GLY 884           H        GLY 884   8.576   7.023   1.471
  355    HA2  GLY 884           HA2      GLY 884   8.117   9.862   1.005
  356    HA3  GLY 884           HA1      GLY 884   8.172   9.038   2.548
  357    H    CYS 885           H        CYS 885   9.647  11.279   1.056
  358    HA   CYS 885           HA       CYS 885  12.392  10.511   1.295
  359    HB2  CYS 885           HB2      CYS 885  11.740  12.135  -0.350
  360    HB3  CYS 885           HB1      CYS 885  11.004  13.181   0.855
  361    H    ASP 886           H        ASP 886  13.797  11.715   2.779
  362    HA   ASP 886           HA       ASP 886  12.524  11.684   5.432
  363    HB2  ASP 886           HB2      ASP 886  14.493  10.181   5.072
  364    HB3  ASP 886           HB1      ASP 886  15.448  11.602   4.757
  365    H    ASP 887           H        ASP 887  14.123  13.780   3.223
  366    HA   ASP 887           HA       ASP 887  14.813  15.711   5.268
  367    HB2  ASP 887           HB2      ASP 887  16.198  15.388   3.216
  368    HB3  ASP 887           HB1      ASP 887  14.884  16.060   2.269
  369    H    CYS 888           H        CYS 888  12.677  15.720   2.438
  370    HA   CYS 888           HA       CYS 888  11.254  17.964   3.619
  371    HB2  CYS 888           HB2      CYS 888   9.954  17.984   1.514
  372    HB3  CYS 888           HB1      CYS 888  11.690  18.133   1.274
  373    H    ASP 889           H        ASP 889  10.920  14.582   3.400
  374    HA   ASP 889           HA       ASP 889   9.423  13.072   4.237
  375    HB2  ASP 889           HB2      ASP 889   9.508  14.493   6.302
  376    HB3  ASP 889           HB1      ASP 889   8.219  15.493   5.664
  377    H    ASP 890           H        ASP 890   9.071  14.444   1.739
  378    HA   ASP 890           HA       ASP 890   6.222  14.779   1.358
  379    HB2  ASP 890           HB2      ASP 890   8.297  16.072   0.303
  380    HB3  ASP 890           HB1      ASP 890   8.224  14.760  -0.860
  381    H    TRP 891           H        TRP 891   5.562  13.660  -0.893
  382    HA   TRP 891           HA       TRP 891   6.334  10.833  -0.650
  383    HD1  TRP 891           HD       TRP 891   3.448  12.470   1.833
  384    HE1  TRP 891           HE1      TRP 891   3.813  11.098   3.976
  385    HE3  TRP 891           HE3      TRP 891   5.255   8.199  -0.247
  386    HZ2  TRP 891           HZ2      TRP 891   4.757   8.549   4.672
  387    HZ3  TRP 891           HZ3      TRP 891   5.883   6.327   1.234
  388    HH2  TRP 891           HH       TRP 891   5.641   6.526   3.660
  389    HB2  TRP 891           HB2      TRP 891   3.520  11.895  -0.702
  390    HB3  TRP 891           HB1      TRP 891   3.897  10.233  -1.152
  391    H    TYR 892           H        TYR 892   7.122  10.094  -2.420
  392    HA   TYR 892           HA       TYR 892   6.109  11.092  -4.999
  393    HD1  TYR 892           HD2      TYR 892   8.809  11.972  -2.612
  394    HD2  TYR 892           HD1      TYR 892   8.821  12.243  -6.850
  395    HE1  TYR 892           HE2      TYR 892   9.812  14.196  -2.457
  396    HE2  TYR 892           HE1      TYR 892   9.838  14.470  -6.715
  397    HH   TYR 892           HH       TYR 892  11.260  15.578  -3.924
  398    HB2  TYR 892           HB2      TYR 892   8.778   9.920  -4.225
  399    HB3  TYR 892           HB1      TYR 892   8.277  10.232  -5.874
  400    H    HIS 893           H        HIS 893   5.801   9.528  -6.592
  401    HA   HIS 893           HA       HIS 893   5.215   6.849  -5.621
  402    HD2  HIS 893           HD2      HIS 893   2.356   6.436  -5.998
  403    HE1  HIS 893           HE1      HIS 893   0.856   9.775  -8.108
  404    HE2  HIS 893           HE2      HIS 893   0.285   7.825  -6.580
  405    HB2  HIS 893           HB2      HIS 893   5.110   7.941  -8.441
  406    HB3  HIS 893           HB1      HIS 893   4.655   6.307  -8.019
  407    H    TRP 894           H        TRP 894   6.096   4.973  -6.810
  408    HA   TRP 894           HA       TRP 894   8.882   5.032  -6.515
  409    HD1  TRP 894           HD       TRP 894   8.138   4.781  -4.461
  410    HE1  TRP 894           HE1      TRP 894   7.943   3.376  -2.299
  411    HE3  TRP 894           HE3      TRP 894   7.428   0.210  -6.554
  412    HZ2  TRP 894           HZ2      TRP 894   7.533   0.684  -1.601
  413    HZ3  TRP 894           HZ3      TRP 894   7.146  -1.707  -5.137
  414    HH2  TRP 894           HH       TRP 894   7.208  -1.497  -2.659
  415    HB2  TRP 894           HB2      TRP 894   6.973   2.891  -7.344
  416    HB3  TRP 894           HB1      TRP 894   8.708   2.631  -7.335
  417    HA   PRO 895           HA       PRO 895   9.253   4.214 -11.279
  418    HB2  PRO 895           HB2      PRO 895   7.208   5.004 -12.876
  419    HB3  PRO 895           HB1      PRO 895   7.293   3.378 -12.184
  420    HG2  PRO 895           HG2      PRO 895   5.809   5.777 -11.157
  421    HG3  PRO 895           HG1      PRO 895   5.184   4.139 -11.404
  422    HD2  PRO 895           HD2      PRO 895   5.926   4.935  -8.994
  423    HD3  PRO 895           HD1      PRO 895   6.333   3.298  -9.557
  424    H    CYS 896           H        CYS 896   7.883   6.928  -9.778
  425    HA   CYS 896           HA       CYS 896   8.623   8.851 -11.740
  426    HB2  CYS 896           HB2      CYS 896   7.789   9.202  -8.875
  427    HB3  CYS 896           HB1      CYS 896   7.660  10.382 -10.190
  428    H    VAL 897           H        VAL 897  10.022   7.374  -8.908
  429    HA   VAL 897           HA       VAL 897  12.246   9.290  -9.033
  430    HB   VAL 897           HB       VAL 897  12.787   8.676  -6.698
  431   HG11  VAL 897          HG11      VAL 897  11.485  10.669  -7.162
  432   HG12  VAL 897          HG12      VAL 897  10.875   9.901  -5.692
  433   HG13  VAL 897          HG13      VAL 897  10.010   9.713  -7.214
  434   HG21  VAL 897          HG21      VAL 897  11.166   7.471  -5.343
  435   HG22  VAL 897          HG22      VAL 897  11.705   6.462  -6.691
  436   HG23  VAL 897          HG23      VAL 897  10.133   7.249  -6.756
  437    H    GLY 898           H        GLY 898  11.478   6.025  -9.526
  438    HA2  GLY 898           HA2      GLY 898  13.050   4.654 -10.696
  439    HA3  GLY 898           HA1      GLY 898  14.342   5.509  -9.871
  440    H    ILE 899           H        ILE 899  11.542   4.420  -8.150
  441    HA   ILE 899           HA       ILE 899  13.219   2.433  -6.795
  442    HB   ILE 899           HB       ILE 899  10.640   3.794  -5.916
  443   HG12  ILE 899          HG12      ILE 899  12.722   5.147  -5.704
  444   HG13  ILE 899          HG11      ILE 899  11.931   4.843  -4.164
  445   HG21  ILE 899          HG21      ILE 899  10.590   1.485  -5.127
  446   HG22  ILE 899          HG22      ILE 899  10.831   2.591  -3.780
  447   HG23  ILE 899          HG23      ILE 899  12.194   1.678  -4.418
  448   HD11  ILE 899          HD11      ILE 899  13.589   3.105  -3.711
  449   HD12  ILE 899          HD12      ILE 899  14.299   4.697  -3.962
  450   HD13  ILE 899          HD13      ILE 899  14.388   3.481  -5.248
  451    H    MET 900           H        MET 900  12.697   0.327  -7.048
  452    HA   MET 900           HA       MET 900  10.205  -0.276  -8.546
  453    HB2  MET 900           HB2      MET 900  12.796  -1.823  -8.496
  454    HB3  MET 900           HB1      MET 900  11.342  -2.306  -9.358
  455    HG2  MET 900           HG2      MET 900  11.527  -0.345 -10.779
  456    HG3  MET 900           HG1      MET 900  12.960   0.174  -9.893
  457    HE1  MET 900           HE1      MET 900  11.421  -2.469 -12.334
  458    HE2  MET 900           HE2      MET 900  11.945  -3.507 -11.005
  459    HE3  MET 900           HE3      MET 900  12.761  -3.590 -12.563
  460    H    ALA 901           H        ALA 901  12.217  -1.149  -5.877
  461    HA   ALA 901           HA       ALA 901   9.973  -2.645  -4.790
  462    HB1  ALA 901           HB1      ALA 901  11.561  -4.281  -3.841
  463    HB2  ALA 901           HB2      ALA 901  12.878  -3.490  -4.712
  464    HB3  ALA 901           HB3      ALA 901  11.587  -4.298  -5.605
  465    H    ALA 902           H        ALA 902   9.864  -2.478  -2.563
  466    HA   ALA 902           HA       ALA 902  10.656   0.000  -1.568
  467    HB1  ALA 902           HB1      ALA 902   9.619  -0.709   0.523
  468    HB2  ALA 902           HB2      ALA 902   9.517  -2.364  -0.084
  469    HB3  ALA 902           HB3      ALA 902   8.602  -1.073  -0.868
  470    HA   PRO 903           HA       PRO 903  14.649  -1.444   0.092
  471    HB2  PRO 903           HB2      PRO 903  15.011   1.229   1.109
  472    HB3  PRO 903           HB1      PRO 903  15.867   0.472  -0.225
  473    HG2  PRO 903           HG2      PRO 903  14.131   2.575  -0.540
  474    HG3  PRO 903           HG1      PRO 903  14.510   1.403  -1.808
  475    HD2  PRO 903           HD2      PRO 903  12.131   1.578  -0.030
  476    HD3  PRO 903           HD1      PRO 903  12.245   1.099  -1.738
  477    HA   PRO 904           HA       PRO 904  13.609  -1.952   4.329
  478    HB2  PRO 904           HB2      PRO 904  15.930  -1.332   5.678
  479    HB3  PRO 904           HB1      PRO 904  15.654  -2.874   4.860
  480    HG2  PRO 904           HG2      PRO 904  17.137  -0.471   3.944
  481    HG3  PRO 904           HG1      PRO 904  17.559  -2.186   3.732
  482    HD2  PRO 904           HD2      PRO 904  16.485  -0.688   1.760
  483    HD3  PRO 904           HD1      PRO 904  16.122  -2.411   1.900
  484    H    GLU 905           H        GLU 905  12.525  -0.746   5.616
  485    HA   GLU 905           HA       GLU 905  12.056   1.942   5.300
  486    HB2  GLU 905           HB2      GLU 905  11.680   0.539   7.929
  487    HB3  GLU 905           HB1      GLU 905  10.758   1.883   7.285
  488    HG2  GLU 905           HG2      GLU 905   9.311   0.106   7.004
  489    HG3  GLU 905           HG1      GLU 905  10.109   0.224   5.428
  490    H    GLU 906           H        GLU 906  14.242   0.344   7.391
  491    HA   GLU 906           HA       GLU 906  14.908   2.580   9.034
  492    HB2  GLU 906           HB2      GLU 906  16.726   1.170   9.906
  493    HB3  GLU 906           HB1      GLU 906  15.171   0.354   9.908
  494    HG2  GLU 906           HG2      GLU 906  15.829  -0.820   7.840
  495    HG3  GLU 906           HG1      GLU 906  17.416  -0.057   7.951
  496    H    MET 907           H        MET 907  15.950   1.631   5.910
  497    HA   MET 907           HA       MET 907  18.400   3.166   6.101
  498    HB2  MET 907           HB2      MET 907  18.423   1.171   4.729
  499    HB3  MET 907           HB1      MET 907  17.090   1.807   3.762
  500    HG2  MET 907           HG2      MET 907  18.971   2.139   2.419
  501    HG3  MET 907           HG1      MET 907  18.686   3.707   3.148
  502    HE1  MET 907           HE1      MET 907  20.287   4.762   5.076
  503    HE2  MET 907           HE2      MET 907  21.786   4.014   5.600
  504    HE3  MET 907           HE3      MET 907  20.265   3.371   6.179
  505    H    GLN 908           H        GLN 908  18.492   5.142   5.511
  506    HA   GLN 908           HA       GLN 908  15.994   6.425   4.947
  507    HB2  GLN 908           HB2      GLN 908  18.687   7.658   5.437
  508    HB3  GLN 908           HB1      GLN 908  17.193   8.568   5.226
  509    HG2  GLN 908           HG2      GLN 908  17.787   6.579   7.412
  510    HG3  GLN 908           HG1      GLN 908  17.670   8.330   7.585
  511   HE21  GLN 908          HE21      GLN 908  15.635   9.285   7.491
  512   HE22  GLN 908          HE22      GLN 908  14.193   8.395   7.729
  513    H    TRP 909           H        TRP 909  15.790   8.122   3.378
  514    HA   TRP 909           HA       TRP 909  17.182   7.719   0.896
  515    HD1  TRP 909           HD       TRP 909  16.469   5.761  -1.628
  516    HE1  TRP 909           HE1      TRP 909  15.454   6.591  -3.854
  517    HE3  TRP 909           HE3      TRP 909  12.831   8.830   0.224
  518    HZ2  TRP 909           HZ2      TRP 909  13.369   8.315  -4.696
  519    HZ3  TRP 909           HZ3      TRP 909  11.376  10.032  -1.345
  520    HH2  TRP 909           HH       TRP 909  11.642   9.780  -3.748
  521    HB2  TRP 909           HB2      TRP 909  15.562   5.847   0.886
  522    HB3  TRP 909           HB1      TRP 909  14.258   6.963   1.251
  523    H    PHE 910           H        PHE 910  16.743   9.445  -0.491
  524    HA   PHE 910           HA       PHE 910  14.994  11.526   0.493
  525    HD1  PHE 910           HD1      PHE 910  16.133  13.430   2.458
  526    HD2  PHE 910           HD2      PHE 910  19.028  10.573   1.222
  527    HE1  PHE 910           HE1      PHE 910  16.876  13.174   4.783
  528    HE2  PHE 910           HE2      PHE 910  19.764  10.300   3.541
  529    HZ   PHE 910           HZ       PHE 910  18.668  11.586   5.333
  530    HB2  PHE 910           HB2      PHE 910  17.891  11.925  -0.378
  531    HB3  PHE 910           HB1      PHE 910  16.774  13.203   0.098
  532    H    CYS 911           H        CYS 911  14.158  12.702  -1.243
  533    HA   CYS 911           HA       CYS 911  13.837  11.212  -3.635
  534    HB2  CYS 911           HB2      CYS 911  12.384  13.106  -4.287
  535    HB3  CYS 911           HB1      CYS 911  12.078  12.556  -2.654
  536    HA   PRO 912           HA       PRO 912  16.770  12.909  -6.579
  537    HB2  PRO 912           HB2      PRO 912  15.162  13.850  -8.633
  538    HB3  PRO 912           HB1      PRO 912  15.632  12.159  -8.423
  539    HG2  PRO 912           HG2      PRO 912  13.136  13.552  -7.528
  540    HG3  PRO 912           HG1      PRO 912  13.299  11.978  -8.341
  541    HD2  PRO 912           HD2      PRO 912  12.886  12.056  -5.742
  542    HD3  PRO 912           HD1      PRO 912  14.096  10.943  -6.391
  543    H    LYS 913           H        LYS 913  14.640  14.846  -4.968
  544    HA   LYS 913           HA       LYS 913  15.792  17.360  -5.906
  545    HB2  LYS 913           HB2      LYS 913  13.600  16.729  -3.927
  546    HB3  LYS 913           HB1      LYS 913  14.185  18.354  -4.235
  547    HG2  LYS 913           HG2      LYS 913  12.913  16.560  -6.295
  548    HG3  LYS 913           HG1      LYS 913  12.068  17.816  -5.395
  549    HD2  LYS 913           HD2      LYS 913  13.719  19.460  -6.315
  550    HD3  LYS 913           HD1      LYS 913  14.343  18.164  -7.334
  551    HE2  LYS 913           HE2      LYS 913  12.179  17.908  -8.391
  552    HE3  LYS 913           HE1      LYS 913  11.491  19.133  -7.327
  553    HZ1  LYS 913           HZ1      LYS 913  13.629  19.564  -9.329
  554    HZ2  LYS 913           HZ2      LYS 913  12.990  20.755  -8.301
  555    HZ3  LYS 913           HZ3      LYS 913  12.021  20.066  -9.478
  556    H    CYS 914           H        CYS 914  15.219  15.584  -2.871
  557    HA   CYS 914           HA       CYS 914  17.043  17.222  -1.441
  558    HB2  CYS 914           HB2      CYS 914  15.427  14.829  -0.691
  559    HB3  CYS 914           HB1      CYS 914  16.517  15.570   0.467
  560    H    ALA 915           H        ALA 915  17.295  14.015  -2.827
  561    HA   ALA 915           HA       ALA 915  19.800  13.513  -1.533
  562    HB1  ALA 915           HB1      ALA 915  18.604  12.109  -3.918
  563    HB2  ALA 915           HB2      ALA 915  18.255  11.708  -2.249
  564    HB3  ALA 915           HB3      ALA 915  19.893  11.490  -2.879
  565    H    ASN 916           H        ASN 916  18.763  15.269  -4.082
  566    HA   ASN 916           HA       ASN 916  21.101  15.044  -5.796
  567    HB2  ASN 916           HB2      ASN 916  18.760  15.313  -6.677
  568    HB3  ASN 916           HB1      ASN 916  18.750  16.922  -5.991
  569   HD21  ASN 916          HD21      ASN 916  18.475  15.936  -8.703
  570   HD22  ASN 916          HD22      ASN 916  19.651  16.776  -9.648
  571    H    LYS 917           H        LYS 917  19.491  17.442  -3.748
  572    HA   LYS 917           HA       LYS 917  21.252  19.522  -4.168
  573    HB2  LYS 917           HB2      LYS 917  20.451  20.530  -2.066
  574    HB3  LYS 917           HB1      LYS 917  19.128  19.891  -3.028
  575    HG2  LYS 917           HG2      LYS 917  18.945  17.987  -1.616
  576    HG3  LYS 917           HG1      LYS 917  20.390  18.440  -0.731
  577    HD2  LYS 917           HD2      LYS 917  19.236  20.489   0.039
  578    HD3  LYS 917           HD1      LYS 917  17.775  19.939  -0.789
  579    HE2  LYS 917           HE2      LYS 917  17.707  17.945   0.580
  580    HE3  LYS 917           HE1      LYS 917  19.223  18.391   1.350
  581    HZ1  LYS 917           HZ1      LYS 917  16.716  19.956   1.510
  582    HZ2  LYS 917           HZ2      LYS 917  18.165  20.297   2.325
  583    HZ3  LYS 917           HZ3      LYS 917  17.285  18.901   2.690
  584    H    ILE 918           H        ILE 918  21.452  16.861  -1.958
  585    HA   ILE 918           HA       ILE 918  23.639  17.643  -0.345
  586    HB   ILE 918           HB       ILE 918  22.908  14.811  -1.182
  587   HG12  ILE 918          HG12      ILE 918  21.835  16.446   1.138
  588   HG13  ILE 918          HG11      ILE 918  20.950  15.952  -0.304
  589   HG21  ILE 918          HG21      ILE 918  23.903  14.148   0.963
  590   HG22  ILE 918          HG22      ILE 918  24.343  15.826   1.272
  591   HG23  ILE 918          HG23      ILE 918  25.075  14.959  -0.081
  592   HD11  ILE 918          HD11      ILE 918  20.368  14.561   1.603
  593   HD12  ILE 918          HD12      ILE 918  22.061  14.089   1.786
  594   HD13  ILE 918          HD13      ILE 918  21.167  13.615   0.346
  595    H    LYS 919           H        LYS 919  23.386  16.355  -3.540
  596    HA   LYS 919           HA       LYS 919  26.248  15.858  -3.641
  597    HB2  LYS 919           HB2      LYS 919  24.047  14.904  -5.466
  598    HB3  LYS 919           HB1      LYS 919  25.753  14.523  -5.640
  599    HG2  LYS 919           HG2      LYS 919  23.984  13.728  -3.332
  600    HG3  LYS 919           HG1      LYS 919  24.533  12.673  -4.634
  601    HD2  LYS 919           HD2      LYS 919  26.875  13.071  -3.908
  602    HD3  LYS 919           HD1      LYS 919  26.263  14.048  -2.575
  603    HE2  LYS 919           HE2      LYS 919  26.811  11.791  -1.820
  604    HE3  LYS 919           HE1      LYS 919  25.083  12.107  -1.677
  605    HZ1  LYS 919           HZ1      LYS 919  25.651   9.888  -2.594
  606    HZ2  LYS 919           HZ2      LYS 919  26.294  10.633  -3.966
  607    HZ3  LYS 919           HZ3      LYS 919  24.662  10.789  -3.594
  608    H    LYS 920           H        LYS 920  24.627  18.487  -3.986
  609    HA   LYS 920           HA       LYS 920  26.083  19.178  -6.442
  610    HB2  LYS 920           HB2      LYS 920  24.372  20.643  -7.228
  611    HB3  LYS 920           HB1      LYS 920  23.584  19.142  -6.779
  612    HG2  LYS 920           HG2      LYS 920  22.922  20.222  -4.635
  613    HG3  LYS 920           HG1      LYS 920  23.604  21.719  -5.236
  614    HD2  LYS 920           HD2      LYS 920  22.102  21.661  -7.182
  615    HD3  LYS 920           HD1      LYS 920  21.349  20.192  -6.563
  616    HE2  LYS 920           HE2      LYS 920  20.668  21.464  -4.535
  617    HE3  LYS 920           HE1      LYS 920  21.375  22.906  -5.254
  618    HZ1  LYS 920           HZ1      LYS 920  19.011  22.845  -5.566
  619    HZ2  LYS 920           HZ2      LYS 920  19.079  21.379  -6.390
  620    HZ3  LYS 920           HZ3      LYS 920  19.769  22.762  -7.054
  621    H    ASP 921           H        ASP 921  25.652  19.871  -3.143
  622    HA   ASP 921           HA       ASP 921  26.537  22.574  -3.460
  623    HB2  ASP 921           HB2      ASP 921  26.617  22.705  -0.925
  624    HB3  ASP 921           HB1      ASP 921  25.047  22.394  -1.635
  625    H    LYS 922           H        LYS 922  28.091  20.281  -1.262
  626    HA   LYS 922           HA       LYS 922  30.673  21.430  -1.994
  627    HB2  LYS 922           HB2      LYS 922  31.590  19.994  -0.239
  628    HB3  LYS 922           HB1      LYS 922  30.225  20.910   0.361
  629    HG2  LYS 922           HG2      LYS 922  28.787  18.998   0.231
  630    HG3  LYS 922           HG1      LYS 922  30.037  18.056  -0.570
  631    HD2  LYS 922           HD2      LYS 922  30.417  19.193   2.194
  632    HD3  LYS 922           HD1      LYS 922  29.620  17.650   1.934
  633    HE2  LYS 922           HE2      LYS 922  31.912  17.216   2.458
  634    HE3  LYS 922           HE1      LYS 922  31.681  16.856   0.759
  635    HZ1  LYS 922           HZ1      LYS 922  32.810  18.948   0.205
  636    HZ2  LYS 922           HZ2      LYS 922  33.752  18.012   1.208
  637    HZ3  LYS 922           HZ3      LYS 922  32.929  19.323   1.850
  638    H    LYS 923           H        LYS 923  28.739  19.153  -3.207
  639    HA   LYS 923           HA       LYS 923  30.882  17.333  -3.942
  640    HB2  LYS 923           HB2      LYS 923  28.989  16.269  -2.902
  641    HB3  LYS 923           HB1      LYS 923  27.896  17.027  -4.046
  642    HG2  LYS 923           HG2      LYS 923  28.258  14.653  -4.544
  643    HG3  LYS 923           HG1      LYS 923  28.810  15.699  -5.851
  644    HD2  LYS 923           HD2      LYS 923  31.108  15.464  -5.095
  645    HD3  LYS 923           HD1      LYS 923  30.574  14.472  -3.738
  646    HE2  LYS 923           HE2      LYS 923  31.458  13.122  -5.575
  647    HE3  LYS 923           HE1      LYS 923  29.763  12.782  -5.260
  648    HZ1  LYS 923           HZ1      LYS 923  30.310  12.953  -7.633
  649    HZ2  LYS 923           HZ2      LYS 923  30.719  14.574  -7.456
  650    HZ3  LYS 923           HZ3      LYS 923  29.147  14.065  -7.183
  651    H    HIS 924           H        HIS 924  31.775  17.560  -5.814
  652    HA   HIS 924           HA       HIS 924  30.153  18.222  -8.132
  653    HD1  HIS 924           HD1      HIS 924  30.334  20.450 -10.060
  654    HD2  HIS 924           HD2      HIS 924  34.288  19.184  -9.809
  655    HE1  HIS 924           HE1      HIS 924  31.273  20.773 -12.328
  656    HE2  HIS 924           HE2      HIS 924  33.639  19.961 -12.206
  657    HB2  HIS 924           HB2      HIS 924  31.414  20.273  -7.553
  658    HB3  HIS 924           HB1      HIS 924  32.904  19.348  -7.458
  Start of MODEL   17
    1    HA   ALA   1           HA       ALA   1  11.887   6.254   1.881
    2    H1   ALA   1           HT1      ALA   1  13.093   7.193   3.734
    3    H2   ALA   1           HT2      ALA   1  12.326   6.118   4.784
    4    H3   ALA   1           HT3      ALA   1  11.435   7.271   3.920
    5    HB1  ALA   1           HB1      ALA   1  13.600   4.213   3.357
    6    HB2  ALA   1           HB2      ALA   1  14.239   5.576   2.550
    7    HB3  ALA   1           HB3      ALA   1  13.325   4.327   1.591
    8    H    ARG   2           H        ARG   2  10.157   6.140   4.303
    9    HA   ARG   2           HA       ARG   2   9.102   3.661   4.807
   10    HE   ARG   2           HE       ARG   2   4.861   4.125   7.205
   11    HB2  ARG   2           HB2      ARG   2   8.585   5.913   5.912
   12    HB3  ARG   2           HB1      ARG   2   7.588   6.239   4.516
   13    HG2  ARG   2           HG2      ARG   2   6.200   4.328   5.028
   14    HG3  ARG   2           HG1      ARG   2   7.244   3.984   6.417
   15    HD2  ARG   2           HD2      ARG   2   6.689   6.124   7.417
   16    HD3  ARG   2           HD1      ARG   2   5.694   6.540   6.024
   17   HH11  ARG   2          HH11      ARG   2   4.730   7.618   7.647
   18   HH12  ARG   2          HH12      ARG   2   3.278   7.606   8.540
   19   HH21  ARG   2          HH21      ARG   2   2.860   4.095   8.407
   20   HH22  ARG   2          HH22      ARG   2   2.200   5.561   8.996
   21    H    THR   3           H        THR   3   7.848   2.357   3.614
   22    HA   THR   3           HA       THR   3   6.970   3.386   1.058
   23    HB   THR   3           HB       THR   3   7.268   0.941   0.360
   24    HG1  THR   3           HG1      THR   3   9.268   0.931   2.332
   25   HG21  THR   3          HG21      THR   3   9.622   1.369  -0.196
   26   HG22  THR   3          HG22      THR   3   9.662   2.671   0.992
   27   HG23  THR   3          HG23      THR   3   8.646   2.818  -0.437
   28    HA   M3L   4           HA       M3L   4   3.360   1.182   2.090
   29    H    M3L   4           H        M3L   4   4.963   3.051   0.526
   30    HB2  M3L   4           HB2      M3L   4   3.117   3.630   2.840
   31    HB3  M3L   4           HB1      M3L   4   1.635   2.798   2.391
   32    HG2  M3L   4           HG2      M3L   4   2.306   3.885   0.013
   33    HG3  M3L   4           HG1      M3L   4   3.006   5.083   1.098
   34    HD2  M3L   4           HD2      M3L   4   0.561   5.385   0.325
   35    HD3  M3L   4           HD1      M3L   4   0.199   4.103   1.478
   36    HE2  M3L   4           HE2      M3L   4   0.414   5.450   3.209
   37    HE3  M3L   4           HE1      M3L   4   1.968   5.983   2.679
   38   HM11  M3L   4          HM11      M3L   4   0.126   7.408  -0.199
   39   HM12  M3L   4          HM12      M3L   4   0.941   8.764   0.530
   40   HM13  M3L   4          HM13      M3L   4   1.757   7.247   0.339
   41   HM21  M3L   4          HM21      M3L   4  -1.519   6.205   1.524
   42   HM22  M3L   4          HM22      M3L   4  -1.680   7.927   1.446
   43   HM23  M3L   4          HM23      M3L   4  -1.598   7.128   2.991
   44   HM31  M3L   4          HM31      M3L   4   0.831   7.820   4.008
   45   HM32  M3L   4          HM32      M3L   4   0.095   9.096   3.096
   46   HM33  M3L   4          HM33      M3L   4   1.752   8.660   2.810
   47    H    GLN   5           H        GLN   5   1.337   0.704   0.909
   48    HA   GLN   5           HA       GLN   5   1.214   1.572  -1.815
   49    HB2  GLN   5           HB2      GLN   5   2.560  -0.539  -1.938
   50    HB3  GLN   5           HB1      GLN   5   1.234  -1.387  -1.146
   51    HG2  GLN   5           HG2      GLN   5  -0.250  -0.705  -3.035
   52    HG3  GLN   5           HG1      GLN   5   1.152  -0.005  -3.812
   53   HE21  GLN   5          HE21      GLN   5   2.941  -2.208  -2.986
   54   HE22  GLN   5          HE22      GLN   5   2.465  -3.495  -4.018
   55    H    THR   6           H        THR   6  -0.745   2.380  -1.789
   56    HA   THR   6           HA       THR   6  -2.774   1.583  -0.026
   57    HB   THR   6           HB       THR   6  -2.913   3.095  -2.636
   58    HG1  THR   6           HG1      THR   6  -2.197   4.712  -1.645
   59   HG21  THR   6          HG21      THR   6  -5.127   2.369  -1.835
   60   HG22  THR   6          HG22      THR   6  -4.952   4.121  -1.710
   61   HG23  THR   6          HG23      THR   6  -4.809   3.114  -0.266
   62    H    ALA   7           H        ALA   7  -1.811   0.636  -3.228
