*HEADER    METAL BINDING PROTEIN                   29-SEP-03   1R2U              
*TITLE     NMR STRUCTURE OF THE N DOMAIN OF TROUT CARDIAC TROPONIN C             
*TITLE    2 AT 30 C                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TROPONIN C;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN;                                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS MYKISS;                            
*SOURCE   3 ORGANISM_COMMON: RAINBOW TROUT;                                      
*SOURCE   4 ORGAN: HEART;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX                                      
*KEYWDS    EF-HAND                                                               
*EXPDTA    NMR, 40 STRUCTURES                                                    
*AUTHOR    T.M.BLUMENSCHEIN, T.E.GILLIS, G.F.TIBBITS, B.D.SYKES                  
*REVDAT   1   08-JUN-04 1R2U    0                                                
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assign (resid 37 and name HA) (resid 37 and name HN) 	 2.414 0.715 0.715
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assign (resid 36 and name HB) (resid 37 and name HN) 	 2.670 0.970 1.970
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assign (resid 46 and name HA) (resid 46 and name HN) 	 2.411 0.711 0.711
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assign (resid 45 and name HA) (resid 48 and name HN) 	 3.350 1.650 1.650
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assign (resid 72 and name HG1*) (resid 72 and name HN) 	 2.398 0.698 2.298
assign (resid 36 and name HD1*) (resid 72 and name HN)   2.345 0.645 2.655
assign (resid 76 and name HN) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 72 and name HA) (resid 73 and name HN) 	 2.685 0.985 0.985
assign (resid 73 and name HB2) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 73 and name HN) ((resid 76 and name HG2) or (resid 76 and name HG1))  	 3.350 1.650 1.650
assign (resid 73 and name HB1) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 76 and name HB2) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 76 and name HB1) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 72 and name HG2*) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 72 and name HG1*) (resid 73 and name HN) 	 3.350 1.650 1.650
assign (resid 75 and name HN) (resid 74 and name HN) 	 2.488 0.788 0.788
assign (resid 24 and name HZ) (resid 74 and name HN)     2.570 0.870 0.870
assign (resid 24 and name HE*) (resid 74 and name HN) 	 2.732 1.032 1.532
assign (resid 74 and name HD*) (resid 74 and name HN) 	 2.783 1.083 1.783
assign (resid 73 and name HA) (resid 74 and name HN) 	 2.266 0.566 0.566
assign (resid 74 and name HA) (resid 74 and name HN) 	 2.415 0.715 0.715
assign (resid 73 and name HB2) (resid 74 and name HN) 	 2.410 0.710 0.910
assign (resid 73 and name HB1) (resid 74 and name HN) 	 2.410 0.710 0.910
assign (resid 74 and name HB2) (resid 74 and name HN) 	 2.272 0.572 0.772
assign (resid 74 and name HB1) (resid 74 and name HN) 	 2.272 0.572 0.772
assign (resid 77 and name HN) (resid 75 and name HN) 	 3.044 1.344 1.344
assign (resid 76 and name HN) (resid 75 and name HN) 	 2.371 0.671 0.671
assign (resid 74 and name HD*) (resid 75 and name HN) 	 3.027 1.327 1.927
assign (resid 75 and name HA) (resid 75 and name HN) 	 2.409 0.709 0.709
assign (resid 74 and name HA) (resid 75 and name HN) 	 2.852 1.152 1.152
assign (resid 75 and name HN) ((resid 73 and name HB2) or (resid 73 and name HB1))  	 2.796 1.096 1.096
assign (resid 75 and name HN) ((resid 76 and name HG2) or (resid 76 and name HG1))  	 2.907 1.207 1.207
assign (resid 75 and name HB1) (resid 75 and name HN) 	 2.388 0.688 1.088
assign (resid 75 and name HB2) (resid 75 and name HN) 	 2.388 0.688 1.088
assign (resid 77 and name HN) (resid 76 and name HN) 	 2.416 0.716 0.716
assign (resid 76 and name HG2) (resid 76 and name HN) 	 2.480 0.780 0.980
assign (resid 76 and name HA) (resid 76 and name HN) 	 2.413 0.713 0.713
assign (resid 76 and name HN) ((resid 75 and name HB1) or (resid 75 and name HB2))  	 2.495 0.795 0.795
assign (resid 76 and name HG1) (resid 76 and name HN) 	 2.480 0.780 0.980
assign (resid 76 and name HN) ((resid 76 and name HB2) or (resid 76 and name HB1))  	 2.345 0.645 0.645
assign (resid 76 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*))      2.345 0.645 2.655
assign (resid 78 and name HN) (resid 77 and name HN) 	 2.472 0.772 0.772
assign (resid 79 and name HN) (resid 77 and name HN) 	 2.702 1.002 1.802
assign (resid 76 and name HA) (resid 77 and name HN) 	 2.708 1.008 1.008
assign (resid 77 and name HA) (resid 77 and name HN) 	 2.413 0.713 0.713
assign (resid 74 and name HA) (resid 77 and name HN) 	 2.573 0.873 0.873
assign (resid 77 and name HB2) (resid 77 and name HN) 	 2.278 0.578 0.778
assign (resid 77 and name HB1) (resid 77 and name HN) 	 2.278 0.578 0.778
assign (resid 77 and name HN) ((resid 76 and name HG1) or (resid 76 and name HG2))  	 2.821 1.120 1.320
assign (resid 76 and name HB2) (resid 77 and name HN) 	 2.641 0.941 1.541
assign (resid 76 and name HB1) (resid 77 and name HN) 	 2.641 0.941 1.541
assign (resid 77 and name HN) ((resid 78 and name HB2) or (resid 78 and name HB1))        2.345 0.645 2.655
assign (resid 79 and name HN) (resid 78 and name HN) 	 2.338 0.638 2.238
assign (resid 75 and name HA) (resid 78 and name HN) 	 2.685 0.985 0.985
assign (resid 77 and name HA) (resid 78 and name HN) 	 2.820 1.120 1.120
assign (resid 78 and name HA) (resid 78 and name HN) 	 2.415 0.715 0.715
assign (resid 78 and name HN) ((resid 77 and name HB2) or (resid 77 and name HB1))  	 2.471 0.771 1.171
assign (resid 78 and name HB2) (resid 78 and name HN) 	 2.253 0.553 1.553
assign (resid 78 and name HB1) (resid 78 and name HN) 	 2.253 0.553 1.553
assign (resid 78 and name HN) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  	 2.598 0.898 1.298
assign (resid 78 and name HN) (resid 79 and name HN) 	 2.461 0.761 0.761
assign (resid 80 and name HN) (resid 79 and name HN) 	 2.362 0.662 0.662
assign (resid 76 and name HA) (resid 79 and name HN) 	 2.695 0.995 1.195
assign (resid 79 and name HA) (resid 79 and name HN) 	 2.409 0.709 0.709
assign (resid 79 and name HB) (resid 79 and name HN) 	 2.209 0.509 1.409
assign (resid 79 and name HN) ((resid 78 and name HB2) or (resid 78 and name HB1))  	 2.468 0.768 0.768
assign (resid 79 and name HG2*) (resid 79 and name HN) 	 2.677 0.977 1.777
assign (resid 79 and name HG1*) (resid 79 and name HN) 	 2.677 0.977 1.777
assign (resid 78 and name HA) (resid 79 and name HN) 	 2.827 1.127 1.127
assign (resid 81 and name HN) (resid 80 and name HN) 	 2.468 0.768 0.768
assign (resid 79 and name HG2*) (resid 80 and name HN) 	 2.671 0.971 2.271
assign (resid 80 and name HN) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  	 2.472 0.772 1.572
assign (resid 77 and name HA) (resid 80 and name HN) 	 2.628 0.928 1.328
assign (resid 79 and name HG1*) (resid 80 and name HN) 	 2.671 0.971 2.271
assign (resid 80 and name HA) (resid 80 and name HN) 	 2.416 0.716 0.716
assign (resid 79 and name HA) (resid 80 and name HN) 	 2.704 1.004 1.004
assign (resid 80 and name HN) ((resid 80 and name HG2) or (resid 80 and name HG1))  	 2.635 0.935 0.935
assign (resid 79 and name HB) (resid 80 and name HN) 	 2.324 0.624 1.424
assign (resid 80 and name HB2) (resid 80 and name HN) 	 2.312 0.612 1.212
assign (resid 80 and name HB1) (resid 80 and name HN) 	 2.312 0.612 1.212
assign (resid 80 and name HN) ((resid 83 and name HG1) or (resid 83 and name HG2))  	 2.408 0.708 2.592
assign (resid 82 and name HN) (resid 81 and name HN) 	 2.510 0.811 0.811
assign (resid 79 and name HN) (resid 81 and name HN) 	 2.932 1.232 1.632
assign (resid 81 and name HA) (resid 81 and name HN) 	 2.412 0.712 0.712
assign (resid 80 and name HA) (resid 81 and name HN) 	 2.720 1.020 1.020
assign (resid 78 and name HA) (resid 81 and name HN) 	 2.562 0.862 1.462
assign (resid 80 and name HB2) (resid 81 and name HN) 	 2.551 0.851 1.551
assign (resid 80 and name HB1) (resid 81 and name HN) 	 2.551 0.851 1.551
assign (resid 81 and name HB2) (resid 81 and name HN) 	 2.557 0.857 1.357
assign (resid 81 and name HG2) (resid 81 and name HN) 	 2.530 0.830 1.930
assign (resid 81 and name HG1) (resid 81 and name HN) 	 2.530 0.830 1.930
assign (resid 81 and name HB1) (resid 81 and name HN) 	 2.557 0.857 1.357
assign (resid 82 and name HA) (resid 82 and name HN) 	 2.409 0.709 0.709
assign (resid 79 and name HA) (resid 82 and name HN) 	 2.780 1.080 1.080
assign (resid 82 and name HB) (resid 82 and name HN) 	 2.355 0.655 1.255
assign ((resid 81 and name HB2) or (resid 81 and name HB1)) (resid 82 and name HN) 	 2.524 0.824 1.324
assign (resid 82 and name HG2*) (resid 82 and name HN) 	 2.359 0.659 1.459
assign (resid 82 and name HG1*) (resid 82 and name HN) 	 2.359 0.659 1.459
assign (resid 82 and name HA) (resid 83 and name HN) 	 2.669 0.969 0.969
assign (resid 83 and name HA) (resid 83 and name HN) 	 2.410 0.710 0.710
assign (resid 80 and name HA) (resid 83 and name HN) 	 2.791 1.091 1.091
assign (resid 79 and name HA) (resid 83 and name HN) 	 3.023 1.323 1.623
assign (resid 83 and name HD*) (resid 83 and name HN) 	 3.015 1.315 1.715
assign (resid 82 and name HB) (resid 83 and name HN) 	 2.539 0.839 1.639
assign (resid 83 and name HB*) (resid 83 and name HN) 	 2.392 0.692 0.692
assign (resid 83 and name HG2) (resid 83 and name HN) 	 2.431 0.731 0.931
assign (resid 83 and name HG1) (resid 83 and name HN) 	 2.431 0.731 0.931
assign ((resid 82 and name HG1*) or (resid 82 and name HG2*)) (resid 83 and name HN) 	 2.717 1.017 1.017
assign (resid 83 and name HN) (resid 84 and name HN) 	 2.398 0.698 0.698
assign (resid 85 and name HN) (resid 84 and name HN) 	 2.374 0.674 0.674
assign (resid 84 and name HA) (resid 84 and name HN) 	 2.409 0.710 0.710
assign (resid 81 and name HA) (resid 84 and name HN) 	 2.621 0.921 1.621
assign (resid 83 and name HA) (resid 84 and name HN) 	 2.746 1.046 1.046
assign (resid 84 and name HB*) (resid 84 and name HN) 	 2.263 0.563 0.563
assign (resid 83 and name HB*) (resid 84 and name HN) 	 2.585 0.885 1.585
assign ((resid 83 and name HG2) or (resid 83 and name HG1)) (resid 84 and name HN) 	 2.588 0.888 2.188
assign (resid 86 and name HN) (resid 85 and name HN) 	 2.697 0.997 0.997
assign (resid 85 and name HA) (resid 85 and name HN) 	 2.407 0.707 0.707
assign (resid 82 and name HA) (resid 85 and name HN) 	 2.681 0.981 0.981
assign (resid 83 and name HA) (resid 85 and name HN) 	 3.144 1.444 1.444
assign (resid 84 and name HB*) (resid 85 and name HN) 	 2.606 0.906 0.906
assign (resid 85 and name HG2) (resid 85 and name HN) 	 2.754 1.054 1.454
assign (resid 85 and name HG1) (resid 85 and name HN) 	 2.754 1.054 1.454
assign (resid 85 and name HN) ((resid 85 and name HB1) or (resid 85 and name HB2))  	 2.331 0.631 0.931
assign (resid 87 and name HN) (resid 86 and name HN) 	 3.290 1.590 1.590
assign (resid 86 and name HA) (resid 86 and name HN) 	 2.404 0.704 0.704
assign (resid 86 and name HN) ((resid 85 and name HB1) or (resid 85 and name HB2))  	 2.997 1.297 1.497
assign (resid 86 and name HN) ((resid 86 and name HB1) or (resid 86 and name HB2))  	 2.614 0.914 0.914
assign (resid 86 and name HG*) (resid 86 and name HN) 	 2.874 1.174 1.174
assign (resid 83 and name HA) (resid 86 and name HN) 	 3.092 1.392 1.608
assign (resid 86 and name HA) (resid 87 and name HN) 	 2.687 0.987 0.987
assign (resid 87 and name HB2) (resid 87 and name HN) 	 3.272 1.572 1.772
assign (resid 87 and name HB1) (resid 87 and name HN) 	 3.272 1.572 1.772
assign (resid 87 and name HN) ((resid 86 and name HB2) or (resid 86 and name HB1))  	 3.293 1.593 1.593
assign (resid 86 and name HG*) (resid 87 and name HN) 	 3.350 1.650 1.650
assign (resid 88 and name HA) (resid 88 and name HN) 	 2.402 0.702 0.702
assign (resid 89 and name HN) (resid 88 and name HN) 	 3.350 1.650 1.650
assign (resid 88 and name HN) ((resid 88 and name HB1) or (resid 88 and name HB2))  	 3.293 1.593 1.593
assign (resid 88 and name HN) ((resid 86 and name HB2) or (resid 86 and name HB1))        2.345 0.645 2.655
assign (resid 88 and name HA) (resid 89 and name HN) 	 2.318 0.618 0.618
assign (resid 89 and name HA) (resid 89 and name HN) 	 2.428 0.728 0.728
assign (resid 89 and name HN) ((resid 89 and name HB2) or (resid 89 and name HB1))        2.345 0.645 2.655
assign (resid 5 and name HA) (resid 5 and name HD*) 3.400 1.6 0.9 
assign (resid 5 and name HD*) ((resid 5 and name HB1) or (resid 5 and name HB2))  3.400 1.6 0.0 
assign (resid 20 and name HA) (resid 20 and name HD*) 2.800 1.0 1.3 
assign (resid 20 and name HB*) (resid 20 and name HD*) 3.400 1.6 0.0 
assign (resid 24 and name HA) (resid 24 and name HD*) 5.000 3.2 0.0
assign (resid 24 and name HD*) ((resid 24 and name HB1) or (resid 24 and name HB2))  3.400 1.6 0.0 
assign (resid 27 and name HA) (resid 27 and name HD*) 3.400 1.6 0.0 
assign (resid 27 and name HD*) ((resid 27 and name HB1) or (resid 27 and name HB2))  5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 24 and name HE*) 3.400 1.6 0.6 
assign (resid 35 and name HA) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 73 and name HA) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 21 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 21 and name HA) (resid 74 and name HE*) 3.400 1.6 0.0 
assign (resid 74 and name HA) (resid 74 and name HD*) 2.800 1.0 0.0 
assign (resid 74 and name HD*) ((resid 74 and name HB1) or (resid 74 and name HB2))  3.400 1.6 0.0 
assign (resid 24 and name HD*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HE*) ((resid 44 and name HG1*) or (resid 44 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 74 and name HD*) 5.000 3.2 0.0 
assign (resid 74 and name HD*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HA) (resid 77 and name HD*) 3.400 1.6 0.0 
assign (resid 77 and name HD*) ((resid 77 and name HB1) or (resid 77 and name HB2))  3.400 1.6 0.0 
assign (resid 21 and name HD1*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HA) (resid 27 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HB*) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 24 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 2 and name HB*) (resid 5 and name HD*) 3.400 1.6 0.0 
assign (resid 8 and name HB*) (resid 5 and name HD*) 5.000 3.2 0.3 
assign (resid 5 and name HA) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 5 and name HB*) (resid 5 and name HE*) 3.400 1.6 1.6 
assign (resid 17 and name HG*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 25 and name HA) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 73 and name HA) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 17 and name HA) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 74 and name HZ) 3.400 1.6 0.0 
assign (resid 21 and name HA) (resid 74 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HA) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 24 and name HE*) 3.400 1.6 0.0 
assign (resid 77 and name HB*) (resid 74 and name HD*) 3.400 1.6 0.0 
assign (resid 24 and name HB*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 72 and name HG1*) or (resid 72 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HD*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 78 and name HG) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 77 and name HD*) 3.400 1.6 0.8 
assign (resid 78 and name HG) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 36 and name HD1*) or (resid 36 and name HG2*))  5.000 3.2 0.0 
assign (resid 17 and name HA) (resid 20 and name HD*) 2.800 1.0 2.2 
assign (resid 48 and name HD1*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 5 and name HD*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 82 and name HG1*) or (resid 82 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 4 and name HD1*) or (resid 4 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 20 and name HA) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HB*) (resid 24 and name HE*) 5.000 1.6 1.5 
assign (resid 47 and name HB*) (resid 27 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HE*) ((resid 28 and name HG11) or (resid 28 and name HG12))  5.000 3.2 0.0 
assign (resid 44 and name HA) (resid 27 and name HE*) 5.000 3.2 0.0 
assign (resid 27 and name HD*) ((resid 44 and name HG2*) or (resid 44 and name HG1*))  5.000 3.2 0.0 
assign (resid 27 and name HE*) ((resid 44 and name HG2*) or (resid 44 and name HG1*))  5.000 3.2 0.0 
assign (resid 19 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 48 and name HG) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 21 and name HD*) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HB*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HD*) (resid 74 and name HD*) 3.400 1.6 0.0 
assign (resid 74 and name HA) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HA) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 77 and name HE*) 3.400 1.6 0.0 
assign (resid 77 and name HB*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB1) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB2) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 36 and name HD1*) or (resid 36 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HE*) ((resid 48 and name HD1*) or (resid 48 and name HD2*))  5.000 3.2 0.0 
assign (resid 78 and name HG) (resid 74 and name HE*) 3.400 1.6 0.4 
assign (resid 78 and name HG) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 5 and name HD*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 24 and name HE*) ((resid 28 and name HG11) or (resid 28 and name HG12))  3.400 1.6 1.4 
assign (resid 20 and name HE*) ((resid 81 and name HG1) or (resid 81 and name HG2))  2.800 1.0 0.2 
assign (resid 5 and name HD*) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 83 and name HA) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 4 and name HB) (resid 4 and name HA) 2.800 1.0 0.0 
assign (resid 4 and name HD1*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG2*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 6 and name HE*) (resid 5 and name HB*) 2.800 1.0 0.0 
assign (resid 6 and name HD*) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 7 and name HB*) (resid 7 and name HA) 2.800 1.0 0.0 
assign (resid 8 and name HB*) (resid 8 and name HA) 2.800 1.0 0.0 
assign (resid 9 and name HG1*) (resid 9 and name HA) 3.400 1.6 0.4 
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assign (resid 10 and name HG*) (resid 10 and name HA) 3.400 1.6 0.3 
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assign (resid 11 and name HB*) (resid 11 and name HA) 2.800 1.0 0.0 
assign (resid 12 and name HB*) (resid 12 and name HA) 2.800 1.0 0.0 
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 12 and name HA) 5.000 3.2 0.0 
assign (resid 13 and name HA) (resid 13 and name HB) 2.800 1.0 0.0 
assign (resid 13 and name HG2*) (resid 13 and name HA) 2.800 1.0 0.0 
assign (resid 13 and name HG2*) (resid 13 and name HB) 2.800 1.0 0.0 
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assign (resid 17 and name HD*) (resid 17 and name HA) 5.000 3.2 0.0 
assign (resid 17 and name HG*) (resid 17 and name HE*) 5.000 3.2 0.0 
assign (resid 18 and name HB*) (resid 18 and name HA) 3.400 1.6 0.0 
assign (resid 19 and name HG*) (resid 18 and name HB*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 20 and name HA) 3.400 1.6 0.0 
assign (resid 23 and name HB*) (resid 20 and name HA) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 23 and name HA) 3.400 1.6 0.0 
assign (resid 24 and name HB*) (resid 24 and name HA) 5.000 3.2 0.0 
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assign (resid 29 and name HG*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HB) (resid 26 and name HA) 3.400 1.6 0.0 
assign (resid 26 and name HD1*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HG1*) (resid 26 and name HA) 3.400 1.6 0.3 
assign (resid 26 and name HG2*) (resid 26 and name HA) 5.000 3.2 0.0 
assign ((resid 26 and name HG2*) or (resid 26 and name HD1*)) (resid 26 and name HB) 5.000 3.2 0.0 
assign (resid 26 and name HG2*) (resid 26 and name HD1*) 5.000 3.2 0.0 
assign ((resid 26 and name HG2*) or (resid 26 and name HD1*)) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 27 and name HB*) (resid 27 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 25 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HB) (resid 28 and name HA) 2.800 1.0 0.2 
assign (resid 28 and name HD1*) (resid 28 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HB) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 28 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HG2*) 5.000 3.2 0.0 
assign (resid 31 and name HB*) (resid 31 and name HA) 3.400 1.6 0.0 
assign (resid 32 and name HB*) (resid 33 and name HA) 5.000 3.2 0.0 
assign (resid 33 and name HB*) (resid 33 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HD1*) (resid 35 and name HA) 5.000 3.2 0.0 
assign (resid 35 and name HB*) (resid 35 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HD1*) (resid 36 and name HG1*) 5.000 3.2 0.0 
assign ((resid 36 and name HG2*) or (resid 36 and name HD1*)) (resid 35 and name HA) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) (resid 36 and name HA) 5.000 3.2 0.0 
assign (resid 36 and name HG2*) (resid 36 and name HA) 5.000 3.2 0.0 
assign (resid 37 and name HB*) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 38 and name HA) (resid 38 and name HB) 2.800 1.0 0.0 
assign (resid 38 and name HG2*) (resid 38 and name HB) 3.400 1.6 0.0 
assign ((resid 61 and name HG11) or (resid 61 and name HG12)) (resid 38 and name HB) 5.000 3.2 0.0 
assign (resid 41 and name HB*) (resid 41 and name HA) 3.400 1.6 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HB) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG1*) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG1*) (resid 44 and name HB) 5.000 3.2 0.0 
assign (resid 44 and name HG2*) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG2*) (resid 44 and name HB) 5.000 3.2 0.0 
assign (resid 46 and name HG*) (resid 46 and name HD*) 3.400 1.6 0.0 
assign (resid 47 and name HB*) (resid 44 and name HA) 5.000 3.2 0.0 
assign ((resid 48 and name HD2*) or (resid 48 and name HD1*)) (resid 48 and name HA) 3.400 1.6 1.2 
assign (resid 50 and name HB*) (resid 50 and name HA) 5.000 3.2 0.0 
assign (resid 46 and name HG*) (resid 51 and name HA) 5.000 3.2 0.3 
assign (resid 51 and name HB*) (resid 51 and name HA) 2.800 1.0 0.0 
assign (resid 52 and name HD*) (resid 51 and name HA) 2.800 1.0 1.0 
assign (resid 52 and name HG*) (resid 51 and name HA) 5.000 3.2 0.7 
assign (resid 52 and name HB*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HD*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HB*) (resid 52 and name HD*) 5.000 3.2 0.0 
assign (resid 52 and name HG*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HG*) (resid 52 and name HD*) 3.400 1.6 0.0 
assign (resid 53 and name HA) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 53 and name HG2*) (resid 53 and name HA) 3.400 1.6 0.0 
assign (resid 54 and name HD*) (resid 53 and name HA) 2.800 1.0 0.0 
assign (resid 54 and name HD*) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 58 and name HA) (resid 59 and name HA) 5.000 3.2 0.0 
assign (resid 59 and name HB*) (resid 59 and name HA) 2.800 1.0 0.0 
assign (resid 60 and name HB*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HB) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 61 and name HA) 3.400 1.6 0.0 
assign (resid 61 and name HG2*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 64 and name HA) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  3.400 1.6 0.0 
assign (resid 65 and name HB*) (resid 65 and name HA) 5.000 3.2 0.0 
assign (resid 67 and name HB*) (resid 67 and name HA) 5.000 3.2 0.0 
assign (resid 69 and name HB*) (resid 69 and name HA) 2.800 1.0 0.0 
assign (resid 35 and name HB*) (resid 71 and name HB) 3.400 1.6 0.0 
assign (resid 71 and name HG2*) (resid 35 and name HB*) 5.000 3.2 0.0 
assign (resid 37 and name HA) (resid 71 and name HA) 3.400 1.6 0.0 
assign (resid 20 and name HA) ((resid 48 and name HD2*) or (resid 48 and name HD1*))  5.000 3.2 0.0 
assign (resid 71 and name HB) (resid 71 and name HA) 2.800 1.0 0.0 
assign (resid 71 and name HG2*) (resid 71 and name HA) 3.400 1.6 0.0 
assign (resid 71 and name HG2*) (resid 71 and name HB) 2.800 1.0 0.0 
assign (resid 71 and name HG2*) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HB) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 35 and name HA) (resid 73 and name HA) 5.000 3.2 0.0 
assign (resid 73 and name HB*) (resid 73 and name HA) 3.400 1.6 0.0 
assign (resid 74 and name HB*) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 76 and name HB*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 76 and name HB*) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  5.000 3.2 0.0 
assign (resid 76 and name HB*) (resid 76 and name HG*) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 77 and name HA) 5.000 3.2 0.0 
assign (resid 75 and name HA) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.4 
assign (resid 78 and name HG) (resid 75 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HB*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HA) ((resid 78 and name HD2*) or (resid 78 and name HD1*))  5.000 3.2 0.0 
assign (resid 79 and name HB) (resid 79 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HG1*) (resid 79 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HG2*) (resid 79 and name HA) 3.400 1.6 1.6 
assign (resid 80 and name HA) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 80 and name HG*) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HG*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 80 and name HA) (resid 81 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HA) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 82 and name HA) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 83 and name HD*) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  5.000 3.2 0.0 
assign (resid 83 and name HB*) (resid 83 and name HA) 3.400 1.6 0.0 
assign (resid 83 and name HB*) (resid 83 and name HD*) 5.000 3.2 0.0 
assign (resid 83 and name HG*) (resid 83 and name HD*) 5.000 3.2 0.0 
assign (resid 83 and name HG*) (resid 83 and name HA) 5.000 3.2 0.0 
assign (resid 84 and name HB*) (resid 84 and name HA) 3.400 1.6 0.0 
assign (resid 85 and name HB*) (resid 85 and name HA) 3.400 1.6 0.0 
assign (resid 86 and name HD*) (resid 86 and name HA) 5.000 3.2 0.0 
assign (resid 86 and name HG*) (resid 86 and name HA) 5.000 3.2 0.0 
assign (resid 87 and name HB*) (resid 89 and name HB*) 5.000 3.2 0.0 
assign (resid 4 and name HD1*) (resid 4 and name HB) 5.000 3.2 0.0 
assign ((resid 4 and name HD1*) or (resid 4 and name HG2*)) (resid 4 and name HG1*) 5.000 3.2 0.0 
assign (resid 4 and name HG1*) (resid 4 and name HB) 2.800 1.0 0.0 
assign (resid 4 and name HG2*) (resid 4 and name HB) 5.000 3.2 0.0 
assign (resid 12 and name HD1*) (resid 12 and name HB*) 5.000 3.2 0.0 
assign (resid 12 and name HD2*) (resid 12 and name HB*) 5.000 3.2 0.0 
assign (resid 17 and name HG*) (resid 17 and name HB*) 3.400 1.6 0.0 
assign (resid 21 and name HG*) (resid 21 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HD*) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 28 and name HB) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 28 and name HG1*) 3.400 1.6 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 36 and name HB) 5.000 3.2 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 36 and name HG1*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HB*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HG) 5.000 3.2 0.0 
assign (resid 43 and name HG*) (resid 43 and name HB*) 5.000 3.2 0.0 
assign (resid 45 and name HE*) (resid 45 and name HB*) 3.400 1.6 0.0 
assign (resid 45 and name HE*) (resid 45 and name HG*) 5.000 3.2 0.0 
assign ((resid 48 and name HD1*) or (resid 48 and name HD2*)) (resid 48 and name HB*) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 48 and name HG) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 48 and name HG) 5.000 3.2 0.0 
assign (resid 50 and name HB*) (resid 50 and name HG*) 2.800 1.0 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 61 and name HB) 2.800 1.0 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign (resid 61 and name HG2*) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 64 and name HB) 3.400 1.6 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HG2*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 45 and name HG*) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 76 and name HB*) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 76 and name HB*) 5.000 3.2 0.0 
assign ((resid 78 and name HD2*) or (resid 78 and name HD1*)) (resid 78 and name HB*) 5.000 3.2 0.0 
assign (resid 79 and name HG1*) (resid 79 and name HB) 5.000 3.2 0.0 
assign (resid 79 and name HG2*) (resid 79 and name HB) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 81 and name HG*) (resid 81 and name HB*) 5.000 3.2 0.0 
assign (resid 82 and name HG1*) (resid 82 and name HG2*) 3.400 1.6 0.0 
assign (resid 85 and name HB*) (resid 85 and name HG*) 5.000 3.2 0.0 
assign (resid 3 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 4 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 5 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 5 and name HN) ((resid 4 and name HD1*) or (resid 4 and name HG2*)) 5.000 3.2 0.0 
assign (resid 8 and name HN) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HN) (resid 5 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HN) (resid 6 and name HD*) 5.000 3.2 0.2 
assign (resid 11 and name HN) (resid 8 and name HB*) 5.000 3.2 0.1 
assign (resid 13 and name HN) (resid 12 and name HN) 5.000 3.2 0.0 
assign (resid 13 and name HN) (resid 13 and name HG1) 5.000 3.2 0.0 
assign (resid 14 and name HN) (resid 15 and name HB*) 5.000 3.2 0.1 
assign (resid 13 and name HN) (resid 16 and name HB*) 2.800 1.0 0.4 
assign (resid 17 and name HN) (resid 17 and name HG*) 3.400 1.6 0.7 
assign (resid 15 and name HN) (resid 18 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 19 and name HA) 5.000 3.2 0.0 
assign (resid 24 and name HN) (resid 21 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 22 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 23 and name HN) (resid 21 and name HA) 5.000 3.2 0.0 
assign (resid 23 and name HN) (resid 21 and name HN) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 21 and name HD*) 5.000 3.2 0.0 
assign (resid 26 and name HN) (resid 24 and name HA) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 23 and name HA) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 25 and name HA) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 29 and name HN) (resid 27 and name HA) 5.000 3.2 0.0 
assign (resid 31 and name HN) (resid 28 and name HD1*) 5.000 3.2 0.0 
assign (resid 30 and name HN) (resid 31 and name HB*) 5.000 3.2 0.0 
assign (resid 31 and name HN) (resid 30 and name HB*) 5.000 3.2 0.0 
assign (resid 33 and name HN) (resid 32 and name HG*) 5.000 3.2 0.0 
assign (resid 35 and name HN) (resid 33 and name HB*) 5.000 3.2 0.0 
assign (resid 35 and name HN) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 40 and name HN) ((resid 36 and name HD1*) or (resid 36 and name HG2*)) 5.000 3.2 0.2 
assign (resid 40 and name HN) (resid 39 and name HG*) 5.000 3.2 0.0 
assign (resid 42 and name HN) (resid 40 and name HA) 5.000 3.2 0.0 
assign (resid 43 and name HN) (resid 40 and name HB*) 5.000 3.2 0.0 
assign (resid 43 and name HN) ((resid 57 and name HD1*) or (resid 57 and name HD2*)) 5.000 3.2 0.5 
assign (resid 46 and name HN) (resid 42 and name HA*) 5.000 3.2 0.4 
assign (resid 20 and name HN) ((resid 48 and name HD2*) or (resid 48 and name HD1*)) 5.000 3.2 0.0 
assign (resid 51 and name HN) (resid 50 and name HB*) 5.000 3.2 0.0 
assign (resid 53 and name HN) (resid 54 and name HD*) 5.000 3.2 0.0 
assign (resid 55 and name HN) (resid 54 and name HB*) 2.800 1.0 0.8 
assign (resid 56 and name HN) (resid 54 and name HA) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 58 and name HA) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign (resid 63 and name HN) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 64 and name HN) (resid 63 and name HG*) 5.000 3.2 0.0 
assign (resid 65 and name HN) (resid 62 and name HA) 5.000 3.2 0.0 
assign (resid 68 and name HN) (resid 65 and name HA) 5.000 3.2 0.0 
assign (resid 68 and name HN) (resid 65 and name HB*) 5.000 3.2 0.0 
assign (resid 70 and name HN) (resid 38 and name HG2*) 5.000 3.2 0.0 
assign (resid 36 and name HN) (resid 73 and name HA) 5.000 3.2 0.0 
assign (resid 73 and name HN) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 74 and name HZ) 3.400 1.6 0.0 
assign (resid 77 and name HN) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HN) ((resid 72 and name HG1*) or (resid 72 and name HG2*)) 5.000 3.2 0.0 
assign (resid 77 and name HN) (resid 76 and name HG*) 5.000 3.2 0.0 
assign (resid 79 and name HN) (resid 80 and name HB*) 5.000 3.2 0.0 
assign (resid 77 and name HN) ((resid 79 and name HG2*) or (resid 79 and name HG1*)) 5.000 3.2 0.0 
assign (resid 79 and name HN) (resid 77 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HN) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 82 and name HN) (resid 81 and name HG*) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 83 and name HG*) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 85 and name HB*) 5.000 3.2 0.0 
assign (resid 86 and name HN) (resid 85 and name HG*) 5.000 3.2 0.0 
assign (resid 86 and name HN) (resid 86 and name HD*) 5.000 3.2 0.0 
assign (resid 2 and name HD21) (resid 2 and name HA) 3.400 1.6 0.0 
assign (resid 2 and name HD21) (resid 2 and name HB2) 5.000 3.2 0.0 
assign (resid 2 and name HD22) (resid 2 and name HA) 3.400 1.6 0.0 
assign (resid 2 and name HD21) (resid 2 and name HB1) 5.000 3.2 0.0 