   63    HA   ALA   7           HA       ALA   7  -2.311  -1.035  -4.602
   64    HB1  ALA   7           HB1      ALA   7  -3.756  -2.239  -2.230
   65    HB2  ALA   7           HB2      ALA   7  -2.054  -2.472  -2.617
   66    HB3  ALA   7           HB3      ALA   7  -3.298  -3.099  -3.698
   67    H    ARG   8           H        ARG   8  -4.427  -2.488  -5.202
   68    HA   ARG   8           HA       ARG   8  -6.657  -0.603  -5.401
   69    HE   ARG   8           HE       ARG   8  -2.679  -0.540  -9.045
   70    HB2  ARG   8           HB2      ARG   8  -6.185  -2.669  -7.543
   71    HB3  ARG   8           HB1      ARG   8  -7.100  -1.180  -7.644
   72    HG2  ARG   8           HG2      ARG   8  -5.304  -0.749  -8.961
   73    HG3  ARG   8           HG1      ARG   8  -4.792  -0.027  -7.435
   74    HD2  ARG   8           HD2      ARG   8  -3.655  -2.186  -6.886
   75    HD3  ARG   8           HD1      ARG   8  -3.999  -2.725  -8.527
   76   HH11  ARG   8          HH11      ARG   8  -2.005  -3.011  -6.579
   77   HH12  ARG   8          HH12      ARG   8  -0.321  -2.739  -6.575
   78   HH21  ARG   8          HH21      ARG   8  -0.312  -0.232  -9.032
   79   HH22  ARG   8          HH22      ARG   8   0.642  -1.205  -8.012
   80    H    LYS   9           H        LYS   9  -7.425  -1.513  -3.653
   81    HA   LYS   9           HA       LYS   9  -7.454  -4.350  -3.420
   82    HB2  LYS   9           HB2      LYS   9  -6.931  -3.001  -1.450
   83    HB3  LYS   9           HB1      LYS   9  -8.540  -2.298  -1.493
   84    HG2  LYS   9           HG2      LYS   9  -8.340  -4.063   0.202
   85    HG3  LYS   9           HG1      LYS   9  -9.529  -4.478  -1.039
   86    HD2  LYS   9           HD2      LYS   9  -7.839  -5.861  -2.170
   87    HD3  LYS   9           HD1      LYS   9  -6.677  -5.466  -0.903
   88    HE2  LYS   9           HE2      LYS   9  -8.078  -6.569   0.736
   89    HE3  LYS   9           HE1      LYS   9  -9.307  -6.879  -0.492
   90    HZ1  LYS   9           HZ1      LYS   9  -7.748  -8.266  -1.673
   91    HZ2  LYS   9           HZ2      LYS   9  -7.905  -8.824  -0.097
   92    HZ3  LYS   9           HZ3      LYS   9  -6.544  -7.941  -0.548
   93    H    SER  10           H        SER  10  -8.744  -5.285  -4.719
   94    HA   SER  10           HA       SER  10 -11.378  -4.543  -5.328
   95    HG   SER  10           HG       SER  10  -9.862  -5.258  -7.393
   96    HB2  SER  10           HB2      SER  10 -10.160  -7.295  -5.456
   97    HB3  SER  10           HB1      SER  10 -11.383  -6.589  -6.516
   98    H    THR  11           H        THR  11 -12.667  -4.371  -3.538
   99    HA   THR  11           HA       THR  11 -12.437  -6.289  -1.417
  100    HB   THR  11           HB       THR  11 -14.321  -3.924  -1.692
  101    HG1  THR  11           HG1      THR  11 -11.983  -3.467  -1.651
  102   HG21  THR  11          HG21      THR  11 -15.064  -5.617  -0.043
  103   HG22  THR  11          HG22      THR  11 -14.554  -4.128   0.748
  104   HG23  THR  11          HG23      THR  11 -13.486  -5.531   0.743
  105    H    GLY  12           H        GLY  12 -13.217  -8.186  -1.880
  106    HA2  GLY  12           HA2      GLY  12 -16.034  -8.464  -2.532
  107    HA3  GLY  12           HA1      GLY  12 -14.874  -9.196  -3.635
  108    H    GLY  13           H        GLY  13 -13.723 -10.980  -3.011
  109    HA2  GLY  13           HA2      GLY  13 -12.934 -12.168  -0.928
  110    HA3  GLY  13           HA1      GLY  13 -14.657 -12.263  -0.564
  111    H1   GLY 850           HT1      GLY 850  -3.362  30.743   1.932
  112    H2   GLY 850           HT2      GLY 850  -2.887  30.108   3.431
  113    H3   GLY 850           HT3      GLY 850  -4.422  30.790   3.246
  114    HA2  GLY 850           HA1      GLY 850  -4.536  28.398   3.286
  115    HA3  GLY 850           HA2      GLY 850  -5.029  29.043   1.722
  116    H    SER 851           H        SER 851  -4.323  27.701   0.157
  117    HA   SER 851           HA       SER 851  -2.352  25.776   0.455
  118    HG   SER 851           HG       SER 851  -4.351  25.136  -0.203
  119    HB2  SER 851           HB2      SER 851  -3.445  26.947  -2.100
  120    HB3  SER 851           HB1      SER 851  -2.591  25.406  -1.943
  121    H    HIS 852           H        HIS 852  -1.960  29.113  -0.408
  122    HA   HIS 852           HA       HIS 852   0.477  28.929  -1.826
  123    HD2  HIS 852           HD2      HIS 852  -0.481  30.333  -3.897
  124    HE1  HIS 852           HE1      HIS 852  -3.471  33.176  -2.947
  125    HE2  HIS 852           HE2      HIS 852  -2.275  31.986  -4.809
  126    HB2  HIS 852           HB2      HIS 852  -0.422  31.194  -0.034
  127    HB3  HIS 852           HB1      HIS 852   0.888  31.273  -1.193
  128    H    MET 853           H        MET 853  -0.253  28.787   1.574
  129    HA   MET 853           HA       MET 853   2.627  28.777   2.237
  130    HB2  MET 853           HB2      MET 853   0.263  29.293   4.061
  131    HB3  MET 853           HB1      MET 853   1.954  29.380   4.513
  132    HG2  MET 853           HG2      MET 853   0.575  31.182   2.536
  133    HG3  MET 853           HG1      MET 853   0.967  31.598   4.202
  134    HE1  MET 853           HE1      MET 853   3.403  33.804   2.039
  135    HE2  MET 853           HE2      MET 853   2.142  33.818   3.272
  136    HE3  MET 853           HE3      MET 853   1.757  33.333   1.621
  137    H    ALA 854           H        ALA 854   0.696  26.684   1.264
  138    HA   ALA 854           HA       ALA 854   1.357  24.619   3.216
  139    HB1  ALA 854           HB1      ALA 854  -0.928  25.325   3.771
  140    HB2  ALA 854           HB2      ALA 854  -0.930  23.699   3.085
  141    HB3  ALA 854           HB3      ALA 854  -1.422  25.075   2.097
  142    H    MET 855           H        MET 855   2.596  25.251   0.832
  143    HA   MET 855           HA       MET 855   1.485  23.718  -1.300
  144    HB2  MET 855           HB2      MET 855   4.215  25.011  -1.080
  145    HB3  MET 855           HB1      MET 855   3.605  24.203  -2.514
  146    HG2  MET 855           HG2      MET 855   1.767  25.836  -2.629
  147    HG3  MET 855           HG1      MET 855   2.431  26.658  -1.223
  148    HE1  MET 855           HE1      MET 855   1.748  28.131  -3.931
  149    HE2  MET 855           HE2      MET 855   3.169  29.145  -4.172
  150    HE3  MET 855           HE3      MET 855   2.474  28.979  -2.564
  151    H    ALA 856           H        ALA 856   1.222  21.791  -0.390
  152    HA   ALA 856           HA       ALA 856   3.589  20.056  -0.453
  153    HB1  ALA 856           HB1      ALA 856   1.118  19.786   1.287
  154    HB2  ALA 856           HB2      ALA 856   2.751  20.157   1.847
  155    HB3  ALA 856           HB3      ALA 856   2.397  18.577   1.153
  156    H    TYR 857           H        TYR 857   2.624  17.656  -0.935
  157    HA   TYR 857           HA       TYR 857   0.891  18.215  -3.174
  158    HD1  TYR 857           HD1      TYR 857   4.559  18.120  -3.027
  159    HD2  TYR 857           HD2      TYR 857   1.641  17.175  -5.958
  160    HE1  TYR 857           HE1      TYR 857   5.709  19.582  -4.636
  161    HE2  TYR 857           HE2      TYR 857   2.753  18.600  -7.571
  162    HH   TYR 857           HH       TYR 857   5.867  19.778  -7.136
  163    HB2  TYR 857           HB2      TYR 857   3.010  16.191  -2.755
  164    HB3  TYR 857           HB1      TYR 857   1.729  15.923  -3.938
  165    H    VAL 858           H        VAL 858   0.469  17.231  -0.290
  166    HA   VAL 858           HA       VAL 858  -1.427  15.111  -0.807
  167    HB   VAL 858           HB       VAL 858  -0.201  15.017   1.296
  168   HG11  VAL 858          HG11      VAL 858  -0.558  16.633   3.093
  169   HG12  VAL 858          HG12      VAL 858  -1.522  17.626   1.992
  170   HG13  VAL 858          HG13      VAL 858   0.195  17.362   1.671
  171   HG21  VAL 858          HG21      VAL 858  -2.433  14.048   1.292
  172   HG22  VAL 858          HG22      VAL 858  -3.128  15.592   1.780
  173   HG23  VAL 858          HG23      VAL 858  -2.060  14.720   2.876
  174    H    ILE 859           H        ILE 859  -3.550  15.259  -1.024
  175    HA   ILE 859           HA       ILE 859  -4.946  17.773  -0.449
  176    HB   ILE 859           HB       ILE 859  -6.381  17.469  -2.420
  177   HG12  ILE 859          HG12      ILE 859  -4.604  15.133  -3.201
  178   HG13  ILE 859          HG11      ILE 859  -6.231  14.995  -2.543
  179   HG21  ILE 859          HG21      ILE 859  -4.804  17.965  -4.235
  180   HG22  ILE 859          HG22      ILE 859  -3.477  17.460  -3.188
  181   HG23  ILE 859          HG23      ILE 859  -4.456  18.862  -2.756
  182   HD11  ILE 859          HD11      ILE 859  -5.496  16.294  -5.160
  183   HD12  ILE 859          HD12      ILE 859  -7.124  16.143  -4.501
  184   HD13  ILE 859          HD13      ILE 859  -6.221  14.699  -4.958
  185    H    ARG 860           H        ARG 860  -7.389  17.204  -0.336
  186    HA   ARG 860           HA       ARG 860  -7.605  14.510   0.775
  187    HE   ARG 860           HE       ARG 860  -8.681  17.088   4.001
  188    HB2  ARG 860           HB2      ARG 860  -9.539  15.264   2.062
  189    HB3  ARG 860           HB1      ARG 860  -8.081  16.141   2.478
  190    HG2  ARG 860           HG2      ARG 860  -8.849  18.043   1.181
  191    HG3  ARG 860           HG1      ARG 860 -10.287  17.113   0.712
  192    HD2  ARG 860           HD2      ARG 860 -10.788  18.612   2.582
  193    HD3  ARG 860           HD1      ARG 860 -10.930  16.882   2.955
  194   HH11  ARG 860          HH11      ARG 860 -10.753  19.972   3.862
  195   HH12  ARG 860          HH12      ARG 860 -10.157  20.593   5.338
  196   HH21  ARG 860          HH21      ARG 860  -7.880  17.983   5.973
  197   HH22  ARG 860          HH22      ARG 860  -8.492  19.477   6.537
  198    H    ASP 861           H        ASP 861  -9.199  13.180   0.145
  199    HA   ASP 861           HA       ASP 861 -10.233  13.741  -2.508
  200    HB2  ASP 861           HB2      ASP 861 -10.711  11.443  -2.688
  201    HB3  ASP 861           HB1      ASP 861  -9.307  11.454  -1.632
  202    H    GLU 862           H        GLU 862 -12.630  12.616  -2.668
  203    HA   GLU 862           HA       GLU 862 -14.345  14.526  -1.576
  204    HB2  GLU 862           HB2      GLU 862 -16.165  13.216  -2.484
  205    HB3  GLU 862           HB1      GLU 862 -14.850  13.365  -3.638
  206    HG2  GLU 862           HG2      GLU 862 -14.141  11.091  -3.117
  207    HG3  GLU 862           HG1      GLU 862 -15.456  10.950  -1.955
  208    H    TRP 863           H        TRP 863 -13.409  11.337  -0.344
  209    HA   TRP 863           HA       TRP 863 -15.531  11.392   1.567
  210    HD1  TRP 863           HD       TRP 863 -16.909   9.807   0.742
  211    HE1  TRP 863           HE1      TRP 863 -17.579   8.157  -1.187
  212    HE3  TRP 863           HE3      TRP 863 -12.442   7.704   0.014
  213    HZ2  TRP 863           HZ2      TRP 863 -16.274   6.210  -2.784
  214    HZ3  TRP 863           HZ3      TRP 863 -12.163   5.931  -1.716
  215    HH2  TRP 863           HH       TRP 863 -14.063   5.215  -3.076
  216    HB2  TRP 863           HB2      TRP 863 -13.180   9.529   1.300
  217    HB3  TRP 863           HB1      TRP 863 -14.484   9.323   2.471
  218    H    GLY 864           H        GLY 864 -12.172  12.229   1.443
  219    HA2  GLY 864           HA2      GLY 864 -11.536  14.079   2.925
  220    HA3  GLY 864           HA1      GLY 864 -12.464  13.290   4.189
  221    H    ASN 865           H        ASN 865 -10.373  11.570   1.999
  222    HA   ASN 865           HA       ASN 865  -8.606  10.784   4.219
  223    HB2  ASN 865           HB2      ASN 865  -8.763   9.793   1.355
  224    HB3  ASN 865           HB1      ASN 865  -7.756   9.113   2.619
  225   HD21  ASN 865          HD21      ASN 865 -10.961   9.501   1.420
  226   HD22  ASN 865          HD22      ASN 865 -11.682   8.193   2.317
  227    H    GLN 866           H        GLN 866  -6.244  10.807   3.738
  228    HA   GLN 866           HA       GLN 866  -5.599  13.209   2.263
  229    HB2  GLN 866           HB2      GLN 866  -3.970  11.440   4.065
  230    HB3  GLN 866           HB1      GLN 866  -3.253  12.723   3.110
  231    HG2  GLN 866           HG2      GLN 866  -4.669  14.331   4.230
  232    HG3  GLN 866           HG1      GLN 866  -5.343  13.049   5.239
  233   HE21  GLN 866          HE21      GLN 866  -2.552  15.032   4.630
  234   HE22  GLN 866          HE22      GLN 866  -1.659  14.575   6.018
  235    H    ILE 867           H        ILE 867  -5.159  13.123   0.280
  236    HA   ILE 867           HA       ILE 867  -4.102  10.642  -0.908
  237    HB   ILE 867           HB       ILE 867  -5.538  12.933  -2.284
  238   HG12  ILE 867          HG12      ILE 867  -7.111  11.725  -0.862
  239   HG13  ILE 867          HG11      ILE 867  -7.436  11.386  -2.559
  240   HG21  ILE 867          HG21      ILE 867  -4.694  10.247  -3.361
  241   HG22  ILE 867          HG22      ILE 867  -3.988  11.807  -3.771
  242   HG23  ILE 867          HG23      ILE 867  -5.652  11.443  -4.235
  243   HD11  ILE 867          HD11      ILE 867  -6.305   9.227  -2.326
  244   HD12  ILE 867          HD12      ILE 867  -7.671   9.396  -1.220
  245   HD13  ILE 867          HD13      ILE 867  -6.021   9.575  -0.618
  246    H    TRP 868           H        TRP 868  -2.010  10.774  -1.386
  247    HA   TRP 868           HA       TRP 868  -0.815  13.385  -1.663
  248    HD1  TRP 868           HD       TRP 868   2.167  13.786  -0.297
  249    HE1  TRP 868           HE1      TRP 868   2.089  14.233   2.236
  250    HE3  TRP 868           HE3      TRP 868  -1.357  10.353   0.991
  251    HZ2  TRP 868           HZ2      TRP 868   0.695  13.238   4.495
  252    HZ3  TRP 868           HZ3      TRP 868  -2.012  10.162   3.357
  253    HH2  TRP 868           HH       TRP 868  -1.000  11.576   5.063
  254    HB2  TRP 868           HB2      TRP 868   0.274  10.668  -1.106
  255    HB3  TRP 868           HB1      TRP 868   1.321  11.893  -1.812
  256    H    ILE 869           H        ILE 869   0.047  14.130  -3.402
  257    HA   ILE 869           HA       ILE 869  -0.111  12.609  -5.866
  258    HB   ILE 869           HB       ILE 869   0.016  15.577  -5.235
  259   HG12  ILE 869          HG12      ILE 869  -1.903  15.727  -6.800
  260   HG13  ILE 869          HG11      ILE 869  -1.844  13.982  -6.997
  261   HG21  ILE 869          HG21      ILE 869   0.303  16.098  -7.575
  262   HG22  ILE 869          HG22      ILE 869   0.512  14.383  -7.924
  263   HG23  ILE 869          HG23      ILE 869   1.688  15.222  -6.916
  264   HD11  ILE 869          HD11      ILE 869  -3.638  14.625  -5.555
  265   HD12  ILE 869          HD12      ILE 869  -2.520  15.481  -4.479
  266   HD13  ILE 869          HD13      ILE 869  -2.431  13.723  -4.639
  267    H    CYS 870           H        CYS 870   1.648  12.024  -6.892
  268    HA   CYS 870           HA       CYS 870   4.134  12.087  -5.529
  269    HB2  CYS 870           HB2      CYS 870   3.481  10.216  -6.953
  270    HB3  CYS 870           HB1      CYS 870   3.357  11.286  -8.336
  271    HA   PRO 871           HA       PRO 871   5.045  16.202  -7.198
  272    HB2  PRO 871           HB2      PRO 871   7.634  15.775  -5.847
  273    HB3  PRO 871           HB1      PRO 871   6.452  17.067  -5.615
  274    HG2  PRO 871           HG2      PRO 871   6.811  15.160  -3.767
  275    HG3  PRO 871           HG1      PRO 871   5.209  15.837  -4.106
  276    HD2  PRO 871           HD2      PRO 871   6.393  13.237  -5.007
  277    HD3  PRO 871           HD1      PRO 871   4.753  13.606  -4.418
  278    H    GLY 872           H        GLY 872   6.282  13.251  -8.038
  279    HA2  GLY 872           HA2      GLY 872   8.468  14.236  -9.660
  280    HA3  GLY 872           HA1      GLY 872   7.943  12.563  -9.512
  281    H    CYS 873           H        CYS 873   5.159  13.059 -10.107
  282    HA   CYS 873           HA       CYS 873   5.385  13.673 -12.985
  283    HB2  CYS 873           HB2      CYS 873   3.530  11.975 -13.161
  284    HB3  CYS 873           HB1      CYS 873   5.111  11.344 -12.693
  285    H    ASN 874           H        ASN 874   3.760  14.242 -10.030
  286    HA   ASN 874           HA       ASN 874   2.202  15.592  -9.285
  287    HB2  ASN 874           HB2      ASN 874   2.958  17.261 -11.096
  288    HB3  ASN 874           HB1      ASN 874   1.639  16.648 -12.084
  289   HD21  ASN 874          HD21      ASN 874   0.548  18.618 -12.108
  290   HD22  ASN 874          HD22      ASN 874  -0.264  19.255 -10.723
  291    H    LYS 875           H        LYS 875   1.832  12.919 -10.404
  292    HA   LYS 875           HA       LYS 875  -1.057  12.943 -10.826
  293    HB2  LYS 875           HB2      LYS 875   0.959  10.698 -10.999
  294    HB3  LYS 875           HB1      LYS 875  -0.773  10.512 -11.218
  295    HG2  LYS 875           HG2      LYS 875  -0.702  11.885 -13.207
  296    HG3  LYS 875           HG1      LYS 875   1.014  12.205 -12.952
  297    HD2  LYS 875           HD2      LYS 875   0.717  10.463 -14.642
  298    HD3  LYS 875           HD1      LYS 875   1.489   9.803 -13.202
  299    HE2  LYS 875           HE2      LYS 875  -0.730   8.943 -12.463
  300    HE3  LYS 875           HE1      LYS 875  -1.427   9.540 -13.967
  301    HZ1  LYS 875           HZ1      LYS 875   0.029   8.018 -15.176
  302    HZ2  LYS 875           HZ2      LYS 875  -0.921   7.183 -14.079
  303    HZ3  LYS 875           HZ3      LYS 875   0.694   7.476 -13.722
  304    HA   PRO 876           HA       PRO 876  -1.583  11.819  -6.515
  305    HB2  PRO 876           HB2      PRO 876  -4.100  10.786  -6.728
  306    HB3  PRO 876           HB1      PRO 876  -3.751  12.511  -6.602
  307    HG2  PRO 876           HG2      PRO 876  -4.458  10.885  -8.977
  308    HG3  PRO 876           HG1      PRO 876  -4.846  12.578  -8.568
  309    HD2  PRO 876           HD2      PRO 876  -2.883  11.839 -10.379
  310    HD3  PRO 876           HD1      PRO 876  -2.905  13.368  -9.482
  311    H    ASP 877           H        ASP 877  -2.345   9.895  -5.281
  312    HA   ASP 877           HA       ASP 877  -0.983   7.630  -6.294
  313    HB2  ASP 877           HB2      ASP 877  -0.803   8.031  -3.941
  314    HB3  ASP 877           HB1      ASP 877  -2.542   7.975  -3.725
  315    H    ASP 878           H        ASP 878  -1.609   6.184  -7.438
  316    HA   ASP 878           HA       ASP 878  -4.383   5.822  -8.229
  317    HB2  ASP 878           HB2      ASP 878  -2.825   6.073 -10.026
  318    HB3  ASP 878           HB1      ASP 878  -1.702   4.945  -9.293
  319    H    GLY 879           H        GLY 879  -2.385   4.644  -5.908
  320    HA2  GLY 879           HA2      GLY 879  -3.094   2.885  -4.483
  321    HA3  GLY 879           HA1      GLY 879  -3.711   2.033  -5.900
  322    H    SER 880           H        SER 880  -0.711   3.747  -5.512
  323    HA   SER 880           HA       SER 880   0.644   1.353  -6.546
  324    HG   SER 880           HG       SER 880  -0.504   3.008  -7.913
  325    HB2  SER 880           HB2      SER 880   1.471   4.255  -6.729
  326    HB3  SER 880           HB1      SER 880   2.140   2.886  -7.624
  327    HA   PRO 881           HA       PRO 881   3.273   1.542  -2.935
  328    HB2  PRO 881           HB2      PRO 881   5.596   0.956  -4.651
  329    HB3  PRO 881           HB1      PRO 881   4.896  -0.029  -3.365
  330    HG2  PRO 881           HG2      PRO 881   4.643  -0.784  -5.918
  331    HG3  PRO 881           HG1      PRO 881   3.324  -0.985  -4.762
  332    HD2  PRO 881           HD2      PRO 881   3.707   1.190  -6.783
  333    HD3  PRO 881           HD1      PRO 881   2.264   0.201  -6.437
  334    H    MET 882           H        MET 882   4.111   3.246  -2.005
  335    HA   MET 882           HA       MET 882   5.421   5.300  -3.671
  336    HB2  MET 882           HB2      MET 882   3.649   5.862  -1.291
  337    HB3  MET 882           HB1      MET 882   4.333   7.028  -2.411
  338    HG2  MET 882           HG2      MET 882   2.922   6.003  -4.207
  339    HG3  MET 882           HG1      MET 882   2.185   5.013  -2.946
  340    HE1  MET 882           HE1      MET 882   1.751   9.580  -3.362
  341    HE2  MET 882           HE2      MET 882   2.441   8.515  -4.591
  342    HE3  MET 882           HE3      MET 882   3.303   8.782  -3.078
  343    H    ILE 883           H        ILE 883   6.977   6.566  -2.570
  344    HA   ILE 883           HA       ILE 883   7.903   5.455  -0.027
  345    HB   ILE 883           HB       ILE 883   9.488   4.676  -1.761
  346   HG12  ILE 883          HG12      ILE 883  10.840   6.949  -0.357
  347   HG13  ILE 883          HG11      ILE 883  10.348   5.472   0.492
  348   HG21  ILE 883          HG21      ILE 883   9.853   7.604  -2.424
  349   HG22  ILE 883          HG22      ILE 883   9.036   6.427  -3.451
  350   HG23  ILE 883          HG23      ILE 883  10.767   6.270  -3.123
  351   HD11  ILE 883          HD11      ILE 883  11.783   4.201  -1.016
  352   HD12  ILE 883          HD12      ILE 883  12.685   5.449  -0.153
  353   HD13  ILE 883          HD13      ILE 883  12.227   5.695  -1.840
  354    H    GLY 884           H        GLY 884   8.384   6.883   1.488
  355    HA2  GLY 884           HA2      GLY 884   7.835   9.688   0.891
  356    HA3  GLY 884           HA1      GLY 884   7.880   8.958   2.492
  357    H    CYS 885           H        CYS 885   9.322  11.165   0.841
  358    HA   CYS 885           HA       CYS 885  12.136  10.594   1.157
  359    HB2  CYS 885           HB2      CYS 885  11.252  12.138  -0.552
  360    HB3  CYS 885           HB1      CYS 885  10.597  13.161   0.701
  361    H    ASP 886           H        ASP 886  13.448  11.214   2.888
  362    HA   ASP 886           HA       ASP 886  12.041  11.621   5.343
  363    HB2  ASP 886           HB2      ASP 886  14.259  10.389   5.115
  364    HB3  ASP 886           HB1      ASP 886  14.980  11.943   4.873
  365    H    ASP 887           H        ASP 887  13.341  13.794   3.010
  366    HA   ASP 887           HA       ASP 887  13.777  15.833   5.037
  367    HB2  ASP 887           HB2      ASP 887  15.326  15.587   3.070
  368    HB3  ASP 887           HB1      ASP 887  14.042  16.274   2.076
  369    H    CYS 888           H        CYS 888  11.868  15.813   2.032
  370    HA   CYS 888           HA       CYS 888  10.387  18.082   2.974
  371    HB2  CYS 888           HB2      CYS 888   9.057  17.743   0.837
  372    HB3  CYS 888           HB1      CYS 888  10.777  18.032   0.630
  373    H    ASP 889           H        ASP 889  10.029  14.714   2.963
  374    HA   ASP 889           HA       ASP 889   8.540  13.229   3.651
  375    HB2  ASP 889           HB2      ASP 889   8.902  14.337   5.862
  376    HB3  ASP 889           HB1      ASP 889   7.535  15.390   5.542
  377    H    ASP 890           H        ASP 890   7.870  13.726   1.420
  378    HA   ASP 890           HA       ASP 890   4.983  13.846   1.540
  379    HB2  ASP 890           HB2      ASP 890   6.142  16.011   0.467
  380    HB3  ASP 890           HB1      ASP 890   6.392  14.944  -0.909
  381    H    TRP 891           H        TRP 891   4.420  12.892  -0.955
  382    HA   TRP 891           HA       TRP 891   5.955  10.395  -0.755
  383    HD1  TRP 891           HD       TRP 891   3.194  11.721   1.662
  384    HE1  TRP 891           HE1      TRP 891   3.593  10.563   3.902
  385    HE3  TRP 891           HE3      TRP 891   4.876   7.278  -0.100
  386    HZ2  TRP 891           HZ2      TRP 891   4.515   8.015   4.810
  387    HZ3  TRP 891           HZ3      TRP 891   5.489   5.532   1.453
  388    HH2  TRP 891           HH       TRP 891   5.330   5.887   3.905
  389    HB2  TRP 891           HB2      TRP 891   2.967  10.680  -0.864
  390    HB3  TRP 891           HB1      TRP 891   3.811   9.160  -1.150
  391    H    TYR 892           H        TYR 892   6.870   9.740  -2.487
  392    HA   TYR 892           HA       TYR 892   5.865  10.600  -5.108
  393    HD1  TYR 892           HD2      TYR 892   8.477  11.617  -2.658
  394    HD2  TYR 892           HD1      TYR 892   8.508  11.801  -6.899
  395    HE1  TYR 892           HE2      TYR 892   9.367  13.889  -2.544
  396    HE2  TYR 892           HE1      TYR 892   9.409  14.067  -6.814
  397    HH   TYR 892           HH       TYR 892  10.787  15.310  -4.080
  398    HB2  TYR 892           HB2      TYR 892   8.536   9.548  -4.196
  399    HB3  TYR 892           HB1      TYR 892   8.098   9.780  -5.875
  400    H    HIS 893           H        HIS 893   5.820   9.045  -6.751
  401    HA   HIS 893           HA       HIS 893   5.127   6.335  -5.905
  402    HD2  HIS 893           HD2      HIS 893   2.432   6.393  -6.309
  403    HE1  HIS 893           HE1      HIS 893   1.112   9.268  -9.115
  404    HE2  HIS 893           HE2      HIS 893   0.538   8.034  -7.034
  405    HB2  HIS 893           HB2      HIS 893   5.385   7.444  -8.721
  406    HB3  HIS 893           HB1      HIS 893   4.786   5.848  -8.317
  407    H    TRP 894           H        TRP 894   6.253   4.478  -6.614
  408    HA   TRP 894           HA       TRP 894   8.998   4.648  -6.331
  409    HD1  TRP 894           HD       TRP 894   8.173   4.310  -4.294
  410    HE1  TRP 894           HE1      TRP 894   8.126   2.863  -2.150
  411    HE3  TRP 894           HE3      TRP 894   8.026  -0.295  -6.428
  412    HZ2  TRP 894           HZ2      TRP 894   8.017   0.133  -1.475
  413    HZ3  TRP 894           HZ3      TRP 894   7.963  -2.265  -4.988
  414    HH2  TRP 894           HH       TRP 894   7.953  -2.057  -2.551
  415    HB2  TRP 894           HB2      TRP 894   7.201   2.411  -7.179
  416    HB3  TRP 894           HB1      TRP 894   8.948   2.216  -7.208
  417    HA   PRO 895           HA       PRO 895   9.606   3.689 -10.997
  418    HB2  PRO 895           HB2      PRO 895   7.632   4.442 -12.751
  419    HB3  PRO 895           HB1      PRO 895   7.779   2.814 -12.082
  420    HG2  PRO 895           HG2      PRO 895   6.057   5.082 -11.145
  421    HG3  PRO 895           HG1      PRO 895   5.616   3.384 -11.394
  422    HD2  PRO 895           HD2      PRO 895   6.138   4.304  -8.951
  423    HD3  PRO 895           HD1      PRO 895   6.693   2.692  -9.448
  424    H    CYS 896           H        CYS 896   7.944   6.444  -9.835
  425    HA   CYS 896           HA       CYS 896   8.862   8.291 -11.785
  426    HB2  CYS 896           HB2      CYS 896   7.631   8.640  -9.070
  427    HB3  CYS 896           HB1      CYS 896   7.825   9.938 -10.268
  428    H    VAL 897           H        VAL 897   9.976   7.148  -8.669
  429    HA   VAL 897           HA       VAL 897  12.138   9.078  -8.867
  430    HB   VAL 897           HB       VAL 897  12.691   8.516  -6.499
  431   HG11  VAL 897          HG11      VAL 897  11.494  10.534  -7.070
  432   HG12  VAL 897          HG12      VAL 897  10.772   9.845  -5.608
  433   HG13  VAL 897          HG13      VAL 897   9.981   9.639  -7.162
  434   HG21  VAL 897          HG21      VAL 897  11.506   6.345  -6.448
  435   HG22  VAL 897          HG22      VAL 897   9.969   7.213  -6.519
  436   HG23  VAL 897          HG23      VAL 897  11.046   7.422  -5.135
  437    H    GLY 898           H        GLY 898  11.605   5.865  -9.479
  438    HA2  GLY 898           HA2      GLY 898  13.295   4.612 -10.607
  439    HA3  GLY 898           HA1      GLY 898  14.510   5.506  -9.703
  440    H    ILE 899           H        ILE 899  11.785   4.371  -7.994
  441    HA   ILE 899           HA       ILE 899  13.491   2.439  -6.631
  442    HB   ILE 899           HB       ILE 899  10.819   3.660  -5.845
  443   HG12  ILE 899          HG12      ILE 899  12.782   5.181  -5.636
  444   HG13  ILE 899          HG11      ILE 899  11.995   4.842  -4.093
  445   HG21  ILE 899          HG21      ILE 899  12.511   1.702  -4.285
  446   HG22  ILE 899          HG22      ILE 899  10.914   1.394  -4.969
  447   HG23  ILE 899          HG23      ILE 899  11.101   2.553  -3.658
  448   HD11  ILE 899          HD11      ILE 899  13.794   3.111  -3.801
  449   HD12  ILE 899          HD12      ILE 899  14.218   4.801  -3.640
  450   HD13  ILE 899          HD13      ILE 899  14.652   3.920  -5.129
  451    H    MET 900           H        MET 900  13.018   0.299  -6.759
  452    HA   MET 900           HA       MET 900  10.533  -0.439  -8.145
  453    HB2  MET 900           HB2      MET 900  11.640  -2.399  -9.097
  454    HB3  MET 900           HB1      MET 900  12.429  -0.916  -9.601
  455    HG2  MET 900           HG2      MET 900  14.220  -1.307  -8.016
  456    HG3  MET 900           HG1      MET 900  13.406  -2.760  -7.435
  457    HE1  MET 900           HE1      MET 900  16.450  -2.611  -8.464
  458    HE2  MET 900           HE2      MET 900  16.548  -4.108  -9.387
  459    HE3  MET 900           HE3      MET 900  15.701  -4.079  -7.839
  460    H    ALA 901           H        ALA 901  12.520  -0.900  -5.405
  461    HA   ALA 901           HA       ALA 901  10.554  -2.734  -4.300
  462    HB1  ALA 901           HB1      ALA 901  12.349  -4.115  -3.303
  463    HB2  ALA 901           HB2      ALA 901  13.550  -3.178  -4.191
  464    HB3  ALA 901           HB3      ALA 901  12.387  -4.175  -5.064
  465    H    ALA 902           H        ALA 902  10.462  -2.570  -2.007
  466    HA   ALA 902           HA       ALA 902  10.739   0.051  -1.068
  467    HB1  ALA 902           HB1      ALA 902  10.027  -0.818   1.082
  468    HB2  ALA 902           HB2      ALA 902  10.280  -2.478   0.512
  469    HB3  ALA 902           HB3      ALA 902   9.054  -1.440  -0.241
  470    HA   PRO 903           HA       PRO 903  15.002  -0.481   0.250
  471    HB2  PRO 903           HB2      PRO 903  15.874   1.710  -0.593
  472    HB3  PRO 903           HB1      PRO 903  15.004   0.665  -1.720
  473    HG2  PRO 903           HG2      PRO 903  14.074   3.114  -0.331
  474    HG3  PRO 903           HG1      PRO 903  13.774   2.642  -2.018
  475    HD2  PRO 903           HD2      PRO 903  12.095   2.149   0.250
  476    HD3  PRO 903           HD1      PRO 903  11.882   1.540  -1.403
  477    HA   PRO 904           HA       PRO 904  15.884   3.059   3.063
  478    HB2  PRO 904           HB2      PRO 904  17.917   2.015   4.240
  479    HB3  PRO 904           HB1      PRO 904  16.356   1.339   4.620
  480    HG2  PRO 904           HG2      PRO 904  18.599   0.290   3.068
  481    HG3  PRO 904           HG1      PRO 904  17.297  -0.662   3.833
  482    HD2  PRO 904           HD2      PRO 904  17.520   0.240   1.030
  483    HD3  PRO 904           HD1      PRO 904  16.255  -0.807   1.703
  484    H    GLU 905           H        GLU 905  17.737   4.602   2.890
  485    HA   GLU 905           HA       GLU 905  19.878   3.688   1.185
  486    HB2  GLU 905           HB2      GLU 905  20.009   5.899   3.286
  487    HB3  GLU 905           HB1      GLU 905  21.135   5.646   1.971
  488    HG2  GLU 905           HG2      GLU 905  19.477   6.292   0.376
  489    HG3  GLU 905           HG1      GLU 905  18.268   6.434   1.659
  490    H    GLU 906           H        GLU 906  19.434   4.664   4.310
  491    HA   GLU 906           HA       GLU 906  20.736   2.435   5.640
  492    HB2  GLU 906           HB2      GLU 906  20.939   4.047   7.559
  493    HB3  GLU 906           HB1      GLU 906  21.866   4.544   6.148
  494    HG2  GLU 906           HG2      GLU 906  20.040   6.076   5.542
  495    HG3  GLU 906           HG1      GLU 906  19.199   5.606   7.015
  496    H    MET 907           H        MET 907  18.098   4.562   5.070
  497    HA   MET 907           HA       MET 907  15.883   3.124   5.559
  498    HB2  MET 907           HB2      MET 907  16.836   3.108   7.820
  499    HB3  MET 907           HB1      MET 907  16.506   4.853   7.833
  500    HG2  MET 907           HG2      MET 907  14.209   4.530   7.531
  501    HG3  MET 907           HG1      MET 907  14.387   2.775   7.454
  502    HE1  MET 907           HE1      MET 907  14.983   5.311  11.303
  503    HE2  MET 907           HE2      MET 907  14.458   5.973   9.753
  504    HE3  MET 907           HE3      MET 907  16.105   5.367   9.946
  505    H    GLN 908           H        GLN 908  17.455   5.793   5.851
  506    HA   GLN 908           HA       GLN 908  15.612   7.943   5.736
  507    HB2  GLN 908           HB2      GLN 908  18.388   7.943   4.611
  508    HB3  GLN 908           HB1      GLN 908  17.384   9.371   4.759
  509    HG2  GLN 908           HG2      GLN 908  18.341   7.657   7.013
  510    HG3  GLN 908           HG1      GLN 908  19.051   9.188   6.499
  511   HE21  GLN 908          HE21      GLN 908  17.782  10.959   6.559
  512   HE22  GLN 908          HE22      GLN 908  16.530  11.165   7.747
  513    H    TRP 909           H        TRP 909  17.446   8.360   3.068
  514    HA   TRP 909           HA       TRP 909  17.189   8.315   0.845
  515    HD1  TRP 909           HD       TRP 909  16.632   6.046  -1.658
  516    HE1  TRP 909           HE1      TRP 909  15.490   6.760  -3.864
  517    HE3  TRP 909           HE3      TRP 909  12.890   8.938   0.254
  518    HZ2  TRP 909           HZ2      TRP 909  13.299   8.335  -4.664
  519    HZ3  TRP 909           HZ3      TRP 909  11.314  10.018  -1.294
  520    HH2  TRP 909           HH       TRP 909  11.516   9.724  -3.696
  521    HB2  TRP 909           HB2      TRP 909  15.904   6.176   0.876
  522    HB3  TRP 909           HB1      TRP 909  14.447   7.083   1.259
  523    H    PHE 910           H        PHE 910  16.751   9.891  -0.441
  524    HA   PHE 910           HA       PHE 910  14.689  11.781   0.356
  525    HD1  PHE 910           HD1      PHE 910  15.402  13.700   2.324
  526    HD2  PHE 910           HD2      PHE 910  18.855  11.477   1.236
  527    HE1  PHE 910           HE1      PHE 910  16.108  13.648   4.675
  528    HE2  PHE 910           HE2      PHE 910  19.551  11.392   3.569
  529    HZ   PHE 910           HZ       PHE 910  18.159  12.491   5.315
  530    HB2  PHE 910           HB2      PHE 910  17.537  12.481  -0.421
  531    HB3  PHE 910           HB1      PHE 910  16.260  13.629  -0.031
  532    H    CYS 911           H        CYS 911  13.745  12.760  -1.365
  533    HA   CYS 911           HA       CYS 911  13.853  11.430  -3.856
  534    HB2  CYS 911           HB2      CYS 911  12.222  13.120  -4.617
  535    HB3  CYS 911           HB1      CYS 911  11.812  12.513  -3.032
  536    HA   PRO 912           HA       PRO 912  17.048  13.361  -6.245
  537    HB2  PRO 912           HB2      PRO 912  15.602  14.332  -8.445
  538    HB3  PRO 912           HB1      PRO 912  16.315  12.725  -8.291
  539    HG2  PRO 912           HG2      PRO 912  13.504  13.605  -7.788
  540    HG3  PRO 912           HG1      PRO 912  14.100  12.088  -8.489
  541    HD2  PRO 912           HD2      PRO 912  13.207  12.171  -5.996
  542    HD3  PRO 912           HD1      PRO 912  14.629  11.191  -6.412
  543    H    LYS 913           H        LYS 913  14.383  15.288  -5.264
  544    HA   LYS 913           HA       LYS 913  15.558  17.800  -6.136
  545    HB2  LYS 913           HB2      LYS 913  13.167  17.308  -4.347
  546    HB3  LYS 913           HB1      LYS 913  13.607  18.833  -5.101
  547    HG2  LYS 913           HG2      LYS 913  13.225  17.873  -7.303
  548    HG3  LYS 913           HG1      LYS 913  12.806  16.329  -6.563
  549    HD2  LYS 913           HD2      LYS 913  10.953  17.472  -5.382
  550    HD3  LYS 913           HD1      LYS 913  11.343  18.946  -6.273
  551    HE2  LYS 913           HE2      LYS 913  10.935  17.765  -8.382
  552    HE3  LYS 913           HE1      LYS 913  10.540  16.301  -7.485
  553    HZ1  LYS 913           HZ1      LYS 913   8.506  17.374  -8.050
  554    HZ2  LYS 913           HZ2      LYS 913   9.063  18.856  -7.529
  555    HZ3  LYS 913           HZ3      LYS 913   8.736  17.670  -6.400
  556    H    CYS 914           H        CYS 914  14.850  16.091  -3.121
  557    HA   CYS 914           HA       CYS 914  16.235  18.011  -1.474
  558    HB2  CYS 914           HB2      CYS 914  15.024  15.321  -0.926
  559    HB3  CYS 914           HB1      CYS 914  15.748  16.319   0.323
  560    H    ALA 915           H        ALA 915  16.928  14.872  -2.841
  561    HA   ALA 915           HA       ALA 915  19.312  14.488  -1.343
  562    HB1  ALA 915           HB1      ALA 915  18.032  12.668  -2.345
  563    HB2  ALA 915           HB2      ALA 915  19.739  12.623  -2.800
  564    HB3  ALA 915           HB3      ALA 915  18.520  13.209  -3.951
  565    H    ASN 916           H        ASN 916  18.522  16.306  -4.090
  566    HA   ASN 916           HA       ASN 916  21.053  16.369  -5.354
  567    HB2  ASN 916           HB2      ASN 916  19.077  17.085  -6.568
  568    HB3  ASN 916           HB1      ASN 916  18.819  18.409  -5.443
  569   HD21  ASN 916          HD21      ASN 916  20.046  20.271  -5.659
  570   HD22  ASN 916          HD22      ASN 916  21.119  20.548  -6.973
  571    H    LYS 917           H        LYS 917  19.675  18.196  -2.702
  572    HA   LYS 917           HA       LYS 917  21.807  20.125  -2.682
  573    HB2  LYS 917           HB2      LYS 917  20.806  21.017  -0.653
  574    HB3  LYS 917           HB1      LYS 917  19.510  20.618  -1.764
  575    HG2  LYS 917           HG2      LYS 917  19.111  18.541  -0.556
  576    HG3  LYS 917           HG1      LYS 917  20.419  18.943   0.549
  577    HD2  LYS 917           HD2      LYS 917  19.176  20.925   1.289
  578    HD3  LYS 917           HD1      LYS 917  17.870  20.524   0.168
  579    HE2  LYS 917           HE2      LYS 917  17.559  18.372   1.330
  580    HE3  LYS 917           HE1      LYS 917  18.825  18.816   2.467
  581    HZ1  LYS 917           HZ1      LYS 917  16.283  20.293   2.092
  582    HZ2  LYS 917           HZ2      LYS 917  17.455  20.638   3.250
  583    HZ3  LYS 917           HZ3      LYS 917  16.587  19.194   3.323
  584    H    ILE 918           H        ILE 918  21.612  16.949  -1.777
  585    HA   ILE 918           HA       ILE 918  23.553  17.057   0.387
  586    HB   ILE 918           HB       ILE 918  22.449  14.668  -1.107
  587   HG12  ILE 918          HG12      ILE 918  20.600  15.975  -0.153
  588   HG13  ILE 918          HG11      ILE 918  20.765  14.417   0.631
  589   HG21  ILE 918          HG21      ILE 918  23.733  14.867   1.612
  590   HG22  ILE 918          HG22      ILE 918  24.450  14.175   0.155
  591   HG23  ILE 918          HG23      ILE 918  23.048  13.406   0.898
  592   HD11  ILE 918          HD11      ILE 918  21.664  17.082   1.719
  593   HD12  ILE 918          HD12      ILE 918  21.867  15.526   2.531
  594   HD13  ILE 918          HD13      ILE 918  20.247  16.161   2.226
  595    H    LYS 919           H        LYS 919  23.197  16.000  -2.940
  596    HA   LYS 919           HA       LYS 919  25.979  15.209  -3.062
  597    HB2  LYS 919           HB2      LYS 919  25.372  14.260  -5.313
  598    HB3  LYS 919           HB1      LYS 919  24.544  13.545  -3.938
  599    HG2  LYS 919           HG2      LYS 919  22.583  15.009  -4.459
  600    HG3  LYS 919           HG1      LYS 919  23.417  15.506  -5.929
  601    HD2  LYS 919           HD2      LYS 919  22.718  12.657  -5.227
  602    HD3  LYS 919           HD1      LYS 919  21.746  13.689  -6.270
  603    HE2  LYS 919           HE2      LYS 919  24.607  12.871  -6.767
  604    HE3  LYS 919           HE1      LYS 919  23.192  12.155  -7.526
  605    HZ1  LYS 919           HZ1      LYS 919  24.129  14.960  -7.839
  606    HZ2  LYS 919           HZ2      LYS 919  22.685  14.366  -8.454
  607    HZ3  LYS 919           HZ3      LYS 919  24.142  13.742  -9.009
  608    H    LYS 920           H        LYS 920  26.647  17.359  -2.829
  609    HA   LYS 920           HA       LYS 920  26.994  18.672  -5.415
  610    HB2  LYS 920           HB2      LYS 920  26.145  19.995  -2.837
  611    HB3  LYS 920           HB1      LYS 920  26.829  20.878  -4.192
  612    HG2  LYS 920           HG2      LYS 920  24.962  20.308  -5.578
  613    HG3  LYS 920           HG1      LYS 920  24.326  19.216  -4.347
  614    HD2  LYS 920           HD2      LYS 920  23.114  21.352  -4.389
  615    HD3  LYS 920           HD1      LYS 920  23.937  21.099  -2.854
  616    HE2  LYS 920           HE2      LYS 920  24.171  23.407  -3.634
  617    HE3  LYS 920           HE1      LYS 920  25.733  22.598  -3.561
  618    HZ1  LYS 920           HZ1      LYS 920  25.674  22.327  -5.944
  619    HZ2  LYS 920           HZ2      LYS 920  25.405  23.949  -5.527
  620    HZ3  LYS 920           HZ3      LYS 920  24.120  22.996  -6.015
  621    H    ASP 921           H        ASP 921  29.075  18.843  -5.776
  622    HA   ASP 921           HA       ASP 921  31.040  18.541  -3.703
  623    HB2  ASP 921           HB2      ASP 921  31.564  17.702  -5.916
  624    HB3  ASP 921           HB1      ASP 921  31.281  19.292  -6.619
  625    H    LYS 922           H        LYS 922  29.744  21.158  -5.632
  626    HA   LYS 922           HA       LYS 922  31.308  23.063  -4.107
  627    HB2  LYS 922           HB2      LYS 922  29.421  23.477  -6.439
  628    HB3  LYS 922           HB1      LYS 922  30.316  24.753  -5.633
  629    HG2  LYS 922           HG2      LYS 922  31.510  22.443  -7.159
  630    HG3  LYS 922           HG1      LYS 922  31.368  24.108  -7.724
  631    HD2  LYS 922           HD2      LYS 922  32.800  24.843  -5.856
  632    HD3  LYS 922           HD1      LYS 922  32.968  23.164  -5.346
  633    HE2  LYS 922           HE2      LYS 922  33.835  24.302  -7.988
  634    HE3  LYS 922           HE1      LYS 922  34.900  23.928  -6.635
  635    HZ1  LYS 922           HZ1      LYS 922  35.006  22.138  -8.172
  636    HZ2  LYS 922           HZ2      LYS 922  33.357  22.042  -8.317
  637    HZ3  LYS 922           HZ3      LYS 922  34.090  21.546  -6.878
  638    H    LYS 923           H        LYS 923  30.395  24.454  -2.702
  639    HA   LYS 923           HA       LYS 923  27.888  23.520  -1.626
  640    HB2  LYS 923           HB2      LYS 923  29.762  25.623  -0.570
  641    HB3  LYS 923           HB1      LYS 923  28.413  24.913   0.304
  642    HG2  LYS 923           HG2      LYS 923  30.910  23.494  -0.611
  643    HG3  LYS 923           HG1      LYS 923  30.527  23.967   1.040
  644    HD2  LYS 923           HD2      LYS 923  28.953  21.980  -0.618
  645    HD3  LYS 923           HD1      LYS 923  30.142  21.560   0.607
  646    HE2  LYS 923           HE2      LYS 923  27.623  23.137   1.112
  647    HE3  LYS 923           HE1      LYS 923  27.817  21.419   1.432
  648    HZ1  LYS 923           HZ1      LYS 923  28.111  22.815   3.384
  649    HZ2  LYS 923           HZ2      LYS 923  29.472  23.539   2.694
  650    HZ3  LYS 923           HZ3      LYS 923  29.468  21.883   3.049
  651    H    HIS 924           H        HIS 924  26.071  24.431  -1.870
  652    HA   HIS 924           HA       HIS 924  24.387  25.728  -2.525
  653    HD1  HIS 924           HD1      HIS 924  25.086  30.011  -2.878
  654    HD2  HIS 924           HD2      HIS 924  22.420  27.416  -1.038
  655    HE1  HIS 924           HE1      HIS 924  22.871  31.190  -2.910
  656    HE2  HIS 924           HE2      HIS 924  21.261  29.587  -1.872
  657    HB2  HIS 924           HB2      HIS 924  25.302  27.148  -0.667
  658    HB3  HIS 924           HB1      HIS 924  26.229  28.044  -1.862
  Start of MODEL   18
    1    HA   ALA   1           HA       ALA   1  11.827   6.251   1.759
    2    H1   ALA   1           HT1      ALA   1  13.199   7.412   3.372
    3    H2   ALA   1           HT2      ALA   1  12.351   6.701   4.637
    4    H3   ALA   1           HT3      ALA   1  11.562   7.664   3.502
    5    HB1  ALA   1           HB1      ALA   1  13.126   4.376   1.649
    6    HB2  ALA   1           HB2      ALA   1  13.340   4.284   3.414
    7    HB3  ALA   1           HB3      ALA   1  14.167   5.556   2.509
    8    H    ARG   2           H        ARG   2  10.035   6.532   4.198
    9    HA   ARG   2           HA       ARG   2   9.054   4.008   4.934
   10    HE   ARG   2           HE       ARG   2   5.592   3.893   7.953
   11    HB2  ARG   2           HB2      ARG   2   8.480   6.590   5.644
   12    HB3  ARG   2           HB1      ARG   2   7.149   6.247   4.572
   13    HG2  ARG   2           HG2      ARG   2   7.849   4.716   7.066
   14    HG3  ARG   2           HG1      ARG   2   6.550   5.891   6.862
   15    HD2  ARG   2           HD2      ARG   2   5.441   4.389   5.262
   16    HD3  ARG   2           HD1      ARG   2   6.744   3.216   5.454
   17   HH11  ARG   2          HH11      ARG   2   4.994   1.776   5.121
   18   HH12  ARG   2          HH12      ARG   2   3.969   0.752   5.989
   19   HH21  ARG   2          HH21      ARG   2   4.210   2.446   9.066
   20   HH22  ARG   2          HH22      ARG   2   3.497   1.113   8.261
   21    H    THR   3           H        THR   3   7.916   2.583   3.702
   22    HA   THR   3           HA       THR   3   6.768   3.595   1.221
   23    HB   THR   3           HB       THR   3   7.017   1.235   0.425
   24    HG1  THR   3           HG1      THR   3   8.943   0.698   2.389
   25   HG21  THR   3          HG21      THR   3   8.641   2.978  -0.179
   26   HG22  THR   3          HG22      THR   3   9.438   1.411  -0.005
   27   HG23  THR   3          HG23      THR   3   9.564   2.620   1.275
   28    HA   M3L   4           HA       M3L   4   3.367   0.964   2.301
   29    H    M3L   4           H        M3L   4   4.690   2.964   0.751
   30    HB2  M3L   4           HB2      M3L   4   2.871   2.666   3.874
   31    HB3  M3L   4           HB1      M3L   4   1.440   2.552   2.874
   32    HG2  M3L   4           HG2      M3L   4   3.265   4.478   1.798
   33    HG3  M3L   4           HG1      M3L   4   2.978   4.821   3.503
   34    HD2  M3L   4           HD2      M3L   4   0.528   4.163   2.047
   35    HD3  M3L   4           HD1      M3L   4   0.880   5.509   3.129
   36    HE2  M3L   4           HE2      M3L   4   2.399   6.107   0.936
   37    HE3  M3L   4           HE1      M3L   4   1.049   5.283   0.206
   38   HM11  M3L   4          HM11      M3L   4   0.180   8.963   0.123
   39   HM12  M3L   4          HM12      M3L   4   1.718   8.217  -0.206
   40   HM13  M3L   4          HM13      M3L   4   0.241   7.534  -0.859
   41   HM21  M3L   4          HM21      M3L   4  -1.400   6.525   0.409
   42   HM22  M3L   4          HM22      M3L   4  -1.564   7.553   1.810
   43   HM23  M3L   4          HM23      M3L   4  -1.103   5.897   2.005
   44   HM31  M3L   4          HM31      M3L   4   0.491   7.530   3.397
   45   HM32  M3L   4          HM32      M3L   4   0.732   8.961   2.453
   46   HM33  M3L   4          HM33      M3L   4   2.028   7.828   2.659
   47    H    GLN   5           H        GLN   5   1.428   0.334   1.312
   48    HA   GLN   5           HA       GLN   5   0.819   1.600  -1.272
   49    HB2  GLN   5           HB2      GLN   5   2.283  -0.483  -1.448
   50    HB3  GLN   5           HB1      GLN   5   0.887  -1.368  -0.837
   51    HG2  GLN   5           HG2      GLN   5  -0.447  -0.547  -2.709
   52    HG3  GLN   5           HG1      GLN   5   0.952   0.327  -3.310
   53   HE21  GLN   5          HE21      GLN   5  -0.533  -1.636  -4.673
   54   HE22  GLN   5          HE22      GLN   5   0.571  -2.905  -5.008
   55    H    THR   6           H        THR   6  -1.233   2.252  -1.025
   56    HA   THR   6           HA       THR   6  -2.886   0.568   0.650
   57    HB   THR   6           HB       THR   6  -2.741   2.787   1.545
   58    HG1  THR   6           HG1      THR   6  -5.190   3.346   0.827
   59   HG21  THR   6          HG21      THR   6  -3.866   3.840  -1.051
   60   HG22  THR   6          HG22      THR   6  -2.206   4.045  -0.500
   61   HG23  THR   6          HG23      THR   6  -3.530   4.809   0.384
   62    H    ALA   7           H        ALA   7  -2.795  -0.794  -1.222
   63    HA   ALA   7           HA       ALA   7  -4.485  -0.096  -3.456
   64    HB1  ALA   7           HB1      ALA   7  -2.407  -1.335  -3.790
   65    HB2  ALA   7           HB2      ALA   7  -3.808  -2.260  -4.347
   66    HB3  ALA   7           HB3      ALA   7  -3.038  -2.650  -2.801
   67    H    ARG   8           H        ARG   8  -4.481  -2.077  -0.636
   68    HA   ARG   8           HA       ARG   8  -7.323  -2.124  -0.560
   69    HE   ARG   8           HE       ARG   8  -4.378  -7.374  -1.291
   70    HB2  ARG   8           HB2      ARG   8  -7.683  -4.562  -0.618
   71    HB3  ARG   8           HB1      ARG   8  -7.078  -3.952  -2.141
   72    HG2  ARG   8           HG2      ARG   8  -4.839  -4.806  -1.586
   73    HG3  ARG   8           HG1      ARG   8  -5.480  -5.440  -0.062
   74    HD2  ARG   8           HD2      ARG   8  -7.066  -6.827  -1.307
   75    HD3  ARG   8           HD1      ARG   8  -6.439  -6.173  -2.815
   76   HH11  ARG   8          HH11      ARG   8  -7.111  -8.142  -3.388
   77   HH12  ARG   8          HH12      ARG   8  -6.487  -9.628  -3.916
   78   HH21  ARG   8          HH21      ARG   8  -3.491  -9.455  -2.034
   79   HH22  ARG   8          HH22      ARG   8  -4.387 -10.370  -3.162
   80    H    LYS   9           H        LYS   9  -4.267  -3.122   0.712
   81    HA   LYS   9           HA       LYS   9  -3.455  -3.404   2.727
   82    HB2  LYS   9           HB2      LYS   9  -5.709  -1.599   3.604
   83    HB3  LYS   9           HB1      LYS   9  -4.289  -1.987   4.565
   84    HG2  LYS   9           HG2      LYS   9  -2.917  -0.986   2.683
   85    HG3  LYS   9           HG1      LYS   9  -4.440  -0.372   2.039
   86    HD2  LYS   9           HD2      LYS   9  -3.250   0.247   4.749
   87    HD3  LYS   9           HD1      LYS   9  -3.337   1.337   3.369
   88    HE2  LYS   9           HE2      LYS   9  -5.680   0.217   4.916
   89    HE3  LYS   9           HE1      LYS   9  -5.053   1.852   5.035
   90    HZ1  LYS   9           HZ1      LYS   9  -6.383   0.614   2.683
   91    HZ2  LYS   9           HZ2      LYS   9  -5.629   2.105   2.625
   92    HZ3  LYS   9           HZ3      LYS   9  -6.958   1.861   3.652
   93    H    SER  10           H        SER  10  -4.933  -5.507   1.934
   94    HA   SER  10           HA       SER  10  -6.669  -6.455   3.967
   95    HG   SER  10           HG       SER  10  -7.448  -6.759   1.824
   96    HB2  SER  10           HB2      SER  10  -4.935  -7.989   1.997
   97    HB3  SER  10           HB1      SER  10  -6.318  -8.637   2.880
   98    H    THR  11           H        THR  11  -3.260  -6.451   3.310
   99    HA   THR  11           HA       THR  11  -2.683  -7.587   5.916
  100    HB   THR  11           HB       THR  11  -0.791  -6.765   3.680
  101    HG1  THR  11           HG1      THR  11  -1.902  -9.295   4.355
  102   HG21  THR  11          HG21      THR  11  -0.387  -8.561   6.094
  103   HG22  THR  11          HG22      THR  11   0.259  -6.933   5.911
  104   HG23  THR  11          HG23      THR  11   0.815  -8.226   4.850
  105    H    GLY  12           H        GLY  12  -3.185  -5.936   7.257
  106    HA2  GLY  12           HA2      GLY  12  -1.627  -3.985   8.085
  107    HA3  GLY  12           HA1      GLY  12  -2.357  -3.211   6.675
  108    H    GLY  13           H        GLY  13  -4.716  -3.155   6.575
  109    HA2  GLY  13           HA2      GLY  13  -6.796  -2.789   7.447
  110    HA3  GLY  13           HA1      GLY  13  -6.321  -3.793   8.811
  111    H1   GLY 850           HT1      GLY 850   2.608  31.220   0.771
  112    H2   GLY 850           HT2      GLY 850   1.175  30.405   1.150
  113    H3   GLY 850           HT3      GLY 850   1.344  32.032   1.528
  114    HA2  GLY 850           HA1      GLY 850   1.361  32.624  -0.775
  115    HA3  GLY 850           HA2      GLY 850   1.263  30.916  -1.195
  116    H    SER 851           H        SER 851  -0.605  33.120  -1.748
  117    HA   SER 851           HA       SER 851  -2.830  32.659  -0.034
  118    HG   SER 851           HG       SER 851  -2.371  35.339  -3.016
  119    HB2  SER 851           HB2      SER 851  -3.922  34.223  -1.749
  120    HB3  SER 851           HB1      SER 851  -2.579  34.862  -0.801
  121    H    HIS 852           H        HIS 852  -2.841  32.594  -3.558
  122    HA   HIS 852           HA       HIS 852  -4.859  30.549  -3.571
  123    HD2  HIS 852           HD2      HIS 852  -2.734  30.767  -7.770
  124    HE1  HIS 852           HE1      HIS 852  -1.010  34.459  -6.646
  125    HE2  HIS 852           HE2      HIS 852  -0.966  32.576  -8.330
  126    HB2  HIS 852           HB2      HIS 852  -4.824  30.848  -6.033
  127    HB3  HIS 852           HB1      HIS 852  -5.046  32.364  -5.172
  128    H    MET 853           H        MET 853  -1.465  30.726  -4.064
  129    HA   MET 853           HA       MET 853  -1.289  28.105  -5.260
  130    HB2  MET 853           HB2      MET 853   1.104  28.398  -5.248
  131    HB3  MET 853           HB1      MET 853   0.359  29.888  -5.808
  132    HG2  MET 853           HG2      MET 853   0.697  30.895  -3.609
  133    HG3  MET 853           HG1      MET 853   1.411  29.399  -3.033
  134    HE1  MET 853           HE1      MET 853   4.734  29.218  -5.112
  135    HE2  MET 853           HE2      MET 853   3.192  28.496  -5.563
  136    HE3  MET 853           HE3      MET 853   3.743  28.432  -3.887
  137    H    ALA 854           H        ALA 854  -0.563  26.261  -4.241
  138    HA   ALA 854           HA       ALA 854   0.090  26.384  -1.427