assign (resid 16 and name HE2*) (resid 12 and name HD2*) 5.000 3.2 0.0 
assign (resid 16 and name HE21) (resid 16 and name HB*) 5.000 3.2 0.0 
assign (resid 16 and name HE22) (resid 16 and name HB*) 3.400 1.6 1.6 
assign (resid 18 and name HD2*) (resid 15 and name HA) 5.000 3.2 0.0 
assign (resid 18 and name HD21) (resid 18 and name HB1) 5.000 3.2 0.0 
assign (resid 18 and name HD21) (resid 18 and name HB2) 5.000 3.2 0.0 
assign (resid 18 and name HD22) (resid 18 and name HB1) 5.000 3.2 0.0 
assign (resid 18 and name HD22) (resid 18 and name HB2) 3.400 1.6 1.6 
assign (resid 29 and name HE21) (resid 29 and name HG*) 5.000 3.2 0.0 
assign (resid 29 and name HE22) (resid 29 and name HG*) 5.000 3.2 0.0 
assign (resid 50 and name HE21) (resid 50 and name HB*) 5.000 3.2 0.0 
assign (resid 50 and name HE22) (resid 50 and name HB*) 3.400 1.6 1.6 
assign (resid 51 and name HD21) (resid 51 and name HB1) 5.000 3.2 0.0 
assign (resid 51 and name HD21) (resid 51 and name HB2) 5.000 3.2 0.0 
assign (resid 51 and name HD22) (resid 51 and name HB1) 5.000 3.2 0.0 
assign (resid 51 and name HD22) (resid 51 and name HB2) 5.000 3.2 0.0 
assign (resid 58 and name HE2*) ((resid 57 and name HD1*) or (resid 57 and name HD2*)) 5.000 3.2 0.0 
assign (resid 58 and name HE2*) (resid 58 and name HA) 5.000 3.2 0.0 
assign (resid 58 and name HE21) (resid 58 and name HG*) 3.400 1.6 0.4 
assign (resid 58 and name HE22) (resid 58 and name HG*) 3.400 1.6 0.4 
assign (resid 58 and name HE21) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 74 and name HZ) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  3.400 1.6 1.6 
assign (resid 74 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  3.400 1.6 1.6 
assign (resid 77 and name HD*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HB1) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HB2) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 36 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*)) 5.000 3.2 0.3 
assign (resid 10 and name HN) (resid 7 and name HA) 5.000 3.2 0.2 
assign (resid 10 and name HN) (resid 11 and name HA) 	 2.471 0.771 2.729
assign (resid 10 and name HN) (resid 6 and name HA) 	 2.471 0.771 2.529
assign (resid 58 and name HA) (resid 62 and name HN) 	 2.785 1.085 2.215
assign (resid 38 and name HN) ((resid 37 and name HB2) or (resid 37 and name HB1))  	 2.785 1.085 2.215
assign (resid 38 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  	 2.785 1.085 2.215
assign (resid 57 and name HG) (resid 58 and name HN) 	 2.785 1.085 2.215
assign (resid 58 and name HE22) (resid 61 and name HB) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) (resid 58 and name HB*) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) (resid 58 and name HA) 	 2.438 0.738 2.562
assign (resid 58 and name HE21) (resid 61 and name HB) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) ((resid 57 and name HD1*) or (resid 57 and name HD2*))  	 2.438 0.738 2.562
assign (resid 40 and name HN) ((resid 39 and name HD1) or (resid 39 and name HD2))  	 2.438 0.738 2.562
assign (resid 22 and name HB*) (resid 25 and name HN) 	 2.438 0.738 3.262
assign (resid 84 and name HN) ((resid 82 and name HG1*) or (resid 82 and name HG2*))  	 2.438 0.738 3.062
assign (resid 52 and name HA) (resid 53 and name HN) 	 2.438 0.738 2.562
assign (resid 35 and name HN) ((resid 28 and name HD1*) or (resid 28 and name HD2*))  	 2.481 0.781 2.519
assign (resid 2 and name HD22) (resid 2 and name HB2) 5.000 3.2 0.0 
assign (resid 2 and name HD22) (resid 2 and name HB1) 5.000 3.2 0.0 
assign (resid 69 and name HA) (resid 68 and name HN) 5.000 3.2 0.0 
assign (resid 80 and name HE*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 47 and name HA) (resid 47 and name HG*) 5.000 3.2 0.0 
assign (resid 25 and name HA) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 59 and name HA) (resid 62 and name HB*) 5.000 3.2 0.0 
assign (resid 75 and name HA) (resid 75 and name HB*) 5.000 3.2 0.0 
assign (resid 28 and name HA) (resid 31 and name HB*) 5.000 3.2 0.0 
assign (resid 58 and name HA) (resid 58 and name HB*) 5.000 3.2 0.0 
assign (resid 16 and name HA) (resid 16 and name HG*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 34 and name HA*) 5.000 3.2 0.0 
assign (resid 10 and name HA) ((resid 9 and name HG2*) or (resid 9 and name HG1*))  5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 81 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG1*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HG2*) (resid 38 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HB) (resid 9 and name HA) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) ((resid 72 and name HG2*) or (resid 72 and name HG1*)) 5.000 3.2 0.0 
assign (resid 41 and name HG) ((resid 41 and name HD2*) or (resid 41 and name HD1*))  5.000 3.2 0.0 
assign (resid 77 and name HN) (resid 74 and name HD*) 5.000 3.2 0.1 
assign (resid 12 and name HN) (resid 10 and name HN) 5.000 3.2 0.0 
assign (resid 22 and name HN) (resid 20 and name HN) 5.000 3.2 0.0
assign (resid 5 and name HD*) (resid 4 and name HN) 5.000 3.2 0.0 
assign (resid 5 and name HE*) (resid 4 and name HN) 5.000 3.2 0.3 
assign (resid 24 and name HE*) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 24 and name HZ) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 73 and name HN) (resid 74 and name HN) 5.000 3.2 0.0 
assign (resid 67 and name HN) (resid 69 and name HN) 5.000 3.2 0.0 
assign (resid 28 and name HN) (resid 26 and name HN) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 70 and name HN) 5.000 3.2 0.0 
assign (resid 69 and name HB*) (resid 70 and name HN) 5.000 3.2 0.0 
assign (resid 65 and name HB*) (resid 67 and name HN) 5.000 3.2 0.0 
assign (resid 85 and name HN) ((resid 4 and name HG12) or (resid 4 and name HG11)) 5.000 3.2 0.4 

assign (resid   3 and name    C) (resid   4 and name    N)
       (resid   4 and name   CA) (resid   4 and name    C)  1.0  -65.5   20.0 2
assign (resid   5 and name    C) (resid   6 and name    N)
       (resid   6 and name   CA) (resid   6 and name    C)  1.0  -59.0   20.0 2
assign (resid   6 and name    C) (resid   7 and name    N)
       (resid   7 and name   CA) (resid   7 and name    C)  1.0  -61.5   20.0 2
assign (resid   7 and name    C) (resid   8 and name    N)
       (resid   8 and name   CA) (resid   8 and name    C)  1.0  -66.5   20.0 2
assign (resid   9 and name    C) (resid  10 and name    N)
       (resid  10 and name   CA) (resid  10 and name    C)  1.0  -64.5   20.0 2
assign (resid  10 and name    C) (resid  11 and name    N)
       (resid  11 and name   CA) (resid  11 and name    C)  1.0 -120.0   40.0 2
assign (resid  11 and name    C) (resid  12 and name    N)
       (resid  12 and name   CA) (resid  12 and name    C)  1.0  -66.0   30.0 2
assign (resid  13 and name    C) (resid  14 and name    N)
       (resid  14 and name   CA) (resid  14 and name    C)  1.0  -49.5   20.0 2
assign (resid  14 and name    C) (resid  15 and name    N)
       (resid  15 and name   CA) (resid  15 and name    C)  1.0  -59.0   20.0 2
assign (resid  15 and name    C) (resid  16 and name    N)
       (resid  16 and name   CA) (resid  16 and name    C)  1.0  -64.5   20.0 2
assign (resid  18 and name    C) (resid  19 and name    N)
       (resid  19 and name   CA) (resid  19 and name    C)  1.0  -67.0   20.0 2
assign (resid  20 and name    C) (resid  21 and name    N)
       (resid  21 and name   CA) (resid  21 and name    C)  1.0  -59.0   20.0 2
assign (resid  21 and name    C) (resid  22 and name    N)
       (resid  22 and name   CA) (resid  22 and name    C)  1.0  -59.0   20.0 2
assign (resid  22 and name    C) (resid  23 and name    N)
       (resid  23 and name   CA) (resid  23 and name    C)  1.0  -67.5   20.0 2
assign (resid  24 and name    C) (resid  25 and name    N)
       (resid  25 and name   CA) (resid  25 and name    C)  1.0  -50.5   10.0 2
assign (resid  28 and name    C) (resid  29 and name    N)
       (resid  29 and name   CA) (resid  29 and name    C)  1.0  -62.0   20.0 2
assign (resid  29 and name    C) (resid  30 and name    N)
       (resid  30 and name   CA) (resid  30 and name    C)  1.0 -120.0   42.0 2
assign (resid  31 and name    C) (resid  32 and name    N)
       (resid  32 and name   CA) (resid  32 and name    C)  1.0  -70.5   50.0 2
assign (resid  32 and name    C) (resid  33 and name    N)
       (resid  33 and name   CA) (resid  33 and name    C)  1.0 -120.0   41.0 2
assign (resid  34 and name    C) (resid  35 and name    N)
       (resid  35 and name   CA) (resid  35 and name    C)  1.0 -120.0   36.0 2
assign (resid  35 and name    C) (resid  36 and name    N)
       (resid  36 and name   CA) (resid  36 and name    C)  1.0 -120.0   41.0 2
assign (resid  36 and name    C) (resid  37 and name    N)
       (resid  37 and name   CA) (resid  37 and name    C)  1.0  -73.0   20.0 2
assign (resid  38 and name    C) (resid  39 and name    N)
       (resid  39 and name   CA) (resid  39 and name    C)  1.0  -64.5   20.0 2
assign (resid  39 and name    C) (resid  40 and name    N)
       (resid  40 and name   CA) (resid  40 and name    C)  1.0 -120.0   40.0 2
assign (resid  42 and name    C) (resid  43 and name    N)
       (resid  43 and name   CA) (resid  43 and name    C)  1.0  -65.5   20.0 2
assign (resid  44 and name    C) (resid  45 and name    N)
       (resid  45 and name   CA) (resid  45 and name    C)  1.0  -58.5   20.0 2
assign (resid  45 and name    C) (resid  46 and name    N)
       (resid  46 and name   CA) (resid  46 and name    C)  1.0  -61.0   20.0 2
assign (resid  46 and name    C) (resid  47 and name    N)
       (resid  47 and name   CA) (resid  47 and name    C)  1.0  -64.5   20.0 2
assign (resid  49 and name    C) (resid  50 and name    N)
       (resid  50 and name   CA) (resid  50 and name    C)  1.0 -120.0   36.0 2
assign (resid  50 and name    C) (resid  51 and name    N)
       (resid  51 and name   CA) (resid  51 and name    C)  1.0 -120.0   37.0 2
assign (resid  54 and name    C) (resid  55 and name    N)
       (resid  55 and name   CA) (resid  55 and name    C)  1.0  -63.0   20.0 2
assign (resid  55 and name    C) (resid  56 and name    N)
       (resid  56 and name   CA) (resid  56 and name    C)  1.0  -71.5   20.0 2
assign (resid  56 and name    C) (resid  57 and name    N)
       (resid  57 and name   CA) (resid  57 and name    C)  1.0  -62.0   20.0 2
assign (resid  57 and name    C) (resid  58 and name    N)
       (resid  58 and name   CA) (resid  58 and name    C)  1.0  -58.0   20.0 2
assign (resid  58 and name    C) (resid  59 and name    N)
       (resid  59 and name   CA) (resid  59 and name    C)  1.0  -62.0   20.0 2
assign (resid  59 and name    C) (resid  60 and name    N)
       (resid  60 and name   CA) (resid  60 and name    C)  1.0  -64.5   20.0 2
assign (resid  61 and name    C) (resid  62 and name    N)
       (resid  62 and name   CA) (resid  62 and name    C)  1.0  -55.5   20.0 2
assign (resid  65 and name    C) (resid  66 and name    N)
       (resid  66 and name   CA) (resid  66 and name    C)  1.0  -56.5   20.0 2
assign (resid  66 and name    C) (resid  67 and name    N)
       (resid  67 and name   CA) (resid  67 and name    C)  1.0 -120.0   38.0 2
assign (resid  68 and name    C) (resid  69 and name    N)
       (resid  69 and name   CA) (resid  69 and name    C)  1.0  -74.0   20.0 2
assign (resid  70 and name    C) (resid  71 and name    N)
       (resid  71 and name   CA) (resid  71 and name    C)  1.0 -120.0   41.0 2
assign (resid  71 and name    C) (resid  72 and name    N)
       (resid  72 and name   CA) (resid  72 and name    C)  1.0 -120.0   36.0 2
assign (resid  72 and name    C) (resid  73 and name    N)
       (resid  73 and name   CA) (resid  73 and name    C)  1.0 -120.0   34.0 2
assign (resid  74 and name    C) (resid  75 and name    N)
       (resid  75 and name   CA) (resid  75 and name    C)  1.0  -71.5   20.0 2
assign (resid  76 and name    C) (resid  77 and name    N)
       (resid  77 and name   CA) (resid  77 and name    C)  1.0  -57.0   20.0 2
assign (resid  77 and name    C) (resid  78 and name    N)
       (resid  78 and name   CA) (resid  78 and name    C)  1.0  -56.5   30.0 2
assign (resid  78 and name    C) (resid  79 and name    N)
       (resid  79 and name   CA) (resid  79 and name    C)  1.0  -68.0   20.0 2
assign (resid  79 and name    C) (resid  80 and name    N)
       (resid  80 and name   CA) (resid  80 and name    C)  1.0  -56.0   20.0 2
assign (resid  80 and name    C) (resid  81 and name    N)
       (resid  81 and name   CA) (resid  81 and name    C)  1.0  -60.0   20.0 2
assign (resid  81 and name    C) (resid  82 and name    N)
       (resid  82 and name   CA) (resid  82 and name    C)  1.0  -68.0   20.0 2
assign (resid  82 and name    C) (resid  83 and name    N)
       (resid  83 and name   CA) (resid  83 and name    C)  1.0  -61.0   20.0 2
assign (resid   3 and name N) (resid   3 and name CA)
       (resid   3 and name C) (resid   4 and name N) 1.0  -30.0  110.0 2
assign (resid   4 and name N) (resid   4 and name CA)
       (resid   4 and name C) (resid   5 and name N) 1.0  -30.0  110.0 2
assign (resid   5 and name N) (resid   5 and name CA)
       (resid   5 and name C) (resid   6 and name N) 1.0  -30.0  110.0 2
assign (resid   6 and name N) (resid   6 and name CA)
       (resid   6 and name C) (resid   7 and name N) 1.0  -30.0  110.0 2
assign (resid   8 and name N) (resid   8 and name CA)
       (resid   8 and name C) (resid   9 and name N) 1.0  -30.0  110.0 2
assign (resid   9 and name N) (resid   9 and name CA)
       (resid   9 and name C) (resid  10 and name N) 1.0  -30.0  110.0 2
assign (resid  10 and name N) (resid  10 and name CA)
       (resid  10 and name C) (resid  11 and name N) 1.0  -30.0  110.0 2
assign (resid  11 and name N) (resid  11 and name CA)
       (resid  11 and name C) (resid  12 and name N) 1.0  -30.0  110.0 2
assign (resid  13 and name N) (resid  13 and name CA)
       (resid  13 and name C) (resid  14 and name N) 1.0  120.0  100.0 2
assign (resid  14 and name N) (resid  14 and name CA)
       (resid  14 and name C) (resid  15 and name N) 1.0  -30.0  110.0 2
assign (resid  15 and name N) (resid  15 and name CA)
       (resid  15 and name C) (resid  16 and name N) 1.0  -30.0  110.0 2
assign (resid  16 and name N) (resid  16 and name CA)
       (resid  16 and name C) (resid  17 and name N) 1.0  -30.0  110.0 2
assign (resid  18 and name N) (resid  18 and name CA)
       (resid  18 and name C) (resid  19 and name N) 1.0  -30.0  110.0 2
assign (resid  20 and name N) (resid  20 and name CA)
       (resid  20 and name C) (resid  21 and name N) 1.0  -30.0  110.0 2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name N) 1.0  -30.0  110.0 2
assign (resid  24 and name N) (resid  24 and name CA)
       (resid  24 and name C) (resid  25 and name N) 1.0  -30.0  110.0 2
assign (resid  25 and name N) (resid  25 and name CA)
       (resid  25 and name C) (resid  26 and name N) 1.0  -30.0  110.0 2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name N) 1.0  -30.0  110.0 2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name N) 1.0  -30.0  110.0 2
assign (resid  29 and name N) (resid  29 and name CA)
       (resid  29 and name C) (resid  30 and name N) 1.0  -30.0  110.0 2
assign (resid  31 and name N) (resid  31 and name CA)
       (resid  31 and name C) (resid  32 and name N) 1.0  120.0  100.0 2
assign (resid  32 and name N) (resid  32 and name CA)
       (resid  32 and name C) (resid  33 and name N) 1.0  -30.0  110.0 2
assign (resid  35 and name N) (resid  35 and name CA)
       (resid  35 and name C) (resid  36 and name N) 1.0  120.0  100.0 2
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name N) 1.0  120.0  100.0 2
assign (resid  37 and name N) (resid  37 and name CA)
       (resid  37 and name C) (resid  38 and name N) 1.0  120.0  100.0 2
assign (resid  38 and name N) (resid  38 and name CA)
       (resid  38 and name C) (resid  39 and name N) 1.0  -30.0  110.0 2
assign (resid  40 and name N) (resid  40 and name CA)
       (resid  40 and name C) (resid  41 and name N) 1.0  -30.0  110.0 2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name N) 1.0  -30.0  110.0 2
assign (resid  44 and name N) (resid  44 and name CA)
       (resid  44 and name C) (resid  45 and name N) 1.0  -30.0  110.0 2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name N) 1.0  -30.0  110.0 2
assign (resid  50 and name N) (resid  50 and name CA)
       (resid  50 and name C) (resid  51 and name N) 1.0  120.0  100.0 2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name N) 1.0  -30.0  110.0 2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name N) 1.0  -30.0  110.0 2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name N) 1.0  -30.0  110.0 2
assign (resid  61 and name N) (resid  61 and name CA)
       (resid  61 and name C) (resid  62 and name N) 1.0  -30.0  110.0 2
assign (resid  62 and name N) (resid  62 and name CA)
       (resid  62 and name C) (resid  63 and name N) 1.0  -30.0  110.0 2
assign (resid  63 and name N) (resid  63 and name CA)
       (resid  63 and name C) (resid  64 and name N) 1.0  -30.0  110.0 2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name N) 1.0  -30.0  110.0 2
assign (resid  65 and name N) (resid  65 and name CA)
       (resid  65 and name C) (resid  66 and name N) 1.0  120.0  100.0 2
assign (resid  66 and name N) (resid  66 and name CA)
       (resid  66 and name C) (resid  67 and name N) 1.0  -30.0  110.0 2
assign (resid  71 and name N) (resid  71 and name CA)
       (resid  71 and name C) (resid  72 and name N) 1.0  120.0  100.0 2
assign (resid  73 and name N) (resid  73 and name CA)
       (resid  73 and name C) (resid  74 and name N) 1.0  120.0  100.0 2
assign (resid  74 and name N) (resid  74 and name CA)
       (resid  74 and name C) (resid  75 and name N) 1.0  -30.0  110.0 2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name N) 1.0  -30.0  110.0 2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name N) 1.0  -30.0  110.0 2
assign (resid  78 and name N) (resid  78 and name CA)
       (resid  78 and name C) (resid  79 and name N) 1.0  -30.0  110.0 2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name N) 1.0  -30.0  110.0 2
assign (resid  80 and name N) (resid  80 and name CA)
       (resid  80 and name C) (resid  81 and name N) 1.0  -30.0  110.0 2
assign (resid  82 and name N) (resid  82 and name CA)
       (resid  82 and name C) (resid  83 and name N) 1.0  -30.0  110.0 2
assign (resid  83 and name N) (resid  83 and name CA)
       (resid  83 and name C) (resid  84 and name N) 1.0  -30.0  110.0 2
assign (resid   4 and name n )   (resid  4 and name  ca )
       (resid   4 and name cb)   (resid  4 and name  cg1 )  1.0 60 40 2 
assign (resid   11 and name n )   (resid  11 and name  ca )
       (resid   11 and name cb)   (resid  11 and name  cg )  1.0 -60 40 2 
assign (resid   13 and name n )   (resid  13 and name  ca )
       (resid   13 and name cb)   (resid  13 and name  og1 )  1.0 60 40 2 
assign (resid   21 and name n )   (resid  21 and name  ca )
       (resid   21 and name cb)   (resid  21 and name  cg )  1.0 180 40 2 
assign (resid   26 and name n )   (resid  26 and name  ca )
       (resid   26 and name cb)   (resid  26 and name  cg1 )  1.0 60 40 2 
assign (resid   37 and name n )   (resid  37 and name  ca )
       (resid   37 and name cb)   (resid  37 and name  og )  1.0 180 40 2 
assign (resid   44 and name n )   (resid  44 and name  ca )
       (resid   44 and name cb)   (resid  44 and name  cg1 )  1.0  -60 40 2 
assign (resid   51 and name n )   (resid  51 and name  ca )
       (resid   51 and name cb)   (resid  51 and name  cg )  1.0 180 40 2
assign (resid   53 and name n )   (resid  53 and name  ca )
       (resid   53 and name cb)   (resid  53 and name  og1 )  1.0 60 40 2
assign (resid   64 and name n )   (resid  64 and name  ca )
       (resid   64 and name cb)   (resid  64 and name  cg1)  1.0 -60 40 2 
assign (resid   65 and name n )   (resid  65 and name  ca )
       (resid   65 and name cb)   (resid  65 and name  cg)  1.0 180 40 2 
assign (resid   74 and name n )   (resid  74 and name  ca )
       (resid   74 and name cb)   (resid  74 and name  cg)  1.0 180 40 2 
assign (resid   75 and name n )   (resid  75 and name  ca )
       (resid   75 and name cb)   (resid  75 and name  cg )  1.0 -60 40 2 
assign (resid   77 and name n )   (resid  77 and name  ca )
       (resid   77 and name cb)   (resid  77 and name  cg )  1.0 180 40 2 
assign (resid   78 and name n )   (resid  78 and name  ca )
       (resid   78 and name cb)   (resid  78 and name  cg )  1.0 -60 40 2 
assign (resid   79 and name n )   (resid  79 and name  ca )
       (resid   79 and name cb)   (resid  79 and name  cg1 )  1.0 -60 40 2
assign (resid   82 and name n )   (resid  82 and name  ca )
       (resid   82 and name cb)   (resid  82 and name  cg1 )  1.0 -60 40 2
 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  16.379   1.822 -16.157
    2   2H    MET   1          2H        MET   1  17.152   2.650 -17.422
    3   3H    MET   1          3H        MET   1  17.231   0.954 -17.340
    4    HA   MET   1           HA       MET   1  14.778   2.564 -17.815
    5   1HB   MET   1          2HB       MET   1  16.656   1.023 -19.589
    6   2HB   MET   1          1HB       MET   1  14.950   1.146 -20.020
    7   1HG   MET   1          2HG       MET   1  16.595   3.584 -19.323
    8   2HG   MET   1          1HG       MET   1  16.510   2.957 -20.968
    9   1HE   MET   1          1HE       MET   1  15.877   5.507 -19.333
   10   2HE   MET   1          2HE       MET   1  14.214   6.085 -19.399
   11   3HE   MET   1          3HE       MET   1  15.182   6.040 -20.870
   12    H    ASN   2           H        ASN   2  12.869   1.418 -17.850
   13    HA   ASN   2           HA       ASN   2  13.005  -1.459 -17.161
   14   1HB   ASN   2          2HB       ASN   2  11.556   0.754 -15.773
   15   2HB   ASN   2          1HB       ASN   2  10.777  -0.826 -15.865
   16   1HD2  ASN   2          1HD2      ASN   2  12.343  -2.731 -15.219
   17   2HD2  ASN   2          2HD2      ASN   2  13.361  -2.434 -13.895
   18    H    ASP   3           H        ASP   3  11.914  -2.688 -18.536
   19    HA   ASP   3           HA       ASP   3   9.798  -1.439 -20.190
   20   1HB   ASP   3          2HB       ASP   3  11.790  -3.618 -20.756
   21   2HB   ASP   3          1HB       ASP   3  10.289  -3.518 -21.676
   22    H    ILE   4           H        ILE   4   9.753  -2.922 -17.435
   23    HA   ILE   4           HA       ILE   4   8.051  -5.209 -18.053
   24    HB   ILE   4           HB       ILE   4   7.984  -5.627 -15.683
   25   1HG1  ILE   4          2HG1      ILE   4   9.388  -3.907 -14.238
   26   2HG1  ILE   4          1HG1      ILE   4   8.922  -2.779 -15.513
   27   1HG2  ILE   4          1HG2      ILE   4  10.106  -6.115 -16.981
   28   2HG2  ILE   4          2HG2      ILE   4  10.320  -5.955 -15.237
   29   3HG2  ILE   4          3HG2      ILE   4  10.773  -4.628 -16.306
   30   1HD1  ILE   4          1HD1      ILE   4   6.752  -4.499 -14.447
   31   2HD1  ILE   4          2HD1      ILE   4   6.717  -2.797 -14.903
   32   3HD1  ILE   4          3HD1      ILE   4   7.381  -3.277 -13.341
   33    H    TYR   5           H        TYR   5   7.731  -1.855 -17.174
   34    HA   TYR   5           HA       TYR   5   5.066  -1.918 -16.176
   35   1HB   TYR   5          2HB       TYR   5   6.521   0.360 -17.550
   36   2HB   TYR   5          1HB       TYR   5   5.072   0.500 -16.556
   37    HD1  TYR   5           HD1      TYR   5   8.555   0.821 -16.508
   38    HD2  TYR   5           HD2      TYR   5   5.311  -0.745 -14.175
   39    HE1  TYR   5           HE1      TYR   5   9.958   0.952 -14.470
   40    HE2  TYR   5           HE2      TYR   5   6.712  -0.608 -12.132
   41    HH   TYR   5           HH       TYR   5   9.720  -0.551 -11.971
   42    H    LYS   6           H        LYS   6   6.473  -1.724 -19.380
   43    HA   LYS   6           HA       LYS   6   3.972  -1.094 -20.704
   44   1HB   LYS   6          2HB       LYS   6   6.433  -2.212 -22.048
   45   2HB   LYS   6          1HB       LYS   6   5.182  -1.183 -22.740
   46   1HG   LYS   6          2HG       LYS   6   7.332  -0.419 -20.754
   47   2HG   LYS   6          1HG       LYS   6   7.045   0.258 -22.356
   48   1HD   LYS   6          2HD       LYS   6   5.066   1.379 -21.644
   49   2HD   LYS   6          1HD       LYS   6   4.985   0.442 -20.151
   50   1HE   LYS   6          2HE       LYS   6   5.828   2.635 -19.588
   51   2HE   LYS   6          1HE       LYS   6   7.167   1.496 -19.459
   52   1HZ   LYS   6          1HZ       LYS   6   6.645   3.017 -21.943
   53   2HZ   LYS   6          2HZ       LYS   6   8.072   2.222 -21.470
   54   3HZ   LYS   6          3HZ       LYS   6   7.595   3.653 -20.689
   55    H    ALA   7           H        ALA   7   5.945  -3.938 -20.090
   56    HA   ALA   7           HA       ALA   7   4.315  -5.728 -21.656
   57   1HB   ALA   7          1HB       ALA   7   6.541  -6.092 -19.669
   58   2HB   ALA   7          2HB       ALA   7   6.518  -6.482 -21.389
   59   3HB   ALA   7          3HB       ALA   7   5.615  -7.477 -20.247
   60    H    ALA   8           H        ALA   8   4.279  -4.537 -18.364
   61    HA   ALA   8           HA       ALA   8   2.459  -6.605 -17.426
   62   1HB   ALA   8          1HB       ALA   8   3.579  -4.127 -16.105
   63   2HB   ALA   8          2HB       ALA   8   4.054  -5.803 -15.820
   64   3HB   ALA   8          3HB       ALA   8   2.459  -5.242 -15.320
   65    H    VAL   9           H        VAL   9   2.334  -3.160 -18.321
   66    HA   VAL   9           HA       VAL   9  -0.295  -2.637 -17.463
   67    HB   VAL   9           HB       VAL   9   1.486  -0.987 -18.340
   68   1HG1  VAL   9          1HG1      VAL   9   1.615  -2.215 -20.581
   69   2HG1  VAL   9          2HG1      VAL   9   1.474  -0.461 -20.661
   70   3HG1  VAL   9          3HG1      VAL   9   0.061  -1.475 -20.960
   71   1HG2  VAL   9          1HG2      VAL   9  -0.408   0.509 -19.263
   72   2HG2  VAL   9          2HG2      VAL   9  -0.589  -0.105 -17.620
   73   3HG2  VAL   9          3HG2      VAL   9  -1.470  -0.864 -18.946
   74    H    GLU  10           H        GLU  10   0.923  -4.234 -20.347
   75    HA   GLU  10           HA       GLU  10  -1.576  -4.241 -21.767
   76   1HB   GLU  10          2HB       GLU  10   0.981  -5.816 -22.102
   77   2HB   GLU  10          1HB       GLU  10  -0.423  -6.034 -23.148
   78   1HG   GLU  10          2HG       GLU  10  -0.347  -3.687 -23.810
   79   2HG   GLU  10          1HG       GLU  10   0.976  -3.382 -22.685
   80    H    GLN  11           H        GLN  11  -0.180  -6.187 -19.241
   81    HA   GLN  11           HA       GLN  11  -1.826  -8.518 -19.730
   82   1HB   GLN  11          2HB       GLN  11  -0.240  -7.756 -17.263
   83   2HB   GLN  11          1HB       GLN  11  -0.944  -9.339 -17.595
   84   1HG   GLN  11          2HG       GLN  11   0.936  -8.107 -19.591
   85   2HG   GLN  11          1HG       GLN  11   1.587  -8.904 -18.159
   86   1HE2  GLN  11          1HE2      GLN  11   0.388  -9.462 -21.325
   87   2HE2  GLN  11          2HE2      GLN  11   0.237 -11.150 -21.213
   88    H    LEU  12           H        LEU  12  -1.867  -5.734 -17.550
   89    HA   LEU  12           HA       LEU  12  -4.092  -6.554 -15.988
   90   1HB   LEU  12          2HB       LEU  12  -3.012  -3.796 -16.554
   91   2HB   LEU  12          1HB       LEU  12  -4.238  -4.158 -15.359
   92    HG   LEU  12           HG       LEU  12  -1.953  -5.838 -14.893
   93   1HD1  LEU  12          1HD1      LEU  12  -0.184  -4.325 -14.670
   94   2HD1  LEU  12          2HD1      LEU  12  -1.251  -2.921 -14.668
   95   3HD1  LEU  12          3HD1      LEU  12  -0.939  -3.791 -16.171
   96   1HD2  LEU  12          1HD2      LEU  12  -2.247  -5.095 -12.700
   97   2HD2  LEU  12          2HD2      LEU  12  -3.851  -4.808 -13.375
   98   3HD2  LEU  12          3HD2      LEU  12  -2.715  -3.471 -13.205
   99    H    THR  13           H        THR  13  -6.236  -5.896 -16.054
  100    HA   THR  13           HA       THR  13  -7.221  -5.188 -18.744
  101    HB   THR  13           HB       THR  13  -9.463  -5.909 -17.432
  102    HG1  THR  13           HG1      THR  13  -8.930  -7.648 -16.072
  103   1HG2  THR  13          1HG2      THR  13  -8.297  -6.847 -19.538
  104   2HG2  THR  13          2HG2      THR  13  -9.335  -7.939 -18.621
  105   3HG2  THR  13          3HG2      THR  13  -7.582  -8.033 -18.446
  106    H    ASP  14           H        ASP  14  -9.333  -3.946 -18.720
  107    HA   ASP  14           HA       ASP  14  -8.923  -1.400 -17.505
  108   1HB   ASP  14          2HB       ASP  14 -11.327  -2.603 -18.896
  109   2HB   ASP  14          1HB       ASP  14 -11.261  -0.932 -18.336
  110    H    GLU  15           H        GLU  15 -10.779  -4.252 -16.666
  111    HA   GLU  15           HA       GLU  15 -12.458  -3.133 -14.687
  112   1HB   GLU  15          2HB       GLU  15 -12.840  -5.399 -13.971
  113   2HB   GLU  15          1HB       GLU  15 -12.722  -5.397 -15.726
  114   1HG   GLU  15          2HG       GLU  15 -10.215  -5.938 -15.355
  115   2HG   GLU  15          1HG       GLU  15 -10.697  -6.363 -13.713
  116    H    GLN  16           H        GLN  16  -9.198  -4.508 -14.544
  117    HA   GLN  16           HA       GLN  16  -8.873  -4.475 -11.733
  118   1HB   GLN  16          2HB       GLN  16  -6.920  -4.389 -14.029
  119   2HB   GLN  16          1HB       GLN  16  -6.373  -4.297 -12.354
  120   1HG   GLN  16          2HG       GLN  16  -7.679  -6.413 -11.902
  121   2HG   GLN  16          1HG       GLN  16  -7.961  -6.535 -13.638
  122   1HE2  GLN  16          1HE2      GLN  16  -6.374  -7.649 -14.802
  123   2HE2  GLN  16          2HE2      GLN  16  -4.799  -7.946 -14.244
  124    H    LYS  17           H        LYS  17  -8.046  -2.072 -14.232
  125    HA   LYS  17           HA       LYS  17  -6.990  -0.146 -12.413
  126   1HB   LYS  17          2HB       LYS  17  -7.725  -0.199 -15.280
  127   2HB   LYS  17          1HB       LYS  17  -7.783   1.383 -14.503
  128   1HG   LYS  17          2HG       LYS  17  -5.550   1.394 -15.009
  129   2HG   LYS  17          1HG       LYS  17  -5.436   0.482 -13.504
  130   1HD   LYS  17          2HD       LYS  17  -5.968  -1.548 -15.203
  131   2HD   LYS  17          1HD       LYS  17  -5.144  -0.454 -16.314
  132   1HE   LYS  17          2HE       LYS  17  -3.989  -1.119 -13.603
  133   2HE   LYS  17          1HE       LYS  17  -3.673  -2.126 -15.015
  134   1HZ   LYS  17          1HZ       LYS  17  -3.079   0.773 -14.757
  135   2HZ   LYS  17          2HZ       LYS  17  -2.845  -0.146 -16.167
  136   3HZ   LYS  17          3HZ       LYS  17  -1.945  -0.488 -14.767
  137    H    ASN  18           H        ASN  18 -10.218  -0.882 -13.594
  138    HA   ASN  18           HA       ASN  18 -11.523   1.504 -12.791
  139   1HB   ASN  18          2HB       ASN  18 -12.329  -1.202 -13.630
  140   2HB   ASN  18          1HB       ASN  18 -13.449  -0.433 -12.504
  141   1HD2  ASN  18          1HD2      ASN  18 -11.615   0.354 -15.519
  142   2HD2  ASN  18          2HD2      ASN  18 -12.830   1.346 -16.165
  143    H    GLU  19           H        GLU  19 -10.989  -1.609 -11.146
  144    HA   GLU  19           HA       GLU  19 -12.315  -0.897  -8.715
  145   1HB   GLU  19          2HB       GLU  19 -10.120  -2.946  -9.146
  146   2HB   GLU  19          1HB       GLU  19 -11.188  -2.845  -7.746
  147   1HG   GLU  19          2HG       GLU  19 -13.060  -2.933  -9.661
  148   2HG   GLU  19          1HG       GLU  19 -11.773  -3.782 -10.515
  149    H    PHE  20           H        PHE  20  -8.963  -0.776  -9.845
  150    HA   PHE  20           HA       PHE  20  -7.730   0.037  -7.443
  151   1HB   PHE  20          2HB       PHE  20  -7.026   0.238 -10.348
  152   2HB   PHE  20          1HB       PHE  20  -6.080   1.156  -9.181
  153    HD1  PHE  20           HD1      PHE  20  -7.649  -2.020  -8.173
  154    HD2  PHE  20           HD2      PHE  20  -4.070  -0.170  -9.665
  155    HE1  PHE  20           HE1      PHE  20  -6.358  -4.056  -7.609
  156    HE2  PHE  20           HE2      PHE  20  -2.780  -2.205  -9.096
  157    HZ   PHE  20           HZ       PHE  20  -3.923  -4.150  -8.068
  158    H    LYS  21           H        LYS  21  -9.205   1.910 -10.081
  159    HA   LYS  21           HA       LYS  21  -8.493   4.483  -9.130
  160   1HB   LYS  21          2HB       LYS  21  -9.324   4.010 -11.442
  161   2HB   LYS  21          1HB       LYS  21 -10.933   3.745 -10.770
  162   1HG   LYS  21          2HG       LYS  21 -10.684   6.055 -11.628
  163   2HG   LYS  21          1HG       LYS  21 -10.958   6.043  -9.886
  164   1HD   LYS  21          2HD       LYS  21  -8.722   6.574  -9.399
  165   2HD   LYS  21          1HD       LYS  21  -8.153   6.041 -10.981
  166   1HE   LYS  21          2HE       LYS  21  -8.107   8.379 -11.190
  167   2HE   LYS  21          1HE       LYS  21  -9.663   7.959 -11.906
  168   1HZ   LYS  21          1HZ       LYS  21 -10.740   8.455  -9.812
  169   2HZ   LYS  21          2HZ       LYS  21  -9.847   9.800 -10.339
  170   3HZ   LYS  21          3HZ       LYS  21  -9.246   8.817  -9.091
  171    H    ALA  22           H        ALA  22 -11.418   2.496  -8.666
  172    HA   ALA  22           HA       ALA  22 -12.809   4.386  -7.054
  173   1HB   ALA  22          1HB       ALA  22 -13.064   1.375  -7.239
  174   2HB   ALA  22          2HB       ALA  22 -14.035   2.573  -8.093
  175   3HB   ALA  22          3HB       ALA  22 -14.173   2.413  -6.343
  176    H    ALA  23           H        ALA  23 -10.701   1.632  -6.299
  177    HA   ALA  23           HA       ALA  23 -10.912   1.743  -3.482
  178   1HB   ALA  23          1HB       ALA  23  -8.839   0.633  -5.363
  179   2HB   ALA  23          2HB       ALA  23  -9.965  -0.236  -4.320
  180   3HB   ALA  23          3HB       ALA  23  -8.588   0.610  -3.617