  139    HB1  ALA 854           HB1      ALA 854  -2.364  26.210  -1.401
  140    HB2  ALA 854           HB2      ALA 854  -1.610  24.746  -0.771
  141    HB3  ALA 854           HB3      ALA 854  -2.270  24.763  -2.406
  142    H    MET 855           H        MET 855   2.066  25.528  -1.806
  143    HA   MET 855           HA       MET 855   2.141  23.080  -3.316
  144    HB2  MET 855           HB2      MET 855   4.426  24.743  -2.252
  145    HB3  MET 855           HB1      MET 855   4.654  23.178  -3.019
  146    HG2  MET 855           HG2      MET 855   3.524  24.086  -5.049
  147    HG3  MET 855           HG1      MET 855   3.514  25.666  -4.270
  148    HE1  MET 855           HE1      MET 855   6.347  25.671  -2.772
  149    HE2  MET 855           HE2      MET 855   5.727  27.043  -3.690
  150    HE3  MET 855           HE3      MET 855   7.359  26.446  -3.992
  151    H    ALA 856           H        ALA 856   0.822  22.162  -1.849
  152    HA   ALA 856           HA       ALA 856   2.324  20.660   0.136
  153    HB1  ALA 856           HB1      ALA 856   0.212  20.538   1.471
  154    HB2  ALA 856           HB2      ALA 856  -0.528  21.684   0.353
  155    HB3  ALA 856           HB3      ALA 856   0.826  22.190   1.358
  156    H    TYR 857           H        TYR 857   2.473  18.758  -0.845
  157    HA   TYR 857           HA       TYR 857   0.624  18.190  -2.941
  158    HD1  TYR 857           HD2      TYR 857   1.774  17.589  -5.488
  159    HD2  TYR 857           HD1      TYR 857   4.479  18.915  -2.487
  160    HE1  TYR 857           HE2      TYR 857   2.705  19.191  -7.058
  161    HE2  TYR 857           HE1      TYR 857   5.414  20.544  -4.056
  162    HH   TYR 857           HH       TYR 857   3.910  21.382  -6.915
  163    HB2  TYR 857           HB2      TYR 857   3.187  16.897  -2.144
  164    HB3  TYR 857           HB1      TYR 857   2.123  16.275  -3.412
  165    H    VAL 858           H        VAL 858  -0.883  18.082  -1.286
  166    HA   VAL 858           HA       VAL 858  -1.783  15.396  -1.085
  167    HB   VAL 858           HB       VAL 858  -0.462  15.502   0.994
  168   HG11  VAL 858          HG11      VAL 858  -0.492  17.872   1.450
  169   HG12  VAL 858          HG12      VAL 858  -1.084  16.981   2.854
  170   HG13  VAL 858          HG13      VAL 858  -2.221  17.811   1.792
  171   HG21  VAL 858          HG21      VAL 858  -2.214  14.824   2.585
  172   HG22  VAL 858          HG22      VAL 858  -2.461  14.124   0.988
  173   HG23  VAL 858          HG23      VAL 858  -3.435  15.497   1.508
  174    H    ILE 859           H        ILE 859  -3.805  15.355  -1.490
  175    HA   ILE 859           HA       ILE 859  -5.488  17.690  -0.926
  176    HB   ILE 859           HB       ILE 859  -6.760  17.232  -2.989
  177   HG12  ILE 859          HG12      ILE 859  -4.607  15.189  -3.639
  178   HG13  ILE 859          HG11      ILE 859  -6.252  14.818  -3.153
  179   HG21  ILE 859          HG21      ILE 859  -5.011  18.900  -3.122
  180   HG22  ILE 859          HG22      ILE 859  -5.125  18.030  -4.653
  181   HG23  ILE 859          HG23      ILE 859  -3.823  17.660  -3.522
  182   HD11  ILE 859          HD11      ILE 859  -7.111  15.858  -5.176
  183   HD12  ILE 859          HD12      ILE 859  -5.940  14.593  -5.564
  184   HD13  ILE 859          HD13      ILE 859  -5.472  16.288  -5.662
  185    H    ARG 860           H        ARG 860  -7.853  16.896  -1.001
  186    HA   ARG 860           HA       ARG 860  -7.881  14.252   0.254
  187    HE   ARG 860           HE       ARG 860 -11.921  18.556   0.018
  188    HB2  ARG 860           HB2      ARG 860 -10.030  14.876   1.263
  189    HB3  ARG 860           HB1      ARG 860  -8.772  16.022   1.702
  190    HG2  ARG 860           HG2      ARG 860  -9.614  17.572   0.010
  191    HG3  ARG 860           HG1      ARG 860 -10.867  16.403  -0.401
  192    HD2  ARG 860           HD2      ARG 860 -11.776  16.552   1.841
  193    HD3  ARG 860           HD1      ARG 860 -10.505  17.691   2.295
  194   HH11  ARG 860          HH11      ARG 860 -12.291  18.323   3.535
  195   HH12  ARG 860          HH12      ARG 860 -13.259  19.730   3.653
  196   HH21  ARG 860          HH21      ARG 860 -13.261  20.461   0.212
  197   HH22  ARG 860          HH22      ARG 860 -13.820  20.945   1.761
  198    H    ASP 861           H        ASP 861  -9.272  12.702  -0.494
  199    HA   ASP 861           HA       ASP 861 -10.098  13.095  -3.259
  200    HB2  ASP 861           HB2      ASP 861 -10.210  10.763  -3.464
  201    HB3  ASP 861           HB1      ASP 861  -8.941  10.952  -2.267
  202    H    GLU 862           H        GLU 862 -12.271  11.672  -3.623
  203    HA   GLU 862           HA       GLU 862 -14.347  13.309  -2.734
  204    HB2  GLU 862           HB2      GLU 862 -15.810  11.618  -3.814
  205    HB3  GLU 862           HB1      GLU 862 -14.505  12.210  -4.836
  206    HG2  GLU 862           HG2      GLU 862 -13.234  10.132  -4.134
  207    HG3  GLU 862           HG1      GLU 862 -14.755   9.555  -3.469
  208    H    TRP 863           H        TRP 863 -13.101  10.278  -1.390
  209    HA   TRP 863           HA       TRP 863 -15.362  10.028   0.362
  210    HD1  TRP 863           HD       TRP 863 -16.295   8.248  -0.857
  211    HE1  TRP 863           HE1      TRP 863 -16.299   6.511  -2.798
  212    HE3  TRP 863           HE3      TRP 863 -11.510   6.852  -0.550
  213    HZ2  TRP 863           HZ2      TRP 863 -14.418   4.755  -4.002
  214    HZ3  TRP 863           HZ3      TRP 863 -10.610   5.111  -2.107
  215    HH2  TRP 863           HH       TRP 863 -12.059   4.102  -3.795
  216    HB2  TRP 863           HB2      TRP 863 -12.731   8.560   0.412
  217    HB3  TRP 863           HB1      TRP 863 -14.155   8.130   1.360
  218    H    GLY 864           H        GLY 864 -12.172  11.391   0.447
  219    HA2  GLY 864           HA2      GLY 864 -11.935  13.348   1.908
  220    HA3  GLY 864           HA1      GLY 864 -12.808  12.447   3.137
  221    H    ASN 865           H        ASN 865 -10.393  10.846   1.230
  222    HA   ASN 865           HA       ASN 865  -8.730  10.497   3.613
  223    HB2  ASN 865           HB2      ASN 865  -8.508   9.237   0.861
  224    HB3  ASN 865           HB1      ASN 865  -7.572   8.788   2.273
  225   HD21  ASN 865          HD21      ASN 865 -10.613   8.625   0.690
  226   HD22  ASN 865          HD22      ASN 865 -11.287   7.347   1.661
  227    H    GLN 866           H        GLN 866  -6.459  10.940   3.470
  228    HA   GLN 866           HA       GLN 866  -5.843  13.189   1.825
  229    HB2  GLN 866           HB2      GLN 866  -4.156  11.583   3.729
  230    HB3  GLN 866           HB1      GLN 866  -3.502  12.893   2.765
  231    HG2  GLN 866           HG2      GLN 866  -5.138  14.395   3.790
  232    HG3  GLN 866           HG1      GLN 866  -5.643  13.084   4.856
  233   HE21  GLN 866          HE21      GLN 866  -3.167  15.376   4.136
  234   HE22  GLN 866          HE22      GLN 866  -2.190  15.092   5.527
  235    H    ILE 867           H        ILE 867  -5.325  13.082  -0.132
  236    HA   ILE 867           HA       ILE 867  -3.986  10.705  -1.187
  237    HB   ILE 867           HB       ILE 867  -5.449  12.916  -2.645
  238   HG12  ILE 867          HG12      ILE 867  -7.004  11.465  -1.469
  239   HG13  ILE 867          HG11      ILE 867  -7.111  11.204  -3.207
  240   HG21  ILE 867          HG21      ILE 867  -3.615  12.049  -3.962
  241   HG22  ILE 867          HG22      ILE 867  -5.165  11.559  -4.655
  242   HG23  ILE 867          HG23      ILE 867  -4.200  10.401  -3.737
  243   HD11  ILE 867          HD11      ILE 867  -5.765   9.165  -2.961
  244   HD12  ILE 867          HD12      ILE 867  -7.254   9.115  -2.020
  245   HD13  ILE 867          HD13      ILE 867  -5.716   9.424  -1.215
  246    H    TRP 868           H        TRP 868  -1.920  11.029  -1.046
  247    HA   TRP 868           HA       TRP 868  -0.756  13.618  -1.281
  248    HD1  TRP 868           HD       TRP 868   2.033  13.918   0.481
  249    HE1  TRP 868           HE1      TRP 868   1.692  13.969   3.049
  250    HE3  TRP 868           HE3      TRP 868  -1.438  10.183   0.955
  251    HZ2  TRP 868           HZ2      TRP 868   0.175  12.643   4.978
  252    HZ3  TRP 868           HZ3      TRP 868  -2.273   9.650   3.204
  253    HH2  TRP 868           HH       TRP 868  -1.485  10.856   5.166
  254    HB2  TRP 868           HB2      TRP 868   0.379  10.867  -0.955
  255    HB3  TRP 868           HB1      TRP 868   1.424  12.215  -1.379
  256    H    ILE 869           H        ILE 869   0.417  14.406  -2.875
  257    HA   ILE 869           HA       ILE 869  -0.035  13.231  -5.531
  258    HB   ILE 869           HB       ILE 869   0.832  16.041  -4.812
  259   HG12  ILE 869          HG12      ILE 869  -1.432  15.710  -3.934
  260   HG13  ILE 869          HG11      ILE 869  -1.453  16.827  -5.289
  261   HG21  ILE 869          HG21      ILE 869   1.473  15.422  -7.049
  262   HG22  ILE 869          HG22      ILE 869   0.180  16.624  -7.116
  263   HG23  ILE 869          HG23      ILE 869  -0.180  14.925  -7.418
  264   HD11  ILE 869          HD11      ILE 869  -2.307  13.946  -5.291
  265   HD12  ILE 869          HD12      ILE 869  -2.228  14.957  -6.727
  266   HD13  ILE 869          HD13      ILE 869  -3.341  15.366  -5.425
  267    H    CYS 870           H        CYS 870   1.746  12.520  -6.608
  268    HA   CYS 870           HA       CYS 870   4.312  12.508  -5.363
  269    HB2  CYS 870           HB2      CYS 870   3.512  10.671  -6.827
  270    HB3  CYS 870           HB1      CYS 870   3.430  11.783  -8.177
  271    HA   PRO 871           HA       PRO 871   5.068  16.631  -7.116
  272    HB2  PRO 871           HB2      PRO 871   7.582  16.595  -5.641
  273    HB3  PRO 871           HB1      PRO 871   6.167  17.620  -5.388
  274    HG2  PRO 871           HG2      PRO 871   6.921  15.688  -3.640
  275    HG3  PRO 871           HG1      PRO 871   5.233  16.174  -3.867
  276    HD2  PRO 871           HD2      PRO 871   6.687  13.798  -4.967
  277    HD3  PRO 871           HD1      PRO 871   5.045  13.930  -4.288
  278    H    GLY 872           H        GLY 872   6.375  13.808  -7.916
  279    HA2  GLY 872           HA2      GLY 872   8.680  14.838  -9.358
  280    HA3  GLY 872           HA1      GLY 872   8.162  13.153  -9.280
  281    H    CYS 873           H        CYS 873   5.611  13.186 -10.116
  282    HA   CYS 873           HA       CYS 873   5.881  14.042 -12.890
  283    HB2  CYS 873           HB2      CYS 873   4.024  12.365 -13.181
  284    HB3  CYS 873           HB1      CYS 873   5.565  11.707 -12.637
  285    H    ASN 874           H        ASN 874   4.144  14.587  -9.994
  286    HA   ASN 874           HA       ASN 874   2.472  15.834  -9.325
  287    HB2  ASN 874           HB2      ASN 874   3.335  17.697 -10.769
  288    HB3  ASN 874           HB1      ASN 874   2.394  17.072 -12.114
  289   HD21  ASN 874          HD21      ASN 874   0.209  17.453 -12.159
  290   HD22  ASN 874          HD22      ASN 874  -0.600  18.545 -11.093
  291    H    LYS 875           H        LYS 875   1.790  13.627  -9.356
  292    HA   LYS 875           HA       LYS 875  -0.848  13.395 -10.576
  293    HB2  LYS 875           HB2      LYS 875   1.331  11.296 -10.592
  294    HB3  LYS 875           HB1      LYS 875  -0.360  10.921 -10.872
  295    HG2  LYS 875           HG2      LYS 875  -0.319  12.271 -12.896
  296    HG3  LYS 875           HG1      LYS 875   1.362  12.716 -12.573
  297    HD2  LYS 875           HD2      LYS 875   2.033  10.380 -12.740
  298    HD3  LYS 875           HD1      LYS 875   0.358   9.901 -12.988
  299    HE2  LYS 875           HE2      LYS 875   1.930  11.709 -14.814
  300    HE3  LYS 875           HE1      LYS 875   1.676   9.986 -15.078
  301    HZ1  LYS 875           HZ1      LYS 875   0.126  11.295 -16.352
  302    HZ2  LYS 875           HZ2      LYS 875  -0.448  12.065 -14.977
  303    HZ3  LYS 875           HZ3      LYS 875  -0.707  10.406 -15.193
  304    HA   PRO 876           HA       PRO 876  -1.635  12.334  -6.326
  305    HB2  PRO 876           HB2      PRO 876  -4.092  11.289  -6.551
  306    HB3  PRO 876           HB1      PRO 876  -3.798  13.015  -6.803
  307    HG2  PRO 876           HG2      PRO 876  -4.066  10.824  -8.792
  308    HG3  PRO 876           HG1      PRO 876  -4.838  12.436  -8.791
  309    HD2  PRO 876           HD2      PRO 876  -2.625  11.892 -10.276
  310    HD3  PRO 876           HD1      PRO 876  -2.915  13.485  -9.548
  311    H    ASP 877           H        ASP 877  -2.019  10.544  -4.965
  312    HA   ASP 877           HA       ASP 877  -0.915   8.077  -5.934
  313    HB2  ASP 877           HB2      ASP 877  -0.376   8.891  -3.657
  314    HB3  ASP 877           HB1      ASP 877  -2.069   8.743  -3.210
  315    H    ASP 878           H        ASP 878  -1.937   6.406  -6.554
  316    HA   ASP 878           HA       ASP 878  -4.877   6.497  -6.780
  317    HB2  ASP 878           HB2      ASP 878  -2.903   4.583  -8.064
  318    HB3  ASP 878           HB1      ASP 878  -4.634   4.598  -8.346
  319    H    GLY 879           H        GLY 879  -2.601   5.321  -4.761
  320    HA2  GLY 879           HA2      GLY 879  -3.121   3.922  -2.914
  321    HA3  GLY 879           HA1      GLY 879  -4.187   2.971  -3.971
  322    H    SER 880           H        SER 880  -1.011   4.295  -4.442
  323    HA   SER 880           HA       SER 880  -0.151   1.685  -5.422
  324    HG   SER 880           HG       SER 880   0.165   5.141  -5.441
  325    HB2  SER 880           HB2      SER 880   1.450   3.109  -6.805
  326    HB3  SER 880           HB1      SER 880  -0.252   3.211  -7.230
  327    HA   PRO 881           HA       PRO 881   3.176   1.801  -2.493
  328    HB2  PRO 881           HB2      PRO 881   5.295   1.194  -4.393
  329    HB3  PRO 881           HB1      PRO 881   4.593   0.142  -3.167
  330    HG2  PRO 881           HG2      PRO 881   4.254  -0.255  -5.828
  331    HG3  PRO 881           HG1      PRO 881   3.074  -0.747  -4.613
  332    HD2  PRO 881           HD2      PRO 881   3.045   1.651  -6.392
  333    HD3  PRO 881           HD1      PRO 881   1.700   0.600  -5.894
  334    H    MET 882           H        MET 882   3.885   3.576  -1.704
  335    HA   MET 882           HA       MET 882   5.237   5.552  -3.441
  336    HB2  MET 882           HB2      MET 882   3.503   6.061  -1.018
  337    HB3  MET 882           HB1      MET 882   4.303   7.273  -1.998
  338    HG2  MET 882           HG2      MET 882   2.463   5.361  -3.282
  339    HG3  MET 882           HG1      MET 882   1.805   6.749  -2.403
  340    HE1  MET 882           HE1      MET 882   1.745   9.088  -3.283
  341    HE2  MET 882           HE2      MET 882   2.886   9.737  -4.464
  342    HE3  MET 882           HE3      MET 882   3.469   9.140  -2.901
  343    H    ILE 883           H        ILE 883   6.806   6.776  -2.419
  344    HA   ILE 883           HA       ILE 883   7.825   5.653   0.091
  345    HB   ILE 883           HB       ILE 883   9.295   4.810  -1.716
  346   HG12  ILE 883          HG12      ILE 883  10.797   6.969  -0.290
  347   HG13  ILE 883          HG11      ILE 883  10.225   5.502   0.526
  348   HG21  ILE 883          HG21      ILE 883  10.618   6.356  -3.089
  349   HG22  ILE 883          HG22      ILE 883   9.852   7.725  -2.309
  350   HG23  ILE 883          HG23      ILE 883   8.895   6.661  -3.351
  351   HD11  ILE 883          HD11      ILE 883  11.563   4.174  -1.010
  352   HD12  ILE 883          HD12      ILE 883  12.555   5.367  -0.164
  353   HD13  ILE 883          HD13      ILE 883  12.072   5.646  -1.834
  354    H    GLY 884           H        GLY 884   8.266   7.054   1.606
  355    HA2  GLY 884           HA2      GLY 884   7.959   9.890   1.006
  356    HA3  GLY 884           HA1      GLY 884   7.959   9.135   2.603
  357    H    CYS 885           H        CYS 885   9.598  11.221   0.905
  358    HA   CYS 885           HA       CYS 885  12.293  10.390   1.022
  359    HB2  CYS 885           HB2      CYS 885  11.543  12.184  -0.371
  360    HB3  CYS 885           HB1      CYS 885  11.023  13.126   1.008
  361    H    ASP 886           H        ASP 886  13.883  10.684   2.594
  362    HA   ASP 886           HA       ASP 886  12.769  10.968   5.226
  363    HB2  ASP 886           HB2      ASP 886  14.966   9.539   4.139
  364    HB3  ASP 886           HB1      ASP 886  15.573  10.610   5.393
  365    H    ASP 887           H        ASP 887  13.916  13.186   3.083
  366    HA   ASP 887           HA       ASP 887  15.198  14.783   5.210
  367    HB2  ASP 887           HB2      ASP 887  16.330  14.783   3.009
  368    HB3  ASP 887           HB1      ASP 887  14.899  15.528   2.280
  369    H    CYS 888           H        CYS 888  12.711  15.074   2.777
  370    HA   CYS 888           HA       CYS 888  11.587  17.270   4.290
  371    HB2  CYS 888           HB2      CYS 888   9.963  17.489   2.396
  372    HB3  CYS 888           HB1      CYS 888  11.642  17.694   1.933
  373    H    ASP 889           H        ASP 889   9.770  14.935   2.639
  374    HA   ASP 889           HA       ASP 889   8.590  13.267   4.457
  375    HB2  ASP 889           HB2      ASP 889   8.022  15.205   5.898
  376    HB3  ASP 889           HB1      ASP 889   7.156  15.965   4.585
  377    H    ASP 890           H        ASP 890   8.716  14.725   1.446
  378    HA   ASP 890           HA       ASP 890   5.991  14.423   0.713
  379    HB2  ASP 890           HB2      ASP 890   8.440  15.167  -0.883
  380    HB3  ASP 890           HB1      ASP 890   6.892  14.842  -1.651
  381    H    TRP 891           H        TRP 891   5.151  13.055  -0.649
  382    HA   TRP 891           HA       TRP 891   6.481  10.494  -0.603
  383    HD1  TRP 891           HD       TRP 891   3.646  12.162   1.744
  384    HE1  TRP 891           HE1      TRP 891   3.755  10.941   4.009
  385    HE3  TRP 891           HE3      TRP 891   5.066   7.580   0.091
  386    HZ2  TRP 891           HZ2      TRP 891   4.368   8.352   4.961
  387    HZ3  TRP 891           HZ3      TRP 891   5.392   5.785   1.698
  388    HH2  TRP 891           HH       TRP 891   5.053   6.155   4.100
  389    HB2  TRP 891           HB2      TRP 891   3.545  11.191  -0.777
  390    HB3  TRP 891           HB1      TRP 891   4.152   9.564  -1.029
  391    H    TYR 892           H        TYR 892   7.141   9.689  -2.524
  392    HA   TYR 892           HA       TYR 892   5.964  10.782  -4.992
  393    HD1  TYR 892           HD2      TYR 892   8.415  11.837  -2.759
  394    HD2  TYR 892           HD1      TYR 892   8.859  12.030  -6.975
  395    HE1  TYR 892           HE2      TYR 892   9.281  14.107  -2.552
  396    HE2  TYR 892           HE1      TYR 892   9.749  14.309  -6.792
  397    HH   TYR 892           HH       TYR 892  10.786  15.515  -3.835
  398    HB2  TYR 892           HB2      TYR 892   8.746   9.713  -4.449
  399    HB3  TYR 892           HB1      TYR 892   8.128  10.063  -6.048
  400    H    HIS 893           H        HIS 893   5.677   9.285  -6.661
  401    HA   HIS 893           HA       HIS 893   4.832   6.681  -5.779
  402    HD2  HIS 893           HD2      HIS 893   1.980   6.575  -6.661
  403    HE1  HIS 893           HE1      HIS 893   1.161   9.951  -9.053
  404    HE2  HIS 893           HE2      HIS 893   0.258   8.382  -7.337
  405    HB2  HIS 893           HB2      HIS 893   5.218   7.670  -8.647
  406    HB3  HIS 893           HB1      HIS 893   4.523   6.126  -8.228
  407    H    TRP 894           H        TRP 894   5.879   4.677  -6.381
  408    HA   TRP 894           HA       TRP 894   8.653   4.625  -6.224
  409    HD1  TRP 894           HD       TRP 894   7.812   4.347  -4.099
  410    HE1  TRP 894           HE1      TRP 894   7.919   2.889  -1.963
  411    HE3  TRP 894           HE3      TRP 894   7.592  -0.257  -6.257
  412    HZ2  TRP 894           HZ2      TRP 894   7.911   0.137  -1.305
  413    HZ3  TRP 894           HZ3      TRP 894   7.640  -2.234  -4.849
  414    HH2  TRP 894           HH       TRP 894   7.804  -2.048  -2.398
  415    HB2  TRP 894           HB2      TRP 894   6.633   2.534  -6.891
  416    HB3  TRP 894           HB1      TRP 894   8.339   2.186  -7.091
  417    HA   PRO 895           HA       PRO 895   8.870   3.434 -10.916
  418    HB2  PRO 895           HB2      PRO 895   6.869   4.403 -12.537
  419    HB3  PRO 895           HB1      PRO 895   6.909   2.766 -11.873
  420    HG2  PRO 895           HG2      PRO 895   5.474   5.184 -10.839
  421    HG3  PRO 895           HG1      PRO 895   4.873   3.524 -11.026
  422    HD2  PRO 895           HD2      PRO 895   5.650   4.418  -8.642
  423    HD3  PRO 895           HD1      PRO 895   6.032   2.764  -9.159
  424    H    CYS 896           H        CYS 896   7.684   6.399  -9.720
  425    HA   CYS 896           HA       CYS 896   8.554   8.091 -11.844
  426    HB2  CYS 896           HB2      CYS 896   7.650   8.591  -9.038
  427    HB3  CYS 896           HB1      CYS 896   7.839   9.856 -10.279
  428    H    VAL 897           H        VAL 897   9.817   7.017  -8.766
  429    HA   VAL 897           HA       VAL 897  12.100   8.794  -9.149
  430    HB   VAL 897           HB       VAL 897  12.683   8.259  -6.776
  431   HG11  VAL 897          HG11      VAL 897   9.980   9.490  -7.338
  432   HG12  VAL 897          HG12      VAL 897  11.532  10.332  -7.359
  433   HG13  VAL 897          HG13      VAL 897  10.882   9.704  -5.844
  434   HG21  VAL 897          HG21      VAL 897   9.909   7.078  -6.721
  435   HG22  VAL 897          HG22      VAL 897  11.002   7.244  -5.341
  436   HG23  VAL 897          HG23      VAL 897  11.395   6.148  -6.666
  437    H    GLY 898           H        GLY 898  11.295   5.550  -9.499
  438    HA2  GLY 898           HA2      GLY 898  12.822   4.072 -10.588
  439    HA3  GLY 898           HA1      GLY 898  14.150   4.947  -9.843
  440    H    ILE 899           H        ILE 899  11.449   4.159  -7.881
  441    HA   ILE 899           HA       ILE 899  13.141   2.298  -6.439
  442    HB   ILE 899           HB       ILE 899  10.510   3.608  -5.671
  443   HG12  ILE 899          HG12      ILE 899  12.548   5.036  -5.564
  444   HG13  ILE 899          HG11      ILE 899  11.769   4.811  -4.001
  445   HG21  ILE 899          HG21      ILE 899  10.559   1.361  -4.726
  446   HG22  ILE 899          HG22      ILE 899  10.756   2.568  -3.456
  447   HG23  ILE 899          HG23      ILE 899  12.155   1.669  -4.040
  448   HD11  ILE 899          HD11      ILE 899  14.270   3.454  -4.997
  449   HD12  ILE 899          HD12      ILE 899  13.476   3.161  -3.441
  450   HD13  ILE 899          HD13      ILE 899  14.143   4.750  -3.796
  451    H    MET 900           H        MET 900  13.005   0.283  -6.909
  452    HA   MET 900           HA       MET 900  10.625  -0.768  -8.285
  453    HB2  MET 900           HB2      MET 900  13.365  -1.985  -7.956
  454    HB3  MET 900           HB1      MET 900  12.048  -2.694  -8.877
  455    HG2  MET 900           HG2      MET 900  12.082  -0.779 -10.399
  456    HG3  MET 900           HG1      MET 900  13.403  -0.073  -9.478
  457    HE1  MET 900           HE1      MET 900  15.163  -2.692  -8.793
  458    HE2  MET 900           HE2      MET 900  15.819  -1.143  -9.306
  459    HE3  MET 900           HE3      MET 900  16.313  -2.623 -10.126
  460    H    ALA 901           H        ALA 901  12.509  -1.166  -5.400
  461    HA   ALA 901           HA       ALA 901  10.403  -2.815  -4.294
  462    HB1  ALA 901           HB1      ALA 901  12.168  -4.389  -4.961
  463    HB2  ALA 901           HB2      ALA 901  12.115  -4.231  -3.202
  464    HB3  ALA 901           HB3      ALA 901  13.370  -3.407  -4.123
  465    H    ALA 902           H        ALA 902  10.399  -2.586  -1.973
  466    HA   ALA 902           HA       ALA 902  10.844   0.041  -1.173
  467    HB1  ALA 902           HB1      ALA 902  10.370  -2.409   0.532
  468    HB2  ALA 902           HB2      ALA 902   9.136  -1.341  -0.162
  469    HB3  ALA 902           HB3      ALA 902  10.228  -0.730   1.066
  470    HA   PRO 903           HA       PRO 903  15.241  -0.125  -0.367
  471    HB2  PRO 903           HB2      PRO 903  14.612   2.194   1.392
  472    HB3  PRO 903           HB1      PRO 903  15.792   2.068   0.086
  473    HG2  PRO 903           HG2      PRO 903  13.606   3.414  -0.286
  474    HG3  PRO 903           HG1      PRO 903  14.194   2.336  -1.565
  475    HD2  PRO 903           HD2      PRO 903  11.986   1.874   0.413
  476    HD3  PRO 903           HD1      PRO 903  12.030   1.552  -1.337
  477    HA   PRO 904           HA       PRO 904  16.280  -2.127   3.415
  478    HB2  PRO 904           HB2      PRO 904  17.913   0.274   4.064
  479    HB3  PRO 904           HB1      PRO 904  18.353  -1.425   4.190
  480    HG2  PRO 904           HG2      PRO 904  19.217  -0.013   2.147
  481    HG3  PRO 904           HG1      PRO 904  18.575  -1.644   1.859
  482    HD2  PRO 904           HD2      PRO 904  17.283   1.010   1.328
  483    HD3  PRO 904           HD1      PRO 904  17.195  -0.503   0.410
  484    H    GLU 905           H        GLU 905  15.945  -2.187   5.637
  485    HA   GLU 905           HA       GLU 905  14.088  -0.364   6.807
  486    HB2  GLU 905           HB2      GLU 905  14.400  -1.740   8.858
  487    HB3  GLU 905           HB1      GLU 905  14.005  -2.694   7.437
  488    HG2  GLU 905           HG2      GLU 905  16.422  -3.250   7.215
  489    HG3  GLU 905           HG1      GLU 905  16.707  -2.383   8.721
  490    H    GLU 906           H        GLU 906  17.207  -0.103   6.218
  491    HA   GLU 906           HA       GLU 906  18.136   1.393   8.511
  492    HB2  GLU 906           HB2      GLU 906  19.285   1.058   5.733
  493    HB3  GLU 906           HB1      GLU 906  20.132   1.726   7.124
  494    HG2  GLU 906           HG2      GLU 906  20.035  -0.375   8.269
  495    HG3  GLU 906           HG1      GLU 906  18.997  -1.032   7.006
  496    H    MET 907           H        MET 907  15.871   1.964   6.226
  497    HA   MET 907           HA       MET 907  14.816   3.520   5.323
  498    HB2  MET 907           HB2      MET 907  15.954   5.001   7.614
  499    HB3  MET 907           HB1      MET 907  14.490   5.251   6.587
  500    HG2  MET 907           HG2      MET 907  14.871   2.851   8.327
  501    HG3  MET 907           HG1      MET 907  14.043   4.306   8.885
  502    HE1  MET 907           HE1      MET 907  10.896   4.457   6.609
  503    HE2  MET 907           HE2      MET 907  12.419   5.289   6.336
  504    HE3  MET 907           HE3      MET 907  11.761   5.170   7.969
  505    H    GLN 908           H        GLN 908  15.621   6.284   5.886
  506    HA   GLN 908           HA       GLN 908  16.408   8.028   4.965