  181    H    PHE  24           H        PHE  24  -9.134   3.678  -5.769
  182    HA   PHE  24           HA       PHE  24  -7.335   4.782  -3.764
  183   1HB   PHE  24          2HB       PHE  24  -6.866   4.420  -6.317
  184   2HB   PHE  24          1HB       PHE  24  -7.742   5.937  -6.511
  185    HD1  PHE  24           HD1      PHE  24  -4.748   4.335  -5.053
  186    HD2  PHE  24           HD2      PHE  24  -6.814   8.043  -5.728
  187    HE1  PHE  24           HE1      PHE  24  -2.706   5.591  -4.419
  188    HE2  PHE  24           HE2      PHE  24  -4.775   9.296  -5.089
  189    HZ   PHE  24           HZ       PHE  24  -2.722   8.070  -4.434
  190    H    ASP  25           H        ASP  25  -9.908   6.016  -5.908
  191    HA   ASP  25           HA       ASP  25 -10.091   8.612  -4.966
  192   1HB   ASP  25          2HB       ASP  25 -11.352   7.371  -6.910
  193   2HB   ASP  25          1HB       ASP  25 -12.605   7.156  -5.686
  194    H    ILE  26           H        ILE  26 -11.659   5.699  -3.613
  195    HA   ILE  26           HA       ILE  26 -13.396   6.963  -1.816
  196    HB   ILE  26           HB       ILE  26 -13.209   4.887  -0.432
  197   1HG1  ILE  26          2HG1      ILE  26 -11.168   4.114  -2.544
  198   2HG1  ILE  26          1HG1      ILE  26 -10.808   4.443  -0.852
  199   1HG2  ILE  26          1HG2      ILE  26 -13.675   3.396  -2.662
  200   2HG2  ILE  26          2HG2      ILE  26 -13.848   5.022  -3.320
  201   3HG2  ILE  26          3HG2      ILE  26 -14.853   4.508  -1.966
  202   1HD1  ILE  26          1HD1      ILE  26 -12.436   2.172  -1.995
  203   2HD1  ILE  26          2HD1      ILE  26 -12.491   2.601  -0.286
  204   3HD1  ILE  26          3HD1      ILE  26 -10.974   2.073  -1.014
  205    H    PHE  27           H        PHE  27  -9.946   6.248  -1.508
  206    HA   PHE  27           HA       PHE  27  -9.826   7.236   1.223
  207   1HB   PHE  27          2HB       PHE  27  -7.817   6.155  -0.731
  208   2HB   PHE  27          1HB       PHE  27  -7.275   7.032   0.699
  209    HD1  PHE  27           HD1      PHE  27  -8.633   3.921  -0.571
  210    HD2  PHE  27           HD2      PHE  27  -8.008   6.240   2.989
  211    HE1  PHE  27           HE1      PHE  27  -9.001   1.894   0.810
  212    HE2  PHE  27           HE2      PHE  27  -8.375   4.215   4.371
  213    HZ   PHE  27           HZ       PHE  27  -8.871   2.042   3.282
  214    H    ILE  28           H        ILE  28  -9.254   8.427  -2.031
  215    HA   ILE  28           HA       ILE  28  -8.044  10.909  -1.051
  216    HB   ILE  28           HB       ILE  28  -8.723  10.250  -3.920
  217   1HG1  ILE  28          2HG1      ILE  28  -7.356   8.419  -3.396
  218   2HG1  ILE  28          1HG1      ILE  28  -6.198   9.615  -3.956
  219   1HG2  ILE  28          1HG2      ILE  28  -8.037  12.448  -3.937
  220   2HG2  ILE  28          2HG2      ILE  28  -6.461  11.660  -4.029
  221   3HG2  ILE  28          3HG2      ILE  28  -7.058  12.264  -2.481
  222   1HD1  ILE  28          1HD1      ILE  28  -6.094  10.297  -1.417
  223   2HD1  ILE  28          2HD1      ILE  28  -5.188   8.892  -1.985
  224   3HD1  ILE  28          3HD1      ILE  28  -6.730   8.671  -1.159
  225    H    GLN  29           H        GLN  29 -10.733  10.425  -0.235
  226    HA   GLN  29           HA       GLN  29 -12.556  11.893  -1.905
  227   1HB   GLN  29          2HB       GLN  29 -14.044  11.845   0.122
  228   2HB   GLN  29          1HB       GLN  29 -13.506  10.256  -0.417
  229   1HG   GLN  29          2HG       GLN  29 -12.060   9.980   1.388
  230   2HG   GLN  29          1HG       GLN  29 -11.894  11.716   1.654
  231   1HE2  GLN  29          1HE2      GLN  29 -13.333   8.986   2.953
  232   2HE2  GLN  29          2HE2      GLN  29 -14.608   9.730   3.790
  233    H    ASP  30           H        ASP  30 -10.347  12.668   0.702
  234    HA   ASP  30           HA       ASP  30 -10.733  15.510   0.192
  235   1HB   ASP  30          2HB       ASP  30 -12.267  14.540   2.165
  236   2HB   ASP  30          1HB       ASP  30 -10.778  14.778   3.079
  237    H    ALA  31           H        ALA  31  -8.561  13.845  -0.424
  238    HA   ALA  31           HA       ALA  31  -6.525  13.942   1.590
  239   1HB   ALA  31          1HB       ALA  31  -6.175  13.677  -1.403
  240   2HB   ALA  31          2HB       ALA  31  -6.533  12.328  -0.325
  241   3HB   ALA  31          3HB       ALA  31  -5.016  13.215  -0.155
  242    H    GLU  32           H        GLU  32  -4.556  15.181   1.466
  243    HA   GLU  32           HA       GLU  32  -5.051  17.974   0.989
  244   1HB   GLU  32          2HB       GLU  32  -2.653  16.415   1.935
  245   2HB   GLU  32          1HB       GLU  32  -2.556  18.145   1.605
  246   1HG   GLU  32          2HG       GLU  32  -3.838  18.704   3.418
  247   2HG   GLU  32          1HG       GLU  32  -4.848  17.265   3.277
  248    H    ASP  33           H        ASP  33  -2.848  15.564  -0.424
  249    HA   ASP  33           HA       ASP  33  -2.350  17.402  -2.683
  250   1HB   ASP  33          2HB       ASP  33  -0.773  15.147  -1.481
  251   2HB   ASP  33          1HB       ASP  33  -0.498  15.624  -3.156
  252    H    GLY  34           H        GLY  34  -3.434  14.145  -1.845
  253   1HA   GLY  34          2HA       GLY  34  -5.256  13.263  -3.290
  254   2HA   GLY  34          1HA       GLY  34  -4.267  13.746  -4.665
  255    H    CYS  35           H        CYS  35  -3.639  11.984  -1.622
  256    HA   CYS  35           HA       CYS  35  -2.989   9.544  -3.052
  257   1HB   CYS  35          2HB       CYS  35  -0.702   9.668  -1.586
  258   2HB   CYS  35          1HB       CYS  35  -0.801  10.094  -3.290
  259    HG   CYS  35           HG       CYS  35  -0.854  12.194  -0.971
  260    H    ILE  36           H        ILE  36  -2.228   7.829  -1.485
  261    HA   ILE  36           HA       ILE  36  -3.759   8.107   1.027
  262    HB   ILE  36           HB       ILE  36  -3.744   5.623   1.069
  263   1HG1  ILE  36          2HG1      ILE  36  -3.087   5.076  -1.644
  264   2HG1  ILE  36          1HG1      ILE  36  -1.755   6.013  -0.971
  265   1HG2  ILE  36          1HG2      ILE  36  -5.474   5.380  -0.512
  266   2HG2  ILE  36          2HG2      ILE  36  -4.731   6.518  -1.636
  267   3HG2  ILE  36          3HG2      ILE  36  -5.488   7.108  -0.156
  268   1HD1  ILE  36          1HD1      ILE  36  -2.338   3.262  -0.548
  269   2HD1  ILE  36          2HD1      ILE  36  -2.586   4.099   0.986
  270   3HD1  ILE  36          3HD1      ILE  36  -1.035   4.217   0.159
  271    H    SER  37           H        SER  37  -2.765   6.366   2.706
  272    HA   SER  37           HA       SER  37  -0.047   7.339   3.201
  273   1HB   SER  37          2HB       SER  37  -2.043   7.258   4.930
  274   2HB   SER  37          1HB       SER  37  -1.528   5.586   5.125
  275    HG   SER  37           HG       SER  37   0.468   6.284   5.758
  276    H    THR  38           H        THR  38   1.718   6.028   3.425
  277    HA   THR  38           HA       THR  38   1.855   3.632   1.951
  278    HB   THR  38           HB       THR  38   4.051   3.294   3.229
  279    HG1  THR  38           HG1      THR  38   4.394   4.549   4.860
  280   1HG2  THR  38          1HG2      THR  38   5.005   5.466   2.184
  281   2HG2  THR  38          2HG2      THR  38   3.352   5.755   1.640
  282   3HG2  THR  38          3HG2      THR  38   4.216   4.310   1.111
  283    H    LYS  39           H        LYS  39   1.400   4.234   5.416
  284    HA   LYS  39           HA       LYS  39   1.512   1.493   6.217
  285   1HB   LYS  39          2HB       LYS  39   0.599   2.293   8.344
  286   2HB   LYS  39          1HB       LYS  39   1.896   3.349   7.790
  287   1HG   LYS  39          2HG       LYS  39   0.512   5.119   7.781
  288   2HG   LYS  39          1HG       LYS  39  -0.606   4.282   6.707
  289   1HD   LYS  39          2HD       LYS  39  -1.918   3.503   8.450
  290   2HD   LYS  39          1HD       LYS  39  -0.578   3.506   9.597
  291   1HE   LYS  39          2HE       LYS  39  -1.455   6.138   8.485
  292   2HE   LYS  39          1HE       LYS  39  -2.489   5.370   9.689
  293   1HZ   LYS  39          1HZ       LYS  39  -0.620   5.225  11.187
  294   2HZ   LYS  39          2HZ       LYS  39  -0.826   6.836  10.689
  295   3HZ   LYS  39          3HZ       LYS  39   0.417   5.891  10.021
  296    H    GLU  40           H        GLU  40  -0.968   3.516   4.838
  297    HA   GLU  40           HA       GLU  40  -3.184   1.851   5.663
  298   1HB   GLU  40          2HB       GLU  40  -2.839   4.345   4.105
  299   2HB   GLU  40          1HB       GLU  40  -4.213   3.340   3.650
  300   1HG   GLU  40          2HG       GLU  40  -3.609   4.199   6.494
  301   2HG   GLU  40          1HG       GLU  40  -4.755   5.019   5.435
  302    H    LEU  41           H        LEU  41  -0.765   1.368   3.416
  303    HA   LEU  41           HA       LEU  41  -2.097   0.464   1.116
  304   1HB   LEU  41          2HB       LEU  41   0.477   0.730   1.748
  305   2HB   LEU  41          1HB       LEU  41   0.327  -0.983   2.061
  306    HG   LEU  41           HG       LEU  41   1.177  -0.514  -0.198
  307   1HD1  LEU  41          1HD1      LEU  41  -1.623  -1.570  -0.530
  308   2HD1  LEU  41          2HD1      LEU  41  -0.432  -2.469   0.412
  309   3HD1  LEU  41          3HD1      LEU  41  -0.133  -2.128  -1.292
  310   1HD2  LEU  41          1HD2      LEU  41  -0.248   1.658  -0.342
  311   2HD2  LEU  41          2HD2      LEU  41  -1.544   0.595  -0.891
  312   3HD2  LEU  41          3HD2      LEU  41  -0.044   0.706  -1.812
  313    H    GLY  42           H        GLY  42  -1.282  -1.203   4.145
  314   1HA   GLY  42          2HA       GLY  42  -2.080  -3.808   3.387
  315   2HA   GLY  42          1HA       GLY  42  -1.994  -3.206   5.038
  316    H    LYS  43           H        LYS  43  -3.947  -0.982   4.108
  317    HA   LYS  43           HA       LYS  43  -6.359  -2.416   4.842
  318   1HB   LYS  43          2HB       LYS  43  -5.720  -0.120   5.723
  319   2HB   LYS  43          1HB       LYS  43  -6.103   0.507   4.121
  320   1HG   LYS  43          2HG       LYS  43  -8.090   0.778   5.399
  321   2HG   LYS  43          1HG       LYS  43  -8.383  -0.627   4.376
  322   1HD   LYS  43          2HD       LYS  43  -7.209  -1.758   6.604
  323   2HD   LYS  43          1HD       LYS  43  -8.169  -0.455   7.304
  324   1HE   LYS  43          2HE       LYS  43 -10.185  -1.322   6.485
  325   2HE   LYS  43          1HE       LYS  43  -9.383  -2.257   5.223
  326   1HZ   LYS  43          1HZ       LYS  43 -10.162  -3.665   7.031
  327   2HZ   LYS  43          2HZ       LYS  43  -9.208  -2.798   8.140
  328   3HZ   LYS  43          3HZ       LYS  43  -8.471  -3.711   6.909
  329    H    VAL  44           H        VAL  44  -5.092  -0.677   2.005
  330    HA   VAL  44           HA       VAL  44  -7.492  -0.884   0.477
  331    HB   VAL  44           HB       VAL  44  -6.028  -0.355  -1.487
  332   1HG1  VAL  44          1HG1      VAL  44  -7.054   1.339   0.140
  333   2HG1  VAL  44          2HG1      VAL  44  -5.703   1.908  -0.841
  334   3HG1  VAL  44          3HG1      VAL  44  -5.443   1.467   0.847
  335   1HG2  VAL  44          1HG2      VAL  44  -3.978  -1.492  -0.567
  336   2HG2  VAL  44          2HG2      VAL  44  -3.834  -0.174   0.596
  337   3HG2  VAL  44          3HG2      VAL  44  -3.686   0.153  -1.131
  338    H    MET  45           H        MET  45  -4.664  -2.963   0.876
  339    HA   MET  45           HA       MET  45  -5.170  -4.729  -1.278
  340   1HB   MET  45          2HB       MET  45  -3.891  -5.468   1.365
  341   2HB   MET  45          1HB       MET  45  -3.694  -6.290  -0.180
  342   1HG   MET  45          2HG       MET  45  -3.013  -3.397  -0.146
  343   2HG   MET  45          1HG       MET  45  -1.926  -4.466   0.741
  344   1HE   MET  45          1HE       MET  45  -3.859  -3.680  -2.199
  345   2HE   MET  45          2HE       MET  45  -3.957  -5.337  -2.792
  346   3HE   MET  45          3HE       MET  45  -2.936  -4.168  -3.630
  347    H    ARG  46           H        ARG  46  -6.294  -4.627   2.059
  348    HA   ARG  46           HA       ARG  46  -7.613  -7.145   2.082
  349   1HB   ARG  46          2HB       ARG  46  -7.757  -4.666   3.757
  350   2HB   ARG  46          1HB       ARG  46  -9.013  -5.892   3.936
  351   1HG   ARG  46          2HG       ARG  46  -6.372  -7.108   3.839
  352   2HG   ARG  46          1HG       ARG  46  -6.476  -5.915   5.133
  353   1HD   ARG  46          2HD       ARG  46  -7.280  -7.830   6.194
  354   2HD   ARG  46          1HD       ARG  46  -8.769  -7.064   5.655
  355    HE   ARG  46           HE       ARG  46  -7.820  -8.857   3.658
  356   1HH1  ARG  46          2HH1      ARG  46  -9.309  -8.782   6.817
  357   2HH1  ARG  46          1HH1      ARG  46 -10.106 -10.304   6.616
  358   1HH2  ARG  46          1HH2      ARG  46  -8.874 -10.853   3.417
  359   2HH2  ARG  46          2HH2      ARG  46  -9.862 -11.475   4.697
  360    H    MET  47           H        MET  47  -8.613  -3.900   1.109
  361    HA   MET  47           HA       MET  47 -11.384  -4.624   0.736
  362   1HB   MET  47          2HB       MET  47  -9.750  -2.177   0.088
  363   2HB   MET  47          1HB       MET  47 -11.405  -2.355  -0.497
  364   1HG   MET  47          2HG       MET  47 -11.928  -2.961   2.007
  365   2HG   MET  47          1HG       MET  47 -10.413  -2.116   2.328
  366   1HE   MET  47          1HE       MET  47 -12.971  -1.415   3.564
  367   2HE   MET  47          2HE       MET  47 -14.134  -1.612   2.256
  368   3HE   MET  47          3HE       MET  47 -13.872  -0.018   2.960
  369    H    LEU  48           H        LEU  48  -8.516  -4.308  -1.313
  370    HA   LEU  48           HA       LEU  48  -9.882  -4.555  -3.810
  371   1HB   LEU  48          2HB       LEU  48  -7.290  -3.998  -3.021
  372   2HB   LEU  48          1HB       LEU  48  -7.144  -5.572  -3.766
  373    HG   LEU  48           HG       LEU  48  -6.688  -3.939  -5.448
  374   1HD1  LEU  48          1HD1      LEU  48  -9.551  -4.887  -5.782
  375   2HD1  LEU  48          2HD1      LEU  48  -8.114  -5.836  -6.158
  376   3HD1  LEU  48          3HD1      LEU  48  -8.474  -4.378  -7.082
  377   1HD2  LEU  48          1HD2      LEU  48  -7.688  -1.987  -4.376
  378   2HD2  LEU  48          2HD2      LEU  48  -9.305  -2.657  -4.594
  379   3HD2  LEU  48          3HD2      LEU  48  -8.359  -2.160  -5.998
  380    H    GLY  49           H        GLY  49  -7.883  -6.885  -1.976
  381   1HA   GLY  49          2HA       GLY  49  -9.296  -9.116  -1.834
  382   2HA   GLY  49          1HA       GLY  49  -8.966  -9.102  -3.564
  383    H    GLN  50           H        GLN  50  -7.131  -8.465  -0.571
  384    HA   GLN  50           HA       GLN  50  -5.234 -10.588  -1.168
  385   1HB   GLN  50          2HB       GLN  50  -4.631  -7.732  -1.661
  386   2HB   GLN  50          1HB       GLN  50  -3.417  -8.613  -0.732
  387   1HG   GLN  50          2HG       GLN  50  -3.678 -10.439  -2.580
  388   2HG   GLN  50          1HG       GLN  50  -4.399  -9.138  -3.529
  389   1HE2  GLN  50          1HE2      GLN  50  -1.399 -10.123  -1.856
  390   2HE2  GLN  50          2HE2      GLN  50  -0.392  -9.041  -2.690
  391    H    ASN  51           H        ASN  51  -3.763 -10.987   0.600
  392    HA   ASN  51           HA       ASN  51  -4.260  -9.532   3.093
  393   1HB   ASN  51          2HB       ASN  51  -5.886 -11.560   2.782
  394   2HB   ASN  51          1HB       ASN  51  -4.467 -12.529   3.176
  395   1HD2  ASN  51          1HD2      ASN  51  -4.485 -13.030   5.372
  396   2HD2  ASN  51          2HD2      ASN  51  -4.958 -11.967   6.609
  397    HA   PRO  52           HA       PRO  52   0.121 -10.964   2.608
  398   1HB   PRO  52          2HB       PRO  52   1.249  -8.471   2.642
  399   2HB   PRO  52          1HB       PRO  52   0.684  -9.269   1.169
  400   1HG   PRO  52          2HG       PRO  52  -0.509  -7.020   2.663
  401   2HG   PRO  52          1HG       PRO  52  -0.676  -7.450   0.955
  402   1HD   PRO  52          2HD       PRO  52  -2.570  -7.939   3.026
  403   2HD   PRO  52          1HD       PRO  52  -2.630  -8.559   1.360
  404    H    THR  53           H        THR  53   2.106  -9.717   3.956
  405    HA   THR  53           HA       THR  53   1.160  -9.654   6.764
  406    HB   THR  53           HB       THR  53   3.125 -10.697   7.445
  407    HG1  THR  53           HG1      THR  53   4.998 -10.210   6.631
  408   1HG2  THR  53          1HG2      THR  53   3.604 -12.553   5.917
  409   2HG2  THR  53          2HG2      THR  53   2.813 -11.686   4.601
  410   3HG2  THR  53          3HG2      THR  53   1.869 -12.240   5.985
  411    HA   PRO  54           HA       PRO  54   2.774  -5.579   7.238
  412   1HB   PRO  54          2HB       PRO  54   4.289  -5.678   9.520
  413   2HB   PRO  54          1HB       PRO  54   2.520  -5.702   9.505
  414   1HG   PRO  54          2HG       PRO  54   4.436  -7.934   9.946
  415   2HG   PRO  54          1HG       PRO  54   2.816  -7.690  10.615
  416   1HD   PRO  54          2HD       PRO  54   3.427  -9.419   8.516
  417   2HD   PRO  54          1HD       PRO  54   1.804  -8.781   8.865
  418    H    GLU  55           H        GLU  55   5.208  -8.111   7.365
  419    HA   GLU  55           HA       GLU  55   7.422  -6.313   6.782
  420   1HB   GLU  55          2HB       GLU  55   7.479  -9.328   6.606
  421   2HB   GLU  55          1HB       GLU  55   8.824  -8.225   6.894
  422   1HG   GLU  55          2HG       GLU  55   7.704  -7.550   9.053
  423   2HG   GLU  55          1HG       GLU  55   6.535  -8.843   8.780
  424    H    GLU  56           H        GLU  56   5.388  -8.672   5.104
  425    HA   GLU  56           HA       GLU  56   6.796  -8.682   2.635
  426   1HB   GLU  56          2HB       GLU  56   4.783 -10.185   3.629
  427   2HB   GLU  56          1HB       GLU  56   3.860  -9.109   2.580
  428   1HG   GLU  56          2HG       GLU  56   5.097  -9.762   0.651
  429   2HG   GLU  56          1HG       GLU  56   6.344 -10.545   1.623
  430    H    LEU  57           H        LEU  57   3.817  -6.972   3.652
  431    HA   LEU  57           HA       LEU  57   3.465  -5.504   1.275
  432   1HB   LEU  57          2HB       LEU  57   1.573  -5.092   2.363
  433   2HB   LEU  57          1HB       LEU  57   2.262  -5.632   3.873
  434    HG   LEU  57           HG       LEU  57   2.842  -2.854   2.915
  435   1HD1  LEU  57          1HD1      LEU  57   0.353  -3.300   2.730
  436   2HD1  LEU  57          2HD1      LEU  57   0.796  -2.020   3.861
  437   3HD1  LEU  57          3HD1      LEU  57   0.357  -3.617   4.465
  438   1HD2  LEU  57          1HD2      LEU  57   3.351  -4.413   5.237
  439   2HD2  LEU  57          2HD2      LEU  57   2.190  -3.169   5.702
  440   3HD2  LEU  57          3HD2      LEU  57   3.732  -2.710   4.981
  441    H    GLN  58           H        GLN  58   5.407  -4.863   4.153
  442    HA   GLN  58           HA       GLN  58   5.996  -2.157   3.752
  443   1HB   GLN  58          2HB       GLN  58   6.643  -3.657   5.740
  444   2HB   GLN  58          1HB       GLN  58   8.044  -4.119   4.775
  445   1HG   GLN  58          2HG       GLN  58   8.694  -2.260   6.184
  446   2HG   GLN  58          1HG       GLN  58   8.584  -1.669   4.526
  447   1HE2  GLN  58          1HE2      GLN  58   6.802  -0.221   3.987
  448   2HE2  GLN  58          2HE2      GLN  58   5.838   0.485   5.194
  449    H    GLU  59           H        GLU  59   7.657  -5.045   2.494
  450    HA   GLU  59           HA       GLU  59   9.723  -3.686   1.118
  451   1HB   GLU  59          2HB       GLU  59   8.439  -6.384   0.653
  452   2HB   GLU  59          1HB       GLU  59   9.813  -5.798  -0.285
  453   1HG   GLU  59          2HG       GLU  59  10.852  -5.330   2.096
  454   2HG   GLU  59          1HG       GLU  59   9.682  -6.540   2.619
  455    H    MET  60           H        MET  60   6.438  -4.620   0.166
  456    HA   MET  60           HA       MET  60   6.653  -3.946  -2.580
  457   1HB   MET  60          2HB       MET  60   4.341  -4.259  -0.681
  458   2HB   MET  60          1HB       MET  60   4.078  -3.649  -2.315
  459   1HG   MET  60          2HG       MET  60   4.597  -5.658  -3.299
  460   2HG   MET  60          1HG       MET  60   5.777  -6.082  -2.058
  461   1HE   MET  60          1HE       MET  60   2.280  -6.023  -3.324
  462   2HE   MET  60          2HE       MET  60   1.921  -5.016  -1.923
  463   3HE   MET  60          3HE       MET  60   1.240  -6.638  -2.032
  464    H    ILE  61           H        ILE  61   5.550  -2.093   0.263
  465    HA   ILE  61           HA       ILE  61   4.726   0.247  -1.000
  466    HB   ILE  61           HB       ILE  61   6.025  -0.207   1.689
  467   1HG1  ILE  61          2HG1      ILE  61   3.192   0.614   1.301
  468   2HG1  ILE  61          1HG1      ILE  61   3.618  -1.028   0.819
  469   1HG2  ILE  61          1HG2      ILE  61   5.033   2.065   2.234
  470   2HG2  ILE  61          2HG2      ILE  61   4.821   2.304   0.499
  471   3HG2  ILE  61          3HG2      ILE  61   6.440   2.095   1.171
  472   1HD1  ILE  61          1HD1      ILE  61   4.297   0.161   3.519
  473   2HD1  ILE  61          2HD1      ILE  61   4.492  -1.517   3.010
  474   3HD1  ILE  61          3HD1      ILE  61   2.876  -0.839   3.213
  475    H    ASP  62           H        ASP  62   7.862  -0.092   0.675
  476    HA   ASP  62           HA       ASP  62   9.114   2.155  -0.331
  477   1HB   ASP  62          2HB       ASP  62   9.954   0.433   1.417
  478   2HB   ASP  62          1HB       ASP  62  10.665  -0.397   0.034
  479    H    GLU  63           H        GLU  63   8.806  -1.024  -1.874
  480    HA   GLU  63           HA       GLU  63  10.616  -0.598  -4.007
  481   1HB   GLU  63          2HB       GLU  63   8.340  -2.469  -3.510
  482   2HB   GLU  63          1HB       GLU  63   8.957  -2.320  -5.155
  483   1HG   GLU  63          2HG       GLU  63  11.239  -2.810  -4.342
  484   2HG   GLU  63          1HG       GLU  63  10.615  -2.982  -2.702
  485    H    VAL  64           H        VAL  64   7.057  -0.234  -3.891
  486    HA   VAL  64           HA       VAL  64   6.917   0.873  -6.544
  487    HB   VAL  64           HB       VAL  64   4.562   1.230  -6.096
  488   1HG1  VAL  64          1HG1      VAL  64   4.064  -0.984  -6.170
  489   2HG1  VAL  64          2HG1      VAL  64   4.875  -1.317  -4.640
  490   3HG1  VAL  64          3HG1      VAL  64   5.813  -1.206  -6.130
  491   1HG2  VAL  64          1HG2      VAL  64   5.152   0.433  -3.231
  492   2HG2  VAL  64          2HG2      VAL  64   3.591   0.911  -3.896
  493   3HG2  VAL  64          3HG2      VAL  64   4.892   2.095  -3.761
  494    H    ASP  65           H        ASP  65   7.516   2.222  -3.407
  495    HA   ASP  65           HA       ASP  65   6.537   4.855  -3.921
  496   1HB   ASP  65          2HB       ASP  65   7.438   3.556  -1.682
  497   2HB   ASP  65          1HB       ASP  65   8.791   4.627  -2.039
  498    H    GLU  66           H        GLU  66   7.305   5.397  -5.960
  499    HA   GLU  66           HA       GLU  66  10.040   5.338  -6.733
  500   1HB   GLU  66          2HB       GLU  66   7.697   6.931  -7.791
  501   2HB   GLU  66          1HB       GLU  66   9.288   6.906  -8.552
  502   1HG   GLU  66          2HG       GLU  66   7.891   4.315  -7.927
  503   2HG   GLU  66          1HG       GLU  66   7.448   5.222  -9.372
  504    H    ASP  67           H        ASP  67   8.010   7.873  -5.306
  505    HA   ASP  67           HA       ASP  67  10.134   9.846  -5.441
  506   1HB   ASP  67          2HB       ASP  67   8.476  11.169  -3.941
  507   2HB   ASP  67          1HB       ASP  67   8.045  10.874  -5.623
  508    H    GLY  68           H        GLY  68   8.567   7.926  -2.883
  509   1HA   GLY  68          2HA       GLY  68   9.423   7.203  -0.854
  510   2HA   GLY  68          1HA       GLY  68  10.963   7.945  -1.282
  511    H    SER  69           H        SER  69   7.722   9.390  -1.035
  512    HA   SER  69           HA       SER  69   8.816  11.485   0.694
  513   1HB   SER  69          2HB       SER  69   6.654  12.629   0.279
  514   2HB   SER  69          1HB       SER  69   7.500  12.235  -1.213
  515    HG   SER  69           HG       SER  69   5.893  10.989  -1.739
  516    H    GLY  70           H        GLY  70   6.033   9.255   0.632
  517   1HA   GLY  70          2HA       GLY  70   6.029   8.170   3.078
  518   2HA   GLY  70          1HA       GLY  70   5.439   9.789   3.437
  519    H    THR  71           H        THR  71   4.091   9.965   0.770
  520    HA   THR  71           HA       THR  71   1.704   8.377   1.466
  521    HB   THR  71           HB       THR  71   0.434   9.987   0.137
  522    HG1  THR  71           HG1      THR  71   2.856  11.412  -0.208
  523   1HG2  THR  71          1HG2      THR  71   2.357  11.233   2.119
  524   2HG2  THR  71          2HG2      THR  71   0.766  10.555   2.468
  525   3HG2  THR  71          3HG2      THR  71   0.905  12.032   1.513
  526    H    VAL  72           H        VAL  72   0.507   7.333  -0.193
  527    HA   VAL  72           HA       VAL  72   2.179   6.525  -2.494
  528    HB   VAL  72           HB       VAL  72  -0.214   5.087  -1.323
  529   1HG1  VAL  72          1HG1      VAL  72   0.452   3.257  -2.739
  530   2HG1  VAL  72          2HG1      VAL  72   1.939   4.084  -3.202
  531   3HG1  VAL  72          3HG1      VAL  72   0.379   4.696  -3.755
  532   1HG2  VAL  72          1HG2      VAL  72   1.525   5.033   0.335
  533   2HG2  VAL  72          2HG2      VAL  72   2.763   4.739  -0.887
  534   3HG2  VAL  72          3HG2      VAL  72   1.586   3.483  -0.505
  535    H    ASP  73           H        ASP  73   1.668   7.585  -4.285
  536    HA   ASP  73           HA       ASP  73  -1.002   8.668  -4.705
  537   1HB   ASP  73          2HB       ASP  73   1.545   8.794  -6.336
  538   2HB   ASP  73          1HB       ASP  73   0.021   9.505  -6.863
  539    H    PHE  74           H        PHE  74  -1.660   8.413  -7.224
  540    HA   PHE  74           HA       PHE  74  -2.505   5.713  -7.489
  541   1HB   PHE  74          2HB       PHE  74  -3.552   7.892  -8.483
  542   2HB   PHE  74          1HB       PHE  74  -2.456   7.591  -9.832
  543    HD1  PHE  74           HD1      PHE  74  -3.607   6.613 -11.602
  544    HD2  PHE  74           HD2      PHE  74  -4.449   5.332  -7.594
  545    HE1  PHE  74           HE1      PHE  74  -5.164   4.894 -12.480
  546    HE2  PHE  74           HE2      PHE  74  -6.012   3.616  -8.468
  547    HZ   PHE  74           HZ       PHE  74  -6.371   3.397 -10.912
  548    H    ASP  75           H        ASP  75   0.219   7.513  -8.816
  549    HA   ASP  75           HA       ASP  75   0.981   5.634 -10.812
  550   1HB   ASP  75          2HB       ASP  75   2.251   7.948  -9.457
  551   2HB   ASP  75          1HB       ASP  75   3.353   6.745 -10.123
  552    H    GLU  76           H        GLU  76   1.653   5.964  -7.373
  553    HA   GLU  76           HA       GLU  76   3.520   3.740  -7.297
  554   1HB   GLU  76          2HB       GLU  76   2.185   4.995  -4.900
  555   2HB   GLU  76          1HB       GLU  76   3.754   4.196  -4.988
  556   1HG   GLU  76          2HG       GLU  76   4.651   6.017  -6.344
  557   2HG   GLU  76          1HG       GLU  76   3.064   6.788  -6.402
  558    H    PHE  77           H        PHE  77   0.109   4.277  -6.958
  559    HA   PHE  77           HA       PHE  77  -0.496   1.861  -5.511
  560   1HB   PHE  77          2HB       PHE  77  -1.937   3.919  -5.513
  561   2HB   PHE  77          1HB       PHE  77  -2.340   3.578  -7.194
  562    HD1  PHE  77           HD1      PHE  77  -2.330   1.952  -3.807
  563    HD2  PHE  77           HD2      PHE  77  -4.161   2.215  -7.684
  564    HE1  PHE  77           HE1      PHE  77  -4.112   0.392  -3.071
  565    HE2  PHE  77           HE2      PHE  77  -5.944   0.652  -6.949
  566    HZ   PHE  77           HZ       PHE  77  -5.917  -0.259  -4.643
  567    H    LEU  78           H        LEU  78  -0.549   2.874  -8.917
  568    HA   LEU  78           HA       LEU  78  -1.663   0.427  -9.905
  569   1HB   LEU  78          2HB       LEU  78  -0.210   2.687 -11.262
  570   2HB   LEU  78          1HB       LEU  78  -0.854   1.310 -12.125
  571    HG   LEU  78           HG       LEU  78  -2.301   3.584 -10.817
  572   1HD1  LEU  78          1HD1      LEU  78  -2.167   2.214 -13.468
  573   2HD1  LEU  78          2HD1      LEU  78  -2.230   3.936 -13.093
  574   3HD1  LEU  78          3HD1      LEU  78  -3.697   2.961 -13.007
  575   1HD2  LEU  78          1HD2      LEU  78  -4.407   2.134 -11.140
  576   2HD2  LEU  78          2HD2      LEU  78  -3.404   1.789  -9.729
  577   3HD2  LEU  78          3HD2      LEU  78  -3.306   0.755 -11.155
  578    H    VAL  79           H        VAL  79   1.649   1.686  -9.601
  579    HA   VAL  79           HA       VAL  79   2.966  -0.264 -11.124
  580    HB   VAL  79           HB       VAL  79   4.968   0.217  -9.663
  581   1HG1  VAL  79          1HG1      VAL  79   4.874   1.500 -11.609
  582   2HG1  VAL  79          2HG1      VAL  79   4.906   2.743 -10.358
  583   3HG1  VAL  79          3HG1      VAL  79   3.380   2.304 -11.128
  584   1HG2  VAL  79          1HG2      VAL  79   4.787   2.068  -8.076
  585   2HG2  VAL  79          2HG2      VAL  79   3.686   0.771  -7.611
  586   3HG2  VAL  79          3HG2      VAL  79   3.063   2.211  -8.411
  587    H    MET  80           H        MET  80   1.653  -0.473  -7.895
  588    HA   MET  80           HA       MET  80   3.056  -2.531  -6.726
  589   1HB   MET  80          2HB       MET  80   0.358  -1.462  -6.509
  590   2HB   MET  80          1HB       MET  80   0.408  -3.192  -6.178
  591   1HG   MET  80          2HG       MET  80   1.719  -2.937  -4.309
  592   2HG   MET  80          1HG       MET  80   2.549  -1.523  -4.956
  593   1HE   MET  80          1HE       MET  80  -1.482  -1.887  -2.921
  594   2HE   MET  80          2HE       MET  80  -0.591  -3.070  -3.875
  595   3HE   MET  80          3HE       MET  80  -1.586  -1.863  -4.687
  596    H    MET  81           H        MET  81   0.707  -2.786  -9.353
  597    HA   MET  81           HA       MET  81   0.644  -5.679  -9.276
  598   1HB   MET  81          2HB       MET  81  -0.523  -3.582 -11.081
  599   2HB   MET  81          1HB       MET  81  -0.498  -5.270 -11.588
  600   1HG   MET  81          2HG       MET  81  -1.494  -4.608  -8.840
  601   2HG   MET  81          1HG       MET  81  -2.554  -4.323 -10.220
  602   1HE   MET  81          1HE       MET  81  -3.063  -7.759  -8.024
  603   2HE   MET  81          2HE       MET  81  -4.057  -6.408  -8.560
  604   3HE   MET  81          3HE       MET  81  -2.585  -6.099  -7.644
  605    H    VAL  82           H        VAL  82   2.014  -3.234 -11.488
  606    HA   VAL  82           HA       VAL  82   3.267  -5.160 -13.197
  607    HB   VAL  82           HB       VAL  82   4.395  -3.229 -14.222
  608   1HG1  VAL  82          1HG1      VAL  82   1.666  -3.758 -14.154
  609   2HG1  VAL  82          2HG1      VAL  82   2.483  -2.702 -15.306
  610   3HG1  VAL  82          3HG1      VAL  82   1.755  -2.022 -13.851
  611   1HG2  VAL  82          1HG2      VAL  82   3.725  -0.941 -13.273
  612   2HG2  VAL  82          2HG2      VAL  82   4.930  -1.845 -12.355
  613   3HG2  VAL  82          3HG2      VAL  82   3.255  -1.807 -11.812
  614    H    ARG  83           H        ARG  83   4.328  -3.442 -10.308
  615    HA   ARG  83           HA       ARG  83   7.106  -3.700 -10.578
  616   1HB   ARG  83          2HB       ARG  83   7.255  -3.422  -8.181
  617   2HB   ARG  83          1HB       ARG  83   5.969  -2.380  -8.784
  618   1HG   ARG  83          2HG       ARG  83   4.698  -3.336  -7.166
  619   2HG   ARG  83          1HG       ARG  83   4.607  -4.714  -8.261
  620   1HD   ARG  83          2HD       ARG  83   6.860  -5.430  -7.157
  621   2HD   ARG  83          1HD       ARG  83   6.396  -4.317  -5.874
  622    HE   ARG  83           HE       ARG  83   4.176  -5.895  -6.230
  623   1HH1  ARG  83          2HH1      ARG  83   7.559  -6.482  -5.586
  624   2HH1  ARG  83          1HH1      ARG  83   7.266  -7.944  -4.707
  625   1HH2  ARG  83          1HH2      ARG  83   3.816  -7.810  -5.073
  626   2HH2  ARG  83          2HH2      ARG  83   5.154  -8.695  -4.417
  627    H    CYS  84           H        CYS  84   4.695  -6.109  -9.910
  628    HA   CYS  84           HA       CYS  84   6.195  -8.076  -8.590
  629   1HB   CYS  84          2HB       CYS  84   3.948  -8.348 -10.599
  630   2HB   CYS  84          1HB       CYS  84   4.621  -9.705  -9.696
  631    HG   CYS  84           HG       CYS  84   3.938  -8.274  -7.477
  632    H    MET  85           H        MET  85   6.151  -7.103 -11.977
  633    HA   MET  85           HA       MET  85   7.428  -9.339 -13.126
  634   1HB   MET  85          2HB       MET  85   7.038  -6.487 -13.871
  635   2HB   MET  85          1HB       MET  85   8.344  -7.347 -14.687
  636   1HG   MET  85          2HG       MET  85   5.603  -8.579 -14.464
  637   2HG   MET  85          1HG       MET  85   5.967  -7.423 -15.745
  638   1HE   MET  85          1HE       MET  85   7.520  -7.449 -17.286
  639   2HE   MET  85          2HE       MET  85   8.058  -8.870 -18.177
  640   3HE   MET  85          3HE       MET  85   9.062  -8.216 -16.886
  641    H    LYS  86           H        LYS  86   8.766  -6.312 -11.792
  642    HA   LYS  86           HA       LYS  86  11.501  -7.152 -12.171
  643   1HB   LYS  86          2HB       LYS  86  10.115  -4.741 -11.240
  644   2HB   LYS  86          1HB       LYS  86  11.571  -5.102 -10.312
  645   1HG   LYS  86          2HG       LYS  86  11.611  -5.205 -13.325
  646   2HG   LYS  86          1HG       LYS  86  11.808  -3.672 -12.476
  647   1HD   LYS  86          2HD       LYS  86  13.853  -4.265 -11.584
  648   2HD   LYS  86          1HD       LYS  86  13.457  -5.983 -11.548
  649   1HE   LYS  86          2HE       LYS  86  13.414  -5.510 -14.234
  650   2HE   LYS  86          1HE       LYS  86  14.655  -4.369 -13.719
  651   1HZ   LYS  86          1HZ       LYS  86  15.629  -6.504 -14.218
  652   2HZ   LYS  86          2HZ       LYS  86  14.591  -7.279 -13.118
  653   3HZ   LYS  86          3HZ       LYS  86  15.770  -6.190 -12.557
  654    H    ASP  87           H        ASP  87  12.044  -8.944 -11.064
  655    HA   ASP  87           HA       ASP  87  11.134  -9.451  -8.371
  656   1HB   ASP  87          2HB       ASP  87  13.179 -10.866 -10.097
  657   2HB   ASP  87          1HB       ASP  87  12.657 -11.426  -8.508
  658    H    ASP  88           H        ASP  88  14.124  -8.313  -9.893
  659    HA   ASP  88           HA       ASP  88  15.995  -7.304  -9.030
  660   1HB   ASP  88          2HB       ASP  88  14.022  -6.104  -7.703
  661   2HB   ASP  88          1HB       ASP  88  14.739  -6.961  -6.339
  662    H    SER  89           HN       SER  89  16.175  -9.958  -9.095
  663    HA   SER  89           HA       SER  89  17.537 -10.639  -6.558
  664   1HB   SER  89          2HB       SER  89  15.255 -11.843  -7.098
  665   2HB   SER  89          1HB       SER  89  16.247 -12.787  -8.204
  666    HG   SER  89           HG       SER  89  17.227 -13.688  -6.556
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  13.848   3.266 -17.513
    2   2H    MET   1          2H        MET   1  15.394   3.659 -18.097
    3   3H    MET   1          3H        MET   1  15.227   2.790 -16.647
    4    HA   MET   1           HA       MET   1  14.467   1.820 -19.351
    5   1HB   MET   1          2HB       MET   1  16.852   1.410 -17.567
    6   2HB   MET   1          1HB       MET   1  16.327   0.099 -18.624
    7   1HG   MET   1          2HG       MET   1  16.753   1.323 -20.574
    8   2HG   MET   1          1HG       MET   1  16.665   2.873 -19.737
    9   1HE   MET   1          1HE       MET   1  20.087  -0.135 -19.926
   10   2HE   MET   1          2HE       MET   1  19.096   0.355 -21.296
   11   3HE   MET   1          3HE       MET   1  18.352  -0.478 -19.934
   12    H    ASN   2           H        ASN   2  12.517   0.892 -18.927
   13    HA   ASN   2           HA       ASN   2  12.489  -1.396 -17.109
   14   1HB   ASN   2          2HB       ASN   2  10.948   1.105 -16.639
   15   2HB   ASN   2          1HB       ASN   2  10.095  -0.420 -16.394
   16   1HD2  ASN   2          1HD2      ASN   2  11.414  -2.084 -15.004
   17   2HD2  ASN   2          2HD2      ASN   2  12.273  -1.442 -13.690
   18    H    ASP   3           H        ASP   3  11.505  -3.042 -18.079
   19    HA   ASP   3           HA       ASP   3   9.525  -2.453 -20.205
   20   1HB   ASP   3          2HB       ASP   3  11.572  -4.676 -20.072
   21   2HB   ASP   3          1HB       ASP   3  10.274  -4.593 -21.263
   22    H    ILE   4           H        ILE   4   9.417  -3.243 -17.163
   23    HA   ILE   4           HA       ILE   4   7.975  -5.768 -17.278
   24    HB   ILE   4           HB       ILE   4   7.685  -5.533 -14.878
   25   1HG1  ILE   4          2HG1      ILE   4   8.905  -3.406 -13.882
   26   2HG1  ILE   4          1HG1      ILE   4   8.500  -2.700 -15.449
   27   1HG2  ILE   4          1HG2      ILE   4  10.139  -5.182 -14.240
   28   2HG2  ILE   4          2HG2      ILE   4  10.423  -4.830 -15.945
   29   3HG2  ILE   4          3HG2      ILE   4   9.814  -6.413 -15.459
   30   1HD1  ILE   4          1HD1      ILE   4   6.811  -2.795 -13.266
   31   2HD1  ILE   4          2HD1      ILE   4   6.276  -4.173 -14.227
   32   3HD1  ILE   4          3HD1      ILE   4   6.300  -2.561 -14.938
   33    H    TYR   5           H        TYR   5   7.266  -2.355 -17.319
   34    HA   TYR   5           HA       TYR   5   4.540  -2.470 -16.512
   35   1HB   TYR   5          2HB       TYR   5   5.901  -0.465 -18.334
   36   2HB   TYR   5          1HB       TYR   5   4.349  -0.246 -17.528
   37    HD1  TYR   5           HD1      TYR   5   4.410  -0.709 -14.899
   38    HD2  TYR   5           HD2      TYR   5   7.801   0.391 -17.288
   39    HE1  TYR   5           HE1      TYR   5   5.574   0.109 -12.867
   40    HE2  TYR   5           HE2      TYR   5   8.969   1.205 -15.259
   41    HH   TYR   5           HH       TYR   5   7.770   2.091 -12.678
   42    H    LYS   6           H        LYS   6   6.203  -2.935 -19.563
   43    HA   LYS   6           HA       LYS   6   3.777  -2.962 -21.154
   44   1HB   LYS   6          2HB       LYS   6   6.453  -4.075 -22.005
   45   2HB   LYS   6          1HB       LYS   6   5.165  -3.429 -23.022
   46   1HG   LYS   6          2HG       LYS   6   7.030  -1.913 -21.190
   47   2HG   LYS   6          1HG       LYS   6   6.811  -1.707 -22.927
   48   1HD   LYS   6          2HD       LYS   6   4.603  -0.782 -22.612
   49   2HD   LYS   6          1HD       LYS   6   4.623  -1.188 -20.895
   50   1HE   LYS   6          2HE       LYS   6   5.989   0.577 -20.352
   51   2HE   LYS   6          1HE       LYS   6   6.857   0.514 -21.886
   52   1HZ   LYS   6          1HZ       LYS   6   5.427   2.489 -21.654
   53   2HZ   LYS   6          2HZ       LYS   6   4.065   1.477 -21.578
   54   3HZ   LYS   6          3HZ       LYS   6   5.010   1.530 -22.989
   55    H    ALA   7           H        ALA   7   5.944  -5.293 -19.669
   56    HA   ALA   7           HA       ALA   7   4.639  -7.606 -20.805
   57   1HB   ALA   7          1HB       ALA   7   6.258  -8.844 -19.750
   58   2HB   ALA   7          2HB       ALA   7   6.245  -7.827 -18.307
   59   3HB   ALA   7          3HB       ALA   7   7.075  -7.281 -19.764
   60    H    ALA   8           H        ALA   8   4.203  -5.606 -17.969
   61    HA   ALA   8           HA       ALA   8   2.541  -7.561 -16.599
   62   1HB   ALA   8          1HB       ALA   8   3.304  -4.709 -15.947
   63   2HB   ALA   8          2HB       ALA   8   3.907  -6.184 -15.188
   64   3HB   ALA   8          3HB       ALA   8   2.232  -5.691 -14.946
   65    H    VAL   9           H        VAL   9   2.131  -4.562 -18.460
   66    HA   VAL   9           HA       VAL   9  -0.585  -4.117 -17.878
   67    HB   VAL   9           HB       VAL   9   1.040  -2.564 -19.099
   68   1HG1  VAL   9          1HG1      VAL   9   0.083  -4.226 -21.448
   69   2HG1  VAL   9          2HG1      VAL   9   1.739  -4.132 -20.853
   70   3HG1  VAL   9          3HG1      VAL   9   0.979  -2.712 -21.567
   71   1HG2  VAL   9          1HG2      VAL   9  -0.777  -1.432 -20.226
   72   2HG2  VAL   9          2HG2      VAL   9  -1.434  -2.195 -18.778
   73   3HG2  VAL   9          3HG2      VAL   9  -1.691  -2.933 -20.359
   74    H    GLU  10           H        GLU  10   0.947  -6.411 -20.032
   75    HA   GLU  10           HA       GLU  10  -1.491  -7.052 -21.459
   76   1HB   GLU  10          2HB       GLU  10   1.293  -8.190 -21.417
   77   2HB   GLU  10          1HB       GLU  10  -0.022  -9.064 -22.202
   78   1HG   GLU  10          2HG       GLU  10   0.432  -6.151 -22.816
   79   2HG   GLU  10          1HG       GLU  10   1.396  -7.388 -23.622
   80    H    GLN  11           H        GLN  11  -0.115  -7.912 -18.438
   81    HA   GLN  11           HA       GLN  11  -1.428 -10.511 -18.292
   82   1HB   GLN  11          2HB       GLN  11   0.139  -8.996 -16.191
   83   2HB   GLN  11          1HB       GLN  11  -0.426 -10.661 -16.056
   84   1HG   GLN  11          2HG       GLN  11   1.212  -9.946 -18.452
   85   2HG   GLN  11          1HG       GLN  11   2.044 -10.091 -16.904
   86   1HE2  GLN  11          1HE2      GLN  11   0.108 -11.895 -19.289
   87   2HE2  GLN  11          2HE2      GLN  11   0.509 -13.433 -18.693
   88    H    LEU  12           H        LEU  12  -1.667  -7.314 -16.749
   89    HA   LEU  12           HA       LEU  12  -3.983  -8.102 -15.196
   90   1HB   LEU  12          2HB       LEU  12  -4.068  -5.621 -14.657
   91   2HB   LEU  12          1HB       LEU  12  -2.682  -6.517 -14.088
   92    HG   LEU  12           HG       LEU  12  -1.345  -5.584 -15.958
   93   1HD1  LEU  12          1HD1      LEU  12  -2.996  -5.183 -17.638
   94   2HD1  LEU  12          2HD1      LEU  12  -2.403  -3.595 -17.154
   95   3HD1  LEU  12          3HD1      LEU  12  -3.955  -4.178 -16.553
   96   1HD2  LEU  12          1HD2      LEU  12  -2.776  -3.770 -14.024
   97   2HD2  LEU  12          2HD2      LEU  12  -1.573  -3.120 -15.136
   98   3HD2  LEU  12          3HD2      LEU  12  -1.113  -4.355 -13.965
   99    H    THR  13           H        THR  13  -5.913  -6.484 -15.260
  100    HA   THR  13           HA       THR  13  -6.727  -6.133 -18.089
  101    HB   THR  13           HB       THR  13  -9.108  -6.376 -16.902
  102    HG1  THR  13           HG1      THR  13  -8.402  -6.752 -14.848
  103   1HG2  THR  13          1HG2      THR  13  -7.219  -8.517 -17.868
  104   2HG2  THR  13          2HG2      THR  13  -8.566  -7.770 -18.726
  105   3HG2  THR  13          3HG2      THR  13  -8.879  -8.892 -17.403
  106    H    ASP  14           H        ASP  14  -8.563  -4.569 -18.343
  107    HA   ASP  14           HA       ASP  14  -7.843  -2.024 -17.282
  108   1HB   ASP  14          2HB       ASP  14  -9.079  -2.596 -19.504
  109   2HB   ASP  14          1HB       ASP  14 -10.532  -2.591 -18.505
  110    H    GLU  15           H        GLU  15 -10.217  -4.464 -16.410
  111    HA   GLU  15           HA       GLU  15 -11.895  -2.964 -14.731
  112   1HB   GLU  15          2HB       GLU  15 -11.117  -5.864 -14.829
  113   2HB   GLU  15          1HB       GLU  15 -12.114  -5.260 -13.505
  114   1HG   GLU  15          2HG       GLU  15 -13.447  -4.135 -15.540
  115   2HG   GLU  15          1HG       GLU  15 -12.763  -5.510 -16.407
  116    H    GLN  16           H        GLN  16  -8.758  -4.498 -14.118
  117    HA   GLN  16           HA       GLN  16  -8.671  -4.224 -11.320
  118   1HB   GLN  16          2HB       GLN  16  -6.594  -4.426 -13.467
  119   2HB   GLN  16          1HB       GLN  16  -6.090  -3.963 -11.843
  120   1HG   GLN  16          2HG       GLN  16  -7.068  -5.976 -10.904
  121   2HG   GLN  16          1HG       GLN  16  -7.759  -6.415 -12.466
  122   1HE2  GLN  16          1HE2      GLN  16  -4.581  -5.829 -10.872
  123   2HE2  GLN  16          2HE2      GLN  16  -3.720  -6.896 -11.873
  124    H    LYS  17           H        LYS  17  -7.521  -2.014 -13.882
  125    HA   LYS  17           HA       LYS  17  -6.662   0.056 -12.141
  126   1HB   LYS  17          2HB       LYS  17  -7.268  -0.157 -15.051
  127   2HB   LYS  17          1HB       LYS  17  -7.241   1.458 -14.346
  128   1HG   LYS  17          2HG       LYS  17  -4.996   1.357 -14.658
  129   2HG   LYS  17          1HG       LYS  17  -4.994   0.313 -13.237
  130   1HD   LYS  17          2HD       LYS  17  -3.929  -1.108 -14.700
  131   2HD   LYS  17          1HD       LYS  17  -5.595  -1.535 -15.090
  132   1HE   LYS  17          2HE       LYS  17  -5.328   0.543 -16.760
  133   2HE   LYS  17          1HE       LYS  17  -3.631   0.072 -16.662
  134   1HZ   LYS  17          1HZ       LYS  17  -4.787  -1.067 -18.462
  135   2HZ   LYS  17          2HZ       LYS  17  -5.881  -1.742 -17.353
  136   3HZ   LYS  17          3HZ       LYS  17  -4.237  -2.167 -17.295
  137    H    ASN  18           H        ASN  18  -9.775  -0.726 -13.607
  138    HA   ASN  18           HA       ASN  18 -11.159   1.664 -13.042
  139   1HB   ASN  18          2HB       ASN  18 -11.873  -1.110 -13.742
  140   2HB   ASN  18          1HB       ASN  18 -13.093  -0.265 -12.787
  141   1HD2  ASN  18          1HD2      ASN  18 -11.241  -0.107 -15.835
  142   2HD2  ASN  18          2HD2      ASN  18 -12.290   0.986 -16.601
  143    H    GLU  19           H        GLU  19 -10.702  -1.304 -11.139
  144    HA   GLU  19           HA       GLU  19 -12.240  -0.420  -8.885
  145   1HB   GLU  19          2HB       GLU  19 -10.066  -2.532  -8.979
  146   2HB   GLU  19          1HB       GLU  19 -11.271  -2.327  -7.709
  147   1HG   GLU  19          2HG       GLU  19 -12.023  -2.817 -10.596
  148   2HG   GLU  19          1HG       GLU  19 -11.783  -4.128  -9.444
  149    H    PHE  20           H        PHE  20  -8.816  -0.388  -9.768
  150    HA   PHE  20           HA       PHE  20  -7.691   0.477  -7.357
  151   1HB   PHE  20          2HB       PHE  20  -6.908   0.726 -10.235
  152   2HB   PHE  20          1HB       PHE  20  -6.021   1.657  -9.033
  153    HD1  PHE  20           HD1      PHE  20  -3.936   0.476  -9.213
  154    HD2  PHE  20           HD2      PHE  20  -7.564  -1.652  -8.356
  155    HE1  PHE  20           HE1      PHE  20  -2.617  -1.533  -8.635
  156    HE2  PHE  20           HE2      PHE  20  -6.243  -3.665  -7.780
  157    HZ   PHE  20           HZ       PHE  20  -3.769  -3.607  -7.915
  158    H    LYS  21           H        LYS  21  -9.224   2.328  -9.971
  159    HA   LYS  21           HA       LYS  21  -8.530   4.911  -9.053
  160   1HB   LYS  21          2HB       LYS  21  -9.456   4.437 -11.320
  161   2HB   LYS  21          1HB       LYS  21 -11.025   4.120 -10.580
  162   1HG   LYS  21          2HG       LYS  21 -10.869   6.444 -11.436
  163   2HG   LYS  21          1HG       LYS  21 -11.091   6.408  -9.687
  164   1HD   LYS  21          2HD       LYS  21  -8.773   6.873  -9.290
  165   2HD   LYS  21          1HD       LYS  21  -8.361   6.597 -10.984
  166   1HE   LYS  21          2HE       LYS  21  -9.522   8.580 -11.679
  167   2HE   LYS  21          1HE       LYS  21 -10.261   8.778 -10.091
  168   1HZ   LYS  21          1HZ       LYS  21  -8.404  10.274 -10.344
  169   2HZ   LYS  21          2HZ       LYS  21  -7.363   8.983 -10.712
  170   3HZ   LYS  21          3HZ       LYS  21  -8.042   9.116  -9.160
  171    H    ALA  22           H        ALA  22 -11.543   3.027  -8.587
  172    HA   ALA  22           HA       ALA  22 -12.763   4.881  -6.818
  173   1HB   ALA  22          1HB       ALA  22 -14.042   3.105  -7.955
  174   2HB   ALA  22          2HB       ALA  22 -14.263   3.037  -6.207
  175   3HB   ALA  22          3HB       ALA  22 -13.191   1.887  -7.005
  176    H    ALA  23           H        ALA  23 -10.691   2.055  -6.296
  177    HA   ALA  23           HA       ALA  23 -10.824   1.944  -3.479
  178   1HB   ALA  23          1HB       ALA  23  -8.475   0.877  -3.769
  179   2HB   ALA  23          2HB       ALA  23  -8.790   1.026  -5.499
  180   3HB   ALA  23          3HB       ALA  23  -9.862   0.058  -4.487
  181    H    PHE  24           H        PHE  24  -9.056   4.026  -5.661
  182    HA   PHE  24           HA       PHE  24  -7.258   5.026  -3.611
  183   1HB   PHE  24          2HB       PHE  24  -6.880   4.865  -6.218
  184   2HB   PHE  24          1HB       PHE  24  -7.718   6.413  -6.234
  185    HD1  PHE  24           HD1      PHE  24  -4.727   4.602  -5.005
  186    HD2  PHE  24           HD2      PHE  24  -6.696   8.410  -5.323
  187    HE1  PHE  24           HE1      PHE  24  -2.632   5.744  -4.328
  188    HE2  PHE  24           HE2      PHE  24  -4.605   9.551  -4.638
  189    HZ   PHE  24           HZ       PHE  24  -2.570   8.216  -4.146
  190    H    ASP  25           H        ASP  25  -9.875   6.404  -5.617
  191    HA   ASP  25           HA       ASP  25 -10.103   8.907  -4.493
  192   1HB   ASP  25          2HB       ASP  25 -12.086   7.074  -5.783
  193   2HB   ASP  25          1HB       ASP  25 -12.645   8.580  -5.057
  194    H    ILE  26           H        ILE  26 -11.640   5.899  -3.302
  195    HA   ILE  26           HA       ILE  26 -13.243   7.065  -1.312
  196    HB   ILE  26           HB       ILE  26 -13.153   4.857  -0.171
  197   1HG1  ILE  26          2HG1      ILE  26 -11.162   4.202  -2.368
  198   2HG1  ILE  26          1HG1      ILE  26 -10.786   4.336  -0.653
  199   1HG2  ILE  26          1HG2      ILE  26 -13.808   5.297  -3.027
  200   2HG2  ILE  26          2HG2      ILE  26 -14.827   4.709  -1.714
  201   3HG2  ILE  26          3HG2      ILE  26 -13.714   3.609  -2.525
  202   1HD1  ILE  26          1HD1      ILE  26 -12.580   2.531  -0.290
  203   2HD1  ILE  26          2HD1      ILE  26 -11.065   2.011  -1.028
  204   3HD1  ILE  26          3HD1      ILE  26 -12.494   2.265  -2.030
  205    H    PHE  27           H        PHE  27  -9.822   6.189  -1.267
  206    HA   PHE  27           HA       PHE  27  -9.525   6.826   1.553
  207   1HB   PHE  27          2HB       PHE  27  -7.724   5.840  -0.614
  208   2HB   PHE  27          1HB       PHE  27  -6.994   6.654   0.769
  209    HD1  PHE  27           HD1      PHE  27  -6.997   5.660   2.967
  210    HD2  PHE  27           HD2      PHE  27  -9.074   3.778  -0.287
  211    HE1  PHE  27           HE1      PHE  27  -7.263   3.602   4.324
  212    HE2  PHE  27           HE2      PHE  27  -9.339   1.721   1.070
  213    HZ   PHE  27           HZ       PHE  27  -8.433   1.633   3.375
  214    H    ILE  28           H        ILE  28  -9.112   8.441  -1.536
  215    HA   ILE  28           HA       ILE  28  -7.678  10.683  -0.317
  216    HB   ILE  28           HB       ILE  28  -8.624  10.506  -3.179
  217   1HG1  ILE  28          2HG1      ILE  28  -7.334   8.552  -3.061
  218   2HG1  ILE  28          1HG1      ILE  28  -6.154   9.762  -3.535
  219   1HG2  ILE  28          1HG2      ILE  28  -6.742  12.200  -1.609
  220   2HG2  ILE  28          2HG2      ILE  28  -7.794  12.637  -2.956
  221   3HG2  ILE  28          3HG2      ILE  28  -6.275  11.790  -3.262
  222   1HD1  ILE  28          1HD1      ILE  28  -6.531   8.452  -0.856
  223   2HD1  ILE  28          2HD1      ILE  28  -5.773  10.041  -0.962
  224   3HD1  ILE  28          3HD1      ILE  28  -5.051   8.661  -1.791
  225    H    GLN  29           H        GLN  29 -10.393  10.170   0.576
  226    HA   GLN  29           HA       GLN  29 -12.154  12.065  -0.678
  227   1HB   GLN  29          2HB       GLN  29 -13.578  11.717   1.364
  228   2HB   GLN  29          1HB       GLN  29 -13.188  10.238   0.493
  229   1HG   GLN  29          2HG       GLN  29 -11.550   9.600   2.111
  230   2HG   GLN  29          1HG       GLN  29 -11.556  11.199   2.854
  231   1HE2  GLN  29          1HE2      GLN  29 -13.942  11.852   3.639
  232   2HE2  GLN  29          2HE2      GLN  29 -14.783  10.624   4.457
  233    H    ASP  30           H        ASP  30  -9.853  12.121   1.971
  234    HA   ASP  30           HA       ASP  30  -9.977  15.035   2.016
  235   1HB   ASP  30          2HB       ASP  30  -9.963  14.941   4.595
  236   2HB   ASP  30          1HB       ASP  30 -11.507  14.741   3.773
  237    H    ALA  31           H        ALA  31  -8.039  13.257   1.011
  238    HA   ALA  31           HA       ALA  31  -5.919  12.759   2.844
  239   1HB   ALA  31          1HB       ALA  31  -4.559  12.337   0.868
  240   2HB   ALA  31          2HB       ALA  31  -5.768  13.109  -0.159
  241   3HB   ALA  31          3HB       ALA  31  -6.146  11.596   0.664
  242    H    GLU  32           H        GLU  32  -3.850  13.786   2.919
  243    HA   GLU  32           HA       GLU  32  -4.029  16.665   3.020
  244   1HB   GLU  32          2HB       GLU  32  -1.881  14.664   3.680
  245   2HB   GLU  32          1HB       GLU  32  -1.516  16.388   3.617
  246   1HG   GLU  32          2HG       GLU  32  -3.500  16.733   5.187
  247   2HG   GLU  32          1HG       GLU  32  -3.505  14.983   5.411
  248    H    ASP  33           H        ASP  33  -2.115  14.323   1.133
  249    HA   ASP  33           HA       ASP  33  -1.484  16.497  -0.780
  250   1HB   ASP  33          2HB       ASP  33   0.322  14.967   0.547
  251   2HB   ASP  33          1HB       ASP  33   0.088  13.994  -0.905
  252    H    GLY  34           H        GLY  34  -3.899  14.657  -0.641
  253   1HA   GLY  34          2HA       GLY  34  -5.273  13.590  -2.146
  254   2HA   GLY  34          1HA       GLY  34  -4.213  14.197  -3.413
  255    H    CYS  35           H        CYS  35  -3.233  12.086  -0.746
  256    HA   CYS  35           HA       CYS  35  -3.027   9.788  -2.576
  257   1HB   CYS  35          2HB       CYS  35  -0.737  10.741  -0.844
  258   2HB   CYS  35          1HB       CYS  35  -0.732   9.347  -1.917
  259    HG   CYS  35           HG       CYS  35  -0.980  11.025  -3.953
  260    H    ILE  36           H        ILE  36  -2.105   7.843  -1.206
  261    HA   ILE  36           HA       ILE  36  -3.700   7.764   1.282
  262    HB   ILE  36           HB       ILE  36  -3.657   5.307   1.027
  263   1HG1  ILE  36          2HG1      ILE  36  -2.899   4.972  -1.658
  264   2HG1  ILE  36          1HG1      ILE  36  -1.631   5.972  -0.948
  265   1HG2  ILE  36          1HG2      ILE  36  -4.538   6.438  -1.619
  266   2HG2  ILE  36          2HG2      ILE  36  -5.351   6.923  -0.131
  267   3HG2  ILE  36          3HG2      ILE  36  -5.328   5.226  -0.610
  268   1HD1  ILE  36          1HD1      ILE  36  -2.265   3.982   0.968
  269   2HD1  ILE  36          2HD1      ILE  36  -0.778   4.145   0.035
  270   3HD1  ILE  36          3HD1      ILE  36  -2.103   3.162  -0.587
  271    H    SER  37           H        SER  37  -2.741   6.034   2.874
  272    HA   SER  37           HA       SER  37   0.005   6.891   3.426
  273   1HB   SER  37          2HB       SER  37  -1.876   6.960   5.166
  274   2HB   SER  37          1HB       SER  37  -1.736   5.206   5.222
  275    HG   SER  37           HG       SER  37   0.045   7.192   6.047
  276    H    THR  38           H        THR  38   1.674   5.452   3.882
  277    HA   THR  38           HA       THR  38   1.871   3.162   2.243
  278    HB   THR  38           HB       THR  38   3.938   2.649   3.537
  279    HG1  THR  38           HG1      THR  38   3.804   3.284   5.535
  280   1HG2  THR  38          1HG2      THR  38   4.516   5.422   3.309
  281   2HG2  THR  38          2HG2      THR  38   3.343   5.032   2.050
  282   3HG2  THR  38          3HG2      THR  38   4.865   4.147   2.143
  283    H    LYS  39           H        LYS  39   1.100   3.545   5.685
  284    HA   LYS  39           HA       LYS  39   1.002   0.739   6.265
  285   1HB   LYS  39          2HB       LYS  39  -0.190   3.104   7.736
  286   2HB   LYS  39          1HB       LYS  39  -0.138   1.454   8.359
  287   1HG   LYS  39          2HG       LYS  39   2.026   1.660   8.971
  288   2HG   LYS  39          1HG       LYS  39   2.476   2.320   7.398
  289   1HD   LYS  39          2HD       LYS  39   1.759   4.543   8.064
  290   2HD   LYS  39          1HD       LYS  39   1.127   3.923   9.590
  291   1HE   LYS  39          2HE       LYS  39   3.282   3.477  10.442
  292   2HE   LYS  39          1HE       LYS  39   4.023   3.537   8.843
  293   1HZ   LYS  39          1HZ       LYS  39   4.465   5.538  10.160
  294   2HZ   LYS  39          2HZ       LYS  39   2.798   5.855  10.240
  295   3HZ   LYS  39          3HZ       LYS  39   3.602   5.893   8.744
  296    H    GLU  40           H        GLU  40  -1.260   3.023   4.903
  297    HA   GLU  40           HA       GLU  40  -3.619   1.446   5.447
  298   1HB   GLU  40          2HB       GLU  40  -3.096   3.867   3.727
  299   2HB   GLU  40          1HB       GLU  40  -4.663   3.059   3.773
  300   1HG   GLU  40          2HG       GLU  40  -4.667   3.349   6.270
  301   2HG   GLU  40          1HG       GLU  40  -3.198   4.311   6.113
  302    H    LEU  41           H        LEU  41  -1.087   0.981   3.301
  303    HA   LEU  41           HA       LEU  41  -2.355   0.321   0.880
  304   1HB   LEU  41          2HB       LEU  41   0.230   0.282   1.805
  305   2HB   LEU  41          1HB       LEU  41  -0.118  -1.422   1.608
  306    HG   LEU  41           HG       LEU  41   0.921  -0.588  -0.404
  307   1HD1  LEU  41          1HD1      LEU  41  -2.060  -1.043  -0.708
  308   2HD1  LEU  41          2HD1      LEU  41  -0.783  -2.255  -0.799
  309   3HD1  LEU  41          3HD1      LEU  41  -0.928  -1.033  -2.062
  310   1HD2  LEU  41          1HD2      LEU  41  -1.030   1.624  -0.002
  311   2HD2  LEU  41          2HD2      LEU  41  -0.707   1.158  -1.672
  312   3HD2  LEU  41          3HD2      LEU  41   0.616   1.678  -0.630
  313    H    GLY  42           H        GLY  42  -1.666  -1.676   3.752
  314   1HA   GLY  42          2HA       GLY  42  -2.550  -4.151   2.765
  315   2HA   GLY  42          1HA       GLY  42  -2.550  -3.683   4.462
  316    H    LYS  43           H        LYS  43  -4.370  -1.332   3.693
  317    HA   LYS  43           HA       LYS  43  -6.864  -2.724   4.140
  318   1HB   LYS  43          2HB       LYS  43  -5.974  -0.351   5.000
  319   2HB   LYS  43          1HB       LYS  43  -6.808   0.191   3.545
  320   1HG   LYS  43          2HG       LYS  43  -8.643   0.195   4.877
  321   2HG   LYS  43          1HG       LYS  43  -8.646  -1.540   4.575
  322   1HD   LYS  43          2HD       LYS  43  -8.783  -1.299   6.950
  323   2HD   LYS  43          1HD       LYS  43  -7.113  -1.756   6.611
  324   1HE   LYS  43          2HE       LYS  43  -6.795   0.045   8.054
  325   2HE   LYS  43          1HE       LYS  43  -6.736   0.852   6.489
  326   1HZ   LYS  43          1HZ       LYS  43  -9.117   1.337   6.725
  327   2HZ   LYS  43          2HZ       LYS  43  -8.193   2.039   7.966
  328   3HZ   LYS  43          3HZ       LYS  43  -9.104   0.637   8.270
  329    H    VAL  44           H        VAL  44  -5.511  -0.628   1.590
  330    HA   VAL  44           HA       VAL  44  -7.784  -0.750  -0.108
  331    HB   VAL  44           HB       VAL  44  -6.198   0.025  -1.906
  332   1HG1  VAL  44          1HG1      VAL  44  -5.691   2.204  -0.713
  333   2HG1  VAL  44          2HG1      VAL  44  -6.300   1.450   0.760
  334   3HG1  VAL  44          3HG1      VAL  44  -7.372   1.675  -0.622
  335   1HG2  VAL  44          1HG2      VAL  44  -4.206  -0.069   0.384
  336   2HG2  VAL  44          2HG2      VAL  44  -3.921   0.674  -1.189
  337   3HG2  VAL  44          3HG2      VAL  44  -4.153  -1.070  -1.068
  338    H    MET  45           H        MET  45  -4.846  -2.733   0.107
  339    HA   MET  45           HA       MET  45  -5.290  -4.247  -2.249
  340   1HB   MET  45          2HB       MET  45  -3.895  -5.239   0.245
  341   2HB   MET  45          1HB       MET  45  -3.679  -5.818  -1.406
  342   1HG   MET  45          2HG       MET  45  -3.198  -2.919  -0.960
  343   2HG   MET  45          1HG       MET  45  -2.016  -4.026  -0.265
  344   1HE   MET  45          1HE       MET  45  -4.100  -4.500  -3.825
  345   2HE   MET  45          2HE       MET  45  -3.169  -3.183  -4.538
  346   3HE   MET  45          3HE       MET  45  -4.059  -2.915  -3.038
  347    H    ARG  46           H        ARG  46  -6.364  -4.619   1.087
  348    HA   ARG  46           HA       ARG  46  -7.520  -7.207   0.781
  349   1HB   ARG  46          2HB       ARG  46  -7.800  -5.001   2.793
  350   2HB   ARG  46          1HB       ARG  46  -8.951  -6.337   2.809
  351   1HG   ARG  46          2HG       ARG  46  -5.967  -6.812   2.753
  352   2HG   ARG  46          1HG       ARG  46  -6.848  -6.607   4.267
  353   1HD   ARG  46          2HD       ARG  46  -7.947  -8.545   2.280
  354   2HD   ARG  46          1HD       ARG  46  -6.499  -9.017   3.158
  355    HE   ARG  46           HE       ARG  46  -9.172  -8.721   4.248
  356   1HH1  ARG  46          2HH1      ARG  46  -5.746  -8.813   4.933
  357   2HH1  ARG  46          1HH1      ARG  46  -5.963  -9.278   6.585
  358   1HH2  ARG  46          1HH2      ARG  46  -9.427  -9.332   6.418
  359   2HH2  ARG  46          2HH2      ARG  46  -8.038  -9.570   7.423
  360    H    MET  47           H        MET  47  -8.712  -3.923   0.289
  361    HA   MET  47           HA       MET  47 -11.456  -4.642  -0.096
  362   1HB   MET  47          2HB       MET  47 -10.093  -2.263   0.217
  363   2HB   MET  47          1HB       MET  47 -10.549  -2.223  -1.487
  364   1HG   MET  47          2HG       MET  47 -12.863  -3.131  -0.374
  365   2HG   MET  47          1HG       MET  47 -12.256  -2.108   0.928
  366   1HE   MET  47          1HE       MET  47 -14.905  -1.819  -0.769
  367   2HE   MET  47          2HE       MET  47 -14.168  -2.287  -2.300
  368   3HE   MET  47          3HE       MET  47 -14.872  -0.683  -2.124
  369    H    LEU  48           H        LEU  48  -8.650  -4.265  -2.213
  370    HA   LEU  48           HA       LEU  48 -10.102  -4.469  -4.675
  371   1HB   LEU  48          2HB       LEU  48  -7.357  -4.149  -3.845
  372   2HB   LEU  48          1HB       LEU  48  -7.469  -5.374  -5.087
  373    HG   LEU  48           HG       LEU  48  -7.005  -3.222  -6.091
  374   1HD1  LEU  48          1HD1      LEU  48  -8.651  -3.268  -7.775
  375   2HD1  LEU  48          2HD1      LEU  48  -9.927  -3.716  -6.642
  376   3HD1  LEU  48          3HD1      LEU  48  -8.707  -4.899  -7.110
  377   1HD2  LEU  48          1HD2      LEU  48  -7.792  -1.597  -4.598
  378   2HD2  LEU  48          2HD2      LEU  48  -9.369  -2.370  -4.435
  379   3HD2  LEU  48          3HD2      LEU  48  -8.965  -1.495  -5.912
  380    H    GLY  49           H        GLY  49  -7.809  -6.754  -3.149
  381   1HA   GLY  49          2HA       GLY  49  -9.245  -9.045  -3.004
  382   2HA   GLY  49          1HA       GLY  49  -8.841  -8.969  -4.717
  383    H    GLN  50           H        GLN  50  -7.133  -8.322  -1.646
  384    HA   GLN  50           HA       GLN  50  -5.147 -10.373  -2.251
  385   1HB   GLN  50          2HB       GLN  50  -4.611  -7.457  -2.477
  386   2HB   GLN  50          1HB       GLN  50  -3.400  -8.419  -1.628
  387   1HG   GLN  50          2HG       GLN  50  -3.526 -10.034  -3.627
  388   2HG   GLN  50          1HG       GLN  50  -4.380  -8.740  -4.467
  389   1HE2  GLN  50          1HE2      GLN  50  -1.453  -9.973  -4.578
  390   2HE2  GLN  50          2HE2      GLN  50  -0.485  -8.582  -4.655
  391    H    ASN  51           H        ASN  51  -3.823 -10.910  -0.437
  392    HA   ASN  51           HA       ASN  51  -4.583  -9.657   2.122
  393   1HB   ASN  51          2HB       ASN  51  -5.885 -11.851   1.541
  394   2HB   ASN  51          1HB       ASN  51  -4.370 -12.648   1.960
  395   1HD2  ASN  51          1HD2      ASN  51  -7.068 -12.519   3.433
  396   2HD2  ASN  51          2HD2      ASN  51  -6.661 -11.996   4.995
  397    HA   PRO  52           HA       PRO  52  -0.025 -10.533   1.861
  398   1HB   PRO  52          2HB       PRO  52   0.823  -7.935   1.881
  399   2HB   PRO  52          1HB       PRO  52   0.431  -8.820   0.402
  400   1HG   PRO  52          2HG       PRO  52  -1.070  -6.676   1.761
  401   2HG   PRO  52          1HG       PRO  52  -1.104  -7.169   0.063
  402   1HD   PRO  52          2HD       PRO  52  -3.032  -7.808   2.071
  403   2HD   PRO  52          1HD       PRO  52  -2.962  -8.448   0.413
  404    H    THR  53           H        THR  53   1.722  -9.091   3.293
  405    HA   THR  53           HA       THR  53   0.587  -9.000   6.026
  406    HB   THR  53           HB       THR  53   2.639  -9.761   6.879
  407    HG1  THR  53           HG1      THR  53   4.534  -9.760   5.502
  408   1HG2  THR  53          1HG2      THR  53   3.323 -11.686   5.469
  409   2HG2  THR  53          2HG2      THR  53   2.356 -11.030   4.148
  410   3HG2  THR  53          3HG2      THR  53   1.571 -11.563   5.636
  411    HA   PRO  54           HA       PRO  54   1.751  -4.766   6.367
  412   1HB   PRO  54          2HB       PRO  54   2.993  -4.603   8.807
  413   2HB   PRO  54          1HB       PRO  54   1.244  -4.780   8.594
  414   1HG   PRO  54          2HG       PRO  54   3.269  -6.815   9.385
  415   2HG   PRO  54          1HG       PRO  54   1.569  -6.669   9.862
  416   1HD   PRO  54          2HD       PRO  54   2.533  -8.462   7.960
  417   2HD   PRO  54          1HD       PRO  54   0.841  -7.926   8.077
  418    H    GLU  55           H        GLU  55   4.361  -7.060   6.925
  419    HA   GLU  55           HA       GLU  55   6.447  -5.081   6.470
  420   1HB   GLU  55          2HB       GLU  55   7.994  -7.014   6.605
  421   2HB   GLU  55          1HB       GLU  55   6.944  -6.896   8.014
  422   1HG   GLU  55          2HG       GLU  55   5.526  -8.667   7.200
  423   2HG   GLU  55          1HG       GLU  55   6.339  -8.672   5.635
  424    H    GLU  56           H        GLU  56   4.706  -7.550   4.678
  425    HA   GLU  56           HA       GLU  56   6.440  -7.614   2.409
  426   1HB   GLU  56          2HB       GLU  56   3.624  -8.529   2.925
  427   2HB   GLU  56          1HB       GLU  56   4.282  -8.545   1.289
  428   1HG   GLU  56          2HG       GLU  56   5.775  -9.793   3.600
  429   2HG   GLU  56          1HG       GLU  56   4.566 -10.695   2.687
  430    H    LEU  57           H        LEU  57   3.205  -6.105   2.884
  431    HA   LEU  57           HA       LEU  57   3.145  -4.745   0.433
  432   1HB   LEU  57          2HB       LEU  57   1.490  -3.259   1.463
  433   2HB   LEU  57          1HB       LEU  57   1.150  -4.947   1.755
  434    HG   LEU  57           HG       LEU  57   2.499  -4.364   4.026
  435   1HD1  LEU  57          1HD1      LEU  57   1.657  -2.127   4.791
  436   2HD1  LEU  57          2HD1      LEU  57   1.131  -1.806   3.139
  437   3HD1  LEU  57          3HD1      LEU  57   2.845  -2.017   3.493
  438   1HD2  LEU  57          1HD2      LEU  57   0.106  -5.266   3.552
  439   2HD2  LEU  57          2HD2      LEU  57  -0.404  -3.591   3.753
  440   3HD2  LEU  57          3HD2      LEU  57   0.387  -4.435   5.082
  441    H    GLN  58           H        GLN  58   4.624  -3.854   3.509
  442    HA   GLN  58           HA       GLN  58   5.151  -1.149   3.042
  443   1HB   GLN  58          2HB       GLN  58   5.976  -3.120   4.940
  444   2HB   GLN  58          1HB       GLN  58   7.406  -2.255   4.381
  445   1HG   GLN  58          2HG       GLN  58   4.868  -0.893   5.329
  446   2HG   GLN  58          1HG       GLN  58   6.280  -1.167   6.348