  507    HB2  GLN 908           HB2      GLN 908  18.518   6.260   3.808
  508    HB3  GLN 908           HB1      GLN 908  18.523   8.023   3.788
  509    HG2  GLN 908           HG2      GLN 908  18.338   6.524   6.335
  510    HG3  GLN 908           HG1      GLN 908  19.896   6.911   5.622
  511   HE21  GLN 908          HE21      GLN 908  16.950   8.205   6.717
  512   HE22  GLN 908          HE22      GLN 908  17.519   9.754   7.254
  513    H    TRP 909           H        TRP 909  17.749   7.707   2.362
  514    HA   TRP 909           HA       TRP 909  17.288   7.830   0.148
  515    HD1  TRP 909           HD       TRP 909  16.353   5.818  -2.354
  516    HE1  TRP 909           HE1      TRP 909  15.040   6.725  -4.383
  517    HE3  TRP 909           HE3      TRP 909  12.985   8.753   0.092
  518    HZ2  TRP 909           HZ2      TRP 909  12.859   8.445  -4.860
  519    HZ3  TRP 909           HZ3      TRP 909  11.326  10.007  -1.210
  520    HH2  TRP 909           HH       TRP 909  11.268   9.858  -3.641
  521    HB2  TRP 909           HB2      TRP 909  15.869   5.806   0.236
  522    HB3  TRP 909           HB1      TRP 909  14.518   6.771   0.820
  523    H    PHE 910           H        PHE 910  16.819   9.482  -1.039
  524    HA   PHE 910           HA       PHE 910  15.185  11.524   0.207
  525    HD1  PHE 910           HD1      PHE 910  16.323  13.258   1.986
  526    HD2  PHE 910           HD2      PHE 910  19.221  10.413   0.753
  527    HE1  PHE 910           HE1      PHE 910  17.065  12.978   4.338
  528    HE2  PHE 910           HE2      PHE 910  19.958  10.141   3.053
  529    HZ   PHE 910           HZ       PHE 910  18.879  11.412   4.859
  530    HB2  PHE 910           HB2      PHE 910  17.998  11.806  -0.874
  531    HB3  PHE 910           HB1      PHE 910  16.985  13.147  -0.332
  532    H    CYS 911           H        CYS 911  13.967  12.583  -1.197
  533    HA   CYS 911           HA       CYS 911  13.595  11.470  -3.747
  534    HB2  CYS 911           HB2      CYS 911  11.879  13.189  -4.100
  535    HB3  CYS 911           HB1      CYS 911  11.752  12.498  -2.502
  536    HA   PRO 912           HA       PRO 912  16.201  13.361  -6.762
  537    HB2  PRO 912           HB2      PRO 912  14.200  14.903  -8.121
  538    HB3  PRO 912           HB1      PRO 912  14.913  13.366  -8.612
  539    HG2  PRO 912           HG2      PRO 912  12.375  13.893  -7.170
  540    HG3  PRO 912           HG1      PRO 912  12.803  12.542  -8.232
  541    HD2  PRO 912           HD2      PRO 912  12.612  12.203  -5.601
  542    HD3  PRO 912           HD1      PRO 912  13.903  11.401  -6.517
  543    H    LYS 913           H        LYS 913  13.849  15.594  -5.310
  544    HA   LYS 913           HA       LYS 913  15.371  17.952  -5.918
  545    HB2  LYS 913           HB2      LYS 913  13.249  17.551  -3.815
  546    HB3  LYS 913           HB1      LYS 913  13.869  19.094  -4.373
  547    HG2  LYS 913           HG2      LYS 913  12.954  18.638  -6.595
  548    HG3  LYS 913           HG1      LYS 913  12.297  17.111  -5.986
  549    HD2  LYS 913           HD2      LYS 913  11.016  18.336  -4.315
  550    HD3  LYS 913           HD1      LYS 913  11.645  19.858  -4.940
  551    HE2  LYS 913           HE2      LYS 913   9.427  19.455  -5.786
  552    HE3  LYS 913           HE1      LYS 913  10.596  19.382  -7.103
  553    HZ1  LYS 913           HZ1      LYS 913  10.508  17.007  -7.036
  554    HZ2  LYS 913           HZ2      LYS 913   8.944  17.574  -7.222
  555    HZ3  LYS 913           HZ3      LYS 913   9.483  17.001  -5.709
  556    H    CYS 914           H        CYS 914  14.797  16.049  -3.004
  557    HA   CYS 914           HA       CYS 914  16.456  17.666  -1.420
  558    HB2  CYS 914           HB2      CYS 914  15.127  15.034  -0.944
  559    HB3  CYS 914           HB1      CYS 914  16.133  15.784   0.283
  560    H    ALA 915           H        ALA 915  16.993  14.655  -3.089
  561    HA   ALA 915           HA       ALA 915  19.521  14.226  -1.878
  562    HB1  ALA 915           HB1      ALA 915  18.196  12.429  -2.864
  563    HB2  ALA 915           HB2      ALA 915  19.831  12.477  -3.540
  564    HB3  ALA 915           HB3      ALA 915  18.467  13.108  -4.469
  565    H    ASN 916           H        ASN 916  18.421  16.109  -4.493
  566    HA   ASN 916           HA       ASN 916  20.926  16.346  -5.905
  567    HB2  ASN 916           HB2      ASN 916  18.629  16.656  -6.944
  568    HB3  ASN 916           HB1      ASN 916  18.525  18.179  -6.077
  569   HD21  ASN 916          HD21      ASN 916  18.403  19.422  -7.922
  570   HD22  ASN 916          HD22      ASN 916  19.744  19.636  -8.982
  571    H    LYS 917           H        LYS 917  19.135  18.173  -3.515
  572    HA   LYS 917           HA       LYS 917  20.867  20.449  -3.558
  573    HB2  LYS 917           HB2      LYS 917  19.538  21.319  -1.780
  574    HB3  LYS 917           HB1      LYS 917  18.430  20.464  -2.846
  575    HG2  LYS 917           HG2      LYS 917  18.703  18.490  -1.290
  576    HG3  LYS 917           HG1      LYS 917  19.498  19.610  -0.193
  577    HD2  LYS 917           HD2      LYS 917  17.453  20.990  -0.163
  578    HD3  LYS 917           HD1      LYS 917  16.661  19.817  -1.220
  579    HE2  LYS 917           HE2      LYS 917  17.261  18.068   0.531
  580    HE3  LYS 917           HE1      LYS 917  17.651  19.414   1.589
  581    HZ1  LYS 917           HZ1      LYS 917  15.266  20.183   1.246
  582    HZ2  LYS 917           HZ2      LYS 917  15.504  18.731   2.052
  583    HZ3  LYS 917           HZ3      LYS 917  15.006  18.671   0.483
  584    H    ILE 918           H        ILE 918  21.153  17.382  -2.225
  585    HA   ILE 918           HA       ILE 918  22.584  18.051   0.145
  586    HB   ILE 918           HB       ILE 918  22.461  15.396  -1.321
  587   HG12  ILE 918          HG12      ILE 918  20.971  16.417   1.113
  588   HG13  ILE 918          HG11      ILE 918  20.302  16.100  -0.486
  589   HG21  ILE 918          HG21      ILE 918  23.325  14.377   0.738
  590   HG22  ILE 918          HG22      ILE 918  23.504  15.974   1.454
  591   HG23  ILE 918          HG23      ILE 918  24.486  15.524   0.059
  592   HD11  ILE 918          HD11      ILE 918  19.725  14.327   1.072
  593   HD12  ILE 918          HD12      ILE 918  21.432  14.035   1.394
  594   HD13  ILE 918          HD13      ILE 918  20.774  13.712  -0.208
  595    H    LYS 919           H        LYS 919  23.606  17.100  -3.106
  596    HA   LYS 919           HA       LYS 919  26.247  18.110  -2.471
  597    HB2  LYS 919           HB2      LYS 919  26.325  15.884  -1.482
  598    HB3  LYS 919           HB1      LYS 919  25.930  15.170  -3.036
  599    HG2  LYS 919           HG2      LYS 919  28.009  15.988  -3.967
  600    HG3  LYS 919           HG1      LYS 919  28.408  16.781  -2.449
  601    HD2  LYS 919           HD2      LYS 919  28.275  14.508  -1.358
  602    HD3  LYS 919           HD1      LYS 919  28.156  13.828  -2.980
  603    HE2  LYS 919           HE2      LYS 919  30.454  13.753  -2.228
  604    HE3  LYS 919           HE1      LYS 919  30.298  14.883  -3.569
  605    HZ1  LYS 919           HZ1      LYS 919  30.242  16.715  -1.910
  606    HZ2  LYS 919           HZ2      LYS 919  31.664  15.848  -1.879
  607    HZ3  LYS 919           HZ3      LYS 919  30.521  15.592  -0.682
  608    H    LYS 920           H        LYS 920  24.616  15.983  -4.858
  609    HA   LYS 920           HA       LYS 920  24.725  15.770  -7.074
  610    HB2  LYS 920           HB2      LYS 920  26.093  18.488  -7.183
  611    HB3  LYS 920           HB1      LYS 920  25.397  17.619  -8.546
  612    HG2  LYS 920           HG2      LYS 920  23.165  17.880  -7.511
  613    HG3  LYS 920           HG1      LYS 920  23.910  18.807  -6.216
  614    HD2  LYS 920           HD2      LYS 920  22.971  20.356  -7.780
  615    HD3  LYS 920           HD1      LYS 920  24.727  20.422  -7.941
  616    HE2  LYS 920           HE2      LYS 920  24.596  18.979  -9.927
  617    HE3  LYS 920           HE1      LYS 920  22.845  18.890  -9.742
  618    HZ1  LYS 920           HZ1      LYS 920  22.765  21.296 -10.053
  619    HZ2  LYS 920           HZ2      LYS 920  23.405  20.530 -11.396
  620    HZ3  LYS 920           HZ3      LYS 920  24.425  21.339 -10.308
  621    H    ASP 921           H        ASP 921  26.099  14.109  -7.381
  622    HA   ASP 921           HA       ASP 921  28.935  14.771  -7.536
  623    HB2  ASP 921           HB2      ASP 921  28.584  14.171  -5.192
  624    HB3  ASP 921           HB1      ASP 921  27.928  12.615  -5.688
  625    H    LYS 922           H        LYS 922  26.783  11.933  -7.567
  626    HA   LYS 922           HA       LYS 922  28.611  10.735  -9.451
  627    HB2  LYS 922           HB2      LYS 922  26.126   9.618  -8.167
  628    HB3  LYS 922           HB1      LYS 922  27.173   8.721  -9.255
  629    HG2  LYS 922           HG2      LYS 922  28.058   9.921  -6.639
  630    HG3  LYS 922           HG1      LYS 922  27.566   8.242  -6.859
  631    HD2  LYS 922           HD2      LYS 922  29.414   7.901  -8.427
  632    HD3  LYS 922           HD1      LYS 922  29.878   9.593  -8.273
  633    HE2  LYS 922           HE2      LYS 922  30.380   9.288  -5.933
  634    HE3  LYS 922           HE1      LYS 922  29.799   7.627  -5.998
  635    HZ1  LYS 922           HZ1      LYS 922  31.603   7.057  -7.442
  636    HZ2  LYS 922           HZ2      LYS 922  32.222   7.802  -6.075
  637    HZ3  LYS 922           HZ3      LYS 922  32.138   8.656  -7.527
  638    H    LYS 923           H        LYS 923  25.061  10.989  -9.481
  639    HA   LYS 923           HA       LYS 923  23.575  11.004 -11.136
  640    HB2  LYS 923           HB2      LYS 923  24.698  13.222 -11.701
  641    HB3  LYS 923           HB1      LYS 923  25.748  12.370 -12.806
  642    HG2  LYS 923           HG2      LYS 923  22.745  12.509 -13.133
  643    HG3  LYS 923           HG1      LYS 923  23.848  13.690 -13.825
  644    HD2  LYS 923           HD2      LYS 923  24.936  11.837 -15.088
  645    HD3  LYS 923           HD1      LYS 923  23.728  10.736 -14.436
  646    HE2  LYS 923           HE2      LYS 923  23.104  11.437 -16.677
  647    HE3  LYS 923           HE1      LYS 923  21.964  12.066 -15.491
  648    HZ1  LYS 923           HZ1      LYS 923  23.013  14.203 -15.613
  649    HZ2  LYS 923           HZ2      LYS 923  22.580  13.710 -17.151
  650    HZ3  LYS 923           HZ3      LYS 923  24.196  13.639 -16.677
  651    H    HIS 924           H        HIS 924  23.577   8.818 -11.134
  652    HA   HIS 924           HA       HIS 924  25.016   7.534 -13.346
  653    HD1  HIS 924           HD1      HIS 924  24.484   3.785 -11.040
  654    HD2  HIS 924           HD2      HIS 924  27.401   5.775 -13.235
  655    HE1  HIS 924           HE1      HIS 924  25.792   1.995 -12.184
  656    HE2  HIS 924           HE2      HIS 924  27.478   3.228 -13.612
  657    HB2  HIS 924           HB2      HIS 924  25.977   7.082 -11.011
  658    HB3  HIS 924           HB1      HIS 924  24.460   6.282 -10.639
  Start of MODEL   19
    1    HA   ALA   1           HA       ALA   1  11.636   6.747   2.962
    2    H1   ALA   1           HT1      ALA   1  13.283   6.874   4.626
    3    H2   ALA   1           HT2      ALA   1  12.913   5.339   5.191
    4    H3   ALA   1           HT3      ALA   1  11.787   6.590   5.373
    5    HB1  ALA   1           HB1      ALA   1  13.120   4.121   3.084
    6    HB2  ALA   1           HB2      ALA   1  13.778   5.620   2.445
    7    HB3  ALA   1           HB3      ALA   1  12.389   4.840   1.651
    8    H    ARG   2           H        ARG   2   9.662   6.692   4.022
    9    HA   ARG   2           HA       ARG   2   8.639   4.158   4.862
   10    HE   ARG   2           HE       ARG   2   4.149   4.476   6.595
   11    HB2  ARG   2           HB2      ARG   2   8.029   6.480   5.834
   12    HB3  ARG   2           HB1      ARG   2   7.050   6.663   4.390
   13    HG2  ARG   2           HG2      ARG   2   5.826   4.654   4.949
   14    HG3  ARG   2           HG1      ARG   2   6.858   4.495   6.381
   15    HD2  ARG   2           HD2      ARG   2   6.000   6.477   7.349
   16    HD3  ARG   2           HD1      ARG   2   5.131   6.905   5.872
   17   HH11  ARG   2          HH11      ARG   2   4.410   7.585   8.270
   18   HH12  ARG   2          HH12      ARG   2   2.950   7.416   9.115
   19   HH21  ARG   2          HH21      ARG   2   2.119   4.263   7.759
   20   HH22  ARG   2          HH22      ARG   2   1.623   5.501   8.818
   21    H    THR   3           H        THR   3   7.321   2.844   3.656
   22    HA   THR   3           HA       THR   3   6.810   3.757   0.947
   23    HB   THR   3           HB       THR   3   7.149   1.203   0.456
   24    HG1  THR   3           HG1      THR   3   9.154   1.307   2.387
   25   HG21  THR   3          HG21      THR   3   9.510   1.666  -0.056
   26   HG22  THR   3          HG22      THR   3   9.456   3.088   0.987
   27   HG23  THR   3          HG23      THR   3   8.493   3.040  -0.491
   28    HA   M3L   4           HA       M3L   4   2.923   2.037   1.951
   29    H    M3L   4           H        M3L   4   4.728   3.832   0.518
   30    HB2  M3L   4           HB2      M3L   4   2.703   4.602   2.093
   31    HB3  M3L   4           HB1      M3L   4   1.258   3.701   1.654
   32    HG2  M3L   4           HG2      M3L   4   1.390   4.359  -0.597
   33    HG3  M3L   4           HG1      M3L   4   3.082   4.818  -0.436
   34    HD2  M3L   4           HD2      M3L   4   2.493   6.713   0.902
   35    HD3  M3L   4           HD1      M3L   4   1.601   6.746  -0.622
   36    HE2  M3L   4           HE2      M3L   4  -0.310   5.668   0.578
   37    HE3  M3L   4           HE1      M3L   4   0.653   5.823   2.028
   38   HM11  M3L   4          HM11      M3L   4   0.996   8.875  -0.295
   39   HM12  M3L   4          HM12      M3L   4  -0.175   7.782  -0.939
   40   HM13  M3L   4          HM13      M3L   4  -0.706   9.267  -0.200
   41   HM21  M3L   4          HM21      M3L   4  -2.199   7.448   0.976
   42   HM22  M3L   4          HM22      M3L   4  -1.816   8.717   2.104
   43   HM23  M3L   4          HM23      M3L   4  -1.616   7.057   2.554
   44   HM31  M3L   4          HM31      M3L   4   0.557   9.491   2.405
   45   HM32  M3L   4          HM32      M3L   4   1.869   8.444   1.958
   46   HM33  M3L   4          HM33      M3L   4   0.786   7.968   3.217
   47    H    GLN   5           H        GLN   5   0.980   1.516   0.594
   48    HA   GLN   5           HA       GLN   5   1.091   1.691  -2.227
   49    HB2  GLN   5           HB2      GLN   5   2.660  -0.222  -1.847
   50    HB3  GLN   5           HB1      GLN   5   1.372  -1.066  -0.996
   51    HG2  GLN   5           HG2      GLN   5   0.029  -1.090  -3.009
   52    HG3  GLN   5           HG1      GLN   5   1.249  -0.166  -3.857
   53   HE21  GLN   5          HE21      GLN   5   1.381  -1.801  -5.419
   54   HE22  GLN   5          HE22      GLN   5   2.268  -3.237  -5.089
   55    H    THR   6           H        THR   6  -0.925   2.438  -2.298
   56    HA   THR   6           HA       THR   6  -3.019   1.285  -0.608
   57    HB   THR   6           HB       THR   6  -3.454   3.497  -2.586
   58    HG1  THR   6           HG1      THR   6  -2.062   4.713  -1.750
   59   HG21  THR   6          HG21      THR   6  -5.272   2.760  -1.081
   60   HG22  THR   6          HG22      THR   6  -4.797   4.424  -0.742
   61   HG23  THR   6          HG23      THR   6  -4.259   3.121   0.317
   62    H    ALA   7           H        ALA   7  -2.039  -0.404  -2.554
   63    HA   ALA   7           HA       ALA   7  -3.378  -0.146  -5.080
   64    HB1  ALA   7           HB1      ALA   7  -1.115  -0.952  -4.882
   65    HB2  ALA   7           HB2      ALA   7  -2.162  -2.130  -5.680
   66    HB3  ALA   7           HB3      ALA   7  -1.689  -2.358  -3.995
   67    H    ARG   8           H        ARG   8  -3.698  -2.118  -2.229
   68    HA   ARG   8           HA       ARG   8  -5.207  -3.597  -1.493
   69    HE   ARG   8           HE       ARG   8  -9.537  -2.581  -1.163
   70    HB2  ARG   8           HB2      ARG   8  -7.029  -2.122  -2.148
   71    HB3  ARG   8           HB1      ARG   8  -6.876  -2.606  -3.827
   72    HG2  ARG   8           HG2      ARG   8  -7.528  -4.871  -3.194
   73    HG3  ARG   8           HG1      ARG   8  -7.808  -4.319  -1.542
   74    HD2  ARG   8           HD2      ARG   8  -9.207  -3.249  -3.999
   75    HD3  ARG   8           HD1      ARG   8  -9.890  -4.429  -2.896
   76   HH11  ARG   8          HH11      ARG   8 -10.262  -1.855  -4.561
   77   HH12  ARG   8          HH12      ARG   8 -11.302  -0.561  -4.197
   78   HH21  ARG   8          HH21      ARG   8 -10.961  -0.794  -0.698
   79   HH22  ARG   8          HH22      ARG   8 -11.717   0.059  -1.963
   80    H    LYS   9           H        LYS   9  -5.295  -3.807  -5.009
   81    HA   LYS   9           HA       LYS   9  -5.207  -6.691  -4.912
   82    HB2  LYS   9           HB2      LYS   9  -5.214  -4.761  -7.219
   83    HB3  LYS   9           HB1      LYS   9  -5.144  -6.503  -7.410
   84    HG2  LYS   9           HG2      LYS   9  -7.285  -6.708  -6.252
   85    HG3  LYS   9           HG1      LYS   9  -7.362  -4.955  -6.094
   86    HD2  LYS   9           HD2      LYS   9  -8.719  -5.735  -7.980
   87    HD3  LYS   9           HD1      LYS   9  -7.389  -4.725  -8.529
   88    HE2  LYS   9           HE2      LYS   9  -7.707  -6.681  -9.982
   89    HE3  LYS   9           HE1      LYS   9  -6.134  -6.714  -9.211
   90    HZ1  LYS   9           HZ1      LYS   9  -7.319  -8.870  -9.252
   91    HZ2  LYS   9           HZ2      LYS   9  -8.478  -8.256  -8.187
   92    HZ3  LYS   9           HZ3      LYS   9  -6.869  -8.388  -7.714
   93    H    SER  10           H        SER  10  -3.098  -4.095  -6.083
   94    HA   SER  10           HA       SER  10  -0.896  -3.929  -6.448
   95    HG   SER  10           HG       SER  10  -1.577  -4.650  -3.967
   96    HB2  SER  10           HB2      SER  10  -0.589  -6.625  -5.062
   97    HB3  SER  10           HB1      SER  10   0.693  -5.450  -5.364
   98    H    THR  11           H        THR  11   1.032  -5.480  -7.540
   99    HA   THR  11           HA       THR  11  -0.090  -6.191 -10.032
  100    HB   THR  11           HB       THR  11   2.351  -6.955 -10.386
  101    HG1  THR  11           HG1      THR  11   3.771  -6.189  -8.747
  102   HG21  THR  11          HG21      THR  11   1.491  -4.777 -11.158
  103   HG22  THR  11          HG22      THR  11   3.137  -4.619 -10.543
  104   HG23  THR  11          HG23      THR  11   1.771  -4.096  -9.556
  105    H    GLY  12           H        GLY  12   1.510  -7.967  -7.436
  106    HA2  GLY  12           HA2      GLY  12   0.597 -10.097  -6.678
  107    HA3  GLY  12           HA1      GLY  12   0.143 -10.425  -8.351
  108    H    GLY  13           H        GLY  13   2.823  -9.092  -9.010
  109    HA2  GLY  13           HA2      GLY  13   5.078  -9.952  -8.226
  110    HA3  GLY  13           HA1      GLY  13   4.409 -11.507  -8.734
  111    H1   GLY 850           HT1      GLY 850  -0.754  32.735   8.171
  112    H2   GLY 850           HT2      GLY 850   0.096  31.293   8.338
  113    H3   GLY 850           HT3      GLY 850  -0.911  31.821   9.588
  114    HA2  GLY 850           HA1      GLY 850  -2.834  31.527   8.178
  115    HA3  GLY 850           HA2      GLY 850  -1.767  30.963   6.899
  116    H    SER 851           H        SER 851  -3.162  30.205  10.024
  117    HA   SER 851           HA       SER 851  -1.961  27.580   9.951
  118    HG   SER 851           HG       SER 851  -1.342  29.450  11.469
  119    HB2  SER 851           HB2      SER 851  -3.819  28.809  11.996
  120    HB3  SER 851           HB1      SER 851  -2.914  27.307  12.174
  121    H    HIS 852           H        HIS 852  -2.933  26.619   8.236
  122    HA   HIS 852           HA       HIS 852  -5.490  25.476   8.677
  123    HD2  HIS 852           HD2      HIS 852  -4.506  26.317   4.327
  124    HE1  HIS 852           HE1      HIS 852  -3.809  30.447   4.934
  125    HE2  HIS 852           HE2      HIS 852  -3.749  28.585   3.267
  126    HB2  HIS 852           HB2      HIS 852  -6.420  26.201   6.444
  127    HB3  HIS 852           HB1      HIS 852  -6.310  27.503   7.616
  128    H    MET 853           H        MET 853  -5.911  24.281   6.254
  129    HA   MET 853           HA       MET 853  -3.636  22.532   6.201
  130    HB2  MET 853           HB2      MET 853  -4.975  21.060   4.793
  131    HB3  MET 853           HB1      MET 853  -5.904  21.551   6.195
  132    HG2  MET 853           HG2      MET 853  -6.191  22.680   3.410
  133    HG3  MET 853           HG1      MET 853  -7.244  21.469   4.128
  134    HE1  MET 853           HE1      MET 853  -8.878  21.993   6.208
  135    HE2  MET 853           HE2      MET 853  -8.979  23.572   6.988
  136    HE3  MET 853           HE3      MET 853  -7.513  22.612   7.144
  137    H    ALA 854           H        ALA 854  -2.222  22.269   4.634
  138    HA   ALA 854           HA       ALA 854  -2.146  24.320   2.572
  139    HB1  ALA 854           HB1      ALA 854   0.166  23.556   2.216
  140    HB2  ALA 854           HB2      ALA 854  -0.081  22.275   3.401
  141    HB3  ALA 854           HB3      ALA 854  -0.124  23.964   3.907
  142    H    MET 855           H        MET 855  -2.314  23.863   0.440
  143    HA   MET 855           HA       MET 855  -3.457  21.329  -0.218
  144    HB2  MET 855           HB2      MET 855  -3.648  22.195  -2.560
  145    HB3  MET 855           HB1      MET 855  -4.422  23.220  -1.367
  146    HG2  MET 855           HG2      MET 855  -2.544  24.751  -1.437
  147    HG3  MET 855           HG1      MET 855  -1.712  23.703  -2.587
  148    HE1  MET 855           HE1      MET 855  -1.396  25.900  -4.056
  149    HE2  MET 855           HE2      MET 855  -2.346  26.878  -2.935
  150    HE3  MET 855           HE3      MET 855  -2.727  26.887  -4.659
  151    H    ALA 856           H        ALA 856  -0.606  22.795  -0.565
  152    HA   ALA 856           HA       ALA 856   1.409  22.219  -1.843
  153    HB1  ALA 856           HB1      ALA 856   1.709  21.816   0.554
  154    HB2  ALA 856           HB2      ALA 856   2.670  20.703  -0.427
  155    HB3  ALA 856           HB3      ALA 856   1.174  20.155   0.333
  156    H    TYR 857           H        TYR 857   1.237  19.067  -1.065
  157    HA   TYR 857           HA       TYR 857   0.363  18.237  -3.744
  158    HD1  TYR 857           HD2      TYR 857   2.063  17.105  -5.820
  159    HD2  TYR 857           HD1      TYR 857   4.112  19.228  -2.767
  160    HE1  TYR 857           HE2      TYR 857   3.324  18.287  -7.529
  161    HE2  TYR 857           HE1      TYR 857   5.403  20.439  -4.478
  162    HH   TYR 857           HH       TYR 857   4.536  20.357  -7.786
  163    HB2  TYR 857           HB2      TYR 857   2.775  17.276  -2.216
  164    HB3  TYR 857           HB1      TYR 857   1.948  16.355  -3.478
  165    H    VAL 858           H        VAL 858  -1.024  18.456  -1.451
  166    HA   VAL 858           HA       VAL 858  -1.808  15.648  -0.869
  167    HB   VAL 858           HB       VAL 858  -2.073  17.872   1.158
  168   HG11  VAL 858          HG11      VAL 858  -3.677  16.103   1.428
  169   HG12  VAL 858          HG12      VAL 858  -2.494  16.040   2.734
  170   HG13  VAL 858          HG13      VAL 858  -2.393  14.893   1.402
  171   HG21  VAL 858          HG21      VAL 858   0.289  17.462   0.855
  172   HG22  VAL 858          HG22      VAL 858   0.021  15.726   1.037
  173   HG23  VAL 858          HG23      VAL 858  -0.244  16.808   2.410
  174    H    ILE 859           H        ILE 859  -3.733  15.388  -1.761
  175    HA   ILE 859           HA       ILE 859  -5.630  17.644  -1.670
  176    HB   ILE 859           HB       ILE 859  -6.847  16.599  -3.530
  177   HG12  ILE 859          HG12      ILE 859  -4.650  14.502  -3.545
  178   HG13  ILE 859          HG11      ILE 859  -6.298  14.269  -2.957
  179   HG21  ILE 859          HG21      ILE 859  -5.192  16.911  -5.324
  180   HG22  ILE 859          HG22      ILE 859  -3.901  16.878  -4.122
  181   HG23  ILE 859          HG23      ILE 859  -5.093  18.175  -4.098
  182   HD11  ILE 859          HD11      ILE 859  -5.947  13.334  -5.191
  183   HD12  ILE 859          HD12      ILE 859  -5.552  14.952  -5.781
  184   HD13  ILE 859          HD13      ILE 859  -7.168  14.606  -5.172
  185    H    ARG 860           H        ARG 860  -7.869  17.022  -1.184
  186    HA   ARG 860           HA       ARG 860  -7.786  14.761   0.658
  187    HE   ARG 860           HE       ARG 860 -12.826  17.526  -0.154
  188    HB2  ARG 860           HB2      ARG 860  -9.677  15.597   1.794
  189    HB3  ARG 860           HB1      ARG 860  -8.680  17.009   1.482
  190    HG2  ARG 860           HG2      ARG 860 -10.115  17.657  -0.354
  191    HG3  ARG 860           HG1      ARG 860 -11.044  16.171  -0.174
  192    HD2  ARG 860           HD2      ARG 860 -11.570  16.955   2.174
  193    HD3  ARG 860           HD1      ARG 860 -10.896  18.517   1.693
  194   HH11  ARG 860          HH11      ARG 860 -12.535  19.301   2.905
  195   HH12  ARG 860          HH12      ARG 860 -14.033  20.080   2.713
  196   HH21  ARG 860          HH21      ARG 860 -14.880  18.545  -0.352
  197   HH22  ARG 860          HH22      ARG 860 -15.395  19.667   0.822
  198    H    ASP 861           H        ASP 861  -9.037  13.104   0.498
  199    HA   ASP 861           HA       ASP 861 -10.448  12.560  -1.959
  200    HB2  ASP 861           HB2      ASP 861  -9.131  10.773  -1.094
  201    HB3  ASP 861           HB1      ASP 861  -9.806  11.022   0.527
  202    H    GLU 862           H        GLU 862 -12.632  11.403  -1.572
  203    HA   GLU 862           HA       GLU 862 -14.434  13.387  -0.639
  204    HB2  GLU 862           HB2      GLU 862 -16.222  11.806  -1.210
  205    HB3  GLU 862           HB1      GLU 862 -15.063  11.978  -2.514
  206    HG2  GLU 862           HG2      GLU 862 -14.121   9.845  -2.057
  207    HG3  GLU 862           HG1      GLU 862 -15.010   9.705  -0.541
  208    H    TRP 863           H        TRP 863 -13.155  10.429   0.804
  209    HA   TRP 863           HA       TRP 863 -14.970  10.643   3.034
  210    HD1  TRP 863           HD       TRP 863 -16.412   8.870   2.520
  211    HE1  TRP 863           HE1      TRP 863 -17.240   7.099   0.756
  212    HE3  TRP 863           HE3      TRP 863 -11.953   7.074   1.154
  213    HZ2  TRP 863           HZ2      TRP 863 -16.056   5.216  -0.960
  214    HZ3  TRP 863           HZ3      TRP 863 -11.813   5.275  -0.553
  215    HH2  TRP 863           HH       TRP 863 -13.835   4.387  -1.582