  447   1HE2  GLN  58          1HE2      GLN  58   4.994   0.799   3.731
  448   2HE2  GLN  58          2HE2      GLN  58   6.329   1.838   3.605
  449    H    GLU  59           H        GLU  59   7.065  -4.015   2.159
  450    HA   GLU  59           HA       GLU  59   9.271  -2.638   1.044
  451   1HB   GLU  59          2HB       GLU  59   8.153  -5.398   0.514
  452   2HB   GLU  59          1HB       GLU  59   9.640  -4.802  -0.223
  453   1HG   GLU  59          2HG       GLU  59  10.440  -4.272   2.148
  454   2HG   GLU  59          1HG       GLU  59   9.072  -5.229   2.716
  455    H    MET  60           H        MET  60   6.223  -3.784  -0.381
  456    HA   MET  60           HA       MET  60   6.849  -3.169  -3.080
  457   1HB   MET  60          2HB       MET  60   4.358  -3.746  -1.551
  458   2HB   MET  60          1HB       MET  60   4.182  -2.943  -3.111
  459   1HG   MET  60          2HG       MET  60   4.192  -5.124  -3.850
  460   2HG   MET  60          1HG       MET  60   5.932  -4.843  -3.840
  461   1HE   MET  60          1HE       MET  60   5.747  -7.163  -4.151
  462   2HE   MET  60          2HE       MET  60   4.758  -8.252  -3.183
  463   3HE   MET  60          3HE       MET  60   6.480  -8.101  -2.843
  464    H    ILE  61           H        ILE  61   5.190  -1.319  -0.526
  465    HA   ILE  61           HA       ILE  61   4.436   0.926  -2.001
  466    HB   ILE  61           HB       ILE  61   5.290   0.669   0.887
  467   1HG1  ILE  61          2HG1      ILE  61   2.497   1.206   0.049
  468   2HG1  ILE  61          1HG1      ILE  61   3.126  -0.392  -0.341
  469   1HG2  ILE  61          1HG2      ILE  61   5.559   2.961   0.462
  470   2HG2  ILE  61          2HG2      ILE  61   3.898   2.851   1.049
  471   3HG2  ILE  61          3HG2      ILE  61   4.213   3.006  -0.679
  472   1HD1  ILE  61          1HD1      ILE  61   2.073  -0.399   1.881
  473   2HD1  ILE  61          2HD1      ILE  61   3.155   0.893   2.404
  474   3HD1  ILE  61          3HD1      ILE  61   3.805  -0.697   2.008
  475    H    ASP  62           H        ASP  62   7.232   0.883   0.221
  476    HA   ASP  62           HA       ASP  62   8.486   3.179  -0.650
  477   1HB   ASP  62          2HB       ASP  62   9.635   0.629   0.479
  478   2HB   ASP  62          1HB       ASP  62  10.637   2.036   0.126
  479    H    GLU  63           H        GLU  63   8.637  -0.051  -2.093
  480    HA   GLU  63           HA       GLU  63  10.789   0.421  -3.875
  481   1HB   GLU  63          2HB       GLU  63   8.584  -1.574  -3.696
  482   2HB   GLU  63          1HB       GLU  63   9.385  -1.394  -5.257
  483   1HG   GLU  63          2HG       GLU  63  11.137  -1.559  -2.848
  484   2HG   GLU  63          1HG       GLU  63  10.328  -3.041  -3.357
  485    H    VAL  64           H        VAL  64   7.253   0.653  -4.371
  486    HA   VAL  64           HA       VAL  64   7.541   1.704  -7.042
  487    HB   VAL  64           HB       VAL  64   5.130   1.996  -7.009
  488   1HG1  VAL  64          1HG1      VAL  64   6.457  -0.397  -6.801
  489   2HG1  VAL  64          2HG1      VAL  64   4.742  -0.232  -7.173
  490   3HG1  VAL  64          3HG1      VAL  64   5.258  -0.540  -5.516
  491   1HG2  VAL  64          1HG2      VAL  64   5.201   1.164  -4.097
  492   2HG2  VAL  64          2HG2      VAL  64   3.801   1.697  -5.026
  493   3HG2  VAL  64          3HG2      VAL  64   5.076   2.844  -4.617
  494    H    ASP  65           H        ASP  65   7.503   3.082  -3.862
  495    HA   ASP  65           HA       ASP  65   6.549   5.672  -4.513
  496   1HB   ASP  65          2HB       ASP  65   7.209   4.400  -2.177
  497   2HB   ASP  65          1HB       ASP  65   8.558   5.516  -2.363
  498    H    GLU  66           H        GLU  66   7.525   6.332  -6.401
  499    HA   GLU  66           HA       GLU  66  10.278   6.283  -6.971
  500   1HB   GLU  66          2HB       GLU  66   8.057   8.048  -7.994
  501   2HB   GLU  66          1HB       GLU  66   9.707   8.131  -8.614
  502   1HG   GLU  66          2HG       GLU  66   9.592   5.683  -9.121
  503   2HG   GLU  66          1HG       GLU  66   7.902   5.693  -8.617
  504    H    ASP  67           H        ASP  67   8.294   8.860  -5.514
  505    HA   ASP  67           HA       ASP  67  10.595  10.603  -5.233
  506   1HB   ASP  67          2HB       ASP  67   8.952  12.049  -3.924
  507   2HB   ASP  67          1HB       ASP  67   8.571  11.768  -5.621
  508    H    GLY  68           H        GLY  68   8.688   8.484  -3.132
  509   1HA   GLY  68          2HA       GLY  68   9.211   7.559  -1.078
  510   2HA   GLY  68          1HA       GLY  68  10.826   8.246  -1.237
  511    H    SER  69           H        SER  69   7.528   9.586  -1.011
  512    HA   SER  69           HA       SER  69   8.497  11.669   0.792
  513   1HB   SER  69          2HB       SER  69   6.185  12.597   0.503
  514   2HB   SER  69          1HB       SER  69   7.083  12.427  -1.002
  515    HG   SER  69           HG       SER  69   4.733  11.447  -0.469
  516    H    GLY  70           H        GLY  70   5.881   9.244   0.730
  517   1HA   GLY  70          2HA       GLY  70   6.022   8.046   3.112
  518   2HA   GLY  70          1HA       GLY  70   5.357   9.611   3.576
  519    H    THR  71           H        THR  71   3.941   9.888   0.985
  520    HA   THR  71           HA       THR  71   1.672   8.097   1.574
  521    HB   THR  71           HB       THR  71   0.274   9.751   0.438
  522    HG1  THR  71           HG1      THR  71   1.518  10.670  -1.068
  523   1HG2  THR  71          1HG2      THR  71   0.687  10.086   2.823
  524   2HG2  THR  71          2HG2      THR  71   0.605  11.649   2.009
  525   3HG2  THR  71          3HG2      THR  71   2.169  10.972   2.462
  526    H    VAL  72           H        VAL  72   0.587   7.058  -0.142
  527    HA   VAL  72           HA       VAL  72   2.329   6.528  -2.451
  528    HB   VAL  72           HB       VAL  72  -0.194   5.073  -1.634
  529   1HG1  VAL  72          1HG1      VAL  72   0.524   3.384  -3.173
  530   2HG1  VAL  72          2HG1      VAL  72   2.097   4.152  -3.384
  531   3HG1  VAL  72          3HG1      VAL  72   0.647   4.918  -4.033
  532   1HG2  VAL  72          1HG2      VAL  72   1.324   4.744   0.167
  533   2HG2  VAL  72          2HG2      VAL  72   2.713   4.654  -0.918
  534   3HG2  VAL  72          3HG2      VAL  72   1.547   3.333  -0.866
  535    H    ASP  73           H        ASP  73   1.968   7.499  -4.311
  536    HA   ASP  73           HA       ASP  73  -0.504   8.968  -4.786
  537   1HB   ASP  73          2HB       ASP  73   1.835   8.586  -6.677
  538   2HB   ASP  73          1HB       ASP  73   0.585   9.821  -6.767
  539    H    PHE  74           H        PHE  74  -1.472   8.735  -7.081
  540    HA   PHE  74           HA       PHE  74  -2.458   6.087  -7.369
  541   1HB   PHE  74          2HB       PHE  74  -3.564   8.280  -8.164
  542   2HB   PHE  74          1HB       PHE  74  -2.540   8.121  -9.593
  543    HD1  PHE  74           HD1      PHE  74  -3.818   7.314 -11.381
  544    HD2  PHE  74           HD2      PHE  74  -4.353   5.607  -7.476
  545    HE1  PHE  74           HE1      PHE  74  -5.393   5.646 -12.322
  546    HE2  PHE  74           HE2      PHE  74  -5.932   3.945  -8.416
  547    HZ   PHE  74           HZ       PHE  74  -6.454   3.964 -10.840
  548    H    ASP  75           H        ASP  75   0.175   7.854  -8.925
  549    HA   ASP  75           HA       ASP  75   0.672   5.994 -11.019
  550   1HB   ASP  75          2HB       ASP  75   2.122   8.267  -9.790
  551   2HB   ASP  75          1HB       ASP  75   3.134   7.044 -10.558
  552    H    GLU  76           H        GLU  76   1.725   6.245  -7.663
  553    HA   GLU  76           HA       GLU  76   3.552   4.000  -7.840
  554   1HB   GLU  76          2HB       GLU  76   2.502   5.147  -5.259
  555   2HB   GLU  76          1HB       GLU  76   4.074   4.416  -5.587
  556   1HG   GLU  76          2HG       GLU  76   4.588   6.348  -7.110
  557   2HG   GLU  76          1HG       GLU  76   3.076   7.095  -6.604
  558    H    PHE  77           H        PHE  77   0.193   4.542  -7.078
  559    HA   PHE  77           HA       PHE  77  -0.284   2.079  -5.678
  560   1HB   PHE  77          2HB       PHE  77  -1.725   4.113  -5.473
  561   2HB   PHE  77          1HB       PHE  77  -2.252   3.869  -7.135
  562    HD1  PHE  77           HD1      PHE  77  -1.950   1.964  -3.904
  563    HD2  PHE  77           HD2      PHE  77  -4.180   2.638  -7.514
  564    HE1  PHE  77           HE1      PHE  77  -3.687   0.374  -3.129
  565    HE2  PHE  77           HE2      PHE  77  -5.919   1.044  -6.738
  566    HZ   PHE  77           HZ       PHE  77  -5.670  -0.085  -4.545
  567    H    LEU  78           H        LEU  78  -0.651   3.196  -9.031
  568    HA   LEU  78           HA       LEU  78  -1.840   0.783 -10.010
  569   1HB   LEU  78          2HB       LEU  78  -0.481   3.090 -11.387
  570   2HB   LEU  78          1HB       LEU  78  -1.161   1.736 -12.257
  571    HG   LEU  78           HG       LEU  78  -2.536   3.979 -10.840
  572   1HD1  LEU  78          1HD1      LEU  78  -4.068   3.553 -12.874
  573   2HD1  LEU  78          2HD1      LEU  78  -2.796   2.473 -13.443
  574   3HD1  LEU  78          3HD1      LEU  78  -2.454   4.185 -13.194
  575   1HD2  LEU  78          1HD2      LEU  78  -3.596   2.247  -9.653
  576   2HD2  LEU  78          2HD2      LEU  78  -3.514   1.131 -11.017
  577   3HD2  LEU  78          3HD2      LEU  78  -4.654   2.476 -11.045
  578    H    VAL  79           H        VAL  79   1.471   2.125 -10.214
  579    HA   VAL  79           HA       VAL  79   2.605   0.044 -11.710
  580    HB   VAL  79           HB       VAL  79   4.788   0.737 -10.740
  581   1HG1  VAL  79          1HG1      VAL  79   2.852   2.793 -11.801
  582   2HG1  VAL  79          2HG1      VAL  79   4.126   1.936 -12.668
  583   3HG1  VAL  79          3HG1      VAL  79   4.545   3.189 -11.500
  584   1HG2  VAL  79          1HG2      VAL  79   4.370   1.358  -8.522
  585   2HG2  VAL  79          2HG2      VAL  79   2.954   2.314  -8.951
  586   3HG2  VAL  79          3HG2      VAL  79   4.570   2.917  -9.318
  587    H    MET  80           H        MET  80   1.932   0.244  -8.264
  588    HA   MET  80           HA       MET  80   3.526  -1.672  -7.144
  589   1HB   MET  80          2HB       MET  80   0.923  -0.564  -6.541
  590   2HB   MET  80          1HB       MET  80   0.989  -2.271  -6.104
  591   1HG   MET  80          2HG       MET  80   3.170  -1.805  -4.927
  592   2HG   MET  80          1HG       MET  80   2.898  -0.088  -5.226
  593   1HE   MET  80          1HE       MET  80   1.569   1.257  -4.501
  594   2HE   MET  80          2HE       MET  80   1.396   1.272  -2.749
  595   3HE   MET  80          3HE       MET  80  -0.018   1.003  -3.765
  596    H    MET  81           H        MET  81   0.690  -2.270  -9.200
  597    HA   MET  81           HA       MET  81   0.683  -5.111  -8.817
  598   1HB   MET  81          2HB       MET  81  -0.621  -3.248 -10.780
  599   2HB   MET  81          1HB       MET  81  -0.673  -4.991 -11.042
  600   1HG   MET  81          2HG       MET  81  -1.424  -3.844  -8.362
  601   2HG   MET  81          1HG       MET  81  -2.596  -3.866  -9.680
  602   1HE   MET  81          1HE       MET  81  -1.980  -6.824  -6.673
  603   2HE   MET  81          2HE       MET  81  -1.451  -5.150  -6.825
  604   3HE   MET  81          3HE       MET  81  -0.363  -6.457  -7.288
  605    H    VAL  82           H        VAL  82   1.613  -3.123 -11.640
  606    HA   VAL  82           HA       VAL  82   2.778  -5.226 -13.120
  607    HB   VAL  82           HB       VAL  82   3.925  -3.408 -14.410
  608   1HG1  VAL  82          1HG1      VAL  82   1.152  -3.971 -14.136
  609   2HG1  VAL  82          2HG1      VAL  82   1.990  -3.325 -15.548
  610   3HG1  VAL  82          3HG1      VAL  82   1.307  -2.226 -14.348
  611   1HG2  VAL  82          1HG2      VAL  82   4.373  -1.761 -12.743
  612   2HG2  VAL  82          2HG2      VAL  82   2.693  -1.737 -12.212
  613   3HG2  VAL  82          3HG2      VAL  82   3.130  -1.054 -13.775
  614    H    ARG  83           H        ARG  83   4.116  -3.149 -10.616
  615    HA   ARG  83           HA       ARG  83   6.855  -3.489 -11.027
  616   1HB   ARG  83          2HB       ARG  83   5.241  -3.145  -8.502
  617   2HB   ARG  83          1HB       ARG  83   7.001  -3.255  -8.479
  618   1HG   ARG  83          2HG       ARG  83   5.975  -1.399 -10.511
  619   2HG   ARG  83          1HG       ARG  83   5.565  -0.929  -8.861
  620   1HD   ARG  83          2HD       ARG  83   7.925  -1.102  -8.206
  621   2HD   ARG  83          1HD       ARG  83   8.351  -1.623  -9.833
  622    HE   ARG  83           HE       ARG  83   7.052   0.828 -10.107
  623   1HH1  ARG  83          2HH1      ARG  83   9.914  -0.433  -8.552
  624   2HH1  ARG  83          1HH1      ARG  83  10.796   1.048  -8.696
  625   1HH2  ARG  83          1HH2      ARG  83   8.226   2.758 -10.286
  626   2HH2  ARG  83          2HH2      ARG  83   9.843   2.852  -9.677
  627    H    CYS  84           H        CYS  84   4.483  -5.762  -9.892
  628    HA   CYS  84           HA       CYS  84   6.098  -7.578  -8.479
  629   1HB   CYS  84          2HB       CYS  84   3.522  -7.557  -8.807
  630   2HB   CYS  84          1HB       CYS  84   3.855  -8.496 -10.261
  631    HG   CYS  84           HG       CYS  84   4.606  -9.441  -7.374
  632    H    MET  85           H        MET  85   5.801  -6.961 -11.915
  633    HA   MET  85           HA       MET  85   6.868  -9.404 -12.892
  634   1HB   MET  85          2HB       MET  85   6.412  -6.677 -13.977
  635   2HB   MET  85          1HB       MET  85   7.623  -7.659 -14.802
  636   1HG   MET  85          2HG       MET  85   4.905  -8.782 -14.124
  637   2HG   MET  85          1HG       MET  85   5.169  -7.859 -15.603
  638   1HE   MET  85          1HE       MET  85   5.169 -11.182 -17.328
  639   2HE   MET  85          2HE       MET  85   4.962  -9.445 -17.535
  640   3HE   MET  85          3HE       MET  85   4.060 -10.289 -16.279
  641    H    LYS  86           H        LYS  86   8.345  -6.431 -11.696
  642    HA   LYS  86           HA       LYS  86  10.970  -6.717 -12.596
  643   1HB   LYS  86          2HB       LYS  86   9.664  -4.965 -10.925
  644   2HB   LYS  86          1HB       LYS  86  10.747  -5.796  -9.808
  645   1HG   LYS  86          2HG       LYS  86  12.624  -5.351 -11.442
  646   2HG   LYS  86          1HG       LYS  86  11.504  -4.330 -12.347
  647   1HD   LYS  86          2HD       LYS  86  11.174  -2.896 -10.396
  648   2HD   LYS  86          1HD       LYS  86  12.198  -3.948  -9.419
  649   1HE   LYS  86          2HE       LYS  86  14.075  -3.485 -11.055
  650   2HE   LYS  86          1HE       LYS  86  13.039  -2.263 -11.791
  651   1HZ   LYS  86          1HZ       LYS  86  13.887  -2.320  -8.945
  652   2HZ   LYS  86          2HZ       LYS  86  12.897  -1.139  -9.661
  653   3HZ   LYS  86          3HZ       LYS  86  14.519  -1.299 -10.141
  654    H    ASP  87           H        ASP  87  12.145  -8.525 -12.464
  655    HA   ASP  87           HA       ASP  87  11.876 -10.331 -10.191
  656   1HB   ASP  87          2HB       ASP  87  12.187 -10.989 -12.704
  657   2HB   ASP  87          1HB       ASP  87  13.896 -10.688 -12.386
  658    H    ASP  88           H        ASP  88  12.850  -9.610  -8.393
  659    HA   ASP  88           HA       ASP  88  15.402  -8.214  -8.501
  660   1HB   ASP  88          2HB       ASP  88  13.536  -8.987  -6.258
  661   2HB   ASP  88          1HB       ASP  88  15.133  -8.307  -5.949
  662    H    SER  89           HN       SER  89  16.740  -9.842  -9.384
  663    HA   SER  89           HA       SER  89  17.673 -11.787  -7.383
  664   1HB   SER  89          2HB       SER  89  16.846 -12.464 -10.210
  665   2HB   SER  89          1HB       SER  89  17.905 -13.495  -9.252
  666    HG   SER  89           HG       SER  89  16.269 -14.020  -7.993
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1   9.226   3.688 -18.806
    2   2H    MET   1          2H        MET   1  10.581   3.567 -19.823
    3   3H    MET   1          3H        MET   1  10.043   5.090 -19.298
    4    HA   MET   1           HA       MET   1  11.932   4.593 -17.999
    5   1HB   MET   1          2HB       MET   1   9.277   4.189 -16.632
    6   2HB   MET   1          1HB       MET   1  10.775   4.109 -15.705
    7   1HG   MET   1          2HG       MET   1  11.299   6.349 -16.100
    8   2HG   MET   1          1HG       MET   1  10.312   6.427 -17.560
    9   1HE   MET   1          1HE       MET   1   9.046   6.839 -13.192
   10   2HE   MET   1          2HE       MET   1  10.635   7.109 -13.906
   11   3HE   MET   1          3HE       MET   1  10.000   5.469 -13.779
   12    H    ASN   2           H        ASN   2   9.534   1.985 -17.464
   13    HA   ASN   2           HA       ASN   2  11.761   0.113 -16.957
   14   1HB   ASN   2          2HB       ASN   2   8.943   0.297 -16.025
   15   2HB   ASN   2          1HB       ASN   2   9.589  -1.323 -16.290
   16   1HD2  ASN   2          1HD2      ASN   2  11.985  -1.536 -15.309
   17   2HD2  ASN   2          2HD2      ASN   2  12.170  -0.888 -13.749
   18    H    ASP   3           H        ASP   3  11.445  -2.126 -17.758
   19    HA   ASP   3           HA       ASP   3  10.451  -2.062 -20.533
   20   1HB   ASP   3          2HB       ASP   3  12.510  -3.741 -19.119
   21   2HB   ASP   3          1HB       ASP   3  11.810  -4.260 -20.653
   22    H    ILE   4           H        ILE   4  10.128  -3.815 -17.482
   23    HA   ILE   4           HA       ILE   4   8.342  -5.777 -18.669
   24    HB   ILE   4           HB       ILE   4   8.179  -6.762 -16.490
   25   1HG1  ILE   4          2HG1      ILE   4   9.567  -5.442 -14.629
   26   2HG1  ILE   4          1HG1      ILE   4   9.088  -4.051 -15.603
   27   1HG2  ILE   4          1HG2      ILE   4  10.408  -6.815 -17.825
   28   2HG2  ILE   4          2HG2      ILE   4  10.426  -7.354 -16.146
   29   3HG2  ILE   4          3HG2      ILE   4  11.012  -5.743 -16.561
   30   1HD1  ILE   4          1HD1      ILE   4   7.075  -6.131 -14.751
   31   2HD1  ILE   4          2HD1      ILE   4   6.785  -4.475 -15.287
   32   3HD1  ILE   4          3HD1      ILE   4   7.496  -4.778 -13.701
   33    H    TYR   5           H        TYR   5   8.096  -2.644 -17.237
   34    HA   TYR   5           HA       TYR   5   5.408  -2.792 -16.274
   35   1HB   TYR   5          2HB       TYR   5   7.143  -0.461 -17.131
   36   2HB   TYR   5          1HB       TYR   5   5.494  -0.255 -16.547
   37    HD1  TYR   5           HD1      TYR   5   7.769  -2.877 -15.268
   38    HD2  TYR   5           HD2      TYR   5   6.081   1.003 -14.564
   39    HE1  TYR   5           HE1      TYR   5   8.621  -2.937 -12.956
   40    HE2  TYR   5           HE2      TYR   5   6.922   0.942 -12.234
   41    HH   TYR   5           HH       TYR   5   9.214  -0.753 -11.153
   42    H    LYS   6           H        LYS   6   6.917  -2.209 -19.363
   43    HA   LYS   6           HA       LYS   6   4.509  -1.271 -20.680
   44   1HB   LYS   6          2HB       LYS   6   6.961  -2.372 -22.062
   45   2HB   LYS   6          1HB       LYS   6   5.789  -1.211 -22.682
   46   1HG   LYS   6          2HG       LYS   6   7.897  -0.776 -20.558
   47   2HG   LYS   6          1HG       LYS   6   7.697   0.086 -22.083
   48   1HD   LYS   6          2HD       LYS   6   5.750   1.217 -21.310
   49   2HD   LYS   6          1HD       LYS   6   5.582   0.135 -19.927
   50   1HE   LYS   6          2HE       LYS   6   7.437   1.083 -18.807
   51   2HE   LYS   6          1HE       LYS   6   8.036   1.857 -20.276
   52   1HZ   LYS   6          1HZ       LYS   6   6.979   3.470 -18.848
   53   2HZ   LYS   6          2HZ       LYS   6   5.544   2.561 -18.817
   54   3HZ   LYS   6          3HZ       LYS   6   6.066   3.282 -20.265
   55    H    ALA   7           H        ALA   7   6.362  -4.265 -20.451
   56    HA   ALA   7           HA       ALA   7   4.657  -5.784 -22.202
   57   1HB   ALA   7          1HB       ALA   7   6.779  -6.730 -21.988
   58   2HB   ALA   7          2HB       ALA   7   5.814  -7.745 -20.916
   59   3HB   ALA   7          3HB       ALA   7   6.829  -6.470 -20.244
   60    H    ALA   8           H        ALA   8   4.627  -4.947 -18.810
   61    HA   ALA   8           HA       ALA   8   2.697  -6.972 -18.057
   62   1HB   ALA   8          1HB       ALA   8   2.659  -5.562 -15.902
   63   2HB   ALA   8          2HB       ALA   8   3.998  -4.666 -16.620
   64   3HB   ALA   8          3HB       ALA   8   4.159  -6.395 -16.307
   65    H    VAL   9           H        VAL   9   2.661  -3.552 -18.967
   66    HA   VAL   9           HA       VAL   9   0.102  -2.873 -18.034
   67    HB   VAL   9           HB       VAL   9   1.953  -1.382 -19.141
   68   1HG1  VAL   9          1HG1      VAL   9   0.164  -1.669 -21.546
   69   2HG1  VAL   9          2HG1      VAL   9   1.578  -2.705 -21.366
   70   3HG1  VAL   9          3HG1      VAL   9   1.774  -0.955 -21.440
   71   1HG2  VAL   9          1HG2      VAL   9  -0.951  -0.818 -19.786
   72   2HG2  VAL   9          2HG2      VAL   9   0.320   0.354 -19.433
   73   3HG2  VAL   9          3HG2      VAL   9  -0.288  -0.700 -18.156
   74    H    GLU  10           H        GLU  10   1.091  -4.681 -20.879
   75    HA   GLU  10           HA       GLU  10  -1.390  -4.593 -22.270
   76   1HB   GLU  10          2HB       GLU  10   0.979  -6.452 -22.361
   77   2HB   GLU  10          1HB       GLU  10  -0.472  -6.771 -23.312
   78   1HG   GLU  10          2HG       GLU  10  -0.145  -4.952 -24.688
   79   2HG   GLU  10          1HG       GLU  10   0.667  -4.015 -23.433
   80    H    GLN  11           H        GLN  11  -0.172  -6.518 -19.605
   81    HA   GLN  11           HA       GLN  11  -2.260  -8.517 -19.770
   82   1HB   GLN  11          2HB       GLN  11  -0.348  -7.912 -17.501
   83   2HB   GLN  11          1HB       GLN  11  -1.348  -9.355 -17.664
   84   1HG   GLN  11          2HG       GLN  11  -0.179  -9.852 -19.828
   85   2HG   GLN  11          1HG       GLN  11   0.893  -8.488 -19.513
   86   1HE2  GLN  11          1HE2      GLN  11   2.744  -8.951 -18.302
   87   2HE2  GLN  11          2HE2      GLN  11   2.956 -10.348 -17.360
   88    H    LEU  12           H        LEU  12  -1.662  -5.517 -18.043
   89    HA   LEU  12           HA       LEU  12  -3.745  -5.756 -16.124
   90   1HB   LEU  12          2HB       LEU  12  -2.786  -3.138 -17.238
   91   2HB   LEU  12          1HB       LEU  12  -3.401  -3.480 -15.637
   92    HG   LEU  12           HG       LEU  12  -0.676  -4.076 -16.772
   93   1HD1  LEU  12          1HD1      LEU  12  -1.392  -1.905 -15.528
   94   2HD1  LEU  12          2HD1      LEU  12   0.096  -2.707 -15.029
   95   3HD1  LEU  12          3HD1      LEU  12  -1.378  -2.916 -14.083
   96   1HD2  LEU  12          1HD2      LEU  12  -0.381  -5.189 -14.410
   97   2HD2  LEU  12          2HD2      LEU  12  -1.074  -6.135 -15.728
   98   3HD2  LEU  12          3HD2      LEU  12  -2.128  -5.423 -14.504
   99    H    THR  13           H        THR  13  -5.869  -5.313 -16.231
  100    HA   THR  13           HA       THR  13  -6.945  -4.437 -18.846
  101    HB   THR  13           HB       THR  13  -9.114  -5.471 -17.659
  102    HG1  THR  13           HG1      THR  13  -8.389  -6.285 -15.835
  103   1HG2  THR  13          1HG2      THR  13  -6.903  -6.845 -19.178
  104   2HG2  THR  13          2HG2      THR  13  -8.454  -6.257 -19.781
  105   3HG2  THR  13          3HG2      THR  13  -8.393  -7.688 -18.752
  106    H    ASP  14           H        ASP  14  -9.069  -3.312 -18.715
  107    HA   ASP  14           HA       ASP  14  -8.877  -0.931 -17.201
  108   1HB   ASP  14          2HB       ASP  14 -11.140  -2.195 -18.745
  109   2HB   ASP  14          1HB       ASP  14 -11.331  -0.660 -17.898
  110    H    GLU  15           H        GLU  15 -10.490  -4.005 -16.634
  111    HA   GLU  15           HA       GLU  15 -12.205  -3.249 -14.526
  112   1HB   GLU  15          2HB       GLU  15 -10.881  -5.866 -15.238
  113   2HB   GLU  15          1HB       GLU  15 -11.950  -5.707 -13.846
  114   1HG   GLU  15          2HG       GLU  15 -13.664  -4.697 -15.456
  115   2HG   GLU  15          1HG       GLU  15 -12.625  -5.271 -16.760
  116    H    GLN  16           H        GLN  16  -8.844  -4.436 -14.508
  117    HA   GLN  16           HA       GLN  16  -8.493  -4.510 -11.703
  118   1HB   GLN  16          2HB       GLN  16  -6.587  -4.240 -14.020
  119   2HB   GLN  16          1HB       GLN  16  -6.007  -4.137 -12.356
  120   1HG   GLN  16          2HG       GLN  16  -7.452  -6.349 -12.072
  121   2HG   GLN  16          1HG       GLN  16  -7.187  -6.473 -13.811
  122   1HE2  GLN  16          1HE2      GLN  16  -4.765  -6.168 -14.480
  123   2HE2  GLN  16          2HE2      GLN  16  -3.606  -6.860 -13.451
  124    H    LYS  17           H        LYS  17  -7.811  -1.949 -14.088
  125    HA   LYS  17           HA       LYS  17  -6.819  -0.060 -12.204
  126   1HB   LYS  17          2HB       LYS  17  -7.667  -0.003 -15.044
  127   2HB   LYS  17          1HB       LYS  17  -7.749   1.532 -14.180
  128   1HG   LYS  17          2HG       LYS  17  -5.544   1.611 -14.862
  129   2HG   LYS  17          1HG       LYS  17  -5.338   0.766 -13.327
  130   1HD   LYS  17          2HD       LYS  17  -4.395  -0.937 -14.463
  131   2HD   LYS  17          1HD       LYS  17  -5.961  -1.237 -15.214
  132   1HE   LYS  17          2HE       LYS  17  -4.125   0.894 -16.298
  133   2HE   LYS  17          1HE       LYS  17  -3.917  -0.794 -16.763
  134   1HZ   LYS  17          1HZ       LYS  17  -5.347   0.374 -18.315
  135   2HZ   LYS  17          2HZ       LYS  17  -6.414   0.791 -17.060
  136   3HZ   LYS  17          3HZ       LYS  17  -6.217  -0.837 -17.507
  137    H    ASN  18           H        ASN  18 -10.049  -0.918 -13.299
  138    HA   ASN  18           HA       ASN  18 -11.439   1.362 -12.338
  139   1HB   ASN  18          2HB       ASN  18 -12.133  -1.296 -13.348
  140   2HB   ASN  18          1HB       ASN  18 -13.214  -0.758 -12.061
  141   1HD2  ASN  18          1HD2      ASN  18 -11.797   0.355 -15.182
  142   2HD2  ASN  18          2HD2      ASN  18 -13.110   1.361 -15.582
  143    H    GLU  19           H        GLU  19 -10.733  -1.811 -10.878
  144    HA   GLU  19           HA       GLU  19 -11.984  -1.298  -8.373
  145   1HB   GLU  19          2HB       GLU  19  -9.684  -3.176  -8.992
  146   2HB   GLU  19          1HB       GLU  19 -10.690  -3.212  -7.543
  147   1HG   GLU  19          2HG       GLU  19 -12.654  -3.346  -9.331
  148   2HG   GLU  19          1HG       GLU  19 -11.370  -4.003 -10.345
  149    H    PHE  20           H        PHE  20  -8.674  -0.946  -9.576
  150    HA   PHE  20           HA       PHE  20  -7.444  -0.134  -7.168
  151   1HB   PHE  20          2HB       PHE  20  -6.789   0.184 -10.077
  152   2HB   PHE  20          1HB       PHE  20  -5.864   1.093  -8.886
  153    HD1  PHE  20           HD1      PHE  20  -3.856  -0.210  -9.619
  154    HD2  PHE  20           HD2      PHE  20  -7.259  -2.100  -7.802
  155    HE1  PHE  20           HE1      PHE  20  -2.488  -2.217  -9.143
  156    HE2  PHE  20           HE2      PHE  20  -5.890  -4.108  -7.331
  157    HZ   PHE  20           HZ       PHE  20  -3.503  -4.169  -8.000
  158    H    LYS  21           H        LYS  21  -9.054   1.715  -9.738
  159    HA   LYS  21           HA       LYS  21  -8.452   4.299  -8.736
  160   1HB   LYS  21          2HB       LYS  21  -9.291   3.811 -11.057
  161   2HB   LYS  21          1HB       LYS  21 -10.882   3.507 -10.361
  162   1HG   LYS  21          2HG       LYS  21 -10.710   5.826 -11.191
  163   2HG   LYS  21          1HG       LYS  21 -10.924   5.798  -9.441
  164   1HD   LYS  21          2HD       LYS  21  -8.552   6.167  -9.086
  165   2HD   LYS  21          1HD       LYS  21  -8.229   6.015 -10.814
  166   1HE   LYS  21          2HE       LYS  21  -8.312   8.331 -10.581
  167   2HE   LYS  21          1HE       LYS  21  -9.984   7.974 -11.012
  168   1HZ   LYS  21          1HZ       LYS  21  -9.905   9.432  -9.112
  169   2HZ   LYS  21          2HZ       LYS  21  -8.922   8.340  -8.261
  170   3HZ   LYS  21          3HZ       LYS  21 -10.525   7.927  -8.640
  171    H    ALA  22           H        ALA  22 -11.191   2.093  -8.225
  172    HA   ALA  22           HA       ALA  22 -12.719   3.880  -6.610
  173   1HB   ALA  22          1HB       ALA  22 -12.725   0.859  -6.815
  174   2HB   ALA  22          2HB       ALA  22 -13.834   1.985  -7.598
  175   3HB   ALA  22          3HB       ALA  22 -13.878   1.779  -5.848
  176    H    ALA  23           H        ALA  23 -10.406   1.282  -5.870
  177    HA   ALA  23           HA       ALA  23 -10.561   1.434  -3.047
  178   1HB   ALA  23          1HB       ALA  23  -9.329  -0.272  -4.710
  179   2HB   ALA  23          2HB       ALA  23  -8.836  -0.079  -3.028
  180   3HB   ALA  23          3HB       ALA  23  -7.950   0.750  -4.308
  181    H    PHE  24           H        PHE  24  -8.927   3.383  -5.431
  182    HA   PHE  24           HA       PHE  24  -7.162   4.682  -3.526
  183   1HB   PHE  24          2HB       PHE  24  -6.791   4.264  -6.094
  184   2HB   PHE  24          1HB       PHE  24  -7.747   5.731  -6.282
  185    HD1  PHE  24           HD1      PHE  24  -4.598   4.309  -4.995
  186    HD2  PHE  24           HD2      PHE  24  -6.895   7.900  -5.542
  187    HE1  PHE  24           HE1      PHE  24  -2.588   5.672  -4.498
  188    HE2  PHE  24           HE2      PHE  24  -4.885   9.261  -5.043
  189    HZ   PHE  24           HZ       PHE  24  -2.733   8.148  -4.522
  190    H    ASP  25           H        ASP  25  -9.842   5.730  -5.641
  191    HA   ASP  25           HA       ASP  25 -10.147   8.324  -4.734
  192   1HB   ASP  25          2HB       ASP  25 -11.377   6.949  -6.629
  193   2HB   ASP  25          1HB       ASP  25 -12.614   6.776  -5.384
  194    H    ILE  26           H        ILE  26 -11.577   5.370  -3.306
  195    HA   ILE  26           HA       ILE  26 -13.346   6.611  -1.520
  196    HB   ILE  26           HB       ILE  26 -13.102   4.569  -0.111
  197   1HG1  ILE  26          2HG1      ILE  26 -11.017   3.819  -2.187
  198   2HG1  ILE  26          1HG1      ILE  26 -10.676   4.219  -0.507
  199   1HG2  ILE  26          1HG2      ILE  26 -14.721   4.198  -1.705
  200   2HG2  ILE  26          2HG2      ILE  26 -13.550   2.990  -2.231
  201   3HG2  ILE  26          3HG2      ILE  26 -13.632   4.552  -3.045
  202   1HD1  ILE  26          1HD1      ILE  26 -10.752   1.846  -0.571
  203   2HD1  ILE  26          2HD1      ILE  26 -12.197   1.846  -1.581
  204   3HD1  ILE  26          3HD1      ILE  26 -12.303   2.336   0.109
  205    H    PHE  27           H        PHE  27  -9.867   6.046  -1.239
  206    HA   PHE  27           HA       PHE  27  -9.764   7.076   1.480
  207   1HB   PHE  27          2HB       PHE  27  -7.756   5.997  -0.466
  208   2HB   PHE  27          1HB       PHE  27  -7.199   6.974   0.892
  209    HD1  PHE  27           HD1      PHE  27  -7.437   6.197   3.195
  210    HD2  PHE  27           HD2      PHE  27  -8.865   3.839  -0.098
  211    HE1  PHE  27           HE1      PHE  27  -7.683   4.240   4.699
  212    HE2  PHE  27           HE2      PHE  27  -9.108   1.883   1.404
  213    HZ   PHE  27           HZ       PHE  27  -8.517   2.084   3.804
  214    H    ILE  28           H        ILE  28  -9.269   8.237  -1.798
  215    HA   ILE  28           HA       ILE  28  -8.139  10.777  -0.866
  216    HB   ILE  28           HB       ILE  28  -8.810  10.061  -3.721
  217   1HG1  ILE  28          2HG1      ILE  28  -7.396   8.270  -3.180
  218   2HG1  ILE  28          1HG1      ILE  28  -6.279   9.481  -3.780
  219   1HG2  ILE  28          1HG2      ILE  28  -7.201  12.135  -2.310
  220   2HG2  ILE  28          2HG2      ILE  28  -8.180  12.271  -3.770
  221   3HG2  ILE  28          3HG2      ILE  28  -6.580  11.531  -3.847
  222   1HD1  ILE  28          1HD1      ILE  28  -6.090  10.213  -1.285
  223   2HD1  ILE  28          2HD1      ILE  28  -5.240   8.755  -1.806
  224   3HD1  ILE  28          3HD1      ILE  28  -6.768   8.621  -0.939
  225    H    GLN  29           H        GLN  29 -10.733  10.314   0.045
  226    HA   GLN  29           HA       GLN  29 -12.651  11.634  -1.659
  227   1HB   GLN  29          2HB       GLN  29 -14.089  11.603   0.435
  228   2HB   GLN  29          1HB       GLN  29 -13.580  10.027  -0.164
  229   1HG   GLN  29          2HG       GLN  29 -12.000   9.742   1.555
  230   2HG   GLN  29          1HG       GLN  29 -11.942  11.467   1.917
  231   1HE2  GLN  29          1HE2      GLN  29 -12.921   8.738   3.358
  232   2HE2  GLN  29          2HE2      GLN  29 -14.321   9.277   4.154
  233    H    ASP  30           H        ASP  30 -10.455  12.572   0.915
  234    HA   ASP  30           HA       ASP  30 -11.050  15.383   0.361
  235   1HB   ASP  30          2HB       ASP  30 -11.036  15.819   2.896
  236   2HB   ASP  30          1HB       ASP  30 -12.510  15.158   2.195
  237    H    ALA  31           H        ALA  31  -8.783  13.587  -0.161
  238    HA   ALA  31           HA       ALA  31  -6.662  14.110   1.668
  239   1HB   ALA  31          1HB       ALA  31  -5.189  13.295  -0.101
  240   2HB   ALA  31          2HB       ALA  31  -6.496  13.429  -1.276
  241   3HB   ALA  31          3HB       ALA  31  -6.604  12.251   0.032
  242    H    GLU  32           H        GLU  32  -4.897  15.524   1.447
  243    HA   GLU  32           HA       GLU  32  -5.590  18.124   0.357
  244   1HB   GLU  32          2HB       GLU  32  -3.115  17.162   1.810
  245   2HB   GLU  32          1HB       GLU  32  -3.408  18.833   1.330