  216    HB2  TRP 863           HB2      TRP 863 -12.640   8.791   2.585
  217    HB3  TRP 863           HB1      TRP 863 -13.816   8.651   3.888
  218    H    GLY 864           H        GLY 864 -12.331  12.253   2.124
  219    HA2  GLY 864           HA2      GLY 864 -11.334  13.951   3.430
  220    HA3  GLY 864           HA1      GLY 864 -11.760  13.042   4.876
  221    H    ASN 865           H        ASN 865 -10.410  11.092   2.508
  222    HA   ASN 865           HA       ASN 865  -8.091  10.593   4.103
  223    HB2  ASN 865           HB2      ASN 865  -8.692   9.597   1.289
  224    HB3  ASN 865           HB1      ASN 865  -7.365   9.056   2.295
  225   HD21  ASN 865          HD21      ASN 865 -10.770   8.759   1.607
  226   HD22  ASN 865          HD22      ASN 865 -11.028   7.523   2.785
  227    H    GLN 866           H        GLN 866  -5.995  11.158   3.754
  228    HA   GLN 866           HA       GLN 866  -5.596  13.431   2.034
  229    HB2  GLN 866           HB2      GLN 866  -3.865  12.021   4.036
  230    HB3  GLN 866           HB1      GLN 866  -3.248  13.286   2.987
  231    HG2  GLN 866           HG2      GLN 866  -4.781  14.835   3.873
  232    HG3  GLN 866           HG1      GLN 866  -5.535  13.607   4.902
  233   HE21  GLN 866          HE21      GLN 866  -2.750  15.623   4.427
  234   HE22  GLN 866          HE22      GLN 866  -2.030  15.385   5.950
  235    H    ILE 867           H        ILE 867  -5.091  13.191   0.055
  236    HA   ILE 867           HA       ILE 867  -3.685  10.748  -0.772
  237    HB   ILE 867           HB       ILE 867  -5.297  12.654  -2.485
  238   HG12  ILE 867          HG12      ILE 867  -6.800  11.432  -1.004
  239   HG13  ILE 867          HG11      ILE 867  -6.976  10.841  -2.647
  240   HG21  ILE 867          HG21      ILE 867  -5.100  10.956  -4.250
  241   HG22  ILE 867          HG22      ILE 867  -4.073   9.993  -3.190
  242   HG23  ILE 867          HG23      ILE 867  -3.525  11.577  -3.741
  243   HD11  ILE 867          HD11      ILE 867  -7.022   9.017  -1.062
  244   HD12  ILE 867          HD12      ILE 867  -5.453   9.519  -0.425
  245   HD13  ILE 867          HD13      ILE 867  -5.577   8.906  -2.077
  246    H    TRP 868           H        TRP 868  -1.655  11.003  -1.323
  247    HA   TRP 868           HA       TRP 868  -0.671  13.670  -1.669
  248    HD1  TRP 868           HD       TRP 868   2.414  14.234  -0.373
  249    HE1  TRP 868           HE1      TRP 868   2.247  14.859   2.165
  250    HE3  TRP 868           HE3      TRP 868  -1.142  10.894   1.083
  251    HZ2  TRP 868           HZ2      TRP 868   0.790  14.061   4.400
  252    HZ3  TRP 868           HZ3      TRP 868  -1.868  10.891   3.423
  253    HH2  TRP 868           HH       TRP 868  -0.916  12.438   5.041
  254    HB2  TRP 868           HB2      TRP 868   0.622  11.067  -1.040
  255    HB3  TRP 868           HB1      TRP 868   1.578  12.325  -1.811
  256    H    ILE 869           H        ILE 869   0.265  14.418  -3.313
  257    HA   ILE 869           HA       ILE 869  -0.058  13.130  -5.917
  258    HB   ILE 869           HB       ILE 869   0.703  15.955  -5.151
  259   HG12  ILE 869          HG12      ILE 869  -1.570  15.553  -4.382
  260   HG13  ILE 869          HG11      ILE 869  -1.581  16.662  -5.745
  261   HG21  ILE 869          HG21      ILE 869   1.459  15.375  -7.369
  262   HG22  ILE 869          HG22      ILE 869   0.141  16.548  -7.470
  263   HG23  ILE 869          HG23      ILE 869  -0.164  14.849  -7.816
  264   HD11  ILE 869          HD11      ILE 869  -2.267  13.742  -5.802
  265   HD12  ILE 869          HD12      ILE 869  -2.253  14.815  -7.205
  266   HD13  ILE 869          HD13      ILE 869  -3.400  15.091  -5.892
  267    H    CYS 870           H        CYS 870   1.784  12.446  -6.932
  268    HA   CYS 870           HA       CYS 870   4.291  12.486  -5.580
  269    HB2  CYS 870           HB2      CYS 870   3.591  10.607  -6.987
  270    HB3  CYS 870           HB1      CYS 870   3.452  11.665  -8.373
  271    HA   PRO 871           HA       PRO 871   5.242  16.538  -7.421
  272    HB2  PRO 871           HB2      PRO 871   7.853  16.189  -6.107
  273    HB3  PRO 871           HB1      PRO 871   6.650  17.461  -5.882
  274    HG2  PRO 871           HG2      PRO 871   7.100  15.610  -3.990
  275    HG3  PRO 871           HG1      PRO 871   5.477  16.254  -4.293
  276    HD2  PRO 871           HD2      PRO 871   6.677  13.662  -5.199
  277    HD3  PRO 871           HD1      PRO 871   5.058  13.997  -4.531
  278    H    GLY 872           H        GLY 872   6.530  13.516  -7.985
  279    HA2  GLY 872           HA2      GLY 872   8.720  14.281  -9.672
  280    HA3  GLY 872           HA1      GLY 872   8.048  12.667  -9.482
  281    H    CYS 873           H        CYS 873   5.444  12.985 -10.192
  282    HA   CYS 873           HA       CYS 873   5.699  13.672 -13.043
  283    HB2  CYS 873           HB2      CYS 873   3.889  12.003 -13.283
  284    HB3  CYS 873           HB1      CYS 873   5.374  11.349 -12.597
  285    H    ASN 874           H        ASN 874   4.005  14.309 -10.114
  286    HA   ASN 874           HA       ASN 874   2.499  15.734  -9.454
  287    HB2  ASN 874           HB2      ASN 874   2.384  16.679 -12.330
  288    HB3  ASN 874           HB1      ASN 874   1.358  17.363 -11.071
  289   HD21  ASN 874          HD21      ASN 874   3.514  18.569 -12.710
  290   HD22  ASN 874          HD22      ASN 874   4.628  19.233 -11.587
  291    H    LYS 875           H        LYS 875   2.050  13.000 -10.541
  292    HA   LYS 875           HA       LYS 875  -0.850  13.143 -10.799
  293    HB2  LYS 875           HB2      LYS 875   1.127  10.934 -11.375
  294    HB3  LYS 875           HB1      LYS 875  -0.578  10.580 -11.168
  295    HG2  LYS 875           HG2      LYS 875  -0.097  10.709 -13.504
  296    HG3  LYS 875           HG1      LYS 875  -1.069  12.109 -13.065
  297    HD2  LYS 875           HD2      LYS 875   0.990  13.471 -12.993
  298    HD3  LYS 875           HD1      LYS 875   1.909  12.050 -13.489
  299    HE2  LYS 875           HE2      LYS 875   1.447  13.509 -15.396
  300    HE3  LYS 875           HE1      LYS 875   0.647  11.949 -15.576
  301    HZ1  LYS 875           HZ1      LYS 875  -0.800  13.850 -16.159
  302    HZ2  LYS 875           HZ2      LYS 875  -0.689  14.407 -14.578
  303    HZ3  LYS 875           HZ3      LYS 875  -1.420  12.937 -14.892
  304    HA   PRO 876           HA       PRO 876  -1.401  11.861  -6.559
  305    HB2  PRO 876           HB2      PRO 876  -3.874  10.812  -6.744
  306    HB3  PRO 876           HB1      PRO 876  -3.602  12.553  -6.860
  307    HG2  PRO 876           HG2      PRO 876  -3.966  10.550  -9.053
  308    HG3  PRO 876           HG1      PRO 876  -4.731  12.141  -8.865
  309    HD2  PRO 876           HD2      PRO 876  -2.618  11.769 -10.486
  310    HD3  PRO 876           HD1      PRO 876  -2.832  13.267  -9.561
  311    H    ASP 877           H        ASP 877  -2.090   9.874  -5.334
  312    HA   ASP 877           HA       ASP 877  -0.817   7.548  -6.391
  313    HB2  ASP 877           HB2      ASP 877  -0.703   7.877  -4.012
  314    HB3  ASP 877           HB1      ASP 877  -2.460   7.938  -3.889
  315    H    ASP 878           H        ASP 878  -1.568   6.301  -7.744
  316    HA   ASP 878           HA       ASP 878  -4.384   6.178  -8.473
  317    HB2  ASP 878           HB2      ASP 878  -2.045   4.556  -9.503
  318    HB3  ASP 878           HB1      ASP 878  -3.654   4.556 -10.195
  319    H    GLY 879           H        GLY 879  -2.372   4.625  -6.308
  320    HA2  GLY 879           HA2      GLY 879  -3.245   2.896  -4.869
  321    HA3  GLY 879           HA1      GLY 879  -3.979   2.161  -6.307
  322    H    SER 880           H        SER 880  -0.860   3.582  -5.591
  323    HA   SER 880           HA       SER 880   0.390   1.179  -6.658
  324    HG   SER 880           HG       SER 880   0.274   3.638  -9.291
  325    HB2  SER 880           HB2      SER 880   1.075   4.063  -7.297
  326    HB3  SER 880           HB1      SER 880   1.937   2.641  -7.894
  327    HA   PRO 881           HA       PRO 881   3.088   1.829  -3.175
  328    HB2  PRO 881           HB2      PRO 881   5.510   1.211  -4.663
  329    HB3  PRO 881           HB1      PRO 881   4.689   0.240  -3.448
  330    HG2  PRO 881           HG2      PRO 881   4.755  -0.481  -6.051
  331    HG3  PRO 881           HG1      PRO 881   3.390  -0.848  -4.988
  332    HD2  PRO 881           HD2      PRO 881   3.671   1.365  -6.979
  333    HD3  PRO 881           HD1      PRO 881   2.290   0.282  -6.683
  334    H    MET 882           H        MET 882   3.943   3.535  -2.306
  335    HA   MET 882           HA       MET 882   5.357   5.497  -4.010
  336    HB2  MET 882           HB2      MET 882   3.557   6.304  -1.716
  337    HB3  MET 882           HB1      MET 882   4.333   7.341  -2.887
  338    HG2  MET 882           HG2      MET 882   2.889   6.355  -4.639
  339    HG3  MET 882           HG1      MET 882   2.046   5.460  -3.373
  340    HE1  MET 882           HE1      MET 882   3.461   9.138  -3.585
  341    HE2  MET 882           HE2      MET 882   1.967  10.029  -3.931
  342    HE3  MET 882           HE3      MET 882   2.591   8.862  -5.105
  343    H    ILE 883           H        ILE 883   6.871   6.802  -2.847
  344    HA   ILE 883           HA       ILE 883   7.679   5.626  -0.299
  345    HB   ILE 883           HB       ILE 883   9.208   4.847  -2.113
  346   HG12  ILE 883          HG12      ILE 883  10.640   6.818  -0.328
  347   HG13  ILE 883          HG11      ILE 883  10.036   5.262   0.239
  348   HG21  ILE 883          HG21      ILE 883   9.005   6.770  -3.629
  349   HG22  ILE 883          HG22      ILE 883  10.696   6.453  -3.239
  350   HG23  ILE 883          HG23      ILE 883   9.856   7.785  -2.461
  351   HD11  ILE 883          HD11      ILE 883  12.063   5.689  -1.939
  352   HD12  ILE 883          HD12      ILE 883  11.510   4.128  -1.334
  353   HD13  ILE 883          HD13      ILE 883  12.427   5.211  -0.289
  354    H    GLY 884           H        GLY 884   8.264   7.039   1.231
  355    HA2  GLY 884           HA2      GLY 884   7.819   9.857   0.615
  356    HA3  GLY 884           HA1      GLY 884   7.776   9.122   2.216
  357    H    CYS 885           H        CYS 885   9.375  11.278   0.693
  358    HA   CYS 885           HA       CYS 885  12.107  10.496   0.965
  359    HB2  CYS 885           HB2      CYS 885  11.444  12.238  -0.568
  360    HB3  CYS 885           HB1      CYS 885  10.747  13.194   0.725
  361    H    ASP 886           H        ASP 886  13.478  10.898   2.650
  362    HA   ASP 886           HA       ASP 886  12.153  11.227   5.165
  363    HB2  ASP 886           HB2      ASP 886  14.967  10.500   4.416
  364    HB3  ASP 886           HB1      ASP 886  14.530  10.827   6.074
  365    H    ASP 887           H        ASP 887  13.547  13.323   2.963
  366    HA   ASP 887           HA       ASP 887  14.357  15.163   5.100
  367    HB2  ASP 887           HB2      ASP 887  15.876  14.787   3.102
  368    HB3  ASP 887           HB1      ASP 887  14.683  15.648   2.142
  369    H    CYS 888           H        CYS 888  12.383  15.188   2.159
  370    HA   CYS 888           HA       CYS 888  11.151  17.639   3.144
  371    HB2  CYS 888           HB2      CYS 888   9.882  17.776   1.023
  372    HB3  CYS 888           HB1      CYS 888  11.606  17.621   0.748
  373    H    ASP 889           H        ASP 889  10.430  14.323   2.942
  374    HA   ASP 889           HA       ASP 889   8.889  12.998   3.872
  375    HB2  ASP 889           HB2      ASP 889   9.038  14.541   5.859
  376    HB3  ASP 889           HB1      ASP 889   7.721  15.484   5.186
  377    H    ASP 890           H        ASP 890   8.534  14.593   1.325
  378    HA   ASP 890           HA       ASP 890   5.667  14.322   1.091
  379    HB2  ASP 890           HB2      ASP 890   7.696  15.432  -0.870
  380    HB3  ASP 890           HB1      ASP 890   5.994  15.226  -1.255
  381    H    TRP 891           H        TRP 891   4.962  13.251  -0.998
  382    HA   TRP 891           HA       TRP 891   6.279  10.624  -0.924
  383    HD1  TRP 891           HD       TRP 891   3.565  12.216   1.469
  384    HE1  TRP 891           HE1      TRP 891   3.756  10.906   3.682
  385    HE3  TRP 891           HE3      TRP 891   4.871   7.698  -0.407
  386    HZ2  TRP 891           HZ2      TRP 891   4.370   8.298   4.507
  387    HZ3  TRP 891           HZ3      TRP 891   5.235   5.839   1.103
  388    HH2  TRP 891           HH       TRP 891   5.001   6.125   3.558
  389    HB2  TRP 891           HB2      TRP 891   3.366  11.323  -1.092
  390    HB3  TRP 891           HB1      TRP 891   3.984   9.708  -1.420
  391    H    TYR 892           H        TYR 892   7.053   9.865  -2.706
  392    HA   TYR 892           HA       TYR 892   6.076  10.869  -5.297
  393    HD1  TYR 892           HD1      TYR 892   8.659  11.866  -2.850
  394    HD2  TYR 892           HD2      TYR 892   8.845  12.090  -7.090
  395    HE1  TYR 892           HE1      TYR 892   9.615  14.111  -2.683
  396    HE2  TYR 892           HE2      TYR 892   9.791  14.345  -6.940
  397    HH   TYR 892           HH       TYR 892  11.058  15.531  -4.081
  398    HB2  TYR 892           HB2      TYR 892   8.767   9.793  -4.455
  399    HB3  TYR 892           HB1      TYR 892   8.308  10.076  -6.121
  400    H    HIS 893           H        HIS 893   6.068   9.243  -6.963
  401    HA   HIS 893           HA       HIS 893   5.343   6.592  -5.971
  402    HD2  HIS 893           HD2      HIS 893   2.584   6.095  -6.600
  403    HE1  HIS 893           HE1      HIS 893   1.246   9.570  -8.594
  404    HE2  HIS 893           HE2      HIS 893   0.726   7.899  -6.825
  405    HB2  HIS 893           HB2      HIS 893   5.461   7.609  -8.816
  406    HB3  HIS 893           HB1      HIS 893   4.949   5.993  -8.365
  407    H    TRP 894           H        TRP 894   6.285   4.664  -6.774
  408    HA   TRP 894           HA       TRP 894   9.050   4.651  -6.505
  409    HD1  TRP 894           HD       TRP 894   7.930   4.451  -4.505
  410    HE1  TRP 894           HE1      TRP 894   7.803   3.085  -2.321
  411    HE3  TRP 894           HE3      TRP 894   8.016  -0.246  -6.484
  412    HZ2  TRP 894           HZ2      TRP 894   7.725   0.388  -1.558
  413    HZ3  TRP 894           HZ3      TRP 894   7.913  -2.176  -4.955
  414    HH2  TRP 894           HH       TRP 894   7.769  -1.860  -2.549
  415    HB2  TRP 894           HB2      TRP 894   7.119   2.518  -7.347
  416    HB3  TRP 894           HB1      TRP 894   8.850   2.228  -7.321
  417    HA   PRO 895           HA       PRO 895   9.487   3.681 -11.207
  418    HB2  PRO 895           HB2      PRO 895   7.496   4.594 -12.857
  419    HB3  PRO 895           HB1      PRO 895   7.597   2.932 -12.264
  420    HG2  PRO 895           HG2      PRO 895   5.987   5.225 -11.202
  421    HG3  PRO 895           HG1      PRO 895   5.496   3.540 -11.471
  422    HD2  PRO 895           HD2      PRO 895   6.126   4.405  -9.028
  423    HD3  PRO 895           HD1      PRO 895   6.609   2.787  -9.578
  424    H    CYS 896           H        CYS 896   8.079   6.535  -9.925
  425    HA   CYS 896           HA       CYS 896   9.029   8.341 -11.908
  426    HB2  CYS 896           HB2      CYS 896   7.998   8.762  -9.114
  427    HB3  CYS 896           HB1      CYS 896   8.136  10.015 -10.363
  428    H    VAL 897           H        VAL 897  10.119   7.148  -8.789
  429    HA   VAL 897           HA       VAL 897  12.442   8.897  -9.022
  430    HB   VAL 897           HB       VAL 897  12.864   8.455  -6.627
  431   HG11  VAL 897          HG11      VAL 897  10.176   9.582  -7.376
  432   HG12  VAL 897          HG12      VAL 897  11.700  10.470  -7.289
  433   HG13  VAL 897          HG13      VAL 897  10.951   9.836  -5.823
  434   HG21  VAL 897          HG21      VAL 897  11.673   6.304  -6.499
  435   HG22  VAL 897          HG22      VAL 897  10.141   7.158  -6.684
  436   HG23  VAL 897          HG23      VAL 897  11.145   7.438  -5.261
  437    H    GLY 898           H        GLY 898  11.643   5.744  -9.584
  438    HA2  GLY 898           HA2      GLY 898  13.143   4.231 -10.554
  439    HA3  GLY 898           HA1      GLY 898  14.477   5.111  -9.819
  440    H    ILE 899           H        ILE 899  11.744   4.291  -7.923
  441    HA   ILE 899           HA       ILE 899  13.433   2.490  -6.427
  442    HB   ILE 899           HB       ILE 899  10.758   3.756  -5.745
  443   HG12  ILE 899          HG12      ILE 899  12.838   5.130  -5.538
  444   HG13  ILE 899          HG11      ILE 899  11.941   4.943  -4.029
  445   HG21  ILE 899          HG21      ILE 899  12.310   1.788  -4.054
  446   HG22  ILE 899          HG22      ILE 899  10.752   1.487  -4.823
  447   HG23  ILE 899          HG23      ILE 899  10.883   2.683  -3.537
  448   HD11  ILE 899          HD11      ILE 899  14.305   4.807  -3.681
  449   HD12  ILE 899          HD12      ILE 899  14.440   3.478  -4.843
  450   HD13  ILE 899          HD13      ILE 899  13.531   3.263  -3.334
  451    H    MET 900           H        MET 900  13.124   0.359  -6.397
  452    HA   MET 900           HA       MET 900  10.911  -0.693  -8.013
  453    HB2  MET 900           HB2      MET 900  13.702  -1.733  -7.634
  454    HB3  MET 900           HB1      MET 900  12.435  -2.595  -8.493
  455    HG2  MET 900           HG2      MET 900  12.308  -0.848 -10.145
  456    HG3  MET 900           HG1      MET 900  13.460   0.127  -9.247
  457    HE1  MET 900           HE1      MET 900  15.651  -1.924  -8.297
  458    HE2  MET 900           HE2      MET 900  16.009  -0.363  -9.026
  459    HE3  MET 900           HE3      MET 900  16.801  -1.818  -9.629
  460    H    ALA 901           H        ALA 901  12.596  -0.844  -4.994
  461    HA   ALA 901           HA       ALA 901  10.679  -2.819  -4.054
  462    HB1  ALA 901           HB1      ALA 901  12.440  -3.983  -2.816
  463    HB2  ALA 901           HB2      ALA 901  13.656  -2.945  -3.567
  464    HB3  ALA 901           HB3      ALA 901  12.712  -4.064  -4.556
  465    H    ALA 902           H        ALA 902  10.279  -2.646  -1.824
  466    HA   ALA 902           HA       ALA 902  10.459   0.043  -0.897
  467    HB1  ALA 902           HB1      ALA 902   8.438  -1.291  -0.594
  468    HB2  ALA 902           HB2      ALA 902   9.078  -0.722   0.945
  469    HB3  ALA 902           HB3      ALA 902   9.325  -2.400   0.455
  470    HA   PRO 903           HA       PRO 903  13.904  -0.988   1.818
  471    HB2  PRO 903           HB2      PRO 903  14.455   1.739   2.297
  472    HB3  PRO 903           HB1      PRO 903  15.279   0.711   1.126
  473    HG2  PRO 903           HG2      PRO 903  13.613   2.909   0.585
  474    HG3  PRO 903           HG1      PRO 903  14.247   1.755  -0.595
  475    HD2  PRO 903           HD2      PRO 903  11.566   1.914   0.654
  476    HD3  PRO 903           HD1      PRO 903  12.051   1.241  -0.917
  477    HA   PRO 904           HA       PRO 904  11.823  -0.402   5.665
  478    HB2  PRO 904           HB2      PRO 904  13.907   0.159   7.400
  479    HB3  PRO 904           HB1      PRO 904  13.455  -1.463   6.871
  480    HG2  PRO 904           HG2      PRO 904  15.662   0.288   5.935
  481    HG3  PRO 904           HG1      PRO 904  15.610  -1.472   6.071
  482    HD2  PRO 904           HD2      PRO 904  15.355  -0.108   3.701
  483    HD3  PRO 904           HD1      PRO 904  14.664  -1.719   3.993
  484    H    GLU 905           H        GLU 905  11.043   1.140   7.073
  485    HA   GLU 905           HA       GLU 905  10.956   3.735   6.025
  486    HB2  GLU 905           HB2      GLU 905   9.498   4.349   7.856
  487    HB3  GLU 905           HB1      GLU 905   9.060   2.779   7.220
  488    HG2  GLU 905           HG2      GLU 905  10.616   3.259   9.756
  489    HG3  GLU 905           HG1      GLU 905   8.890   2.923   9.637
  490    H    GLU 906           H        GLU 906  12.793   2.445   8.680
  491    HA   GLU 906           HA       GLU 906  13.708   4.986   9.584
  492    HB2  GLU 906           HB2      GLU 906  15.385   3.641  10.874
  493    HB3  GLU 906           HB1      GLU 906  13.700   3.239  11.175
  494    HG2  GLU 906           HG2      GLU 906  13.875   1.285   9.796
  495    HG3  GLU 906           HG1      GLU 906  15.512   1.734   9.323
  496    H    MET 907           H        MET 907  14.735   2.907   7.025
  497    HA   MET 907           HA       MET 907  17.402   3.943   6.836
  498    HB2  MET 907           HB2      MET 907  16.929   1.793   5.829
  499    HB3  MET 907           HB1      MET 907  15.666   2.508   4.819
  500    HG2  MET 907           HG2      MET 907  17.372   3.797   3.639
  501    HG3  MET 907           HG1      MET 907  18.623   3.073   4.641
  502    HE1  MET 907           HE1      MET 907  18.708   3.098   1.489
  503    HE2  MET 907           HE2      MET 907  19.217   1.451   1.143
  504    HE3  MET 907           HE3      MET 907  19.954   2.337   2.478
  505    H    GLN 908           H        GLN 908  18.096   5.590   5.589
  506    HA   GLN 908           HA       GLN 908  16.049   7.540   5.033
  507    HB2  GLN 908           HB2      GLN 908  19.003   7.806   4.806
  508    HB3  GLN 908           HB1      GLN 908  17.839   9.094   4.728
  509    HG2  GLN 908           HG2      GLN 908  18.220   7.388   7.176
  510    HG3  GLN 908           HG1      GLN 908  18.948   8.975   6.928
  511   HE21  GLN 908          HE21      GLN 908  15.957   7.258   7.364
  512   HE22  GLN 908          HE22      GLN 908  15.018   8.619   7.847
  513    H    TRP 909           H        TRP 909  15.563   8.230   3.238
  514    HA   TRP 909           HA       TRP 909  17.117   7.818   0.836
  515    HD1  TRP 909           HD       TRP 909  16.520   5.766  -1.706
  516    HE1  TRP 909           HE1      TRP 909  15.554   6.611  -3.971
  517    HE3  TRP 909           HE3      TRP 909  12.829   8.793   0.060
  518    HZ2  TRP 909           HZ2      TRP 909  13.504   8.326  -4.837
  519    HZ3  TRP 909           HZ3      TRP 909  11.409  10.001  -1.528
  520    HH2  TRP 909           HH       TRP 909  11.737   9.771  -3.929
  521    HB2  TRP 909           HB2      TRP 909  15.563   5.882   0.802
  522    HB3  TRP 909           HB1      TRP 909  14.211   6.973   1.091
  523    H    PHE 910           H        PHE 910  16.823   9.519  -0.562
  524    HA   PHE 910           HA       PHE 910  14.939  11.560   0.315
  525    HD1  PHE 910           HD1      PHE 910  15.688  12.968   2.384
  526    HD2  PHE 910           HD2      PHE 910  19.241  11.070   1.045
  527    HE1  PHE 910           HE1      PHE 910  16.383  12.635   4.722
  528    HE2  PHE 910           HE2      PHE 910  19.941  10.717   3.371
  529    HZ   PHE 910           HZ       PHE 910  18.487  11.510   5.226
  530    HB2  PHE 910           HB2      PHE 910  17.818  12.052  -0.496
  531    HB3  PHE 910           HB1      PHE 910  16.650  13.273   0.021
  532    H    CYS 911           H        CYS 911  13.997  12.626  -1.329
  533    HA   CYS 911           HA       CYS 911  13.840  11.301  -3.808
  534    HB2  CYS 911           HB2      CYS 911  12.279  13.073  -4.435
  535    HB3  CYS 911           HB1      CYS 911  11.989  12.534  -2.799
  536    HA   PRO 912           HA       PRO 912  16.891  13.111  -6.507
  537    HB2  PRO 912           HB2      PRO 912  15.341  14.123  -8.582
  538    HB3  PRO 912           HB1      PRO 912  15.903  12.455  -8.438
  539    HG2  PRO 912           HG2      PRO 912  13.264  13.635  -7.665
  540    HG3  PRO 912           HG1      PRO 912  13.600  12.096  -8.479
  541    HD2  PRO 912           HD2      PRO 912  12.999  12.117  -5.918
  542    HD3  PRO 912           HD1      PRO 912  14.305  11.075  -6.502
  543    H    LYS 913           H        LYS 913  14.404  15.108  -5.233
  544    HA   LYS 913           HA       LYS 913  15.722  17.546  -6.139
  545    HB2  LYS 913           HB2      LYS 913  13.245  17.201  -4.437
  546    HB3  LYS 913           HB1      LYS 913  13.873  18.734  -5.021
  547    HG2  LYS 913           HG2      LYS 913  13.519  17.962  -7.335
  548    HG3  LYS 913           HG1      LYS 913  12.796  16.483  -6.700
  549    HD2  LYS 913           HD2      LYS 913  11.088  17.827  -5.558
  550    HD3  LYS 913           HD1      LYS 913  11.800  19.294  -6.230
  551    HE2  LYS 913           HE2      LYS 913  10.579  17.012  -7.780
  552    HE3  LYS 913           HE1      LYS 913   9.870  18.605  -7.539
  553    HZ1  LYS 913           HZ1      LYS 913  12.377  18.023  -9.026
  554    HZ2  LYS 913           HZ2      LYS 913  11.741  19.558  -8.799
  555    HZ3  LYS 913           HZ3      LYS 913  10.899  18.425  -9.704
  556    H    CYS 914           H        CYS 914  14.826  15.917  -3.108
  557    HA   CYS 914           HA       CYS 914  16.339  17.724  -1.558
  558    HB2  CYS 914           HB2      CYS 914  15.041  15.106  -0.909
  559    HB3  CYS 914           HB1      CYS 914  15.981  16.001   0.279
  560    H    ALA 915           H        ALA 915  17.012  14.515  -2.805
  561    HA   ALA 915           HA       ALA 915  19.431  14.242  -1.411
  562    HB1  ALA 915           HB1      ALA 915  18.168  12.367  -2.423
  563    HB2  ALA 915           HB2      ALA 915  19.879  12.350  -2.832
  564    HB3  ALA 915           HB3      ALA 915  18.689  12.910  -4.015
  565    H    ASN 916           H        ASN 916  18.572  16.141  -3.922
  566    HA   ASN 916           HA       ASN 916  21.150  16.372  -5.277
  567    HB2  ASN 916           HB2      ASN 916  18.972  16.538  -6.517
  568    HB3  ASN 916           HB1      ASN 916  18.588  17.979  -5.604
  569   HD21  ASN 916          HD21      ASN 916  18.769  17.593  -8.446
  570   HD22  ASN 916          HD22      ASN 916  19.942  18.693  -9.052
  571    H    LYS 917           H        LYS 917  19.026  18.233  -3.138
  572    HA   LYS 917           HA       LYS 917  20.793  20.456  -2.919
  573    HB2  LYS 917           HB2      LYS 917  19.259  21.342  -1.294
  574    HB3  LYS 917           HB1      LYS 917  18.272  20.498  -2.472
  575    HG2  LYS 917           HG2      LYS 917  18.320  18.522  -0.948
  576    HG3  LYS 917           HG1      LYS 917  19.070  19.563   0.247
  577    HD2  LYS 917           HD2      LYS 917  17.093  21.014   0.186
  578    HD3  LYS 917           HD1      LYS 917  16.345  19.919  -0.992
  579    HE2  LYS 917           HE2      LYS 917  16.708  18.072   0.647
  580    HE3  LYS 917           HE1      LYS 917  17.177  19.271   1.829
  581    HZ1  LYS 917           HZ1      LYS 917  14.532  18.838   0.599
  582    HZ2  LYS 917           HZ2      LYS 917  14.878  20.294   1.394