  246   1HG   GLU  32          2HG       GLU  32  -5.735  18.314   2.619
  247   2HG   GLU  32          1HG       GLU  32  -4.651  17.245   3.510
  248    H    ASP  33           H        ASP  33  -3.095  15.659  -0.204
  249    HA   ASP  33           HA       ASP  33  -2.115  17.110  -2.557
  250   1HB   ASP  33          2HB       ASP  33  -1.135  14.700  -1.033
  251   2HB   ASP  33          1HB       ASP  33  -0.483  15.119  -2.617
  252    H    GLY  34           H        GLY  34  -3.724  14.077  -1.687
  253   1HA   GLY  34          2HA       GLY  34  -5.408  13.162  -3.181
  254   2HA   GLY  34          1HA       GLY  34  -4.419  13.691  -4.538
  255    H    CYS  35           H        CYS  35  -3.723  11.868  -1.553
  256    HA   CYS  35           HA       CYS  35  -3.104   9.454  -3.041
  257   1HB   CYS  35          2HB       CYS  35  -0.781   9.541  -1.658
  258   2HB   CYS  35          1HB       CYS  35  -0.932  10.061  -3.335
  259    HG   CYS  35           HG       CYS  35   0.049  12.147  -2.301
  260    H    ILE  36           H        ILE  36  -2.310   7.710  -1.529
  261    HA   ILE  36           HA       ILE  36  -3.783   7.946   1.023
  262    HB   ILE  36           HB       ILE  36  -3.733   5.462   1.052
  263   1HG1  ILE  36          2HG1      ILE  36  -3.129   4.861  -1.631
  264   2HG1  ILE  36          1HG1      ILE  36  -1.823   5.913  -1.090
  265   1HG2  ILE  36          1HG2      ILE  36  -5.475   5.201  -0.513
  266   2HG2  ILE  36          2HG2      ILE  36  -4.767   6.366  -1.631
  267   3HG2  ILE  36          3HG2      ILE  36  -5.515   6.922  -0.134
  268   1HD1  ILE  36          1HD1      ILE  36  -2.040   3.181  -0.578
  269   2HD1  ILE  36          2HD1      ILE  36  -2.530   3.938   0.938
  270   3HD1  ILE  36          3HD1      ILE  36  -0.956   4.308   0.236
  271    H    SER  37           H        SER  37  -2.726   6.204   2.672
  272    HA   SER  37           HA       SER  37  -0.022   7.236   3.131
  273   1HB   SER  37          2HB       SER  37  -2.052   6.958   4.876
  274   2HB   SER  37          1HB       SER  37  -1.292   5.381   5.078
  275    HG   SER  37           HG       SER  37   0.633   6.412   5.570
  276    H    THR  38           H        THR  38   1.781   5.997   3.172
  277    HA   THR  38           HA       THR  38   1.922   3.624   1.675
  278    HB   THR  38           HB       THR  38   4.195   3.352   2.819
  279    HG1  THR  38           HG1      THR  38   4.312   4.444   4.603
  280   1HG2  THR  38          1HG2      THR  38   4.239   4.415   0.730
  281   2HG2  THR  38          2HG2      THR  38   4.992   5.607   1.788
  282   3HG2  THR  38          3HG2      THR  38   3.305   5.796   1.308
  283    H    LYS  39           H        LYS  39   1.756   4.137   5.184
  284    HA   LYS  39           HA       LYS  39   1.934   1.361   5.869
  285   1HB   LYS  39          2HB       LYS  39   1.338   2.077   8.116
  286   2HB   LYS  39          1HB       LYS  39   2.521   3.193   7.438
  287   1HG   LYS  39          2HG       LYS  39   0.299   4.458   6.634
  288   2HG   LYS  39          1HG       LYS  39  -0.370   3.636   8.043
  289   1HD   LYS  39          2HD       LYS  39   0.414   5.654   8.953
  290   2HD   LYS  39          1HD       LYS  39   1.743   4.541   9.278
  291   1HE   LYS  39          2HE       LYS  39   2.454   5.402   6.806
  292   2HE   LYS  39          1HE       LYS  39   1.616   6.835   7.399
  293   1HZ   LYS  39          1HZ       LYS  39   3.813   5.416   8.809
  294   2HZ   LYS  39          2HZ       LYS  39   3.012   6.810   9.362
  295   3HZ   LYS  39          3HZ       LYS  39   3.969   6.876   7.959
  296    H    GLU  40           H        GLU  40  -0.645   3.432   4.806
  297    HA   GLU  40           HA       GLU  40  -2.771   1.755   5.854
  298   1HB   GLU  40          2HB       GLU  40  -2.773   4.349   5.361
  299   2HB   GLU  40          1HB       GLU  40  -3.243   3.820   3.746
  300   1HG   GLU  40          2HG       GLU  40  -5.298   3.109   4.433
  301   2HG   GLU  40          1HG       GLU  40  -4.684   2.499   5.971
  302    H    LEU  41           H        LEU  41  -0.649   1.261   3.371
  303    HA   LEU  41           HA       LEU  41  -2.256   0.597   1.161
  304   1HB   LEU  41          2HB       LEU  41   0.436   0.502   1.721
  305   2HB   LEU  41          1HB       LEU  41   0.017  -1.193   1.580
  306    HG   LEU  41           HG       LEU  41  -0.515   0.923  -0.509
  307   1HD1  LEU  41          1HD1      LEU  41   1.434  -1.383  -0.647
  308   2HD1  LEU  41          2HD1      LEU  41   1.910   0.215  -0.071
  309   3HD1  LEU  41          3HD1      LEU  41   1.323   0.012  -1.720
  310   1HD2  LEU  41          1HD2      LEU  41  -1.254  -0.895  -1.911
  311   2HD2  LEU  41          2HD2      LEU  41  -2.130  -1.028  -0.386
  312   3HD2  LEU  41          3HD2      LEU  41  -0.761  -2.091  -0.712
  313    H    GLY  42           H        GLY  42  -1.329  -1.255   4.020
  314   1HA   GLY  42          2HA       GLY  42  -2.331  -3.776   3.241
  315   2HA   GLY  42          1HA       GLY  42  -2.122  -3.233   4.901
  316    H    LYS  43           H        LYS  43  -3.966  -0.860   4.173
  317    HA   LYS  43           HA       LYS  43  -6.429  -2.166   4.968
  318   1HB   LYS  43          2HB       LYS  43  -5.496   0.101   5.824
  319   2HB   LYS  43          1HB       LYS  43  -6.154   0.759   4.326
  320   1HG   LYS  43          2HG       LYS  43  -7.882   1.006   5.941
  321   2HG   LYS  43          1HG       LYS  43  -8.355  -0.381   4.961
  322   1HD   LYS  43          2HD       LYS  43  -7.567  -1.926   6.639
  323   2HD   LYS  43          1HD       LYS  43  -6.833  -0.620   7.571
  324   1HE   LYS  43          2HE       LYS  43  -8.843  -0.943   8.716
  325   2HE   LYS  43          1HE       LYS  43  -9.270   0.357   7.604
  326   1HZ   LYS  43          1HZ       LYS  43 -10.208  -1.249   6.094
  327   2HZ   LYS  43          2HZ       LYS  43 -10.915  -1.441   7.627
  328   3HZ   LYS  43          3HZ       LYS  43  -9.729  -2.533   7.093
  329    H    VAL  44           H        VAL  44  -5.200  -0.356   2.144
  330    HA   VAL  44           HA       VAL  44  -7.691  -0.334   0.755
  331    HB   VAL  44           HB       VAL  44  -6.293   0.176  -1.273
  332   1HG1  VAL  44          1HG1      VAL  44  -5.994   1.734   1.293
  333   2HG1  VAL  44          2HG1      VAL  44  -7.085   2.045  -0.057
  334   3HG1  VAL  44          3HG1      VAL  44  -5.356   2.337  -0.236
  335   1HG2  VAL  44          1HG2      VAL  44  -4.003   0.143   0.712
  336   2HG2  VAL  44          2HG2      VAL  44  -3.910   0.527  -1.007
  337   3HG2  VAL  44          3HG2      VAL  44  -4.279  -1.117  -0.491
  338    H    MET  45           H        MET  45  -4.951  -2.585   0.812
  339    HA   MET  45           HA       MET  45  -5.898  -4.218  -1.343
  340   1HB   MET  45          2HB       MET  45  -3.982  -4.889   0.904
  341   2HB   MET  45          1HB       MET  45  -4.239  -5.859  -0.547
  342   1HG   MET  45          2HG       MET  45  -3.548  -3.900  -1.931
  343   2HG   MET  45          1HG       MET  45  -3.189  -3.017  -0.450
  344   1HE   MET  45          1HE       MET  45  -0.441  -3.450   0.795
  345   2HE   MET  45          2HE       MET  45  -0.775  -5.070   1.399
  346   3HE   MET  45          3HE       MET  45  -2.070  -3.874   1.343
  347    H    ARG  46           H        ARG  46  -6.338  -4.199   2.149
  348    HA   ARG  46           HA       ARG  46  -7.520  -6.746   2.455
  349   1HB   ARG  46          2HB       ARG  46  -7.391  -4.253   4.048
  350   2HB   ARG  46          1HB       ARG  46  -8.754  -5.318   4.397
  351   1HG   ARG  46          2HG       ARG  46  -7.275  -7.182   4.829
  352   2HG   ARG  46          1HG       ARG  46  -5.876  -6.262   4.273
  353   1HD   ARG  46          2HD       ARG  46  -5.905  -6.252   6.706
  354   2HD   ARG  46          1HD       ARG  46  -6.260  -4.631   6.120
  355    HE   ARG  46           HE       ARG  46  -8.401  -4.819   7.009
  356   1HH1  ARG  46          2HH1      ARG  46  -6.848  -7.951   6.938
  357   2HH1  ARG  46          1HH1      ARG  46  -8.081  -8.720   7.876
  358   1HH2  ARG  46          1HH2      ARG  46 -10.002  -5.854   8.239
  359   2HH2  ARG  46          2HH2      ARG  46  -9.860  -7.539   8.611
  360    H    MET  47           H        MET  47  -8.889  -3.581   1.640
  361    HA   MET  47           HA       MET  47 -11.620  -4.526   1.621
  362   1HB   MET  47          2HB       MET  47 -10.239  -1.961   0.929
  363   2HB   MET  47          1HB       MET  47 -11.866  -2.244   0.309
  364   1HG   MET  47          2HG       MET  47 -12.468  -2.890   2.741
  365   2HG   MET  47          1HG       MET  47 -10.952  -2.103   3.180
  366   1HE   MET  47          1HE       MET  47 -14.878  -0.325   1.797
  367   2HE   MET  47          2HE       MET  47 -14.452  -1.984   2.208
  368   3HE   MET  47          3HE       MET  47 -14.015  -1.336   0.629
  369    H    LEU  48           H        LEU  48  -9.065  -3.985  -0.755
  370    HA   LEU  48           HA       LEU  48 -10.590  -4.241  -3.114
  371   1HB   LEU  48          2HB       LEU  48  -8.024  -3.657  -2.611
  372   2HB   LEU  48          1HB       LEU  48  -7.832  -5.337  -3.053
  373    HG   LEU  48           HG       LEU  48  -8.834  -4.888  -5.246
  374   1HD1  LEU  48          1HD1      LEU  48  -9.035  -2.300  -5.734
  375   2HD1  LEU  48          2HD1      LEU  48  -9.306  -2.200  -3.993
  376   3HD1  LEU  48          3HD1      LEU  48 -10.385  -3.166  -5.001
  377   1HD2  LEU  48          1HD2      LEU  48  -6.448  -3.473  -4.211
  378   2HD2  LEU  48          2HD2      LEU  48  -7.055  -2.881  -5.756
  379   3HD2  LEU  48          3HD2      LEU  48  -6.598  -4.574  -5.580
  380    H    GLY  49           H        GLY  49  -8.863  -6.669  -1.166
  381   1HA   GLY  49          2HA       GLY  49 -10.272  -8.822  -1.037
  382   2HA   GLY  49          1HA       GLY  49 -10.084  -8.819  -2.787
  383    H    GLN  50           H        GLN  50  -7.883  -8.187  -0.047
  384    HA   GLN  50           HA       GLN  50  -6.255 -10.508  -0.682
  385   1HB   GLN  50          2HB       GLN  50  -5.504  -7.783  -1.533
  386   2HB   GLN  50          1HB       GLN  50  -4.253  -8.645  -0.634
  387   1HG   GLN  50          2HG       GLN  50  -5.043 -10.630  -2.279
  388   2HG   GLN  50          1HG       GLN  50  -5.424  -9.246  -3.303
  389   1HE2  GLN  50          1HE2      GLN  50  -3.589  -7.697  -3.748
  390   2HE2  GLN  50          2HE2      GLN  50  -1.997  -8.280  -3.707
  391    H    ASN  51           H        ASN  51  -4.682 -10.965   0.944
  392    HA   ASN  51           HA       ASN  51  -4.765  -9.275   3.351
  393   1HB   ASN  51          2HB       ASN  51  -6.465 -11.269   3.379
  394   2HB   ASN  51          1HB       ASN  51  -5.029 -12.247   3.675
  395   1HD2  ASN  51          1HD2      ASN  51  -4.017 -12.090   5.752
  396   2HD2  ASN  51          2HD2      ASN  51  -4.643 -11.135   7.009
  397    HA   PRO  52           HA       PRO  52  -0.508 -10.799   2.471
  398   1HB   PRO  52          2HB       PRO  52   0.665  -8.329   2.475
  399   2HB   PRO  52          1HB       PRO  52  -0.063  -9.061   1.041
  400   1HG   PRO  52          2HG       PRO  52  -1.055  -6.856   2.737
  401   2HG   PRO  52          1HG       PRO  52  -1.394  -7.208   1.037
  402   1HD   PRO  52          2HD       PRO  52  -3.093  -7.753   3.253
  403   2HD   PRO  52          1HD       PRO  52  -3.319  -8.314   1.580
  404    H    THR  53           H        THR  53   1.614  -9.679   3.653
  405    HA   THR  53           HA       THR  53   0.956  -9.625   6.540
  406    HB   THR  53           HB       THR  53   2.923 -10.800   7.007
  407    HG1  THR  53           HG1      THR  53   3.959 -10.479   4.422
  408   1HG2  THR  53          1HG2      THR  53   3.084 -12.660   5.323
  409   2HG2  THR  53          2HG2      THR  53   1.978 -11.747   4.294
  410   3HG2  THR  53          3HG2      THR  53   1.443 -12.326   5.873
  411    HA   PRO  54           HA       PRO  54   2.972  -5.716   6.891
  412   1HB   PRO  54          2HB       PRO  54   4.702  -5.980   8.997
  413   2HB   PRO  54          1HB       PRO  54   2.942  -5.871   9.167
  414   1HG   PRO  54          2HG       PRO  54   4.722  -8.235   9.410
  415   2HG   PRO  54          1HG       PRO  54   3.174  -7.901  10.201
  416   1HD   PRO  54          2HD       PRO  54   3.548  -9.609   8.003
  417   2HD   PRO  54          1HD       PRO  54   1.987  -8.950   8.544
  418    H    GLU  55           H        GLU  55   5.191  -8.429   6.687
  419    HA   GLU  55           HA       GLU  55   7.479  -6.789   5.957
  420   1HB   GLU  55          2HB       GLU  55   8.608  -8.977   5.566
  421   2HB   GLU  55          1HB       GLU  55   7.927  -8.833   7.185
  422   1HG   GLU  55          2HG       GLU  55   6.061 -10.227   6.622
  423   2HG   GLU  55          1HG       GLU  55   6.443 -10.158   4.902
  424    H    GLU  56           H        GLU  56   5.007  -8.712   4.358
  425    HA   GLU  56           HA       GLU  56   6.235  -8.709   1.763
  426   1HB   GLU  56          2HB       GLU  56   4.505 -10.374   2.523
  427   2HB   GLU  56          1HB       GLU  56   3.304  -9.088   2.416
  428   1HG   GLU  56          2HG       GLU  56   3.812  -8.787   0.030
  429   2HG   GLU  56          1HG       GLU  56   5.055 -10.035   0.126
  430    H    LEU  57           H        LEU  57   3.445  -6.943   3.148
  431    HA   LEU  57           HA       LEU  57   2.959  -5.272   0.952
  432   1HB   LEU  57          2HB       LEU  57   1.250  -4.748   2.265
  433   2HB   LEU  57          1HB       LEU  57   2.017  -5.532   3.623
  434    HG   LEU  57           HG       LEU  57   2.817  -2.728   2.944
  435   1HD1  LEU  57          1HD1      LEU  57   0.397  -2.599   2.882
  436   2HD1  LEU  57          2HD1      LEU  57   0.945  -1.945   4.426
  437   3HD1  LEU  57          3HD1      LEU  57   0.268  -3.571   4.348
  438   1HD2  LEU  57          1HD2      LEU  57   3.725  -2.797   5.023
  439   2HD2  LEU  57          2HD2      LEU  57   3.487  -4.542   4.928
  440   3HD2  LEU  57          3HD2      LEU  57   2.279  -3.529   5.717
  441    H    GLN  58           H        GLN  58   5.280  -4.971   3.592
  442    HA   GLN  58           HA       GLN  58   6.031  -2.280   3.214
  443   1HB   GLN  58          2HB       GLN  58   6.702  -3.946   5.103
  444   2HB   GLN  58          1HB       GLN  58   8.028  -4.375   4.022
  445   1HG   GLN  58          2HG       GLN  58   8.859  -2.631   5.441
  446   2HG   GLN  58          1HG       GLN  58   8.551  -1.886   3.873
  447   1HE2  GLN  58          1HE2      GLN  58   6.834  -0.317   3.725
  448   2HE2  GLN  58          2HE2      GLN  58   5.986   0.233   5.089
  449    H    GLU  59           H        GLU  59   7.258  -5.281   1.755
  450    HA   GLU  59           HA       GLU  59   9.394  -4.196   0.289
  451   1HB   GLU  59          2HB       GLU  59   7.656  -6.620  -0.075
  452   2HB   GLU  59          1HB       GLU  59   8.824  -6.179  -1.319
  453   1HG   GLU  59          2HG       GLU  59   9.708  -6.282   1.550
  454   2HG   GLU  59          1HG       GLU  59   9.546  -7.785   0.640
  455    H    MET  60           H        MET  60   5.937  -4.390  -0.440
  456    HA   MET  60           HA       MET  60   6.149  -3.520  -3.154
  457   1HB   MET  60          2HB       MET  60   3.815  -3.443  -1.222
  458   2HB   MET  60          1HB       MET  60   3.704  -3.058  -2.939
  459   1HG   MET  60          2HG       MET  60   4.816  -5.390  -3.291
  460   2HG   MET  60          1HG       MET  60   4.291  -5.708  -1.639
  461   1HE   MET  60          1HE       MET  60   0.812  -6.591  -1.761
  462   2HE   MET  60          2HE       MET  60   2.167  -5.999  -0.804
  463   3HE   MET  60          3HE       MET  60   2.359  -7.449  -1.785
  464    H    ILE  61           H        ILE  61   5.289  -1.852  -0.116
  465    HA   ILE  61           HA       ILE  61   4.797   0.697  -1.071
  466    HB   ILE  61           HB       ILE  61   6.096  -0.213   1.502
  467   1HG1  ILE  61          2HG1      ILE  61   3.390   1.001   1.346
  468   2HG1  ILE  61          1HG1      ILE  61   3.569  -0.602   0.636
  469   1HG2  ILE  61          1HG2      ILE  61   5.440   2.084   2.331
  470   2HG2  ILE  61          2HG2      ILE  61   5.175   2.543   0.649
  471   3HG2  ILE  61          3HG2      ILE  61   6.785   2.069   1.191
  472   1HD1  ILE  61          1HD1      ILE  61   4.525  -1.445   2.727
  473   2HD1  ILE  61          2HD1      ILE  61   2.938  -0.739   3.024
  474   3HD1  ILE  61          3HD1      ILE  61   4.395   0.158   3.451
  475    H    ASP  62           H        ASP  62   7.900  -0.213   0.432
  476    HA   ASP  62           HA       ASP  62   9.395   1.972  -0.348
  477   1HB   ASP  62          2HB       ASP  62  10.031  -0.028   1.175
  478   2HB   ASP  62          1HB       ASP  62  10.639  -0.763  -0.308
  479    H    GLU  63           H        GLU  63   8.791  -0.996  -2.224
  480    HA   GLU  63           HA       GLU  63  10.619  -0.419  -4.323
  481   1HB   GLU  63          2HB       GLU  63   8.246  -2.237  -4.067
  482   2HB   GLU  63          1HB       GLU  63   9.013  -1.999  -5.637
  483   1HG   GLU  63          2HG       GLU  63  10.812  -2.559  -3.323
  484   2HG   GLU  63          1HG       GLU  63   9.835  -3.897  -3.923
  485    H    VAL  64           H        VAL  64   7.094   0.140  -4.056
  486    HA   VAL  64           HA       VAL  64   6.974   1.447  -6.632
  487    HB   VAL  64           HB       VAL  64   4.639   1.815  -6.182
  488   1HG1  VAL  64          1HG1      VAL  64   4.101  -0.372  -6.413
  489   2HG1  VAL  64          2HG1      VAL  64   4.818  -0.806  -4.861
  490   3HG1  VAL  64          3HG1      VAL  64   5.836  -0.659  -6.293
  491   1HG2  VAL  64          1HG2      VAL  64   3.660   1.250  -3.965
  492   2HG2  VAL  64          2HG2      VAL  64   4.808   2.584  -3.858
  493   3HG2  VAL  64          3HG2      VAL  64   5.284   0.968  -3.339
  494    H    ASP  65           H        ASP  65   7.716   2.501  -3.430
  495    HA   ASP  65           HA       ASP  65   6.778   5.190  -3.696
  496   1HB   ASP  65          2HB       ASP  65   7.696   3.708  -1.586
  497   2HB   ASP  65          1HB       ASP  65   9.075   4.754  -1.903
  498    H    GLU  66           H        GLU  66   7.527   5.805  -5.763
  499    HA   GLU  66           HA       GLU  66  10.314   5.813  -6.449
  500   1HB   GLU  66          2HB       GLU  66   7.892   7.142  -7.661
  501   2HB   GLU  66          1HB       GLU  66   9.517   7.373  -8.306
  502   1HG   GLU  66          2HG       GLU  66   8.687   4.561  -7.791
  503   2HG   GLU  66          1HG       GLU  66   7.891   5.381  -9.135
  504    H    ASP  67           H        ASP  67   8.122   8.158  -4.984
  505    HA   ASP  67           HA       ASP  67  10.117  10.282  -5.151
  506   1HB   ASP  67          2HB       ASP  67   8.331  11.521  -3.711
  507   2HB   ASP  67          1HB       ASP  67   8.005  11.219  -5.413
  508    H    GLY  68           H        GLY  68   8.685   8.189  -2.672
  509   1HA   GLY  68          2HA       GLY  68   9.519   7.560  -0.608
  510   2HA   GLY  68          1HA       GLY  68  10.991   8.456  -0.976
  511    H    SER  69           H        SER  69   7.629   9.588  -0.878
  512    HA   SER  69           HA       SER  69   8.429  11.760   0.908
  513   1HB   SER  69          2HB       SER  69   6.147  12.649   0.415
  514   2HB   SER  69          1HB       SER  69   7.130  12.415  -1.026
  515    HG   SER  69           HG       SER  69   5.715  11.016  -1.693
  516    H    GLY  70           H        GLY  70   5.871   9.284   0.713
  517   1HA   GLY  70          2HA       GLY  70   5.836   8.104   3.084
  518   2HA   GLY  70          1HA       GLY  70   5.202   9.683   3.538
  519    H    THR  71           H        THR  71   3.913   9.915   0.805
  520    HA   THR  71           HA       THR  71   1.543   8.261   1.409
  521    HB   THR  71           HB       THR  71   0.253   9.896   0.136
  522    HG1  THR  71           HG1      THR  71   2.668  11.349  -0.152
  523   1HG2  THR  71          1HG2      THR  71   2.126  11.149   2.159
  524   2HG2  THR  71          2HG2      THR  71   0.577  10.378   2.498
  525   3HG2  THR  71          3HG2      THR  71   0.629  11.888   1.589
  526    H    VAL  72           H        VAL  72   0.467   7.168  -0.262
  527    HA   VAL  72           HA       VAL  72   2.194   6.515  -2.563
  528    HB   VAL  72           HB       VAL  72  -0.232   5.006  -1.567
  529   1HG1  VAL  72          1HG1      VAL  72   0.429   4.683  -3.956
  530   2HG1  VAL  72          2HG1      VAL  72   0.625   3.219  -2.992
  531   3HG1  VAL  72          3HG1      VAL  72   2.034   4.192  -3.413
  532   1HG2  VAL  72          1HG2      VAL  72   1.457   4.949   0.172
  533   2HG2  VAL  72          2HG2      VAL  72   2.724   4.617  -1.009
  534   3HG2  VAL  72          3HG2      VAL  72   1.493   3.401  -0.671
  535    H    ASP  73           H        ASP  73   1.730   7.509  -4.391
  536    HA   ASP  73           HA       ASP  73  -0.904   8.670  -4.852
  537   1HB   ASP  73          2HB       ASP  73   1.623   8.674  -6.526
  538   2HB   ASP  73          1HB       ASP  73   0.137   9.518  -6.956
  539    H    PHE  74           H        PHE  74  -1.607   8.381  -7.328
  540    HA   PHE  74           HA       PHE  74  -2.416   5.660  -7.559
  541   1HB   PHE  74          2HB       PHE  74  -3.566   7.810  -8.486
  542   2HB   PHE  74          1HB       PHE  74  -2.521   7.551  -9.884
  543    HD1  PHE  74           HD1      PHE  74  -3.689   6.528 -11.609
  544    HD2  PHE  74           HD2      PHE  74  -4.360   5.237  -7.572
  545    HE1  PHE  74           HE1      PHE  74  -5.219   4.757 -12.432
  546    HE2  PHE  74           HE2      PHE  74  -5.900   3.471  -8.389
  547    HZ   PHE  74           HZ       PHE  74  -6.328   3.230 -10.822
  548    H    ASP  75           H        ASP  75   0.225   7.516  -8.946
  549    HA   ASP  75           HA       ASP  75   0.937   5.686 -11.008
  550   1HB   ASP  75          2HB       ASP  75   2.261   7.972  -9.622
  551   2HB   ASP  75          1HB       ASP  75   3.299   6.830 -10.474
  552    H    GLU  76           H        GLU  76   1.791   6.025  -7.598
  553    HA   GLU  76           HA       GLU  76   3.666   3.810  -7.631
  554   1HB   GLU  76          2HB       GLU  76   2.457   5.057  -5.160
  555   2HB   GLU  76          1HB       GLU  76   4.025   4.269  -5.336
  556   1HG   GLU  76          2HG       GLU  76   4.795   6.095  -6.799
  557   2HG   GLU  76          1HG       GLU  76   3.219   6.878  -6.658
  558    H    PHE  77           H        PHE  77   0.273   4.318  -7.167
  559    HA   PHE  77           HA       PHE  77  -0.269   1.904  -5.693
  560   1HB   PHE  77          2HB       PHE  77  -1.717   3.990  -5.709
  561   2HB   PHE  77          1HB       PHE  77  -2.214   3.538  -7.337
  562    HD1  PHE  77           HD1      PHE  77  -1.914   2.064  -3.893
  563    HD2  PHE  77           HD2      PHE  77  -4.078   2.169  -7.603
  564    HE1  PHE  77           HE1      PHE  77  -3.604   0.512  -2.951
  565    HE2  PHE  77           HE2      PHE  77  -5.766   0.616  -6.659
  566    HZ   PHE  77           HZ       PHE  77  -5.530  -0.211  -4.335
  567    H    LEU  78           H        LEU  78  -0.282   2.866  -9.102
  568    HA   LEU  78           HA       LEU  78  -1.450   0.400 -10.038
  569   1HB   LEU  78          2HB       LEU  78  -0.085   2.687 -11.443
  570   2HB   LEU  78          1HB       LEU  78  -0.660   1.270 -12.290
  571    HG   LEU  78           HG       LEU  78  -2.182   3.551 -11.133
  572   1HD1  LEU  78          1HD1      LEU  78  -2.388   1.727 -13.537
  573   2HD1  LEU  78          2HD1      LEU  78  -1.972   3.440 -13.511
  574   3HD1  LEU  78          3HD1      LEU  78  -3.619   2.927 -13.145
  575   1HD2  LEU  78          1HD2      LEU  78  -3.187   0.690 -11.168
  576   2HD2  LEU  78          2HD2      LEU  78  -4.251   2.092 -11.090
  577   3HD2  LEU  78          3HD2      LEU  78  -3.111   1.778  -9.782
  578    H    VAL  79           H        VAL  79   1.838   1.771  -9.964
  579    HA   VAL  79           HA       VAL  79   3.183  -0.201 -11.411
  580    HB   VAL  79           HB       VAL  79   5.201   0.412 -10.052
  581   1HG1  VAL  79          1HG1      VAL  79   5.085   2.885 -10.758
  582   2HG1  VAL  79          2HG1      VAL  79   3.458   2.520 -11.331
  583   3HG1  VAL  79          3HG1      VAL  79   4.845   1.680 -12.024
  584   1HG2  VAL  79          1HG2      VAL  79   3.187   2.191  -8.652
  585   2HG2  VAL  79          2HG2      VAL  79   4.935   2.344  -8.494
  586   3HG2  VAL  79          3HG2      VAL  79   4.121   0.890  -7.921
  587    H    MET  80           H        MET  80   1.967  -0.308  -8.138
  588    HA   MET  80           HA       MET  80   3.432  -2.285  -6.915
  589   1HB   MET  80          2HB       MET  80   0.693  -1.281  -6.708
  590   2HB   MET  80          1HB       MET  80   0.850  -2.966  -6.215
  591   1HG   MET  80          2HG       MET  80   2.814  -2.270  -4.785
  592   2HG   MET  80          1HG       MET  80   2.405  -0.595  -5.155
  593   1HE   MET  80          1HE       MET  80  -0.446   0.385  -3.191
  594   2HE   MET  80          2HE       MET  80  -0.645  -0.043  -4.888
  595   3HE   MET  80          3HE       MET  80   0.855   0.705  -4.345
  596    H    MET  81           H        MET  81   1.092  -2.685  -9.519
  597    HA   MET  81           HA       MET  81   0.928  -5.552  -9.279
  598   1HB   MET  81          2HB       MET  81   0.042  -3.604 -11.407
  599   2HB   MET  81          1HB       MET  81  -0.148  -5.348 -11.581
  600   1HG   MET  81          2HG       MET  81  -1.124  -3.977  -9.089
  601   2HG   MET  81          1HG       MET  81  -2.109  -3.951 -10.550
  602   1HE   MET  81          1HE       MET  81  -2.235  -6.846  -7.390
  603   2HE   MET  81          2HE       MET  81  -1.696  -5.172  -7.495
  604   3HE   MET  81          3HE       MET  81  -0.536  -6.479  -7.720
  605    H    VAL  82           H        VAL  82   2.529  -3.341 -11.594
  606    HA   VAL  82           HA       VAL  82   3.766  -5.457 -13.070
  607    HB   VAL  82           HB       VAL  82   5.108  -3.650 -14.130
  608   1HG1  VAL  82          1HG1      VAL  82   2.405  -2.482 -14.157
  609   2HG1  VAL  82          2HG1      VAL  82   2.439  -4.228 -14.407
  610   3HG1  VAL  82          3HG1      VAL  82   3.352  -3.165 -15.479
  611   1HG2  VAL  82          1HG2      VAL  82   3.545  -1.841 -12.260
  612   2HG2  VAL  82          2HG2      VAL  82   4.649  -1.318 -13.530
  613   3HG2  VAL  82          3HG2      VAL  82   5.270  -2.181 -12.124
  614    H    ARG  83           H        ARG  83   4.844  -3.443 -10.358
  615    HA   ARG  83           HA       ARG  83   7.590  -3.939 -10.455
  616   1HB   ARG  83          2HB       ARG  83   7.674  -3.389  -8.106
  617   2HB   ARG  83          1HB       ARG  83   6.495  -2.339  -8.890
  618   1HG   ARG  83          2HG       ARG  83   4.692  -3.368  -7.871
  619   2HG   ARG  83          1HG       ARG  83   5.521  -4.914  -7.715
  620   1HD   ARG  83          2HD       ARG  83   6.348  -2.464  -6.157
  621   2HD   ARG  83          1HD       ARG  83   5.164  -3.614  -5.548
  622    HE   ARG  83           HE       ARG  83   8.025  -3.999  -5.712
  623   1HH1  ARG  83          2HH1      ARG  83   4.915  -5.591  -5.651
  624   2HH1  ARG  83          1HH1      ARG  83   5.543  -7.059  -4.986
  625   1HH2  ARG  83          1HH2      ARG  83   8.821  -5.931  -4.838
  626   2HH2  ARG  83          2HH2      ARG  83   7.745  -7.253  -4.526
  627    H    CYS  84           H        CYS  84   5.010  -6.110  -9.583
  628    HA   CYS  84           HA       CYS  84   6.392  -7.959  -7.979
  629   1HB   CYS  84          2HB       CYS  84   4.061  -8.252  -9.868
  630   2HB   CYS  84          1HB       CYS  84   4.705  -9.626  -8.970
  631    HG   CYS  84           HG       CYS  84   3.688  -7.064  -7.485
  632    H    MET  85           H        MET  85   6.221  -7.602 -11.504
  633    HA   MET  85           HA       MET  85   7.546 -10.038 -12.155
  634   1HB   MET  85          2HB       MET  85   6.347  -7.956 -13.596
  635   2HB   MET  85          1HB       MET  85   8.043  -7.922 -14.079
  636   1HG   MET  85          2HG       MET  85   7.626 -10.587 -14.142
  637   2HG   MET  85          1HG       MET  85   5.992 -10.034 -14.504
  638   1HE   MET  85          1HE       MET  85   9.191 -10.703 -17.368
  639   2HE   MET  85          2HE       MET  85   8.524 -11.572 -15.990
  640   3HE   MET  85          3HE       MET  85   9.705 -10.291 -15.727
  641    H    LYS  86           H        LYS  86   8.666  -6.765 -11.433
  642    HA   LYS  86           HA       LYS  86  11.367  -7.076 -12.229
  643   1HB   LYS  86          2HB       LYS  86   9.928  -5.223 -10.358
  644   2HB   LYS  86          1HB       LYS  86  11.691  -5.249 -10.366
  645   1HG   LYS  86          2HG       LYS  86  11.220  -5.160 -13.033
  646   2HG   LYS  86          1HG       LYS  86   9.803  -4.291 -12.446
  647   1HD   LYS  86          2HD       LYS  86  11.325  -2.545 -12.611
  648   2HD   LYS  86          1HD       LYS  86  11.587  -3.043 -10.939
  649   1HE   LYS  86          2HE       LYS  86  13.284  -4.730 -12.289
  650   2HE   LYS  86          1HE       LYS  86  13.383  -3.267 -13.269
  651   1HZ   LYS  86          1HZ       LYS  86  15.015  -3.218 -11.509
  652   2HZ   LYS  86          2HZ       LYS  86  13.810  -3.441 -10.333
  653   3HZ   LYS  86          3HZ       LYS  86  13.857  -2.008 -11.246
  654    H    ASP  87           H        ASP  87  13.185  -7.708 -11.128
  655    HA   ASP  87           HA       ASP  87  12.782  -8.947  -8.466
  656   1HB   ASP  87          2HB       ASP  87  14.348 -10.019 -10.825
  657   2HB   ASP  87          1HB       ASP  87  14.527 -10.637  -9.182
  658    H    ASP  88           H        ASP  88  13.625  -6.307  -8.817
  659    HA   ASP  88           HA       ASP  88  15.274  -4.821  -8.243
  660   1HB   ASP  88          2HB       ASP  88  16.345  -7.235  -6.751
  661   2HB   ASP  88          1HB       ASP  88  16.857  -5.568  -6.493
  662    H    SER  89           HN       SER  89  15.626  -5.592 -10.745
  663    HA   SER  89           HA       SER  89  18.496  -6.269 -11.014
  664   1HB   SER  89          2HB       SER  89  16.148  -6.737 -12.846
  665   2HB   SER  89          1HB       SER  89  17.801  -6.764 -13.445
  666    HG   SER  89           HG       SER  89  16.439  -8.599 -11.956
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  15.002  -2.442 -20.286
    2   2H    MET   1          2H        MET   1  14.369  -3.990 -19.988
    3   3H    MET   1          3H        MET   1  16.027  -3.693 -19.779
    4    HA   MET   1           HA       MET   1  14.909  -3.797 -17.643
    5   1HB   MET   1          2HB       MET   1  16.179  -1.295 -18.664
    6   2HB   MET   1          1HB       MET   1  15.428  -1.232 -17.070
    7   1HG   MET   1          2HG       MET   1  16.741  -3.321 -16.481
    8   2HG   MET   1          1HG       MET   1  17.623  -3.102 -17.993
    9   1HE   MET   1          1HE       MET   1  19.534  -3.232 -17.062
   10   2HE   MET   1          2HE       MET   1  19.859  -2.737 -15.403
   11   3HE   MET   1          3HE       MET   1  20.493  -1.781 -16.740
   12    H    ASN   2           H        ASN   2  13.258  -3.130 -16.286
   13    HA   ASN   2           HA       ASN   2  11.119  -2.505 -15.740
   14   1HB   ASN   2          2HB       ASN   2  11.958  -0.123 -17.406
   15   2HB   ASN   2          1HB       ASN   2  10.448  -0.190 -16.499
   16   1HD2  ASN   2          1HD2      ASN   2  11.026  -1.220 -14.078
   17   2HD2  ASN   2          2HD2      ASN   2  12.275  -0.376 -13.304
   18    H    ASP   3           H        ASP   3  11.157  -4.386 -17.710
   19    HA   ASP   3           HA       ASP   3   9.290  -3.496 -19.803
   20   1HB   ASP   3          2HB       ASP   3  10.704  -6.153 -19.465
   21   2HB   ASP   3          1HB       ASP   3   9.716  -5.674 -20.845
   22    H    ILE   4           H        ILE   4   9.075  -4.693 -16.704
   23    HA   ILE   4           HA       ILE   4   7.052  -6.682 -16.998
   24    HB   ILE   4           HB       ILE   4   6.738  -6.567 -14.640
   25   1HG1  ILE   4          2HG1      ILE   4   6.584  -3.999 -14.638
   26   2HG1  ILE   4          1HG1      ILE   4   7.346  -4.747 -13.239
   27   1HG2  ILE   4          1HG2      ILE   4   9.627  -5.974 -15.336
   28   2HG2  ILE   4          2HG2      ILE   4   8.855  -7.558 -15.283
   29   3HG2  ILE   4          3HG2      ILE   4   9.085  -6.638 -13.796
   30   1HD1  ILE   4          1HD1      ILE   4   8.849  -3.032 -13.742
   31   2HD1  ILE   4          2HD1      ILE   4   8.611  -3.197 -15.481
   32   3HD1  ILE   4          3HD1      ILE   4   9.566  -4.392 -14.604
   33    H    TYR   5           H        TYR   5   7.026  -3.201 -16.949
   34    HA   TYR   5           HA       TYR   5   4.237  -2.861 -16.371
   35   1HB   TYR   5          2HB       TYR   5   6.038  -0.938 -17.862
   36   2HB   TYR   5          1HB       TYR   5   4.558  -0.561 -16.982
   37    HD1  TYR   5           HD1      TYR   5   8.039  -0.484 -16.775
   38    HD2  TYR   5           HD2      TYR   5   4.579  -1.512 -14.449
   39    HE1  TYR   5           HE1      TYR   5   9.354  -0.201 -14.699
   40    HE2  TYR   5           HE2      TYR   5   5.895  -1.220 -12.368
   41    HH   TYR   5           HH       TYR   5   8.420   0.402 -11.998
   42    H    LYS   6           H        LYS   6   6.184  -3.278 -19.271
   43    HA   LYS   6           HA       LYS   6   4.074  -2.662 -21.134
   44   1HB   LYS   6          2HB       LYS   6   6.486  -4.363 -21.761
   45   2HB   LYS   6          1HB       LYS   6   5.578  -3.310 -22.843
   46   1HG   LYS   6          2HG       LYS   6   7.472  -2.511 -20.624
   47   2HG   LYS   6          1HG       LYS   6   7.588  -2.126 -22.341
   48   1HD   LYS   6          2HD       LYS   6   5.700  -0.641 -22.219
   49   2HD   LYS   6          1HD       LYS   6   5.311  -1.178 -20.583
   50   1HE   LYS   6          2HE       LYS   6   7.037   0.027 -19.626
   51   2HE   LYS   6          1HE       LYS   6   8.041  -0.057 -21.073
   52   1HZ   LYS   6          1HZ       LYS   6   5.608   1.611 -20.722
   53   2HZ   LYS   6          2HZ       LYS   6   6.512   1.495 -22.155
   54   3HZ   LYS   6          3HZ       LYS   6   7.209   2.170 -20.761
   55    H    ALA   7           H        ALA   7   5.363  -5.551 -19.611
   56    HA   ALA   7           HA       ALA   7   3.802  -7.411 -21.150
   57   1HB   ALA   7          1HB       ALA   7   4.430  -8.943 -19.140
   58   2HB   ALA   7          2HB       ALA   7   5.470  -7.602 -18.657
   59   3HB   ALA   7          3HB       ALA   7   5.711  -8.387 -20.218
   60    H    ALA   8           H        ALA   8   3.301  -5.537 -18.220
   61    HA   ALA   8           HA       ALA   8   0.957  -7.071 -17.424
   62   1HB   ALA   8          1HB       ALA   8   2.257  -6.212 -15.618
   63   2HB   ALA   8          2HB       ALA   8   0.771  -5.262 -15.669
   64   3HB   ALA   8          3HB       ALA   8   2.270  -4.589 -16.311
   65    H    VAL   9           H        VAL   9   1.694  -3.887 -18.836
   66    HA   VAL   9           HA       VAL   9  -0.900  -2.813 -18.768
   67    HB   VAL   9           HB       VAL   9   1.304  -1.643 -19.360
   68   1HG1  VAL   9          1HG1      VAL   9   1.772  -3.290 -21.254
   69   2HG1  VAL   9          2HG1      VAL   9   1.978  -1.585 -21.647
   70   3HG1  VAL   9          3HG1      VAL   9   0.529  -2.443 -22.172
   71   1HG2  VAL   9          1HG2      VAL   9  -1.196  -1.160 -21.013
   72   2HG2  VAL   9          2HG2      VAL   9   0.107   0.007 -20.791
   73   3HG2  VAL   9          3HG2      VAL   9  -0.864  -0.504 -19.410
   74    H    GLU  10           H        GLU  10   0.501  -5.205 -20.899
   75    HA   GLU  10           HA       GLU  10  -1.631  -4.988 -22.865
   76   1HB   GLU  10          2HB       GLU  10   0.708  -6.874 -22.553
   77   2HB   GLU  10          1HB       GLU  10  -0.510  -7.062 -23.816
   78   1HG   GLU  10          2HG       GLU  10  -0.022  -4.815 -24.662
   79   2HG   GLU  10          1HG       GLU  10   1.150  -4.563 -23.369
   80    H    GLN  11           H        GLN  11  -1.240  -6.530 -19.842
   81    HA   GLN  11           HA       GLN  11  -3.121  -8.686 -20.508
   82   1HB   GLN  11          2HB       GLN  11  -1.583  -8.213 -17.948
   83   2HB   GLN  11          1HB       GLN  11  -2.527  -9.644 -18.354
   84   1HG   GLN  11          2HG       GLN  11  -0.270  -8.714 -20.121
   85   2HG   GLN  11          1HG       GLN  11   0.031  -9.752 -18.729
   86   1HE2  GLN  11          1HE2      GLN  11  -1.257  -9.667 -21.987
   87   2HE2  GLN  11          2HE2      GLN  11  -1.636 -11.318 -22.085
   88    H    LEU  12           H        LEU  12  -2.851  -5.760 -18.559
   89    HA   LEU  12           HA       LEU  12  -5.243  -6.241 -17.051
   90   1HB   LEU  12          2HB       LEU  12  -5.069  -3.761 -16.544
   91   2HB   LEU  12          1HB       LEU  12  -3.767  -4.784 -15.992
   92    HG   LEU  12           HG       LEU  12  -2.370  -4.000 -17.870
   93   1HD1  LEU  12          1HD1      LEU  12  -3.283  -1.936 -19.098
   94   2HD1  LEU  12          2HD1      LEU  12  -4.873  -2.448 -18.531
   95   3HD1  LEU  12          3HD1      LEU  12  -3.928  -3.504 -19.583
   96   1HD2  LEU  12          1HD2      LEU  12  -2.001  -1.756 -17.017
   97   2HD2  LEU  12          2HD2      LEU  12  -2.441  -2.800 -15.664
   98   3HD2  LEU  12          3HD2      LEU  12  -3.635  -1.699 -16.354
   99    H    THR  13           H        THR  13  -7.074  -4.659 -17.093
  100    HA   THR  13           HA       THR  13  -7.824  -3.896 -19.851
  101    HB   THR  13           HB       THR  13 -10.232  -4.529 -18.855
  102    HG1  THR  13           HG1      THR  13  -9.980  -5.593 -17.075
  103   1HG2  THR  13          1HG2      THR  13  -9.937  -6.764 -19.961
  104   2HG2  THR  13          2HG2      THR  13  -8.216  -6.404 -20.102
  105   3HG2  THR  13          3HG2      THR  13  -9.401  -5.396 -20.934
  106    H    ASP  14           H        ASP  14 -10.030  -2.603 -19.655
  107    HA   ASP  14           HA       ASP  14  -9.472  -0.171 -18.312
  108   1HB   ASP  14          2HB       ASP  14 -11.032  -0.500 -20.305
  109   2HB   ASP  14          1HB       ASP  14 -12.223  -1.107 -19.154
  110    H    GLU  15           H        GLU  15 -11.190  -3.091 -17.417
  111    HA   GLU  15           HA       GLU  15 -12.569  -2.086 -15.140
  112   1HB   GLU  15          2HB       GLU  15 -11.724  -4.849 -16.001
  113   2HB   GLU  15          1HB       GLU  15 -12.509  -4.570 -14.447
  114   1HG   GLU  15          2HG       GLU  15 -13.685  -3.558 -17.044
  115   2HG   GLU  15          1HG       GLU  15 -14.054  -5.161 -16.407
  116    H    GLN  16           H        GLN  16  -9.352  -3.515 -15.616
  117    HA   GLN  16           HA       GLN  16  -8.596  -3.803 -12.919
  118   1HB   GLN  16          2HB       GLN  16  -7.066  -3.389 -15.471
  119   2HB   GLN  16          1HB       GLN  16  -6.219  -3.325 -13.925
  120   1HG   GLN  16          2HG       GLN  16  -8.067  -5.616 -14.583
  121   2HG   GLN  16          1HG       GLN  16  -6.386  -5.622 -15.120
  122   1HE2  GLN  16          1HE2      GLN  16  -4.722  -5.215 -13.289
  123   2HE2  GLN  16          2HE2      GLN  16  -5.079  -5.872 -11.765
  124    H    LYS  17           H        LYS  17  -8.078  -1.061 -15.156
  125    HA   LYS  17           HA       LYS  17  -6.849   0.672 -13.302
  126   1HB   LYS  17          2HB       LYS  17  -8.315   1.042 -15.878
  127   2HB   LYS  17          1HB       LYS  17  -8.066   2.461 -14.861
  128   1HG   LYS  17          2HG       LYS  17  -5.926   2.595 -15.537
  129   2HG   LYS  17          1HG       LYS  17  -5.622   0.967 -14.933
  130   1HD   LYS  17          2HD       LYS  17  -5.127   0.748 -17.210
  131   2HD   LYS  17          1HD       LYS  17  -6.801   0.200 -17.139
  132   1HE   LYS  17          2HE       LYS  17  -7.593   2.034 -18.255
  133   2HE   LYS  17          1HE       LYS  17  -6.411   3.119 -17.521
  134   1HZ   LYS  17          1HZ       LYS  17  -5.785   1.116 -19.623
  135   2HZ   LYS  17          2HZ       LYS  17  -4.721   2.273 -18.975
  136   3HZ   LYS  17          3HZ       LYS  17  -6.048   2.766 -19.915
  137    H    ASN  18           H        ASN  18 -10.231  -0.045 -13.993
  138    HA   ASN  18           HA       ASN  18 -11.404   2.014 -12.422
  139   1HB   ASN  18          2HB       ASN  18 -12.302  -0.350 -13.875
  140   2HB   ASN  18          1HB       ASN  18 -13.170  -0.147 -12.351
  141   1HD2  ASN  18          1HD2      ASN  18 -12.580   1.301 -15.519
  142   2HD2  ASN  18          2HD2      ASN  18 -13.762   2.511 -15.381
  143    H    GLU  19           H        GLU  19 -10.269  -1.259 -11.707
  144    HA   GLU  19           HA       GLU  19 -11.340  -1.496  -9.088
  145   1HB   GLU  19          2HB       GLU  19  -8.851  -2.772 -10.268
  146   2HB   GLU  19          1HB       GLU  19  -9.630  -3.256  -8.761
  147   1HG   GLU  19          2HG       GLU  19 -11.763  -3.332 -10.436
  148   2HG   GLU  19          1HG       GLU  19 -10.470  -3.741 -11.562
  149    H    PHE  20           H        PHE  20  -8.046  -0.655 -10.196
  150    HA   PHE  20           HA       PHE  20  -7.035   0.018  -7.640
  151   1HB   PHE  20          2HB       PHE  20  -6.162   0.921 -10.394
  152   2HB   PHE  20          1HB       PHE  20  -5.270   1.270  -8.915
  153    HD1  PHE  20           HD1      PHE  20  -5.946  -1.163 -11.478
  154    HD2  PHE  20           HD2      PHE  20  -4.498  -0.699  -7.464
  155    HE1  PHE  20           HE1      PHE  20  -4.885  -3.395 -11.606
  156    HE2  PHE  20           HE2      PHE  20  -3.424  -2.933  -7.592
  157    HZ   PHE  20           HZ       PHE  20  -3.623  -4.281  -9.666
  158    H    LYS  21           H        LYS  21  -8.649   1.950 -10.139
  159    HA   LYS  21           HA       LYS  21  -8.225   4.501  -9.016
  160   1HB   LYS  21          2HB       LYS  21  -9.123   4.079 -11.320
  161   2HB   LYS  21          1HB       LYS  21 -10.659   3.615 -10.588
  162   1HG   LYS  21          2HG       LYS  21 -10.710   5.978 -11.283
  163   2HG   LYS  21          1HG       LYS  21 -10.827   5.844  -9.529
  164   1HD   LYS  21          2HD       LYS  21  -8.545   6.470  -9.225
  165   2HD   LYS  21          1HD       LYS  21  -8.183   6.257 -10.940
  166   1HE   LYS  21          2HE       LYS  21 -10.305   8.224 -10.157
  167   2HE   LYS  21          1HE       LYS  21  -8.615   8.679  -9.949
  168   1HZ   LYS  21          1HZ       LYS  21  -8.203   8.245 -12.255
  169   2HZ   LYS  21          2HZ       LYS  21  -9.532   9.297 -12.135
  170   3HZ   LYS  21          3HZ       LYS  21  -9.777   7.652 -12.483
  171    H    ALA  22           H        ALA  22 -10.873   2.158  -8.566
  172    HA   ALA  22           HA       ALA  22 -12.390   3.763  -6.769
  173   1HB   ALA  22          1HB       ALA  22 -13.466   1.596  -6.126
  174   2HB   ALA  22          2HB       ALA  22 -12.297   0.760  -7.149
  175   3HB   ALA  22          3HB       ALA  22 -13.451   1.885  -7.866
  176    H    ALA  23           H        ALA  23  -9.933   1.240  -6.298
  177    HA   ALA  23           HA       ALA  23 -10.002   1.164  -3.470
  178   1HB   ALA  23          1HB       ALA  23  -7.695   0.573  -5.348
  179   2HB   ALA  23          2HB       ALA  23  -8.899  -0.589  -4.787
  180   3HB   ALA  23          3HB       ALA  23  -7.765   0.128  -3.643
  181    H    PHE  24           H        PHE  24  -8.612   3.426  -5.716
  182    HA   PHE  24           HA       PHE  24  -6.843   4.634  -3.742
  183   1HB   PHE  24          2HB       PHE  24  -6.523   4.451  -6.359
  184   2HB   PHE  24          1HB       PHE  24  -7.516   5.906  -6.376
  185    HD1  PHE  24           HD1      PHE  24  -6.668   8.015  -5.582
  186    HD2  PHE  24           HD2      PHE  24  -4.343   4.430  -5.152
  187    HE1  PHE  24           HE1      PHE  24  -4.688   9.376  -4.974
  188    HE2  PHE  24           HE2      PHE  24  -2.361   5.790  -4.542
  189    HZ   PHE  24           HZ       PHE  24  -2.532   8.262  -4.455
  190    H    ASP  25           H        ASP  25  -9.623   5.692  -5.719
  191    HA   ASP  25           HA       ASP  25 -10.078   8.184  -4.622
  192   1HB   ASP  25          2HB       ASP  25 -11.831   6.166  -5.945
  193   2HB   ASP  25          1HB       ASP  25 -12.595   7.550  -5.164
  194    H    ILE  26           H        ILE  26 -11.270   5.050  -3.383
  195    HA   ILE  26           HA       ILE  26 -13.037   6.012  -1.442
  196    HB   ILE  26           HB       ILE  26 -12.571   3.897  -0.196
  197   1HG1  ILE  26          2HG1      ILE  26 -10.530   3.486  -2.409
  198   2HG1  ILE  26          1HG1      ILE  26 -10.155   3.744  -0.708
  199   1HG2  ILE  26          1HG2      ILE  26 -12.998   2.459  -2.430
  200   2HG2  ILE  26          2HG2      ILE  26 -13.271   4.073  -3.084
  201   3HG2  ILE  26          3HG2      ILE  26 -14.236   3.498  -1.724
  202   1HD1  ILE  26          1HD1      ILE  26 -10.065   1.395  -0.975
  203   2HD1  ILE  26          2HD1      ILE  26 -11.511   1.372  -1.983
  204   3HD1  ILE  26          3HD1      ILE  26 -11.647   1.692  -0.253
  205    H    PHE  27           H        PHE  27  -9.518   5.685  -1.307
  206    HA   PHE  27           HA       PHE  27  -9.430   6.555   1.473
  207   1HB   PHE  27          2HB       PHE  27  -7.367   5.677  -0.525
  208   2HB   PHE  27          1HB       PHE  27  -6.886   6.503   0.957
  209    HD1  PHE  27           HD1      PHE  27  -8.032   3.396  -0.495
  210    HD2  PHE  27           HD2      PHE  27  -7.627   5.555   3.195
  211    HE1  PHE  27           HE1      PHE  27  -8.306   1.283   0.769
  212    HE2  PHE  27           HE2      PHE  27  -7.900   3.440   4.460
  213    HZ   PHE  27           HZ       PHE  27  -8.240   1.306   3.247
  214    H    ILE  28           H        ILE  28  -9.082   7.959  -1.721
  215    HA   ILE  28           HA       ILE  28  -7.899  10.410  -0.631
  216    HB   ILE  28           HB       ILE  28  -8.717   9.968  -3.499
  217   1HG1  ILE  28          2HG1      ILE  28  -7.269   8.144  -3.222
  218   2HG1  ILE  28          1HG1      ILE  28  -6.184   9.422  -3.739
  219   1HG2  ILE  28          1HG2      ILE  28  -7.054  11.913  -1.977
  220   2HG2  ILE  28          2HG2      ILE  28  -8.094  12.174  -3.377
  221   3HG2  ILE  28          3HG2      ILE  28  -6.494  11.459  -3.589
  222   1HD1  ILE  28          1HD1      ILE  28  -5.887   9.891  -1.192
  223   2HD1  ILE  28          2HD1      ILE  28  -5.055   8.503  -1.899
  224   3HD1  ILE  28          3HD1      ILE  28  -6.545   8.266  -0.984
  225    H    GLN  29           H        GLN  29 -10.596   9.659   0.179
  226    HA   GLN  29           HA       GLN  29 -12.495  11.275  -1.240
  227   1HB   GLN  29          2HB       GLN  29 -13.932  10.928   0.797
  228   2HB   GLN  29          1HB       GLN  29 -13.356   9.435   0.059
  229   1HG   GLN  29          2HG       GLN  29 -11.795   9.040   1.770
  230   2HG   GLN  29          1HG       GLN  29 -11.796  10.724   2.292
  231   1HE2  GLN  29          1HE2      GLN  29 -13.783  11.502   3.449
  232   2HE2  GLN  29          2HE2      GLN  29 -14.755  10.381   4.271
  233    H    ASP  30           H        ASP  30 -10.267  11.779   1.418
  234    HA   ASP  30           HA       ASP  30 -10.701  14.652   1.260
  235   1HB   ASP  30          2HB       ASP  30 -12.262  13.523   3.065
  236   2HB   ASP  30          1HB       ASP  30 -10.779  13.480   4.018
  237    H    ALA  31           H        ALA  31  -8.516  13.081   0.451
  238    HA   ALA  31           HA       ALA  31  -6.474  12.925   2.440
  239   1HB   ALA  31          1HB       ALA  31  -6.403  11.594   0.361
  240   2HB   ALA  31          2HB       ALA  31  -4.947  12.573   0.554
  241   3HB   ALA  31          3HB       ALA  31  -6.207  13.077  -0.574
  242    H    GLU  32           H        GLU  32  -4.522  14.191   2.513
  243    HA   GLU  32           HA       GLU  32  -5.023  17.007   2.547
  244   1HB   GLU  32          2HB       GLU  32  -2.439  15.458   2.859
  245   2HB   GLU  32          1HB       GLU  32  -2.607  17.191   3.138
  246   1HG   GLU  32          2HG       GLU  32  -4.047  16.871   4.992
  247   2HG   GLU  32          1HG       GLU  32  -4.371  15.192   4.556
  248    H    ASP  33           H        ASP  33  -2.847  14.974   0.593
  249    HA   ASP  33           HA       ASP  33  -2.572  17.179  -1.350
  250   1HB   ASP  33          2HB       ASP  33  -0.589  15.752  -0.261
  251   2HB   ASP  33          1HB       ASP  33  -0.970  14.680  -1.607
  252    H    GLY  34           H        GLY  34  -3.549  13.806  -1.014
  253   1HA   GLY  34          2HA       GLY  34  -5.521  13.229  -2.472
  254   2HA   GLY  34          1HA       GLY  34  -4.545  13.832  -3.805
  255    H    CYS  35           H        CYS  35  -3.511  11.842  -1.045
  256    HA   CYS  35           HA       CYS  35  -3.183   9.492  -2.765
  257   1HB   CYS  35          2HB       CYS  35  -0.887  10.691  -1.200
  258   2HB   CYS  35          1HB       CYS  35  -0.844   9.195  -2.122
  259    HG   CYS  35           HG       CYS  35  -1.172  10.604  -4.316
  260    H    ILE  36           H        ILE  36  -2.111   7.684  -1.309
  261    HA   ILE  36           HA       ILE  36  -3.616   7.692   1.236
  262    HB   ILE  36           HB       ILE  36  -3.490   5.239   1.144
  263   1HG1  ILE  36          2HG1      ILE  36  -2.758   4.666  -1.479
  264   2HG1  ILE  36          1HG1      ILE  36  -1.550   5.842  -0.959
  265   1HG2  ILE  36          1HG2      ILE  36  -5.229   6.733  -0.154
  266   2HG2  ILE  36          2HG2      ILE  36  -5.197   4.990  -0.421
  267   3HG2  ILE  36          3HG2      ILE  36  -4.430   6.074  -1.582
  268   1HD1  ILE  36          1HD1      ILE  36  -2.269   3.238   0.407
  269   2HD1  ILE  36          2HD1      ILE  36  -1.244   4.473   1.136
  270   3HD1  ILE  36          3HD1      ILE  36  -0.731   3.660  -0.343
  271    H    SER  37           H        SER  37  -2.537   6.246   2.962
  272    HA   SER  37           HA       SER  37   0.205   7.219   3.281
  273   1HB   SER  37          2HB       SER  37  -1.659   7.425   5.069
  274   2HB   SER  37          1HB       SER  37  -1.348   5.720   5.376
  275    HG   SER  37           HG       SER  37   0.008   7.805   6.254
  276    H    THR  38           H        THR  38   1.924   5.902   3.872
  277    HA   THR  38           HA       THR  38   2.202   3.451   2.527
  278    HB   THR  38           HB       THR  38   4.260   3.144   3.898
  279    HG1  THR  38           HG1      THR  38   4.045   3.974   5.821
  280   1HG2  THR  38          1HG2      THR  38   5.238   4.564   2.457
  281   2HG2  THR  38          2HG2      THR  38   4.641   5.948   3.370
  282   3HG2  THR  38          3HG2      THR  38   3.650   5.238   2.094
  283    H    LYS  39           H        LYS  39   1.492   4.155   5.940
  284    HA   LYS  39           HA       LYS  39   1.414   1.452   6.817
  285   1HB   LYS  39          2HB       LYS  39   0.307   2.353   8.819
  286   2HB   LYS  39          1HB       LYS  39   1.706   3.328   8.370
  287   1HG   LYS  39          2HG       LYS  39   0.411   5.156   8.193
  288   2HG   LYS  39          1HG       LYS  39  -0.591   4.351   6.986
  289   1HD   LYS  39          2HD       LYS  39  -2.207   4.651   8.587
  290   2HD   LYS  39          1HD       LYS  39  -1.538   3.138   9.197
  291   1HE   LYS  39          2HE       LYS  39   0.132   4.728  10.473
  292   2HE   LYS  39          1HE       LYS  39  -1.128   5.935  10.212
  293   1HZ   LYS  39          1HZ       LYS  39  -1.406   4.765  12.318
  294   2HZ   LYS  39          2HZ       LYS  39  -1.528   3.284  11.494
  295   3HZ   LYS  39          3HZ       LYS  39  -2.716   4.481  11.279
  296    H    GLU  40           H        GLU  40  -0.894   3.476   5.162
  297    HA   GLU  40           HA       GLU  40  -3.192   1.841   5.842
  298   1HB   GLU  40          2HB       GLU  40  -2.768   4.210   4.032
  299   2HB   GLU  40          1HB       GLU  40  -4.285   3.311   4.041
  300   1HG   GLU  40          2HG       GLU  40  -4.174   3.625   6.633
  301   2HG   GLU  40          1HG       GLU  40  -3.035   4.917   6.258
  302    H    LEU  41           H        LEU  41  -0.626   1.311   3.801
  303    HA   LEU  41           HA       LEU  41  -1.762   0.483   1.376
  304   1HB   LEU  41          2HB       LEU  41   0.741   0.648   2.236
  305   2HB   LEU  41          1HB       LEU  41   0.505  -1.057   2.544
  306    HG   LEU  41           HG       LEU  41   1.576  -0.606   0.362
  307   1HD1  LEU  41          1HD1      LEU  41   0.449  -2.312  -0.709
  308   2HD1  LEU  41          2HD1      LEU  41  -1.140  -1.642  -0.333
  309   3HD1  LEU  41          3HD1      LEU  41  -0.224  -2.494   0.910
  310   1HD2  LEU  41          1HD2      LEU  41  -1.014   0.391  -0.742
  311   2HD2  LEU  41          2HD2      LEU  41   0.634   0.730  -1.269
  312   3HD2  LEU  41          3HD2      LEU  41  -0.020   1.540   0.154
  313    H    GLY  42           H        GLY  42  -1.292  -1.293   4.427
  314   1HA   GLY  42          2HA       GLY  42  -2.078  -3.848   3.542
  315   2HA   GLY  42          1HA       GLY  42  -2.191  -3.271   5.199
  316    H    LYS  43           H        LYS  43  -3.966  -0.994   4.087
  317    HA   LYS  43           HA       LYS  43  -6.478  -2.389   4.474
  318   1HB   LYS  43          2HB       LYS  43  -5.723  -0.012   5.335
  319   2HB   LYS  43          1HB       LYS  43  -6.317   0.510   3.759
  320   1HG   LYS  43          2HG       LYS  43  -8.236   0.667   5.074
  321   2HG   LYS  43          1HG       LYS  43  -8.414  -0.935   4.361
  322   1HD   LYS  43          2HD       LYS  43  -8.821  -1.359   6.629
  323   2HD   LYS  43          1HD       LYS  43  -7.106  -1.739   6.483
  324   1HE   LYS  43          2HE       LYS  43  -6.442   0.215   7.568
  325   2HE   LYS  43          1HE       LYS  43  -7.932   1.066   7.164
  326   1HZ   LYS  43          1HZ       LYS  43  -9.125  -0.361   8.705
  327   2HZ   LYS  43          2HZ       LYS  43  -7.865   0.457   9.499
  328   3HZ   LYS  43          3HZ       LYS  43  -7.691  -1.183   9.091
  329    H    VAL  44           H        VAL  44  -4.885  -0.548   1.873
  330    HA   VAL  44           HA       VAL  44  -7.059  -0.652   0.052
  331    HB   VAL  44           HB       VAL  44  -5.341  -0.138  -1.700
  332   1HG1  VAL  44          1HG1      VAL  44  -4.657   2.063  -0.612
  333   2HG1  VAL  44          2HG1      VAL  44  -5.447   1.475   0.852
  334   3HG1  VAL  44          3HG1      VAL  44  -6.386   1.715  -0.621
  335   1HG2  VAL  44          1HG2      VAL  44  -3.416  -0.075   0.637
  336   2HG2  VAL  44          2HG2      VAL  44  -3.045   0.236  -1.059
  337   3HG2  VAL  44          3HG2      VAL  44  -3.477  -1.390  -0.537
  338    H    MET  45           H        MET  45  -4.394  -2.866   0.723
  339    HA   MET  45           HA       MET  45  -4.659  -4.529  -1.545
  340   1HB   MET  45          2HB       MET  45  -3.848  -5.450   1.223
  341   2HB   MET  45          1HB       MET  45  -3.436  -6.200  -0.319
  342   1HG   MET  45          2HG       MET  45  -2.656  -3.350  -0.019
  343   2HG   MET  45          1HG       MET  45  -1.778  -4.501   0.986
  344   1HE   MET  45          1HE       MET  45  -3.136  -3.495  -2.205
  345   2HE   MET  45          2HE       MET  45  -3.209  -5.123  -2.877
  346   3HE   MET  45          3HE       MET  45  -2.005  -3.984  -3.479
  347    H    ARG  46           H        ARG  46  -6.356  -4.412   1.528
  348    HA   ARG  46           HA       ARG  46  -7.742  -6.885   1.301
  349   1HB   ARG  46          2HB       ARG  46  -7.979  -4.443   2.971
  350   2HB   ARG  46          1HB       ARG  46  -9.441  -5.415   2.803
  351   1HG   ARG  46          2HG       ARG  46  -6.880  -6.847   3.380
  352   2HG   ARG  46          1HG       ARG  46  -7.630  -5.941   4.694
  353   1HD   ARG  46          2HD       ARG  46  -9.807  -7.213   3.696
  354   2HD   ARG  46          1HD       ARG  46  -8.561  -8.396   3.317
  355    HE   ARG  46           HE       ARG  46  -8.160  -7.651   5.973
  356   1HH1  ARG  46          2HH1      ARG  46 -10.659  -9.138   4.039
  357   2HH1  ARG  46          1HH1      ARG  46 -11.292 -10.072   5.350
  358   1HH2  ARG  46          1HH2      ARG  46  -9.008  -8.886   7.677
  359   2HH2  ARG  46          2HH2      ARG  46 -10.362  -9.931   7.403
  360    H    MET  47           H        MET  47  -8.457  -3.597   0.208
  361    HA   MET  47           HA       MET  47 -11.117  -4.231  -0.712
  362   1HB   MET  47          2HB       MET  47  -9.311  -1.846  -0.909
  363   2HB   MET  47          1HB       MET  47 -10.721  -1.955  -1.961
  364   1HG   MET  47          2HG       MET  47 -10.877  -2.318   1.041
  365   2HG   MET  47          1HG       MET  47 -11.113  -0.761   0.248
  366   1HE   MET  47          1HE       MET  47 -13.530  -1.488  -2.405
  367   2HE   MET  47          2HE       MET  47 -12.326  -0.442  -1.659
  368   3HE   MET  47          3HE       MET  47 -14.007  -0.347  -1.140
  369    H    LEU  48           H        LEU  48  -7.903  -3.964  -2.177
  370    HA   LEU  48           HA       LEU  48  -8.693  -4.098  -4.889
  371   1HB   LEU  48          2HB       LEU  48  -6.196  -4.459  -3.370
  372   2HB   LEU  48          1HB       LEU  48  -6.261  -5.318  -4.893
  373    HG   LEU  48           HG       LEU  48  -6.833  -2.360  -4.678
  374   1HD1  LEU  48          1HD1      LEU  48  -4.212  -3.808  -5.135
  375   2HD1  LEU  48          2HD1      LEU  48  -4.586  -2.660  -3.850
  376   3HD1  LEU  48          3HD1      LEU  48  -4.465  -2.106  -5.520
  377   1HD2  LEU  48          1HD2      LEU  48  -7.533  -3.807  -6.700
  378   2HD2  LEU  48          2HD2      LEU  48  -5.807  -3.954  -7.031
  379   3HD2  LEU  48          3HD2      LEU  48  -6.574  -2.366  -7.038
  380    H    GLY  49           H        GLY  49  -7.298  -6.698  -2.868
  381   1HA   GLY  49          2HA       GLY  49  -8.957  -8.759  -3.053
  382   2HA   GLY  49          1HA       GLY  49  -8.362  -8.719  -4.710
  383    H    GLN  50           H        GLN  50  -6.772  -8.209  -1.561
  384    HA   GLN  50           HA       GLN  50  -5.202 -10.639  -1.809
  385   1HB   GLN  50          2HB       GLN  50  -4.125  -8.002  -2.558
  386   2HB   GLN  50          1HB       GLN  50  -3.147  -8.873  -1.374
  387   1HG   GLN  50          2HG       GLN  50  -2.700 -10.626  -2.822
  388   2HG   GLN  50          1HG       GLN  50  -4.184 -10.380  -3.740
  389   1HE2  GLN  50          1HE2      GLN  50  -3.578  -9.799  -5.835
  390   2HE2  GLN  50          2HE2      GLN  50  -2.387  -8.650  -6.211
  391    H    ASN  51           H        ASN  51  -3.708 -10.881   0.093
  392    HA   ASN  51           HA       ASN  51  -4.432  -9.231   2.407
  393   1HB   ASN  51          2HB       ASN  51  -5.931 -11.389   2.100
  394   2HB   ASN  51          1HB       ASN  51  -4.526 -12.198   2.793
  395   1HD2  ASN  51          1HD2      ASN  51  -6.624  -9.322   3.422
  396   2HD2  ASN  51          2HD2      ASN  51  -6.552  -9.464   5.112
  397    HA   PRO  52           HA       PRO  52   0.013 -10.519   2.429
  398   1HB   PRO  52          2HB       PRO  52   1.049  -7.989   2.352
  399   2HB   PRO  52          1HB       PRO  52   0.648  -8.921   0.906
  400   1HG   PRO  52          2HG       PRO  52  -0.749  -6.614   2.104
  401   2HG   PRO  52          1HG       PRO  52  -0.745  -7.179   0.428
  402   1HD   PRO  52          2HD       PRO  52  -2.805  -7.583   2.353
  403   2HD   PRO  52          1HD       PRO  52  -2.689  -8.333   0.743
  404    H    THR  53           H        THR  53   1.814  -9.124   3.849
  405    HA   THR  53           HA       THR  53   0.599  -8.841   6.535
  406    HB   THR  53           HB       THR  53   2.550  -9.695   7.495
  407    HG1  THR  53           HG1      THR  53   4.478  -9.296   6.736
  408   1HG2  THR  53          1HG2      THR  53   1.478 -11.471   6.208
  409   2HG2  THR  53          2HG2      THR  53   3.229 -11.683   6.182
  410   3HG2  THR  53          3HG2      THR  53   2.399 -11.015   4.776
  411    HA   PRO  54           HA       PRO  54   1.915  -4.645   6.740
  412   1HB   PRO  54          2HB       PRO  54   3.073  -4.445   9.219
  413   2HB   PRO  54          1HB       PRO  54   1.326  -4.543   8.944
  414   1HG   PRO  54          2HG       PRO  54   3.220  -6.655   9.863
  415   2HG   PRO  54          1HG       PRO  54   1.527  -6.386  10.311
  416   1HD   PRO  54          2HD       PRO  54   2.366  -8.320   8.515
  417   2HD   PRO  54          1HD       PRO  54   0.731  -7.617   8.530
  418    H    GLU  55           H        GLU  55   4.367  -7.045   7.457
  419    HA   GLU  55           HA       GLU  55   6.602  -5.227   7.065
  420   1HB   GLU  55          2HB       GLU  55   6.758  -8.241   7.105
  421   2HB   GLU  55          1HB       GLU  55   8.007  -7.074   7.533
  422   1HG   GLU  55          2HG       GLU  55   6.489  -6.312   9.425
  423   2HG   GLU  55          1HG       GLU  55   5.479  -7.713   9.069
  424    H    GLU  56           H        GLU  56   4.809  -7.665   5.255
  425    HA   GLU  56           HA       GLU  56   6.584  -7.842   3.030
  426   1HB   GLU  56          2HB       GLU  56   3.735  -8.624   3.539
  427   2HB   GLU  56          1HB       GLU  56   4.341  -8.616   1.882
  428   1HG   GLU  56          2HG       GLU  56   6.024  -9.930   3.976
  429   2HG   GLU  56          1HG       GLU  56   4.577 -10.777   3.430
  430    H    LEU  57           H        LEU  57   3.416  -6.181   3.381
  431    HA   LEU  57           HA       LEU  57   3.511  -4.812   0.927
  432   1HB   LEU  57          2HB       LEU  57   1.819  -3.338   1.850
  433   2HB   LEU  57          1HB       LEU  57   1.466  -5.010   2.219
  434    HG   LEU  57           HG       LEU  57   2.726  -4.367   4.494
  435   1HD1  LEU  57          1HD1      LEU  57   3.228  -2.146   4.463
  436   2HD1  LEU  57          2HD1      LEU  57   1.515  -1.933   4.829
  437   3HD1  LEU  57          3HD1      LEU  57   2.083  -1.811   3.164
  438   1HD2  LEU  57          1HD2      LEU  57   0.433  -5.246   4.272
  439   2HD2  LEU  57          2HD2      LEU  57  -0.141  -3.644   3.813
  440   3HD2  LEU  57          3HD2      LEU  57   0.482  -3.925   5.439
  441    H    GLN  58           H        GLN  58   5.009  -4.085   4.022
  442    HA   GLN  58           HA       GLN  58   5.537  -1.361   3.754
  443   1HB   GLN  58          2HB       GLN  58   6.335  -3.391   5.513
  444   2HB   GLN  58          1HB       GLN  58   7.837  -2.749   4.850
  445   1HG   GLN  58          2HG       GLN  58   5.616  -1.088   6.083
  446   2HG   GLN  58          1HG       GLN  58   7.139  -1.498   6.870
  447   1HE2  GLN  58          1HE2      GLN  58   5.656   0.544   4.405
  448   2HE2  GLN  58          2HE2      GLN  58   7.039   1.471   4.080
  449    H    GLU  59           H        GLU  59   7.500  -4.124   2.644
  450    HA   GLU  59           HA       GLU  59   9.565  -2.601   1.450
  451   1HB   GLU  59          2HB       GLU  59   8.584  -5.422   1.057
  452   2HB   GLU  59          1HB       GLU  59   9.865  -4.756   0.043
  453   1HG   GLU  59          2HG       GLU  59  10.059  -4.476   3.028
  454   2HG   GLU  59          1HG       GLU  59  10.489  -6.009   2.273
  455    H    MET  60           H        MET  60   6.487  -3.838   0.204
  456    HA   MET  60           HA       MET  60   6.866  -3.256  -2.528
  457   1HB   MET  60          2HB       MET  60   4.273  -3.197  -0.959
  458   2HB   MET  60          1HB       MET  60   4.421  -3.307  -2.711
  459   1HG   MET  60          2HG       MET  60   5.759  -5.428  -2.369
  460   2HG   MET  60          1HG       MET  60   5.322  -5.348  -0.664
  461   1HE   MET  60          1HE       MET  60   3.073  -7.227  -0.104
  462   2HE   MET  60          2HE       MET  60   4.684  -7.458  -0.779
  463   3HE   MET  60          3HE       MET  60   3.292  -8.198  -1.566
  464    H    ILE  61           H        ILE  61   5.512  -1.301   0.117
  465    HA   ILE  61           HA       ILE  61   4.692   0.937  -1.325
  466    HB   ILE  61           HB       ILE  61   5.815   0.702   1.470
  467   1HG1  ILE  61          2HG1      ILE  61   2.966   1.300   0.879
  468   2HG1  ILE  61          1HG1      ILE  61   3.522  -0.327   0.488
  469   1HG2  ILE  61          1HG2      ILE  61   4.503   2.923   1.726
  470   2HG2  ILE  61          2HG2      ILE  61   4.657   3.045  -0.027
  471   3HG2  ILE  61          3HG2      ILE  61   6.103   2.979   0.984
  472   1HD1  ILE  61          1HD1      ILE  61   4.275  -0.695   2.736
  473   2HD1  ILE  61          2HD1      ILE  61   2.631  -0.066   2.836
  474   3HD1  ILE  61          3HD1      ILE  61   4.003   0.992   3.167
  475    H    ASP  62           H        ASP  62   7.687   0.848   0.616
  476    HA   ASP  62           HA       ASP  62   8.920   3.091  -0.406
  477   1HB   ASP  62          2HB       ASP  62  10.206   0.510   0.514
  478   2HB   ASP  62          1HB       ASP  62  11.081   2.014   0.236
  479    H    GLU  63           H        GLU  63   8.882  -0.177  -1.779
  480    HA   GLU  63           HA       GLU  63  10.835   0.196  -3.785
  481   1HB   GLU  63          2HB       GLU  63   8.552  -1.701  -3.399
  482   2HB   GLU  63          1HB       GLU  63   9.342  -1.630  -4.974
  483   1HG   GLU  63          2HG       GLU  63  11.517  -2.066  -3.926
  484   2HG   GLU  63          1HG       GLU  63  10.761  -2.086  -2.332
  485    H    VAL  64           H        VAL  64   7.269   0.483  -3.960
  486    HA   VAL  64           HA       VAL  64   7.322   1.431  -6.678
  487    HB   VAL  64           HB       VAL  64   4.936   1.755  -6.453
  488   1HG1  VAL  64          1HG1      VAL  64   5.965  -0.736  -5.071
  489   2HG1  VAL  64          2HG1      VAL  64   5.604  -0.539  -6.784
  490   3HG1  VAL  64          3HG1      VAL  64   4.297  -0.531  -5.602
  491   1HG2  VAL  64          1HG2      VAL  64   5.233   1.112  -3.509
  492   2HG2  VAL  64          2HG2      VAL  64   3.771   1.615  -4.354
  493   3HG2  VAL  64          3HG2      VAL  64   5.095   2.758  -4.128
  494    H    ASP  65           H        ASP  65   7.482   2.978  -3.545
  495    HA   ASP  65           HA       ASP  65   6.603   5.558  -4.396
  496   1HB   ASP  65          2HB       ASP  65   7.119   4.439  -1.949
  497   2HB   ASP  65          1HB       ASP  65   8.521   5.486  -2.159
  498    H    GLU  66           H        GLU  66   7.692   5.934  -6.327
  499    HA   GLU  66           HA       GLU  66  10.475   5.811  -6.729
  500   1HB   GLU  66          2HB       GLU  66   8.288   7.374  -8.087
  501   2HB   GLU  66          1HB       GLU  66   9.973   7.517  -8.588
  502   1HG   GLU  66          2HG       GLU  66   9.980   5.468  -9.567
  503   2HG   GLU  66          1HG       GLU  66   9.079   4.734  -8.240
  504    H    ASP  67           H        ASP  67   8.429   8.534  -5.685
  505    HA   ASP  67           HA       ASP  67  10.701  10.330  -5.530
  506   1HB   ASP  67          2HB       ASP  67   8.994  11.877  -4.415
  507   2HB   ASP  67          1HB       ASP  67   8.684  11.432  -6.091
  508    H    GLY  68           H        GLY  68   8.777   8.405  -3.272
  509   1HA   GLY  68          2HA       GLY  68   9.252   7.726  -1.116
  510   2HA   GLY  68          1HA       GLY  68  10.849   8.447  -1.295
  511    H    SER  69           H        SER  69   7.522   9.730  -1.363