  583    HZ3  LYS 917           HZ3      LYS 917  14.966  18.811   2.223
  584    H    ILE 918           H        ILE 918  20.401  17.443  -1.260
  585    HA   ILE 918           HA       ILE 918  22.066  18.010   1.003
  586    HB   ILE 918           HB       ILE 918  21.122  15.357  -0.162
  587   HG12  ILE 918          HG12      ILE 918  19.981  17.090   2.042
  588   HG13  ILE 918          HG11      ILE 918  19.307  16.741   0.447
  589   HG21  ILE 918          HG21      ILE 918  23.069  15.017   1.283
  590   HG22  ILE 918          HG22      ILE 918  21.603  14.365   2.022
  591   HG23  ILE 918          HG23      ILE 918  22.258  15.908   2.572
  592   HD11  ILE 918          HD11      ILE 918  18.956  14.438   1.042
  593   HD12  ILE 918          HD12      ILE 918  18.191  15.492   2.230
  594   HD13  ILE 918          HD13      ILE 918  19.719  14.700   2.610
  595    H    LYS 919           H        LYS 919  22.624  17.340  -2.251
  596    HA   LYS 919           HA       LYS 919  25.233  16.168  -1.833
  597    HB2  LYS 919           HB2      LYS 919  23.601  15.493  -3.679
  598    HB3  LYS 919           HB1      LYS 919  23.978  17.032  -4.442
  599    HG2  LYS 919           HG2      LYS 919  26.306  16.367  -4.638
  600    HG3  LYS 919           HG1      LYS 919  25.947  14.842  -3.833
  601    HD2  LYS 919           HD2      LYS 919  24.394  14.258  -5.635
  602    HD3  LYS 919           HD1      LYS 919  24.777  15.786  -6.435
  603    HE2  LYS 919           HE2      LYS 919  26.751  13.587  -5.833
  604    HE3  LYS 919           HE1      LYS 919  25.997  13.876  -7.396
  605    HZ1  LYS 919           HZ1      LYS 919  27.748  15.848  -5.999
  606    HZ2  LYS 919           HZ2      LYS 919  27.116  15.989  -7.556
  607    HZ3  LYS 919           HZ3      LYS 919  28.234  14.809  -7.215
  608    H    LYS 920           H        LYS 920  23.950  19.144  -1.625
  609    HA   LYS 920           HA       LYS 920  26.286  20.630  -2.599
  610    HB2  LYS 920           HB2      LYS 920  23.926  21.600  -0.968
  611    HB3  LYS 920           HB1      LYS 920  25.146  22.612  -1.707
  612    HG2  LYS 920           HG2      LYS 920  24.296  21.898  -3.929
  613    HG3  LYS 920           HG1      LYS 920  23.020  21.007  -3.105
  614    HD2  LYS 920           HD2      LYS 920  23.475  23.986  -2.751
  615    HD3  LYS 920           HD1      LYS 920  22.392  23.320  -3.957
  616    HE2  LYS 920           HE2      LYS 920  21.110  24.065  -2.028
  617    HE3  LYS 920           HE1      LYS 920  21.018  22.321  -2.136
  618    HZ1  LYS 920           HZ1      LYS 920  21.296  23.212   0.128
  619    HZ2  LYS 920           HZ2      LYS 920  22.811  23.793  -0.241
  620    HZ3  LYS 920           HZ3      LYS 920  22.495  22.126  -0.254
  621    H    ASP 921           H        ASP 921  28.003  20.643  -1.247
  622    HA   ASP 921           HA       ASP 921  29.295  20.518   0.577
  623    HB2  ASP 921           HB2      ASP 921  26.807  21.391   2.117
  624    HB3  ASP 921           HB1      ASP 921  28.450  21.335   2.740
  625    H    LYS 922           H        LYS 922  28.463  19.612   3.255
  626    HA   LYS 922           HA       LYS 922  28.355  17.633   4.394
  627    HB2  LYS 922           HB2      LYS 922  26.297  16.971   2.264
  628    HB3  LYS 922           HB1      LYS 922  26.491  16.114   3.787
  629    HG2  LYS 922           HG2      LYS 922  25.857  18.148   4.998
  630    HG3  LYS 922           HG1      LYS 922  25.665  18.994   3.462
  631    HD2  LYS 922           HD2      LYS 922  23.493  18.293   4.245
  632    HD3  LYS 922           HD1      LYS 922  23.927  17.345   2.824
  633    HE2  LYS 922           HE2      LYS 922  22.916  15.916   4.521
  634    HE3  LYS 922           HE1      LYS 922  24.603  15.475   4.297
  635    HZ1  LYS 922           HZ1      LYS 922  25.126  16.738   6.304
  636    HZ2  LYS 922           HZ2      LYS 922  23.985  15.544   6.625
  637    HZ3  LYS 922           HZ3      LYS 922  23.502  17.151   6.477
  638    H    LYS 923           H        LYS 923  30.402  17.844   2.778
  639    HA   LYS 923           HA       LYS 923  30.718  15.933   0.743
  640    HB2  LYS 923           HB2      LYS 923  32.798  17.404   2.348
  641    HB3  LYS 923           HB1      LYS 923  33.112  16.454   0.909
  642    HG2  LYS 923           HG2      LYS 923  31.719  17.999  -0.398
  643    HG3  LYS 923           HG1      LYS 923  31.455  18.972   1.050
  644    HD2  LYS 923           HD2      LYS 923  33.845  19.382   1.233
  645    HD3  LYS 923           HD1      LYS 923  34.151  18.344  -0.154
  646    HE2  LYS 923           HE2      LYS 923  34.262  20.654  -0.844
  647    HE3  LYS 923           HE1      LYS 923  32.843  19.895  -1.560
  648    HZ1  LYS 923           HZ1      LYS 923  32.840  21.683   0.822
  649    HZ2  LYS 923           HZ2      LYS 923  31.476  20.971   0.153
  650    HZ3  LYS 923           HZ3      LYS 923  32.344  22.095  -0.726
  651    H    HIS 924           H        HIS 924  31.696  14.029   0.701
  652    HA   HIS 924           HA       HIS 924  32.461  12.804   3.245
  653    HD1  HIS 924           HD1      HIS 924  30.368  10.538   4.269
  654    HD2  HIS 924           HD2      HIS 924  28.763  12.745   1.139
  655    HE1  HIS 924           HE1      HIS 924  27.972  10.884   4.852
  656    HE2  HIS 924           HE2      HIS 924  26.972  11.876   2.807
  657    HB2  HIS 924           HB2      HIS 924  31.267  11.482   0.781
  658    HB3  HIS 924           HB1      HIS 924  31.873  10.619   2.185
  Start of MODEL   20
    1    HA   ALA   1           HA       ALA   1  11.994   6.332   3.205
    2    H1   ALA   1           HT1      ALA   1  12.115   6.124   5.507
    3    H2   ALA   1           HT2      ALA   1  13.680   6.136   4.892
    4    H3   ALA   1           HT3      ALA   1  12.974   4.693   5.427
    5    HB1  ALA   1           HB1      ALA   1  14.029   5.151   2.552
    6    HB2  ALA   1           HB2      ALA   1  12.625   4.455   1.748
    7    HB3  ALA   1           HB3      ALA   1  13.352   3.626   3.121
    8    H    ARG   2           H        ARG   2  10.051   6.382   4.273
    9    HA   ARG   2           HA       ARG   2   8.598   4.127   5.058
   10    HE   ARG   2           HE       ARG   2   8.668   4.136   7.438
   11    HB2  ARG   2           HB2      ARG   2   7.779   6.856   4.137
   12    HB3  ARG   2           HB1      ARG   2   6.679   5.580   4.631
   13    HG2  ARG   2           HG2      ARG   2   8.844   6.431   6.415
   14    HG3  ARG   2           HG1      ARG   2   7.342   7.388   6.253
   15    HD2  ARG   2           HD2      ARG   2   7.097   5.901   8.151
   16    HD3  ARG   2           HD1      ARG   2   6.062   5.348   6.847
   17   HH11  ARG   2          HH11      ARG   2   5.193   3.756   6.689
   18   HH12  ARG   2          HH12      ARG   2   5.153   2.088   6.975
   19   HH21  ARG   2          HH21      ARG   2   8.562   1.769   7.909
   20   HH22  ARG   2          HH22      ARG   2   7.122   0.932   7.659
   21    H    THR   3           H        THR   3   7.526   2.757   3.922
   22    HA   THR   3           HA       THR   3   6.917   3.319   1.147
   23    HB   THR   3           HB       THR   3   7.598   0.789   0.813
   24    HG1  THR   3           HG1      THR   3   9.435   1.697   2.803
   25   HG21  THR   3          HG21      THR   3   9.762   1.537  -0.056
   26   HG22  THR   3          HG22      THR   3   9.638   3.020   0.897
   27   HG23  THR   3          HG23      THR   3   8.512   2.728  -0.424
   28    HA   M3L   4           HA       M3L   4   3.616   0.605   1.909
   29    H    M3L   4           H        M3L   4   4.905   2.888   0.733
   30    HB2  M3L   4           HB2      M3L   4   2.970   2.185   3.586
   31    HB3  M3L   4           HB1      M3L   4   1.590   2.004   2.521
   32    HG2  M3L   4           HG2      M3L   4   3.165   4.136   1.533
   33    HG3  M3L   4           HG1      M3L   4   3.013   4.367   3.275
   34    HD2  M3L   4           HD2      M3L   4   0.470   3.612   2.081
   35    HD3  M3L   4           HD1      M3L   4   0.876   4.987   3.101
   36    HE2  M3L   4           HE2      M3L   4   2.072   5.664   0.727
   37    HE3  M3L   4           HE1      M3L   4   0.704   4.740   0.169
   38   HM11  M3L   4          HM11      M3L   4   1.131   7.471  -0.476
   39   HM12  M3L   4          HM12      M3L   4  -0.525   7.098  -0.748
   40   HM13  M3L   4          HM13      M3L   4  -0.088   8.473   0.230
   41   HM21  M3L   4          HM21      M3L   4  -1.575   5.378   0.689
   42   HM22  M3L   4          HM22      M3L   4  -2.004   6.876   1.456
   43   HM23  M3L   4          HM23      M3L   4  -1.397   5.542   2.407
   44   HM31  M3L   4          HM31      M3L   4   0.351   6.914   3.400
   45   HM32  M3L   4          HM32      M3L   4   0.214   8.364   2.474
   46   HM33  M3L   4          HM33      M3L   4   1.704   7.480   2.464
   47    H    GLN   5           H        GLN   5   2.042  -0.174   0.609
   48    HA   GLN   5           HA       GLN   5   1.662   1.268  -1.915
   49    HB2  GLN   5           HB2      GLN   5   2.857  -0.924  -2.029
   50    HB3  GLN   5           HB1      GLN   5   1.380  -1.683  -1.443
   51    HG2  GLN   5           HG2      GLN   5   0.171  -0.950  -3.360
   52    HG3  GLN   5           HG1      GLN   5   1.545   0.010  -3.908
   53   HE21  GLN   5          HE21      GLN   5   0.169  -2.030  -5.303
   54   HE22  GLN   5          HE22      GLN   5   1.363  -3.236  -5.627
   55    H    THR   6           H        THR   6  -0.137   2.220  -1.994
   56    HA   THR   6           HA       THR   6  -2.251   1.753  -0.214
   57    HB   THR   6           HB       THR   6  -2.141   3.403  -2.752
   58    HG1  THR   6           HG1      THR   6  -1.384   4.975  -1.541
   59   HG21  THR   6          HG21      THR   6  -4.430   3.124  -1.827
   60   HG22  THR   6          HG22      THR   6  -3.849   4.782  -1.680
   61   HG23  THR   6          HG23      THR   6  -3.856   3.719  -0.266
   62    H    ALA   7           H        ALA   7  -1.430   0.206  -3.098
   63    HA   ALA   7           HA       ALA   7  -2.283  -1.499  -4.275
   64    HB1  ALA   7           HB1      ALA   7  -3.068  -2.427  -2.124
   65    HB2  ALA   7           HB2      ALA   7  -4.147  -2.834  -3.460
   66    HB3  ALA   7           HB3      ALA   7  -4.591  -1.561  -2.325
   67    H    ARG   8           H        ARG   8  -2.604  -0.664  -6.115
   68    HA   ARG   8           HA       ARG   8  -4.817   1.050  -6.762
   69    HE   ARG   8           HE       ARG   8  -2.098  -0.589 -11.052
   70    HB2  ARG   8           HB2      ARG   8  -3.850   0.771  -9.156
   71    HB3  ARG   8           HB1      ARG   8  -2.946   1.675  -7.958
   72    HG2  ARG   8           HG2      ARG   8  -1.576  -0.329  -7.535
   73    HG3  ARG   8           HG1      ARG   8  -2.459  -1.164  -8.817
   74    HD2  ARG   8           HD2      ARG   8  -0.995   1.419  -9.265
   75    HD3  ARG   8           HD1      ARG   8  -0.196  -0.142  -9.394
   76   HH11  ARG   8          HH11      ARG   8  -0.955   2.696 -10.615
   77   HH12  ARG   8          HH12      ARG   8  -0.673   3.006 -12.269
   78   HH21  ARG   8          HH21      ARG   8  -1.807  -0.148 -13.393
   79   HH22  ARG   8          HH22      ARG   8  -1.186   1.366 -13.871
   80    H    LYS   9           H        LYS   9  -4.412  -2.205  -6.666
   81    HA   LYS   9           HA       LYS   9  -6.790  -2.652  -8.313
   82    HB2  LYS   9           HB2      LYS   9  -6.164  -5.056  -8.156
   83    HB3  LYS   9           HB1      LYS   9  -4.892  -4.091  -8.890
   84    HG2  LYS   9           HG2      LYS   9  -3.706  -4.064  -6.722
   85    HG3  LYS   9           HG1      LYS   9  -4.956  -5.110  -6.057
   86    HD2  LYS   9           HD2      LYS   9  -4.401  -6.841  -7.666
   87    HD3  LYS   9           HD1      LYS   9  -3.200  -5.783  -8.412
   88    HE2  LYS   9           HE2      LYS   9  -1.939  -5.739  -6.313
   89    HE3  LYS   9           HE1      LYS   9  -3.139  -6.799  -5.572
   90    HZ1  LYS   9           HZ1      LYS   9  -2.552  -8.507  -7.172
   91    HZ2  LYS   9           HZ2      LYS   9  -1.216  -8.021  -6.295
   92    HZ3  LYS   9           HZ3      LYS   9  -1.397  -7.503  -7.883
   93    H    SER  10           H        SER  10  -8.549  -3.746  -7.277
   94    HA   SER  10           HA       SER  10  -8.406  -3.660  -4.357
   95    HG   SER  10           HG       SER  10  -8.861  -1.485  -4.931
   96    HB2  SER  10           HB2      SER  10 -10.810  -3.089  -6.118
   97    HB3  SER  10           HB1      SER  10 -10.772  -3.003  -4.356
   98    H    THR  11           H        THR  11  -7.843  -5.806  -4.196
   99    HA   THR  11           HA       THR  11  -9.967  -7.717  -4.507
  100    HB   THR  11           HB       THR  11  -8.950  -7.501  -6.811
  101    HG1  THR  11           HG1      THR  11  -9.771  -9.386  -6.806
  102   HG21  THR  11          HG21      THR  11  -6.503  -8.690  -5.495
  103   HG22  THR  11          HG22      THR  11  -6.636  -7.075  -6.191
  104   HG23  THR  11          HG23      THR  11  -6.732  -8.494  -7.235
  105    H    GLY  12           H        GLY  12  -7.968  -6.478  -2.540
  106    HA2  GLY  12           HA2      GLY  12  -6.247  -8.708  -1.836
  107    HA3  GLY  12           HA1      GLY  12  -6.203  -7.086  -1.155
  108    H    GLY  13           H        GLY  13  -8.302  -9.904  -1.359
  109    HA2  GLY  13           HA2      GLY  13  -8.746  -9.697   1.506
  110    HA3  GLY  13           HA1      GLY  13 -10.148  -9.757   0.428
  111    H1   GLY 850           HT1      GLY 850   5.750  25.317   6.822
  112    H2   GLY 850           HT2      GLY 850   5.322  24.751   5.272
  113    H3   GLY 850           HT3      GLY 850   5.820  23.667   6.432
  114    HA2  GLY 850           HA1      GLY 850   3.877  24.128   7.748
  115    HA3  GLY 850           HA2      GLY 850   3.373  25.282   6.524
  116    H    SER 851           H        SER 851   1.893  23.028   7.341
  117    HA   SER 851           HA       SER 851   2.307  20.983   5.375
  118    HG   SER 851           HG       SER 851   0.862  21.610   8.662
  119    HB2  SER 851           HB2      SER 851   0.194  20.030   6.499
  120    HB3  SER 851           HB1      SER 851   1.673  20.111   7.453
  121    H    HIS 852           H        HIS 852   0.340  23.778   5.759
  122    HA   HIS 852           HA       HIS 852  -1.125  24.874   4.429
  123    HD2  HIS 852           HD2      HIS 852  -0.199  26.838   2.669
  124    HE1  HIS 852           HE1      HIS 852   3.340  25.473   0.787
  125    HE2  HIS 852           HE2      HIS 852   2.122  27.491   1.680
  126    HB2  HIS 852           HB2      HIS 852  -0.183  22.909   2.346
  127    HB3  HIS 852           HB1      HIS 852  -1.409  24.112   2.001
  128    H    MET 853           H        MET 853  -3.109  24.638   3.173
  129    HA   MET 853           HA       MET 853  -4.394  22.113   3.117
  130    HB2  MET 853           HB2      MET 853  -6.481  22.901   4.168
  131    HB3  MET 853           HB1      MET 853  -5.176  23.114   5.304
  132    HG2  MET 853           HG2      MET 853  -6.355  25.062   5.601
  133    HG3  MET 853           HG1      MET 853  -5.170  25.571   4.403
  134    HE1  MET 853           HE1      MET 853  -9.619  24.647   3.501
  135    HE2  MET 853           HE2      MET 853  -8.884  24.564   5.103
  136    HE3  MET 853           HE3      MET 853  -8.464  23.372   3.874
  137    H    ALA 854           H        ALA 854  -4.947  21.917   1.119
  138    HA   ALA 854           HA       ALA 854  -5.200  22.318  -1.053
  139    HB1  ALA 854           HB1      ALA 854  -7.127  23.791  -0.493
  140    HB2  ALA 854           HB2      ALA 854  -6.233  24.404  -1.886
  141    HB3  ALA 854           HB3      ALA 854  -6.015  25.147  -0.304
  142    H    MET 855           H        MET 855  -4.087  23.404  -2.899
  143    HA   MET 855           HA       MET 855  -2.232  24.087  -3.958
  144    HB2  MET 855           HB2      MET 855  -1.891  25.871  -1.538
  145    HB3  MET 855           HB1      MET 855  -0.762  25.871  -2.874
  146    HG2  MET 855           HG2      MET 855  -2.223  27.702  -3.176
  147    HG3  MET 855           HG1      MET 855  -2.638  26.494  -4.382
  148    HE1  MET 855           HE1      MET 855  -3.604  26.728  -0.528
  149    HE2  MET 855           HE2      MET 855  -5.161  27.544  -0.651
  150    HE3  MET 855           HE3      MET 855  -3.686  28.382  -1.139
  151    H    ALA 856           H        ALA 856  -2.197  21.994  -1.783
  152    HA   ALA 856           HA       ALA 856   0.713  21.738  -1.513
  153    HB1  ALA 856           HB1      ALA 856  -1.496  20.524   0.155
  154    HB2  ALA 856           HB2      ALA 856  -0.482  21.892   0.616
  155    HB3  ALA 856           HB3      ALA 856   0.236  20.293   0.414
  156    H    TYR 857           H        TYR 857   0.959  19.112  -1.041
  157    HA   TYR 857           HA       TYR 857  -0.042  17.909  -3.499
  158    HD1  TYR 857           HD2      TYR 857   1.749  17.165  -5.355
  159    HD2  TYR 857           HD1      TYR 857   3.655  19.063  -2.086
  160    HE1  TYR 857           HE2      TYR 857   3.052  18.516  -6.925
  161    HE2  TYR 857           HE1      TYR 857   4.965  20.437  -3.627
  162    HH   TYR 857           HH       TYR 857   5.723  20.391  -5.908
  163    HB2  TYR 857           HB2      TYR 857   2.254  17.167  -1.705
  164    HB3  TYR 857           HB1      TYR 857   1.658  16.204  -3.059
  165    H    VAL 858           H        VAL 858  -1.136  18.250  -0.789
  166    HA   VAL 858           HA       VAL 858  -2.175  15.505  -0.458
  167    HB   VAL 858           HB       VAL 858  -2.091  17.686   1.654
  168   HG11  VAL 858          HG11      VAL 858  -2.934  14.799   1.881
  169   HG12  VAL 858          HG12      VAL 858  -4.006  16.196   1.904
  170   HG13  VAL 858          HG13      VAL 858  -2.841  15.963   3.205
  171   HG21  VAL 858          HG21      VAL 858  -0.443  15.170   1.417
  172   HG22  VAL 858          HG22      VAL 858  -0.438  16.270   2.797
  173   HG23  VAL 858          HG23      VAL 858   0.136  16.824   1.222
  174    H    ILE 859           H        ILE 859  -4.110  15.401  -1.358
  175    HA   ILE 859           HA       ILE 859  -5.963  17.653  -0.943
  176    HB   ILE 859           HB       ILE 859  -7.146  17.054  -3.010
  177   HG12  ILE 859          HG12      ILE 859  -4.977  14.970  -3.440
  178   HG13  ILE 859          HG11      ILE 859  -6.655  14.644  -3.011
  179   HG21  ILE 859          HG21      ILE 859  -4.199  17.463  -3.491
  180   HG22  ILE 859          HG22      ILE 859  -5.410  18.716  -3.217
  181   HG23  ILE 859          HG23      ILE 859  -5.471  17.734  -4.680
  182   HD11  ILE 859          HD11      ILE 859  -7.396  15.548  -5.140
  183   HD12  ILE 859          HD12      ILE 859  -6.232  14.248  -5.381
  184   HD13  ILE 859          HD13      ILE 859  -5.731  15.931  -5.570
  185    H    ARG 860           H        ARG 860  -8.320  16.785  -1.049
  186    HA   ARG 860           HA       ARG 860  -8.312  14.247   0.428
  187    HE   ARG 860           HE       ARG 860 -13.289  17.411   0.094
  188    HB2  ARG 860           HB2      ARG 860 -10.276  14.928   1.592
  189    HB3  ARG 860           HB1      ARG 860  -9.198  16.309   1.623
  190    HG2  ARG 860           HG2      ARG 860 -10.468  17.349  -0.183
  191    HG3  ARG 860           HG1      ARG 860 -11.543  15.952  -0.222
  192    HD2  ARG 860           HD2      ARG 860 -12.030  16.426   2.205
  193    HD3  ARG 860           HD1      ARG 860 -11.174  17.955   1.983
  194   HH11  ARG 860          HH11      ARG 860 -12.381  19.155   3.059
  195   HH12  ARG 860          HH12      ARG 860 -13.833  20.060   3.069
  196   HH21  ARG 860          HH21      ARG 860 -15.200  18.665   0.154
  197   HH22  ARG 860          HH22      ARG 860 -15.442  19.794   1.412
  198    H    ASP 861           H        ASP 861  -9.726  12.627  -0.185
  199    HA   ASP 861           HA       ASP 861 -10.777  12.780  -2.910
  200    HB2  ASP 861           HB2      ASP 861 -11.027  10.416  -2.775
  201    HB3  ASP 861           HB1      ASP 861  -9.536  10.737  -1.898
  202    H    GLU 862           H        GLU 862 -13.005  11.119  -2.616
  203    HA   GLU 862           HA       GLU 862 -14.910  13.074  -1.858
  204    HB2  GLU 862           HB2      GLU 862 -16.592  11.425  -2.439
  205    HB3  GLU 862           HB1      GLU 862 -15.358  11.518  -3.688
  206    HG2  GLU 862           HG2      GLU 862 -14.349   9.476  -2.869
  207    HG3  GLU 862           HG1      GLU 862 -15.515   9.402  -1.550
  208    H    TRP 863           H        TRP 863 -13.532  10.272  -0.239
  209    HA   TRP 863           HA       TRP 863 -15.499  10.294   1.825
  210    HD1  TRP 863           HD       TRP 863 -12.617   6.926   0.152
  211    HE1  TRP 863           HE1      TRP 863 -14.297   5.403  -1.110
  212    HE3  TRP 863           HE3      TRP 863 -16.871   8.922   1.857
  213    HZ2  TRP 863           HZ2      TRP 863 -17.097   5.114  -1.322
  214    HZ3  TRP 863           HZ3      TRP 863 -19.069   7.994   1.116
  215    HH2  TRP 863           HH       TRP 863 -19.151   6.125  -0.459
  216    HB2  TRP 863           HB2      TRP 863 -12.786   8.945   1.725
  217    HB3  TRP 863           HB1      TRP 863 -14.059   8.614   2.890
  218    H    GLY 864           H        GLY 864 -12.277  11.460   1.323
  219    HA2  GLY 864           HA2      GLY 864 -11.798  13.663   2.345
  220    HA3  GLY 864           HA1      GLY 864 -12.622  13.064   3.780
  221    H    ASN 865           H        ASN 865 -10.451  11.112   1.907
  222    HA   ASN 865           HA       ASN 865  -8.693  10.840   4.213
  223    HB2  ASN 865           HB2      ASN 865  -8.570   9.497   1.494
  224    HB3  ASN 865           HB1      ASN 865  -7.600   9.077   2.894
  225   HD21  ASN 865          HD21      ASN 865 -10.684   8.907   1.392
  226   HD22  ASN 865          HD22      ASN 865 -11.368   7.703   2.435
  227    H    GLN 866           H        GLN 866  -6.338  10.949   3.760
  228    HA   GLN 866           HA       GLN 866  -5.744  13.284   2.202
  229    HB2  GLN 866           HB2      GLN 866  -3.990  11.476   3.850
  230    HB3  GLN 866           HB1      GLN 866  -3.419  12.908   3.008
  231    HG2  GLN 866           HG2      GLN 866  -4.934  14.252   4.270
  232    HG3  GLN 866           HG1      GLN 866  -5.468  12.847   5.201
  233   HE21  GLN 866          HE21      GLN 866  -2.957  15.116   4.694
  234   HE22  GLN 866          HE22      GLN 866  -1.947  14.699   6.016
  235    H    ILE 867           H        ILE 867  -5.289  13.201   0.228
  236    HA   ILE 867           HA       ILE 867  -4.201  10.726  -0.936
  237    HB   ILE 867           HB       ILE 867  -5.685  12.972  -2.325
  238   HG12  ILE 867          HG12      ILE 867  -7.235  11.682  -0.941
  239   HG13  ILE 867          HG11      ILE 867  -7.531  11.360  -2.643
  240   HG21  ILE 867          HG21      ILE 867  -5.703  11.500  -4.300
  241   HG22  ILE 867          HG22      ILE 867  -4.719  10.331  -3.424
  242   HG23  ILE 867          HG23      ILE 867  -4.066  11.925  -3.799
  243   HD11  ILE 867          HD11      ILE 867  -6.064   9.561  -0.718
  244   HD12  ILE 867          HD12      ILE 867  -6.312   9.235  -2.432
  245   HD13  ILE 867          HD13      ILE 867  -7.697   9.324  -1.343
  246    H    TRP 868           H        TRP 868  -2.153  10.866  -1.417
  247    HA   TRP 868           HA       TRP 868  -0.920  13.480  -1.524
  248    HD1  TRP 868           HD       TRP 868   1.806  13.777   0.284
  249    HE1  TRP 868           HE1      TRP 868   1.457  13.739   2.823
  250    HE3  TRP 868           HE3      TRP 868  -1.545   9.943   0.561
  251    HZ2  TRP 868           HZ2      TRP 868  -0.063  12.266   4.701
  252    HZ3  TRP 868           HZ3      TRP 868  -2.401   9.285   2.757
  253    HH2  TRP 868           HH       TRP 868  -1.684  10.414   4.773
  254    HB2  TRP 868           HB2      TRP 868   0.216  10.725  -1.238
  255    HB3  TRP 868           HB1      TRP 868   1.228  12.112  -1.630
  256    H    ILE 869           H        ILE 869   0.005  14.302  -3.144
  257    HA   ILE 869           HA       ILE 869  -0.062  12.959  -5.725
  258    HB   ILE 869           HB       ILE 869  -0.001  15.878  -4.912
  259   HG12  ILE 869          HG12      ILE 869  -1.911  16.061  -6.506
  260   HG13  ILE 869          HG11      ILE 869  -1.868  14.316  -6.693
  261   HG21  ILE 869          HG21      ILE 869   0.275  16.530  -7.238
  262   HG22  ILE 869          HG22      ILE 869   0.441  14.839  -7.695
  263   HG23  ILE 869          HG23      ILE 869   1.663  15.590  -6.674
  264   HD11  ILE 869          HD11      ILE 869  -2.516  15.850  -4.185
  265   HD12  ILE 869          HD12      ILE 869  -2.399  14.090  -4.307
  266   HD13  ILE 869          HD13      ILE 869  -3.632  14.953  -5.225
  267    H    CYS 870           H        CYS 870   1.716  12.329  -6.595
  268    HA   CYS 870           HA       CYS 870   4.207  12.563  -5.262
  269    HB2  CYS 870           HB2      CYS 870   3.615  10.597  -6.568
  270    HB3  CYS 870           HB1      CYS 870   3.407  11.581  -8.002
  271    HA   PRO 871           HA       PRO 871   4.894  16.593  -7.194
  272    HB2  PRO 871           HB2      PRO 871   7.530  16.357  -5.874
  273    HB3  PRO 871           HB1      PRO 871   6.307  17.621  -5.710
  274    HG2  PRO 871           HG2      PRO 871   6.736  15.879  -3.738
  275    HG3  PRO 871           HG1      PRO 871   5.092  16.422  -4.134
  276    HD2  PRO 871           HD2      PRO 871   6.465  13.865  -4.883
  277    HD3  PRO 871           HD1      PRO 871   4.816  14.138  -4.265
  278    H    GLY 872           H        GLY 872   6.321  13.638  -7.862
  279    HA2  GLY 872           HA2      GLY 872   8.417  14.591  -9.592
  280    HA3  GLY 872           HA1      GLY 872   7.869  12.929  -9.414
  281    H    CYS 873           H        CYS 873   5.111  13.369  -9.970
  282    HA   CYS 873           HA       CYS 873   5.243  13.939 -12.865
  283    HB2  CYS 873           HB2      CYS 873   3.346  12.285 -12.840
  284    HB3  CYS 873           HB1      CYS 873   4.946  11.654 -12.423
  285    H    ASN 874           H        ASN 874   3.705  14.558  -9.853
  286    HA   ASN 874           HA       ASN 874   2.201  15.957  -9.094
  287    HB2  ASN 874           HB2      ASN 874   2.939  17.617 -10.845
  288    HB3  ASN 874           HB1      ASN 874   1.751  16.949 -11.948
  289   HD21  ASN 874          HD21      ASN 874  -0.334  17.649 -11.783
  290   HD22  ASN 874          HD22      ASN 874  -0.888  18.844 -10.682
  291    H    LYS 875           H        LYS 875   1.790  13.238 -10.143
  292    HA   LYS 875           HA       LYS 875  -1.096  13.290 -10.539
  293    HB2  LYS 875           HB2      LYS 875   0.884  11.023 -10.823
  294    HB3  LYS 875           HB1      LYS 875  -0.844  10.902 -11.117
  295    HG2  LYS 875           HG2      LYS 875  -0.681  12.431 -12.965
  296    HG3  LYS 875           HG1      LYS 875   1.028  12.695 -12.626
  297    HD2  LYS 875           HD2      LYS 875   1.414  10.269 -13.023
  298    HD3  LYS 875           HD1      LYS 875  -0.281  10.115 -13.491
  299    HE2  LYS 875           HE2      LYS 875   0.072  11.718 -15.307
  300    HE3  LYS 875           HE1      LYS 875   1.755  11.887 -14.814
  301    HZ1  LYS 875           HZ1      LYS 875   0.481   9.407 -15.828
  302    HZ2  LYS 875           HZ2      LYS 875   2.070   9.517 -15.308
  303    HZ3  LYS 875           HZ3      LYS 875   1.574  10.375 -16.669
  304    HA   PRO 876           HA       PRO 876  -1.564  12.108  -6.286
  305    HB2  PRO 876           HB2      PRO 876  -4.111  11.155  -6.459
  306    HB3  PRO 876           HB1      PRO 876  -3.704  12.865  -6.339
  307    HG2  PRO 876           HG2      PRO 876  -4.538  11.277  -8.684
  308    HG3  PRO 876           HG1      PRO 876  -4.817  12.989  -8.290
  309    HD2  PRO 876           HD2      PRO 876  -2.912  12.091 -10.127
  310    HD3  PRO 876           HD1      PRO 876  -2.887  13.648  -9.286
  311    H    ASP 877           H        ASP 877  -2.272  10.296  -5.043
  312    HA   ASP 877           HA       ASP 877  -0.973   7.902  -5.867
  313    HB2  ASP 877           HB2      ASP 877  -0.989   8.646  -3.531
  314    HB3  ASP 877           HB1      ASP 877  -2.735   8.498  -3.483
  315    H    ASP 878           H        ASP 878  -1.791   6.220  -6.794
  316    HA   ASP 878           HA       ASP 878  -4.705   6.173  -7.300
  317    HB2  ASP 878           HB2      ASP 878  -4.284   5.048  -9.417
  318    HB3  ASP 878           HB1      ASP 878  -3.345   6.529  -9.363
  319    H    GLY 879           H        GLY 879  -2.570   4.884  -5.376
  320    HA2  GLY 879           HA2      GLY 879  -3.232   2.883  -4.103
  321    HA3  GLY 879           HA1      GLY 879  -3.600   2.156  -5.644
  322    H    SER 880           H        SER 880  -0.897   4.242  -5.159
  323    HA   SER 880           HA       SER 880   0.701   2.340  -6.595
  324    HG   SER 880           HG       SER 880  -0.123   4.863  -7.909
  325    HB2  SER 880           HB2      SER 880   1.591   4.983  -5.621
  326    HB3  SER 880           HB1      SER 880   1.902   4.200  -7.172
  327    HA   PRO 881           HA       PRO 881   3.313   1.690  -2.883
  328    HB2  PRO 881           HB2      PRO 881   5.617   1.245  -4.579
  329    HB3  PRO 881           HB1      PRO 881   4.724   0.044  -3.647
  330    HG2  PRO 881           HG2      PRO 881   4.784   0.148  -6.384
  331    HG3  PRO 881           HG1      PRO 881   3.491  -0.602  -5.439
  332    HD2  PRO 881           HD2      PRO 881   3.536   2.054  -6.793
  333    HD3  PRO 881           HD1      PRO 881   2.190   0.921  -6.556
  334    H    MET 882           H        MET 882   4.021   3.448  -1.878
  335    HA   MET 882           HA       MET 882   5.421   5.454  -3.509
  336    HB2  MET 882           HB2      MET 882   3.551   6.074  -1.223
  337    HB3  MET 882           HB1      MET 882   4.366   7.228  -2.272
  338    HG2  MET 882           HG2      MET 882   3.118   6.227  -4.177
  339    HG3  MET 882           HG1      MET 882   2.218   5.290  -2.987
  340    HE1  MET 882           HE1      MET 882   2.023   9.859  -3.502
  341    HE2  MET 882           HE2      MET 882   2.768   8.735  -4.643
  342    HE3  MET 882           HE3      MET 882   3.500   8.988  -3.047
  343    H    ILE 883           H        ILE 883   6.884   6.783  -2.409
  344    HA   ILE 883           HA       ILE 883   7.818   5.637   0.090
  345    HB   ILE 883           HB       ILE 883   9.236   4.833  -1.761
  346   HG12  ILE 883          HG12      ILE 883  10.806   6.880  -0.201
  347   HG13  ILE 883          HG11      ILE 883  10.215   5.379   0.519
  348   HG21  ILE 883          HG21      ILE 883   8.909   6.634  -3.348
  349   HG22  ILE 883          HG22      ILE 883  10.634   6.392  -3.053
  350   HG23  ILE 883          HG23      ILE 883   9.794   7.746  -2.302
  351   HD11  ILE 883          HD11      ILE 883  12.088   5.617  -1.822
  352   HD12  ILE 883          HD12      ILE 883  11.543   4.108  -1.086
  353   HD13  ILE 883          HD13      ILE 883  12.552   5.229  -0.171
  354    H    GLY 884           H        GLY 884   8.450   7.053   1.584
  355    HA2  GLY 884           HA2      GLY 884   7.688   9.846   1.110
  356    HA3  GLY 884           HA1      GLY 884   7.892   9.072   2.669
  357    H    CYS 885           H        CYS 885   9.142  11.354   0.813
  358    HA   CYS 885           HA       CYS 885  11.980  10.916   1.120
  359    HB2  CYS 885           HB2      CYS 885  10.933  12.374  -0.679
  360    HB3  CYS 885           HB1      CYS 885  10.384  13.423   0.597
  361    H    ASP 886           H        ASP 886  13.264  11.731   2.717
  362    HA   ASP 886           HA       ASP 886  11.960  12.331   5.218
  363    HB2  ASP 886           HB2      ASP 886  14.079  11.012   5.095
  364    HB3  ASP 886           HB1      ASP 886  14.886  12.455   4.549
  365    H    ASP 887           H        ASP 887  13.464  14.118   2.670
  366    HA   ASP 887           HA       ASP 887  13.686  16.480   4.344
  367    HB2  ASP 887           HB2      ASP 887  15.418  15.958   2.619
  368    HB3  ASP 887           HB1      ASP 887  14.230  16.308   1.377
  369    H    CYS 888           H        CYS 888  12.042  15.641   1.317
  370    HA   CYS 888           HA       CYS 888  10.343  17.914   1.283
  371    HB2  CYS 888           HB2      CYS 888   9.734  15.144   0.197
  372    HB3  CYS 888           HB1      CYS 888   8.757  16.557  -0.087
  373    H    ASP 889           H        ASP 889   9.940  14.705   2.641
  374    HA   ASP 889           HA       ASP 889   8.565  13.735   4.070
  375    HB2  ASP 889           HB2      ASP 889   8.967  15.709   5.577
  376    HB3  ASP 889           HB1      ASP 889   7.591  16.520   4.842
  377    H    ASP 890           H        ASP 890   7.993  14.605   1.376
  378    HA   ASP 890           HA       ASP 890   5.079  14.312   1.312
  379    HB2  ASP 890           HB2      ASP 890   7.004  15.294  -0.836
  380    HB3  ASP 890           HB1      ASP 890   5.310  14.941  -1.133
  381    H    TRP 891           H        TRP 891   4.392  12.910  -0.552
  382    HA   TRP 891           HA       TRP 891   6.068  10.523  -0.469
  383    HD1  TRP 891           HD       TRP 891   3.069  11.792   1.758
  384    HE1  TRP 891           HE1      TRP 891   3.185  10.529   3.965
  385    HE3  TRP 891           HE3      TRP 891   4.913   7.395   0.031
  386    HZ2  TRP 891           HZ2      TRP 891   3.958   7.958   4.881
  387    HZ3  TRP 891           HZ3      TRP 891   5.317   5.592   1.595
  388    HH2  TRP 891           HH       TRP 891   4.837   5.854   3.997
  389    HB2  TRP 891           HB2      TRP 891   3.098  10.854  -0.805
  390    HB3  TRP 891           HB1      TRP 891   3.935   9.329  -1.067
  391    H    TYR 892           H        TYR 892   6.964   9.841  -2.226
  392    HA   TYR 892           HA       TYR 892   6.065  10.903  -4.804
  393    HD1  TYR 892           HD2      TYR 892   8.398  12.078  -2.254
  394    HD2  TYR 892           HD1      TYR 892   8.793  12.293  -6.477
  395    HE1  TYR 892           HE2      TYR 892   9.052  14.445  -2.069
  396    HE2  TYR 892           HE1      TYR 892   9.442  14.655  -6.311
  397    HH   TYR 892           HH       TYR 892  10.098  16.169  -3.249
  398    HB2  TYR 892           HB2      TYR 892   8.772   9.997  -3.813
  399    HB3  TYR 892           HB1      TYR 892   8.412  10.228  -5.513
  400    H    HIS 893           H        HIS 893   6.065   9.418  -6.521
  401    HA   HIS 893           HA       HIS 893   5.405   6.696  -5.734
  402    HD2  HIS 893           HD2      HIS 893   2.825   6.469  -6.060
  403    HE1  HIS 893           HE1      HIS 893   1.144   9.598  -8.343
  404    HE2  HIS 893           HE2      HIS 893   0.667   7.600  -6.870
  405    HB2  HIS 893           HB2      HIS 893   5.505   7.953  -8.485
  406    HB3  HIS 893           HB1      HIS 893   5.021   6.299  -8.173
  407    H    TRP 894           H        TRP 894   6.445   4.838  -6.538
  408    HA   TRP 894           HA       TRP 894   9.199   4.920  -6.328
  409    HD1  TRP 894           HD       TRP 894   8.207   4.558  -4.291
  410    HE1  TRP 894           HE1      TRP 894   8.049   3.068  -2.196
  411    HE3  TRP 894           HE3      TRP 894   8.138  -0.001  -6.558
  412    HZ2  TRP 894           HZ2      TRP 894   7.895   0.319  -1.594
  413    HZ3  TRP 894           HZ3      TRP 894   7.986  -2.017  -5.168
  414    HH2  TRP 894           HH       TRP 894   7.868  -1.862  -2.738
  415    HB2  TRP 894           HB2      TRP 894   7.345   2.750  -7.255
  416    HB3  TRP 894           HB1      TRP 894   9.086   2.523  -7.227
  417    HA   PRO 895           HA       PRO 895   9.568   4.073 -11.080
  418    HB2  PRO 895           HB2      PRO 895   7.503   4.954 -12.677
  419    HB3  PRO 895           HB1      PRO 895   7.689   3.287 -12.125
  420    HG2  PRO 895           HG2      PRO 895   6.001   5.479 -10.978
  421    HG3  PRO 895           HG1      PRO 895   5.576   3.783 -11.262
  422    HD2  PRO 895           HD2      PRO 895   6.232   4.650  -8.823
  423    HD3  PRO 895           HD1      PRO 895   6.758   3.054  -9.398
  424    H    CYS 896           H        CYS 896   8.076   6.833  -9.712
  425    HA   CYS 896           HA       CYS 896   8.902   8.709 -11.676
  426    HB2  CYS 896           HB2      CYS 896   7.893   9.034  -8.868
  427    HB3  CYS 896           HB1      CYS 896   7.995  10.320 -10.085
  428    H    VAL 897           H        VAL 897  10.055   7.651  -8.513
  429    HA   VAL 897           HA       VAL 897  12.280   9.521  -8.730
  430    HB   VAL 897           HB       VAL 897  12.773   8.958  -6.361
  431   HG11  VAL 897          HG11      VAL 897  10.759  10.117  -5.465
  432   HG12  VAL 897          HG12      VAL 897   9.977   9.867  -7.019
  433   HG13  VAL 897          HG13      VAL 897  11.412  10.882  -6.913
  434   HG21  VAL 897          HG21      VAL 897  10.189   7.403  -6.528
  435   HG22  VAL 897          HG22      VAL 897  11.152   7.676  -5.071
  436   HG23  VAL 897          HG23      VAL 897  11.794   6.698  -6.395
  437    H    GLY 898           H        GLY 898  11.722   6.271  -9.346
  438    HA2  GLY 898           HA2      GLY 898  13.431   5.062 -10.526
  439    HA3  GLY 898           HA1      GLY 898  14.634   5.910  -9.567
  440    H    ILE 899           H        ILE 899  11.909   4.734  -7.892
  441    HA   ILE 899           HA       ILE 899  13.599   2.728  -6.621
  442    HB   ILE 899           HB       ILE 899  10.874   3.835  -5.832
  443   HG12  ILE 899          HG12      ILE 899  12.848   5.357  -5.507
  444   HG13  ILE 899          HG11      ILE 899  11.971   4.980  -4.025
  445   HG21  ILE 899          HG21      ILE 899  11.020   1.528  -5.117
  446   HG22  ILE 899          HG22      ILE 899  11.112   2.606  -3.724
  447   HG23  ILE 899          HG23      ILE 899  12.575   1.842  -4.343
  448   HD11  ILE 899          HD11      ILE 899  14.591   3.793  -4.932
  449   HD12  ILE 899          HD12      ILE 899  13.712   3.382  -3.447
  450   HD13  ILE 899          HD13      ILE 899  14.343   5.007  -3.669
  451    H    MET 900           H        MET 900  13.193   0.584  -6.898
  452    HA   MET 900           HA       MET 900  10.783  -0.114  -8.439
  453    HB2  MET 900           HB2      MET 900  12.036  -1.917  -9.542
  454    HB3  MET 900           HB1      MET 900  12.719  -0.335  -9.880
  455    HG2  MET 900           HG2      MET 900  14.472  -0.767  -8.218
  456    HG3  MET 900           HG1      MET 900  13.787  -2.369  -7.939
  457    HE1  MET 900           HE1      MET 900  15.580   0.009 -10.499
  458    HE2  MET 900           HE2      MET 900  14.140  -0.445 -11.416
  459    HE3  MET 900           HE3      MET 900  15.727  -1.025 -11.919
  460    H    ALA 901           H        ALA 901  12.684  -0.732  -5.686
  461    HA   ALA 901           HA       ALA 901  10.828  -2.768  -4.834
  462    HB1  ALA 901           HB1      ALA 901  13.843  -2.967  -4.688
  463    HB2  ALA 901           HB2      ALA 901  12.774  -3.989  -5.654
  464    HB3  ALA 901           HB3      ALA 901  12.713  -4.068  -3.894
  465    H    ALA 902           H        ALA 902  10.792  -2.814  -2.476
  466    HA   ALA 902           HA       ALA 902  11.076  -0.128  -1.484
  467    HB1  ALA 902           HB1      ALA 902   9.923  -0.938   0.497
  468    HB2  ALA 902           HB2      ALA 902  10.053  -2.601  -0.085
  469    HB3  ALA 902           HB3      ALA 902   9.077  -1.422  -0.969
  470    HA   PRO 903           HA       PRO 903  14.979  -1.074   0.497
  471    HB2  PRO 903           HB2      PRO 903  15.515   1.410   1.396
  472    HB3  PRO 903           HB1      PRO 903  15.627   1.027  -0.327
  473    HG2  PRO 903           HG2      PRO 903  13.461   2.423   1.173
  474    HG3  PRO 903           HG1      PRO 903  14.136   2.795  -0.422
  475    HD2  PRO 903           HD2      PRO 903  11.790   1.431   0.014
  476    HD3  PRO 903           HD1      PRO 903  12.765   1.328  -1.463
  477    HA   PRO 904           HA       PRO 904  13.809  -1.645   4.737
  478    HB2  PRO 904           HB2      PRO 904  16.272  -0.699   5.888
  479    HB3  PRO 904           HB1      PRO 904  15.713  -2.359   5.715
  480    HG2  PRO 904           HG2      PRO 904  17.804  -1.160   4.319
  481    HG3  PRO 904           HG1      PRO 904  17.033  -2.695   3.903
  482    HD2  PRO 904           HD2      PRO 904  16.804  -0.058   2.644
  483    HD3  PRO 904           HD1      PRO 904  16.411  -1.657   1.992
  484    H    GLU 905           H        GLU 905  12.906  -0.486   6.396
  485    HA   GLU 905           HA       GLU 905  12.763   2.339   6.006
  486    HB2  GLU 905           HB2      GLU 905  11.183   2.378   7.823
  487    HB3  GLU 905           HB1      GLU 905  10.829   1.023   6.767
  488    HG2  GLU 905           HG2      GLU 905  11.907  -0.481   8.362
  489    HG3  GLU 905           HG1      GLU 905  12.240   0.890   9.414
  490    H    GLU 906           H        GLU 906  14.949   0.431   7.576
  491    HA   GLU 906           HA       GLU 906  15.713   2.249   9.689
  492    HB2  GLU 906           HB2      GLU 906  17.215  -0.074   8.477
  493    HB3  GLU 906           HB1      GLU 906  17.625   0.754   9.975
  494    HG2  GLU 906           HG2      GLU 906  15.132  -0.804   9.437
  495    HG3  GLU 906           HG1      GLU 906  16.508  -1.368  10.397
  496    H    MET 907           H        MET 907  15.995   2.198   6.428
  497    HA   MET 907           HA       MET 907  18.451   3.801   6.371
  498    HB2  MET 907           HB2      MET 907  18.464   1.878   4.889
  499    HB3  MET 907           HB1      MET 907  16.933   2.383   4.180
  500    HG2  MET 907           HG2      MET 907  18.804   2.840   2.692
  501    HG3  MET 907           HG1      MET 907  18.026   4.330   3.210
  502    HE1  MET 907           HE1      MET 907  20.151   5.628   2.259
  503    HE2  MET 907           HE2      MET 907  20.937   4.109   1.823
  504    HE3  MET 907           HE3      MET 907  21.805   5.310   2.779
  505    H    GLN 908           H        GLN 908  18.355   5.827   5.643
  506    HA   GLN 908           HA       GLN 908  15.704   7.004   5.497
  507    HB2  GLN 908           HB2      GLN 908  18.407   8.365   5.505
  508    HB3  GLN 908           HB1      GLN 908  16.864   9.198   5.508
  509    HG2  GLN 908           HG2      GLN 908  16.344   8.116   7.669
  510    HG3  GLN 908           HG1      GLN 908  17.966   7.415   7.668
  511   HE21  GLN 908          HE21      GLN 908  17.143  10.643   6.554
  512   HE22  GLN 908          HE22      GLN 908  17.971  11.473   7.807
  513    H    TRP 909           H        TRP 909  15.431   8.759   3.741
  514    HA   TRP 909           HA       TRP 909  16.822   8.169   1.322
  515    HD1  TRP 909           HD       TRP 909  16.292   6.012  -1.040
  516    HE1  TRP 909           HE1      TRP 909  15.380   6.619  -3.355
  517    HE3  TRP 909           HE3      TRP 909  12.523   9.109   0.403
  518    HZ2  TRP 909           HZ2      TRP 909  13.302   8.239  -4.428
  519    HZ3  TRP 909           HZ3      TRP 909  11.124  10.153  -1.308
  520    HH2  TRP 909           HH       TRP 909  11.500   9.729  -3.668
  521    HB2  TRP 909           HB2      TRP 909  15.282   6.282   1.392
  522    HB3  TRP 909           HB1      TRP 909  13.913   7.366   1.619
  523    H    PHE 910           H        PHE 910  16.509   9.694  -0.186
  524    HA   PHE 910           HA       PHE 910  14.677  11.881   0.333
  525    HD1  PHE 910           HD2      PHE 910  15.701  14.036   2.150
  526    HD2  PHE 910           HD1      PHE 910  18.636  11.037   1.503
  527    HE1  PHE 910           HE2      PHE 910  16.276  14.102   4.514
  528    HE2  PHE 910           HE1      PHE 910  19.213  11.073   3.877
  529    HZ   PHE 910           HZ       PHE 910  18.039  12.569   5.401
  530    HB2  PHE 910           HB2      PHE 910  17.634  12.185  -0.339
  531    HB3  PHE 910           HB1      PHE 910  16.479  13.491  -0.101
  532    H    CYS 911           H        CYS 911  13.908  12.630  -1.624
  533    HA   CYS 911           HA       CYS 911  14.027  10.924  -3.841
  534    HB2  CYS 911           HB2      CYS 911  12.693  12.694  -4.965
  535    HB3  CYS 911           HB1      CYS 911  12.136  12.374  -3.336
  536    HA   PRO 912           HA       PRO 912  17.490  11.901  -6.479
  537    HB2  PRO 912           HB2      PRO 912  16.194  13.115  -8.693
  538    HB3  PRO 912           HB1      PRO 912  16.664  11.422  -8.519
  539    HG2  PRO 912           HG2      PRO 912  14.028  12.720  -8.021
  540    HG3  PRO 912           HG1      PRO 912  14.386  11.088  -8.618
  541    HD2  PRO 912           HD2      PRO 912  13.543  11.455  -6.128
  542    HD3  PRO 912           HD1      PRO 912  14.820  10.273  -6.478
  543    H    LYS 913           H        LYS 913  15.231  14.533  -5.955
  544    HA   LYS 913           HA       LYS 913  17.164  16.581  -6.640
  545    HB2  LYS 913           HB2      LYS 913  14.470  16.738  -5.291
  546    HB3  LYS 913           HB1      LYS 913  15.472  18.134  -5.643
  547    HG2  LYS 913           HG2      LYS 913  15.294  17.695  -8.013
  548    HG3  LYS 913           HG1      LYS 913  14.353  16.238  -7.696
  549    HD2  LYS 913           HD2      LYS 913  12.613  17.568  -6.637
  550    HD3  LYS 913           HD1      LYS 913  13.573  19.026  -6.872
  551    HE2  LYS 913           HE2      LYS 913  13.421  18.735  -9.286
  552    HE3  LYS 913           HE1      LYS 913  12.484  17.261  -9.053
  553    HZ1  LYS 913           HZ1      LYS 913  11.111  19.151  -9.564
  554    HZ2  LYS 913           HZ2      LYS 913  11.615  19.974  -8.164
  555    HZ3  LYS 913           HZ3      LYS 913  10.734  18.539  -8.052
  556    H    CYS 914           H        CYS 914  15.588  15.447  -3.663
  557    HA   CYS 914           HA       CYS 914  17.065  17.183  -2.028
  558    HB2  CYS 914           HB2      CYS 914  15.309  14.847  -1.449
  559    HB3  CYS 914           HB1      CYS 914  16.099  15.708  -0.138
  560    H    ALA 915           H        ALA 915  17.656  13.949  -3.092
  561    HA   ALA 915           HA       ALA 915  19.742  13.583  -1.185
  562    HB1  ALA 915           HB1      ALA 915  19.156  11.978  -3.671
  563    HB2  ALA 915           HB2      ALA 915  18.444  11.700  -2.091
  564    HB3  ALA 915           HB3      ALA 915  20.182  11.468  -2.323
  565    H    ASN 916           H        ASN 916  19.441  15.073  -4.208
  566    HA   ASN 916           HA       ASN 916  22.231  14.812  -4.940
  567    HB2  ASN 916           HB2      ASN 916  20.444  14.942  -6.684
  568    HB3  ASN 916           HB1      ASN 916  20.126  16.591  -6.172
  569   HD21  ASN 916          HD21      ASN 916  20.678  17.478  -8.139
  570   HD22  ASN 916          HD22      ASN 916  22.304  17.530  -8.718
  571    H    LYS 917           H        LYS 917  20.025  17.298  -3.753
  572    HA   LYS 917           HA       LYS 917  21.701  19.516  -3.884
  573    HB2  LYS 917           HB2      LYS 917  20.221  20.598  -2.257
  574    HB3  LYS 917           HB1      LYS 917  19.288  19.656  -3.412
  575    HG2  LYS 917           HG2      LYS 917  19.071  17.898  -1.748
  576    HG3  LYS 917           HG1      LYS 917  20.023  18.868  -0.625
  577    HD2  LYS 917           HD2      LYS 917  18.355  20.632  -0.705
  578    HD3  LYS 917           HD1      LYS 917  17.408  19.698  -1.864
  579    HE2  LYS 917           HE2      LYS 917  16.420  19.374   0.271
  580    HE3  LYS 917           HE1      LYS 917  17.283  17.899  -0.187
  581    HZ1  LYS 917           HZ1      LYS 917  18.484  19.920   1.623
  582    HZ2  LYS 917           HZ2      LYS 917  18.957  18.298   1.410
  583    HZ3  LYS 917           HZ3      LYS 917  17.492  18.682   2.132
  584    H    ILE 918           H        ILE 918  21.751  16.952  -1.589
  585    HA   ILE 918           HA       ILE 918  23.167  18.113   0.542
  586    HB   ILE 918           HB       ILE 918  23.489  15.270  -0.490
  587   HG12  ILE 918          HG12      ILE 918  21.408  16.355   1.432
  588   HG13  ILE 918          HG11      ILE 918  21.100  15.847  -0.223
  589   HG21  ILE 918          HG21      ILE 918  23.966  14.744   1.863
  590   HG22  ILE 918          HG22      ILE 918  23.789  16.447   2.271
  591   HG23  ILE 918          HG23      ILE 918  25.106  15.928   1.219
  592   HD11  ILE 918          HD11      ILE 918  22.039  14.063   2.017
  593   HD12  ILE 918          HD12      ILE 918  21.722  13.559   0.357
  594   HD13  ILE 918          HD13      ILE 918  20.402  14.148   1.368
  595    H    LYS 919           H        LYS 919  24.176  16.677  -2.474
  596    HA   LYS 919           HA       LYS 919  27.010  17.131  -1.928
  597    HB2  LYS 919           HB2      LYS 919  25.556  15.545  -4.046
  598    HB3  LYS 919           HB1      LYS 919  27.308  15.700  -3.963
  599    HG2  LYS 919           HG2      LYS 919  27.427  14.537  -1.917
  600    HG3  LYS 919           HG1      LYS 919  25.695  14.674  -1.652
  601    HD2  LYS 919           HD2      LYS 919  26.959  13.078  -3.874
  602    HD3  LYS 919           HD1      LYS 919  26.489  12.396  -2.317
  603    HE2  LYS 919           HE2      LYS 919  24.158  13.268  -2.782
  604    HE3  LYS 919           HE1      LYS 919  24.702  13.623  -4.416
  605    HZ1  LYS 919           HZ1      LYS 919  24.652  10.962  -3.119
  606    HZ2  LYS 919           HZ2      LYS 919  25.249  11.250  -4.668
  607    HZ3  LYS 919           HZ3      LYS 919  23.624  11.490  -4.344
  608    H    LYS 920           H        LYS 920  24.425  18.000  -4.143
  609    HA   LYS 920           HA       LYS 920  24.033  19.657  -5.522
  610    HB2  LYS 920           HB2      LYS 920  26.333  20.918  -4.091
  611    HB3  LYS 920           HB1      LYS 920  25.582  21.717  -5.468
  612    HG2  LYS 920           HG2      LYS 920  23.486  21.864  -4.365
  613    HG3  LYS 920           HG1      LYS 920  24.013  20.776  -3.087
  614    HD2  LYS 920           HD2      LYS 920  25.221  23.496  -3.597
  615    HD3  LYS 920           HD1      LYS 920  23.929  23.195  -2.435
  616    HE2  LYS 920           HE2      LYS 920  26.676  21.928  -2.378
  617    HE3  LYS 920           HE1      LYS 920  26.128  23.244  -1.351
  618    HZ1  LYS 920           HZ1      LYS 920  26.048  20.979  -0.334
  619    HZ2  LYS 920           HZ2      LYS 920  24.722  20.601  -1.328
  620    HZ3  LYS 920           HZ3      LYS 920  24.641  21.852  -0.237
  621    H    ASP 921           H        ASP 921  27.411  18.860  -5.634
  622    HA   ASP 921           HA       ASP 921  27.218  19.073  -8.550
  623    HB2  ASP 921           HB2      ASP 921  28.863  20.616  -7.657
  624    HB3  ASP 921           HB1      ASP 921  29.652  19.316  -6.776
  625    H    LYS 922           H        LYS 922  27.370  17.326  -9.671
  626    HA   LYS 922           HA       LYS 922  28.407  14.903  -8.413
  627    HB2  LYS 922           HB2      LYS 922  26.852  13.666 -10.015
  628    HB3  LYS 922           HB1      LYS 922  26.071  14.537  -8.706
  629    HG2  LYS 922           HG2      LYS 922  25.409  16.307 -10.200
  630    HG3  LYS 922           HG1      LYS 922  26.354  15.614 -11.513
  631    HD2  LYS 922           HD2      LYS 922  23.990  15.129 -11.823
  632    HD3  LYS 922           HD1      LYS 922  24.876  13.644 -11.509
  633    HE2  LYS 922           HE2      LYS 922  24.113  13.662  -9.192
  634    HE3  LYS 922           HE1      LYS 922  23.278  15.191  -9.464
  635    HZ1  LYS 922           HZ1      LYS 922  21.858  14.057 -11.090
  636    HZ2  LYS 922           HZ2      LYS 922  21.734  13.337  -9.589
  637    HZ3  LYS 922           HZ3      LYS 922  22.634  12.595 -10.789
  638    H    LYS 923           H        LYS 923  30.422  14.851  -9.118
  639    HA   LYS 923           HA       LYS 923  32.212  15.047 -10.373
  640    HB2  LYS 923           HB2      LYS 923  32.380  13.386 -12.259
  641    HB3  LYS 923           HB1      LYS 923  31.839  12.723 -10.735
  642    HG2  LYS 923           HG2      LYS 923  29.555  12.617 -11.562
  643    HG3  LYS 923           HG1      LYS 923  30.014  13.374 -13.076
  644    HD2  LYS 923           HD2      LYS 923  29.897  11.065 -13.527
  645    HD3  LYS 923           HD1      LYS 923  31.617  11.418 -13.393
  646    HE2  LYS 923           HE2      LYS 923  31.169   9.372 -12.229
  647    HE3  LYS 923           HE1      LYS 923  31.523  10.611 -11.027
  648    HZ1  LYS 923           HZ1      LYS 923  29.588   9.219 -10.428
  649    HZ2  LYS 923           HZ2      LYS 923  28.791   9.741 -11.811
  650    HZ3  LYS 923           HZ3      LYS 923  29.151  10.834 -10.603
  651    H    HIS 924           H        HIS 924  30.901  14.699 -13.451
  652    HA   HIS 924           HA       HIS 924  30.613  17.462 -14.001
  653    HD1  HIS 924           HD1      HIS 924  33.150  19.647 -14.623
  654    HD2  HIS 924           HD2      HIS 924  32.159  17.121 -17.768
  655    HE1  HIS 924           HE1      HIS 924  33.161  21.092 -16.668
  656    HE2  HIS 924           HE2      HIS 924  32.624  19.553 -18.569
  657    HB2  HIS 924           HB2      HIS 924  33.136  17.212 -13.959
  658    HB3  HIS 924           HB1      HIS 924  32.982  16.019 -15.240