  512    HA   SER  69           HA       SER  69   8.359  12.017   0.240
  513   1HB   SER  69          2HB       SER  69   5.992  12.783  -0.170
  514   2HB   SER  69          1HB       SER  69   6.948  12.541  -1.627
  515    HG   SER  69           HG       SER  69   5.052  11.494  -1.989
  516    H    GLY  70           H        GLY  70   5.899   9.446   0.404
  517   1HA   GLY  70          2HA       GLY  70   6.027   8.520   2.891
  518   2HA   GLY  70          1HA       GLY  70   5.298  10.096   3.191
  519    H    THR  71           H        THR  71   3.914  10.031   0.551
  520    HA   THR  71           HA       THR  71   1.718   8.205   1.302
  521    HB   THR  71           HB       THR  71   0.234   9.713   0.088
  522    HG1  THR  71           HG1      THR  71   1.032  11.505  -0.934
  523   1HG2  THR  71          1HG2      THR  71   0.468  11.710   1.523
  524   2HG2  THR  71          2HG2      THR  71   2.102  11.200   1.955
  525   3HG2  THR  71          3HG2      THR  71   0.715  10.226   2.444
  526    H    VAL  72           H        VAL  72   0.665   7.006  -0.327
  527    HA   VAL  72           HA       VAL  72   2.413   6.353  -2.594
  528    HB   VAL  72           HB       VAL  72  -0.143   4.967  -1.763
  529   1HG1  VAL  72          1HG1      VAL  72   2.223   4.029  -3.410
  530   2HG1  VAL  72          2HG1      VAL  72   0.690   4.581  -4.085
  531   3HG1  VAL  72          3HG1      VAL  72   0.744   3.124  -3.093
  532   1HG2  VAL  72          1HG2      VAL  72   1.466   3.289  -0.743
  533   2HG2  VAL  72          2HG2      VAL  72   1.357   4.825   0.117
  534   3HG2  VAL  72          3HG2      VAL  72   2.735   4.498  -0.936
  535    H    ASP  73           H        ASP  73   2.075   7.163  -4.537
  536    HA   ASP  73           HA       ASP  73  -0.363   8.647  -5.129
  537   1HB   ASP  73          2HB       ASP  73   2.014   8.108  -6.931
  538   2HB   ASP  73          1HB       ASP  73   0.764   9.326  -7.168
  539    H    PHE  74           H        PHE  74  -1.280   8.293  -7.441
  540    HA   PHE  74           HA       PHE  74  -2.406   5.702  -7.550
  541   1HB   PHE  74          2HB       PHE  74  -3.330   7.884  -8.563
  542   2HB   PHE  74          1HB       PHE  74  -2.272   7.548  -9.932
  543    HD1  PHE  74           HD1      PHE  74  -3.804   6.975 -11.643
  544    HD2  PHE  74           HD2      PHE  74  -4.102   5.075  -7.799
  545    HE1  PHE  74           HE1      PHE  74  -5.477   5.388 -12.553
  546    HE2  PHE  74           HE2      PHE  74  -5.769   3.488  -8.714
  547    HZ   PHE  74           HZ       PHE  74  -6.459   3.644 -11.090
  548    H    ASP  75           H        ASP  75   0.363   7.151  -9.213
  549    HA   ASP  75           HA       ASP  75   0.796   5.024 -11.062
  550   1HB   ASP  75          2HB       ASP  75   2.335   7.382 -10.109
  551   2HB   ASP  75          1HB       ASP  75   3.276   6.051 -10.780
  552    H    GLU  76           H        GLU  76   1.929   5.703  -7.783
  553    HA   GLU  76           HA       GLU  76   3.681   3.397  -7.667
  554   1HB   GLU  76          2HB       GLU  76   2.668   4.878  -5.252
  555   2HB   GLU  76          1HB       GLU  76   4.223   4.085  -5.490
  556   1HG   GLU  76          2HG       GLU  76   4.803   5.814  -7.196
  557   2HG   GLU  76          1HG       GLU  76   3.279   6.627  -6.850
  558    H    PHE  77           H        PHE  77   0.354   4.067  -7.123
  559    HA   PHE  77           HA       PHE  77  -0.219   1.916  -5.305
  560   1HB   PHE  77          2HB       PHE  77  -1.598   3.956  -5.409
  561   2HB   PHE  77          1HB       PHE  77  -2.047   3.575  -7.068
  562    HD1  PHE  77           HD1      PHE  77  -3.856   2.140  -7.532
  563    HD2  PHE  77           HD2      PHE  77  -2.198   2.275  -3.568
  564    HE1  PHE  77           HE1      PHE  77  -5.729   0.742  -6.699
  565    HE2  PHE  77           HE2      PHE  77  -4.068   0.876  -2.741
  566    HZ   PHE  77           HZ       PHE  77  -5.832   0.110  -4.302
  567    H    LEU  78           H        LEU  78  -0.401   2.392  -8.816
  568    HA   LEU  78           HA       LEU  78  -1.677  -0.165  -9.289
  569   1HB   LEU  78          2HB       LEU  78  -0.459   1.889 -11.119
  570   2HB   LEU  78          1HB       LEU  78  -1.166   0.394 -11.696
  571    HG   LEU  78           HG       LEU  78  -2.958   1.905  -9.933
  572   1HD1  LEU  78          1HD1      LEU  78  -2.876   3.188 -12.565
  573   2HD1  LEU  78          2HD1      LEU  78  -1.422   3.489 -11.613
  574   3HD1  LEU  78          3HD1      LEU  78  -3.005   3.913 -10.963
  575   1HD2  LEU  78          1HD2      LEU  78  -4.562   1.295 -11.592
  576   2HD2  LEU  78          2HD2      LEU  78  -3.458  -0.075 -11.480
  577   3HD2  LEU  78          3HD2      LEU  78  -3.315   1.063 -12.819
  578    H    VAL  79           H        VAL  79   1.617   1.138  -9.543
  579    HA   VAL  79           HA       VAL  79   2.800  -1.052 -10.872
  580    HB   VAL  79           HB       VAL  79   4.935  -0.301  -9.777
  581   1HG1  VAL  79          1HG1      VAL  79   3.132   1.575 -11.294
  582   2HG1  VAL  79          2HG1      VAL  79   4.514   0.654 -11.885
  583   3HG1  VAL  79          3HG1      VAL  79   4.769   2.059 -10.850
  584   1HG2  VAL  79          1HG2      VAL  79   3.933   0.544  -7.685
  585   2HG2  VAL  79          2HG2      VAL  79   3.122   1.816  -8.592
  586   3HG2  VAL  79          3HG2      VAL  79   4.881   1.791  -8.490
  587    H    MET  80           H        MET  80   1.784  -0.638  -7.585
  588    HA   MET  80           HA       MET  80   3.265  -2.352  -6.072
  589   1HB   MET  80          2HB       MET  80   0.354  -1.687  -6.120
  590   2HB   MET  80          1HB       MET  80   0.903  -2.988  -5.066
  591   1HG   MET  80          2HG       MET  80   2.766  -1.193  -4.419
  592   2HG   MET  80          1HG       MET  80   1.515  -0.067  -4.944
  593   1HE   MET  80          1HE       MET  80  -1.541  -1.018  -2.972
  594   2HE   MET  80          2HE       MET  80  -0.864  -0.615  -4.547
  595   3HE   MET  80          3HE       MET  80  -0.709   0.525  -3.212
  596    H    MET  81           H        MET  81   0.900  -3.261  -8.542
  597    HA   MET  81           HA       MET  81   0.928  -6.065  -7.829
  598   1HB   MET  81          2HB       MET  81  -0.310  -4.436 -10.016
  599   2HB   MET  81          1HB       MET  81  -0.206  -6.187 -10.193
  600   1HG   MET  81          2HG       MET  81  -1.106  -5.569  -7.532
  601   2HG   MET  81          1HG       MET  81  -2.115  -4.707  -8.692
  602   1HE   MET  81          1HE       MET  81  -2.863  -5.631 -10.776
  603   2HE   MET  81          2HE       MET  81  -3.611  -7.215 -10.957
  604   3HE   MET  81          3HE       MET  81  -1.898  -7.012 -11.316
  605    H    VAL  82           H        VAL  82   2.250  -4.150 -10.547
  606    HA   VAL  82           HA       VAL  82   3.543  -6.388 -11.777
  607    HB   VAL  82           HB       VAL  82   4.757  -4.640 -13.115
  608   1HG1  VAL  82          1HG1      VAL  82   2.429  -5.622 -13.598
  609   2HG1  VAL  82          2HG1      VAL  82   2.847  -4.115 -14.412
  610   3HG1  VAL  82          3HG1      VAL  82   1.791  -4.092 -12.997
  611   1HG2  VAL  82          1HG2      VAL  82   4.195  -2.321 -12.825
  612   2HG2  VAL  82          2HG2      VAL  82   4.677  -2.926 -11.241
  613   3HG2  VAL  82          3HG2      VAL  82   2.969  -2.706 -11.620
  614    H    ARG  83           H        ARG  83   4.570  -4.069  -9.327
  615    HA   ARG  83           HA       ARG  83   7.361  -4.406  -9.556
  616   1HB   ARG  83          2HB       ARG  83   7.519  -3.559  -7.281
  617   2HB   ARG  83          1HB       ARG  83   6.307  -2.638  -8.168
  618   1HG   ARG  83          2HG       ARG  83   4.994  -3.071  -6.361
  619   2HG   ARG  83          1HG       ARG  83   4.769  -4.641  -7.130
  620   1HD   ARG  83          2HD       ARG  83   7.162  -4.958  -5.782
  621   2HD   ARG  83          1HD       ARG  83   6.229  -3.952  -4.680
  622    HE   ARG  83           HE       ARG  83   4.453  -5.892  -5.313
  623   1HH1  ARG  83          2HH1      ARG  83   7.795  -5.990  -4.293
  624   2HH1  ARG  83          1HH1      ARG  83   7.639  -7.527  -3.514
  625   1HH2  ARG  83          1HH2      ARG  83   4.275  -7.901  -4.282
  626   2HH2  ARG  83          2HH2      ARG  83   5.654  -8.606  -3.506
  627    H    CYS  84           H        CYS  84   4.907  -6.507  -8.263
  628    HA   CYS  84           HA       CYS  84   6.567  -8.114  -6.589
  629   1HB   CYS  84          2HB       CYS  84   4.040  -8.082  -6.550
  630   2HB   CYS  84          1HB       CYS  84   4.072  -9.003  -8.055
  631    HG   CYS  84           HG       CYS  84   4.086 -10.433  -5.633
  632    H    MET  85           H        MET  85   5.694  -8.192 -10.009
  633    HA   MET  85           HA       MET  85   7.366 -10.575 -10.442
  634   1HB   MET  85          2HB       MET  85   5.221  -9.187 -12.013
  635   2HB   MET  85          1HB       MET  85   6.403 -10.186 -12.860
  636   1HG   MET  85          2HG       MET  85   5.859 -12.045 -11.229
  637   2HG   MET  85          1HG       MET  85   4.531 -11.044 -10.640
  638   1HE   MET  85          1HE       MET  85   3.012 -13.959 -12.845
  639   2HE   MET  85          2HE       MET  85   2.928 -13.167 -11.272
  640   3HE   MET  85          3HE       MET  85   4.424 -13.948 -11.779
  641    H    LYS  86           H        LYS  86   9.084  -8.789  -9.751
  642    HA   LYS  86           HA       LYS  86   9.900  -6.858 -11.665
  643   1HB   LYS  86          2HB       LYS  86  12.053  -6.834 -10.434
  644   2HB   LYS  86          1HB       LYS  86  10.666  -6.711  -9.355
  645   1HG   LYS  86          2HG       LYS  86  11.021  -8.783  -8.434
  646   2HG   LYS  86          1HG       LYS  86  11.638  -9.463  -9.939
  647   1HD   LYS  86          2HD       LYS  86  13.653  -9.329  -8.876
  648   2HD   LYS  86          1HD       LYS  86  13.588  -7.643  -9.389
  649   1HE   LYS  86          2HE       LYS  86  12.347  -8.516  -6.782
  650   2HE   LYS  86          1HE       LYS  86  14.065  -8.135  -6.884
  651   1HZ   LYS  86          1HZ       LYS  86  11.765  -6.351  -7.432
  652   2HZ   LYS  86          2HZ       LYS  86  13.343  -5.978  -7.942
  653   3HZ   LYS  86          3HZ       LYS  86  12.999  -6.149  -6.287
  654    H    ASP  87           H        ASP  87  11.845  -6.882 -12.973
  655    HA   ASP  87           HA       ASP  87  12.220  -9.496 -14.274
  656   1HB   ASP  87          2HB       ASP  87  11.560  -7.515 -15.663
  657   2HB   ASP  87          1HB       ASP  87  13.098  -6.765 -15.244
  658    H    ASP  88           H        ASP  88  14.296  -6.663 -13.541
  659    HA   ASP  88           HA       ASP  88  16.508  -6.508 -12.940
  660   1HB   ASP  88          2HB       ASP  88  15.353  -7.900 -10.992
  661   2HB   ASP  88          1HB       ASP  88  16.397  -9.183 -11.603
  662    H    SER  89           HN       SER  89  16.185  -7.395 -15.492
  663    HA   SER  89           HA       SER  89  18.517  -9.152 -15.824
  664   1HB   SER  89          2HB       SER  89  16.338 -10.494 -15.968
  665   2HB   SER  89          1HB       SER  89  16.017  -9.605 -17.453
  666    HG   SER  89           HG       SER  89  17.252 -11.060 -18.333
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  16.165   0.760 -16.719
    2   2H    MET   1          2H        MET   1  17.448   0.284 -17.724
    3   3H    MET   1          3H        MET   1  16.610  -0.874 -16.805
    4    HA   MET   1           HA       MET   1  15.268   0.780 -18.861
    5   1HB   MET   1          2HB       MET   1  15.469  -1.322 -20.302
    6   2HB   MET   1          1HB       MET   1  16.943  -0.378 -20.112
    7   1HG   MET   1          2HG       MET   1  17.974  -1.989 -18.832
    8   2HG   MET   1          1HG       MET   1  16.462  -2.528 -18.104
    9   1HE   MET   1          1HE       MET   1  16.525  -5.450 -18.740
   10   2HE   MET   1          2HE       MET   1  15.152  -5.237 -19.824
   11   3HE   MET   1          3HE       MET   1  15.348  -4.165 -18.440
   12    H    ASN   2           H        ASN   2  13.551   0.814 -17.284
   13    HA   ASN   2           HA       ASN   2  12.385  -1.653 -16.345
   14   1HB   ASN   2          2HB       ASN   2  11.876   1.227 -15.988
   15   2HB   ASN   2          1HB       ASN   2  10.425   0.224 -15.985
   16   1HD2  ASN   2          1HD2      ASN   2  13.783  -0.221 -14.701
   17   2HD2  ASN   2          2HD2      ASN   2  13.271  -0.700 -13.157
   18    H    ASP   3           H        ASP   3  11.664  -2.955 -17.942
   19    HA   ASP   3           HA       ASP   3   9.740  -1.814 -19.884
   20   1HB   ASP   3          2HB       ASP   3  11.698  -4.097 -20.152
   21   2HB   ASP   3          1HB       ASP   3  10.355  -3.866 -21.271
   22    H    ILE   4           H        ILE   4   9.406  -3.070 -17.072
   23    HA   ILE   4           HA       ILE   4   7.847  -5.459 -17.653
   24    HB   ILE   4           HB       ILE   4   7.578  -5.748 -15.331
   25   1HG1  ILE   4          2HG1      ILE   4   6.852  -3.305 -14.981
   26   2HG1  ILE   4          1HG1      ILE   4   7.744  -4.063 -13.666
   27   1HG2  ILE   4          1HG2      ILE   4   9.835  -5.582 -14.437
   28   2HG2  ILE   4          2HG2      ILE   4  10.264  -4.382 -15.656
   29   3HG2  ILE   4          3HG2      ILE   4   9.908  -6.039 -16.138
   30   1HD1  ILE   4          1HD1      ILE   4   8.643  -1.948 -15.600
   31   2HD1  ILE   4          2HD1      ILE   4   9.843  -3.036 -14.904
   32   3HD1  ILE   4          3HD1      ILE   4   8.856  -2.024 -13.852
   33    H    TYR   5           H        TYR   5   7.320  -2.051 -17.173
   34    HA   TYR   5           HA       TYR   5   4.529  -2.154 -16.569
   35   1HB   TYR   5          2HB       TYR   5   6.034   0.113 -17.900
   36   2HB   TYR   5          1HB       TYR   5   4.520   0.219 -17.004
   37    HD1  TYR   5           HD1      TYR   5   4.765  -1.081 -14.569
   38    HD2  TYR   5           HD2      TYR   5   7.879   0.922 -16.742
   39    HE1  TYR   5           HE1      TYR   5   6.034  -0.764 -12.460
   40    HE2  TYR   5           HE2      TYR   5   9.147   1.235 -14.638
   41    HH   TYR   5           HH       TYR   5   9.016  -0.284 -12.166
   42    H    LYS   6           H        LYS   6   6.430  -2.078 -19.519
   43    HA   LYS   6           HA       LYS   6   4.168  -1.640 -21.271
   44   1HB   LYS   6          2HB       LYS   6   6.839  -2.749 -22.128
   45   2HB   LYS   6          1HB       LYS   6   5.702  -1.781 -23.064
   46   1HG   LYS   6          2HG       LYS   6   7.484  -0.876 -20.793
   47   2HG   LYS   6          1HG       LYS   6   7.465  -0.290 -22.455
   48   1HD   LYS   6          2HD       LYS   6   5.400   0.844 -22.149
   49   2HD   LYS   6          1HD       LYS   6   5.050  -0.034 -20.658
   50   1HE   LYS   6          2HE       LYS   6   5.777   2.077 -19.894
   51   2HE   LYS   6          1HE       LYS   6   7.214   1.068 -19.747
   52   1HZ   LYS   6          1HZ       LYS   6   8.006   1.910 -21.849
   53   2HZ   LYS   6          2HZ       LYS   6   7.679   3.209 -20.804
   54   3HZ   LYS   6          3HZ       LYS   6   6.597   2.830 -22.057
   55    H    ALA   7           H        ALA   7   6.044  -4.362 -20.089
   56    HA   ALA   7           HA       ALA   7   4.800  -6.314 -21.808
   57   1HB   ALA   7          1HB       ALA   7   6.619  -6.445 -19.420
   58   2HB   ALA   7          2HB       ALA   7   6.909  -6.999 -21.070
   59   3HB   ALA   7          3HB       ALA   7   5.826  -7.905 -20.013
   60    H    ALA   8           H        ALA   8   4.142  -4.935 -18.644
   61    HA   ALA   8           HA       ALA   8   2.176  -6.964 -17.962
   62   1HB   ALA   8          1HB       ALA   8   1.773  -5.415 -15.987
   63   2HB   ALA   8          2HB       ALA   8   3.106  -4.436 -16.600
   64   3HB   ALA   8          3HB       ALA   8   3.391  -6.106 -16.108
   65    H    VAL   9           H        VAL   9   2.222  -3.742 -19.391
   66    HA   VAL   9           HA       VAL   9  -0.394  -2.916 -18.887
   67    HB   VAL   9           HB       VAL   9   1.486  -1.625 -20.066
   68   1HG1  VAL   9          1HG1      VAL   9   1.838  -1.875 -22.337
   69   2HG1  VAL   9          2HG1      VAL   9   0.221  -2.518 -22.624
   70   3HG1  VAL   9          3HG1      VAL   9   1.464  -3.543 -21.911
   71   1HG2  VAL   9          1HG2      VAL   9  -1.255  -1.459 -21.341
   72   2HG2  VAL   9          2HG2      VAL   9  -0.105  -0.145 -21.091
   73   3HG2  VAL   9          3HG2      VAL   9  -0.915  -0.882 -19.709
   74    H    GLU  10           H        GLU  10   0.779  -5.250 -21.258
   75    HA   GLU  10           HA       GLU  10  -1.729  -5.467 -22.662
   76   1HB   GLU  10          2HB       GLU  10   0.721  -7.245 -22.626
   77   2HB   GLU  10          1HB       GLU  10  -0.677  -7.507 -23.670
   78   1HG   GLU  10          2HG       GLU  10  -0.257  -4.952 -24.286
   79   2HG   GLU  10          1HG       GLU  10   1.383  -5.339 -23.768
   80    H    GLN  11           H        GLN  11  -0.422  -6.809 -19.753
   81    HA   GLN  11           HA       GLN  11  -2.232  -9.091 -19.722
   82   1HB   GLN  11          2HB       GLN  11  -0.381  -8.106 -17.542
   83   2HB   GLN  11          1HB       GLN  11  -1.178  -9.676 -17.620
   84   1HG   GLN  11          2HG       GLN  11   0.814  -8.661 -19.670
   85   2HG   GLN  11          1HG       GLN  11   1.211  -9.766 -18.355
   86   1HE2  GLN  11          1HE2      GLN  11  -0.048  -9.587 -21.570
   87   2HE2  GLN  11          2HE2      GLN  11  -0.520 -11.210 -21.705
   88    H    LEU  12           H        LEU  12  -1.807  -5.999 -18.039
   89    HA   LEU  12           HA       LEU  12  -3.891  -6.337 -16.153
   90   1HB   LEU  12          2HB       LEU  12  -2.836  -3.772 -17.338
   91   2HB   LEU  12          1HB       LEU  12  -3.795  -3.913 -15.882
   92    HG   LEU  12           HG       LEU  12  -1.409  -5.564 -15.724
   93   1HD1  LEU  12          1HD1      LEU  12  -0.683  -3.680 -17.301
   94   2HD1  LEU  12          2HD1      LEU  12   0.272  -3.886 -15.833
   95   3HD1  LEU  12          3HD1      LEU  12  -0.919  -2.589 -15.935
   96   1HD2  LEU  12          1HD2      LEU  12  -1.132  -4.231 -13.638
   97   2HD2  LEU  12          2HD2      LEU  12  -2.763  -4.884 -13.799
   98   3HD2  LEU  12          3HD2      LEU  12  -2.454  -3.185 -14.156
   99    H    THR  13           H        THR  13  -6.008  -5.719 -16.147
  100    HA   THR  13           HA       THR  13  -7.213  -5.207 -18.798
  101    HB   THR  13           HB       THR  13  -9.340  -5.900 -17.320
  102    HG1  THR  13           HG1      THR  13  -8.771  -6.760 -15.512
  103   1HG2  THR  13          1HG2      THR  13  -7.300  -7.646 -18.691
  104   2HG2  THR  13          2HG2      THR  13  -8.847  -7.068 -19.312
  105   3HG2  THR  13          3HG2      THR  13  -8.810  -8.304 -18.055
  106    H    ASP  14           H        ASP  14  -9.267  -3.943 -18.734
  107    HA   ASP  14           HA       ASP  14  -8.825  -1.369 -17.614
  108   1HB   ASP  14          2HB       ASP  14 -11.291  -2.631 -18.830
  109   2HB   ASP  14          1HB       ASP  14 -11.203  -0.939 -18.339
  110    H    GLU  15           H        GLU  15 -10.621  -4.195 -16.552
  111    HA   GLU  15           HA       GLU  15 -12.182  -2.967 -14.533
  112   1HB   GLU  15          2HB       GLU  15 -11.405  -5.736 -15.240
  113   2HB   GLU  15          1HB       GLU  15 -11.859  -5.468 -13.558
  114   1HG   GLU  15          2HG       GLU  15 -13.546  -4.511 -15.885
  115   2HG   GLU  15          1HG       GLU  15 -13.777  -6.081 -15.115
  116    H    GLN  16           H        GLN  16  -8.941  -4.468 -14.458
  117    HA   GLN  16           HA       GLN  16  -8.561  -4.290 -11.668
  118   1HB   GLN  16          2HB       GLN  16  -6.393  -4.967 -12.031
  119   2HB   GLN  16          1HB       GLN  16  -7.122  -5.478 -13.546
  120   1HG   GLN  16          2HG       GLN  16  -5.322  -4.343 -14.410
  121   2HG   GLN  16          1HG       GLN  16  -6.422  -2.977 -14.255
  122   1HE2  GLN  16          1HE2      GLN  16  -4.192  -4.781 -12.035
  123   2HE2  GLN  16          2HE2      GLN  16  -3.519  -3.380 -11.355
  124    H    LYS  17           H        LYS  17  -8.106  -1.924 -14.245
  125    HA   LYS  17           HA       LYS  17  -6.819   0.020 -12.533
  126   1HB   LYS  17          2HB       LYS  17  -7.716  -0.086 -15.363
  127   2HB   LYS  17          1HB       LYS  17  -7.673   1.509 -14.610
  128   1HG   LYS  17          2HG       LYS  17  -5.467   1.494 -15.141
  129   2HG   LYS  17          1HG       LYS  17  -5.295   0.416 -13.755
  130   1HD   LYS  17          2HD       LYS  17  -4.358  -0.979 -15.306
  131   2HD   LYS  17          1HD       LYS  17  -6.041  -1.377 -15.650
  132   1HE   LYS  17          2HE       LYS  17  -4.825   0.982 -17.040
  133   2HE   LYS  17          1HE       LYS  17  -4.396  -0.635 -17.599
  134   1HZ   LYS  17          1HZ       LYS  17  -6.300   0.112 -18.801
  135   2HZ   LYS  17          2HZ       LYS  17  -7.128   0.506 -17.372
  136   3HZ   LYS  17          3HZ       LYS  17  -6.801  -1.119 -17.747
  137    H    ASN  18           H        ASN  18 -10.080  -0.665 -13.695
  138    HA   ASN  18           HA       ASN  18 -11.359   1.702 -12.816
  139   1HB   ASN  18          2HB       ASN  18 -12.208  -1.027 -13.618
  140   2HB   ASN  18          1HB       ASN  18 -13.332  -0.145 -12.582
  141   1HD2  ASN  18          1HD2      ASN  18 -12.446  -0.595 -15.812
  142   2HD2  ASN  18          2HD2      ASN  18 -13.122   0.823 -16.457
  143    H    GLU  19           H        GLU  19 -10.677  -1.389 -11.224
  144    HA   GLU  19           HA       GLU  19 -12.043  -0.761  -8.776
  145   1HB   GLU  19          2HB       GLU  19  -9.840  -2.795  -9.250
  146   2HB   GLU  19          1HB       GLU  19 -10.936  -2.742  -7.870
  147   1HG   GLU  19          2HG       GLU  19 -12.118  -2.840 -10.619
  148   2HG   GLU  19          1HG       GLU  19 -11.444  -4.321  -9.942
  149    H    PHE  20           H        PHE  20  -8.730  -0.537  -9.965
  150    HA   PHE  20           HA       PHE  20  -7.463   0.170  -7.542
  151   1HB   PHE  20          2HB       PHE  20  -6.798   0.460 -10.442
  152   2HB   PHE  20          1HB       PHE  20  -5.850   1.370  -9.269
  153    HD1  PHE  20           HD1      PHE  20  -7.348  -1.805  -8.222
  154    HD2  PHE  20           HD2      PHE  20  -3.848   0.047  -9.885
  155    HE1  PHE  20           HE1      PHE  20  -6.032  -3.834  -7.707
  156    HE2  PHE  20           HE2      PHE  20  -2.530  -1.980  -9.367
  157    HZ   PHE  20           HZ       PHE  20  -3.619  -3.926  -8.275
  158    H    LYS  21           H        LYS  21  -8.889   2.170 -10.127
  159    HA   LYS  21           HA       LYS  21  -8.184   4.672  -8.992
  160   1HB   LYS  21          2HB       LYS  21  -9.196   4.020 -11.375
  161   2HB   LYS  21          1HB       LYS  21 -10.702   4.460 -10.567
  162   1HG   LYS  21          2HG       LYS  21  -8.256   6.229 -10.470
  163   2HG   LYS  21          1HG       LYS  21  -9.451   6.360 -11.760
  164   1HD   LYS  21          2HD       LYS  21 -11.166   6.478  -9.769
  165   2HD   LYS  21          1HD       LYS  21  -9.745   6.945  -8.831
  166   1HE   LYS  21          2HE       LYS  21 -10.277   9.044  -9.552
  167   2HE   LYS  21          1HE       LYS  21  -9.430   8.538 -11.013
  168   1HZ   LYS  21          1HZ       LYS  21 -12.355   8.386 -10.519
  169   2HZ   LYS  21          2HZ       LYS  21 -11.576   7.756 -11.892
  170   3HZ   LYS  21          3HZ       LYS  21 -11.561   9.428 -11.598
  171    H    ALA  22           H        ALA  22 -11.189   2.762  -8.837
  172    HA   ALA  22           HA       ALA  22 -12.620   4.534  -7.166
  173   1HB   ALA  22          1HB       ALA  22 -12.831   1.568  -7.663
  174   2HB   ALA  22          2HB       ALA  22 -13.913   2.853  -8.200
  175   3HB   ALA  22          3HB       ALA  22 -13.877   2.384  -6.500
  176    H    ALA  23           H        ALA  23 -10.560   1.729  -6.411
  177    HA   ALA  23           HA       ALA  23 -10.863   1.790  -3.598
  178   1HB   ALA  23          1HB       ALA  23  -9.903  -0.172  -4.559
  179   2HB   ALA  23          2HB       ALA  23  -8.620   0.585  -3.615
  180   3HB   ALA  23          3HB       ALA  23  -8.642   0.759  -5.370
  181    H    PHE  24           H        PHE  24  -8.966   3.724  -5.786
  182    HA   PHE  24           HA       PHE  24  -7.241   4.795  -3.702
  183   1HB   PHE  24          2HB       PHE  24  -6.675   4.442  -6.234
  184   2HB   PHE  24          1HB       PHE  24  -7.518   5.972  -6.455
  185    HD1  PHE  24           HD1      PHE  24  -4.604   4.313  -4.924
  186    HD2  PHE  24           HD2      PHE  24  -6.603   8.058  -5.578
  187    HE1  PHE  24           HE1      PHE  24  -2.578   5.527  -4.175
  188    HE2  PHE  24           HE2      PHE  24  -4.575   9.271  -4.831
  189    HZ   PHE  24           HZ       PHE  24  -2.564   8.005  -4.129
  190    H    ASP  25           H        ASP  25  -9.661   6.131  -5.974
  191    HA   ASP  25           HA       ASP  25  -9.815   8.707  -4.948
  192   1HB   ASP  25          2HB       ASP  25 -10.898   7.762  -7.063
  193   2HB   ASP  25          1HB       ASP  25 -12.225   7.247  -6.020
  194    H    ILE  26           H        ILE  26 -11.552   5.805  -3.802
  195    HA   ILE  26           HA       ILE  26 -13.417   7.054  -2.138
  196    HB   ILE  26           HB       ILE  26 -13.352   4.963  -0.761
  197   1HG1  ILE  26          2HG1      ILE  26 -11.157   4.207  -2.720
  198   2HG1  ILE  26          1HG1      ILE  26 -10.940   4.486  -0.996
  199   1HG2  ILE  26          1HG2      ILE  26 -13.809   5.168  -3.669
  200   2HG2  ILE  26          2HG2      ILE  26 -14.880   4.581  -2.398
  201   3HG2  ILE  26          3HG2      ILE  26 -13.645   3.518  -3.069
  202   1HD1  ILE  26          1HD1      ILE  26 -12.512   2.274  -2.324
  203   2HD1  ILE  26          2HD1      ILE  26 -12.660   2.649  -0.607
  204   3HD1  ILE  26          3HD1      ILE  26 -11.112   2.118  -1.263
  205    H    PHE  27           H        PHE  27 -10.013   6.293  -1.544
  206    HA   PHE  27           HA       PHE  27 -10.105   7.287   1.188
  207   1HB   PHE  27          2HB       PHE  27  -7.930   6.210  -0.593
  208   2HB   PHE  27          1HB       PHE  27  -7.536   7.035   0.915
  209    HD1  PHE  27           HD1      PHE  27  -9.001   4.044  -0.598
  210    HD2  PHE  27           HD2      PHE  27  -8.290   6.119   3.093
  211    HE1  PHE  27           HE1      PHE  27  -9.537   1.978   0.663
  212    HE2  PHE  27           HE2      PHE  27  -8.826   4.053   4.356
  213    HZ   PHE  27           HZ       PHE  27  -9.452   1.985   3.140
  214    H    ILE  28           H        ILE  28  -9.223   8.448  -2.010
  215    HA   ILE  28           HA       ILE  28  -8.104  10.936  -0.931
  216    HB   ILE  28           HB       ILE  28  -8.451  10.244  -3.849
  217   1HG1  ILE  28          2HG1      ILE  28  -7.182   8.400  -3.168
  218   2HG1  ILE  28          1HG1      ILE  28  -5.945   9.574  -3.587
  219   1HG2  ILE  28          1HG2      ILE  28  -7.802  12.489  -3.656
  220   2HG2  ILE  28          2HG2      ILE  28  -6.263  11.651  -3.858
  221   3HG2  ILE  28          3HG2      ILE  28  -6.781  12.171  -2.253
  222   1HD1  ILE  28          1HD1      ILE  28  -6.804   8.630  -0.876
  223   2HD1  ILE  28          2HD1      ILE  28  -6.154  10.261  -1.044
  224   3HD1  ILE  28          3HD1      ILE  28  -5.175   8.867  -1.509
  225    H    GLN  29           H        GLN  29 -10.881  10.465  -0.447
  226    HA   GLN  29           HA       GLN  29 -12.450  11.953  -2.355
  227   1HB   GLN  29          2HB       GLN  29 -14.239  11.825  -0.611
  228   2HB   GLN  29          1HB       GLN  29 -13.579  10.254  -1.055
  229   1HG   GLN  29          2HG       GLN  29 -12.452  10.003   0.968
  230   2HG   GLN  29          1HG       GLN  29 -12.366  11.739   1.255
  231   1HE2  GLN  29          1HE2      GLN  29 -14.925   9.209   0.860
  232   2HE2  GLN  29          2HE2      GLN  29 -15.920   9.833   2.086
  233    H    ASP  30           H        ASP  30 -10.652  12.674   0.565
  234    HA   ASP  30           HA       ASP  30 -11.057  15.531   0.094
  235   1HB   ASP  30          2HB       ASP  30 -12.728  14.430   1.877
  236   2HB   ASP  30          1HB       ASP  30 -11.339  14.672   2.934
  237    H    ALA  31           H        ALA  31  -8.789  13.728  -0.242
  238    HA   ALA  31           HA       ALA  31  -6.976  14.069   1.960
  239   1HB   ALA  31          1HB       ALA  31  -6.354  13.417  -0.931
  240   2HB   ALA  31          2HB       ALA  31  -6.745  12.226   0.307
  241   3HB   ALA  31          3HB       ALA  31  -5.276  13.195   0.448
  242    H    GLU  32           H        GLU  32  -5.148  15.419   2.047
  243    HA   GLU  32           HA       GLU  32  -5.569  18.048   0.900
  244   1HB   GLU  32          2HB       GLU  32  -3.619  16.887   2.868
  245   2HB   GLU  32          1HB       GLU  32  -3.295  18.458   2.132
  246   1HG   GLU  32          2HG       GLU  32  -5.912  17.779   3.501
  247   2HG   GLU  32          1HG       GLU  32  -4.560  18.548   4.331
  248    H    ASP  33           H        ASP  33  -3.115  15.493   0.678
  249    HA   ASP  33           HA       ASP  33  -1.719  16.905  -1.472
  250   1HB   ASP  33          2HB       ASP  33  -1.170  14.304  -0.026
  251   2HB   ASP  33          1HB       ASP  33  -0.198  14.885  -1.379
  252    H    GLY  34           H        GLY  34  -3.781  14.084  -0.970
  253   1HA   GLY  34          2HA       GLY  34  -5.267  13.290  -2.670
  254   2HA   GLY  34          1HA       GLY  34  -4.134  13.864  -3.889
  255    H    CYS  35           H        CYS  35  -3.533  11.898  -0.984
  256    HA   CYS  35           HA       CYS  35  -3.102   9.486  -2.544
  257   1HB   CYS  35          2HB       CYS  35  -0.708   9.427  -1.298
  258   2HB   CYS  35          1HB       CYS  35  -0.925  10.006  -2.944
  259    HG   CYS  35           HG       CYS  35  -0.837  11.954  -0.490
  260    H    ILE  36           H        ILE  36  -2.244   7.695  -1.096
  261    HA   ILE  36           HA       ILE  36  -3.603   7.904   1.519
  262    HB   ILE  36           HB       ILE  36  -3.583   5.409   1.481
  263   1HG1  ILE  36          2HG1      ILE  36  -3.203   4.956  -1.292
  264   2HG1  ILE  36          1HG1      ILE  36  -1.811   5.890  -0.746
  265   1HG2  ILE  36          1HG2      ILE  36  -5.418   6.971   0.487
  266   2HG2  ILE  36          2HG2      ILE  36  -5.469   5.253   0.089
  267   3HG2  ILE  36          3HG2      ILE  36  -4.822   6.409  -1.076
  268   1HD1  ILE  36          1HD1      ILE  36  -0.958   4.015   0.151
  269   2HD1  ILE  36          2HD1      ILE  36  -2.416   3.113  -0.261
  270   3HD1  ILE  36          3HD1      ILE  36  -2.315   3.978   1.276
  271    H    SER  37           H        SER  37  -2.552   6.139   3.106
  272    HA   SER  37           HA       SER  37   0.214   7.033   3.468
  273   1HB   SER  37          2HB       SER  37  -1.575   7.094   5.321
  274   2HB   SER  37          1HB       SER  37  -1.360   5.348   5.408
  275    HG   SER  37           HG       SER  37   0.436   7.425   5.994
  276    H    THR  38           H        THR  38   1.885   5.560   4.011
  277    HA   THR  38           HA       THR  38   2.067   3.287   2.332
  278    HB   THR  38           HB       THR  38   4.148   2.768   3.621
  279    HG1  THR  38           HG1      THR  38   3.611   5.140   5.057
  280   1HG2  THR  38          1HG2      THR  38   3.509   5.217   2.178
  281   2HG2  THR  38          2HG2      THR  38   4.934   4.187   2.055
  282   3HG2  THR  38          3HG2      THR  38   4.861   5.443   3.288
  283    H    LYS  39           H        LYS  39   1.522   3.610   5.833
  284    HA   LYS  39           HA       LYS  39   1.342   0.810   6.361
  285   1HB   LYS  39          2HB       LYS  39   0.491   1.470   8.545
  286   2HB   LYS  39          1HB       LYS  39   1.848   2.506   8.101
  287   1HG   LYS  39          2HG       LYS  39   0.095   4.141   7.176
  288   2HG   LYS  39          1HG       LYS  39  -1.099   3.178   8.046
  289   1HD   LYS  39          2HD       LYS  39  -0.323   3.828  10.116
  290   2HD   LYS  39          1HD       LYS  39   1.330   4.049   9.544
  291   1HE   LYS  39          2HE       LYS  39   0.571   6.254   9.915
  292   2HE   LYS  39          1HE       LYS  39   0.380   6.031   8.177
  293   1HZ   LYS  39          1HZ       LYS  39  -1.787   5.574  10.152
  294   2HZ   LYS  39          2HZ       LYS  39  -1.929   5.587   8.459
  295   3HZ   LYS  39          3HZ       LYS  39  -1.579   7.023   9.297
  296    H    GLU  40           H        GLU  40  -0.901   3.158   5.119
  297    HA   GLU  40           HA       GLU  40  -3.299   1.708   5.810
  298   1HB   GLU  40          2HB       GLU  40  -2.685   4.105   4.110
  299   2HB   GLU  40          1HB       GLU  40  -4.265   3.327   4.006
  300   1HG   GLU  40          2HG       GLU  40  -4.346   3.499   6.566
  301   2HG   GLU  40          1HG       GLU  40  -2.971   4.596   6.426
  302    H    LEU  41           H        LEU  41  -0.892   1.114   3.527
  303    HA   LEU  41           HA       LEU  41  -2.371   0.374   1.236
  304   1HB   LEU  41          2HB       LEU  41   0.248   0.526   1.746
  305   2HB   LEU  41          1HB       LEU  41   0.042  -1.196   1.974
  306    HG   LEU  41           HG       LEU  41  -0.495   0.403  -0.534
  307   1HD1  LEU  41          1HD1      LEU  41   1.151  -1.493  -1.333
  308   2HD1  LEU  41          2HD1      LEU  41   1.562  -1.583   0.380
  309   3HD1  LEU  41          3HD1      LEU  41   1.786  -0.072  -0.502
  310   1HD2  LEU  41          1HD2      LEU  41  -2.255  -1.268  -0.326
  311   2HD2  LEU  41          2HD2      LEU  41  -1.075  -2.509   0.092
  312   3HD2  LEU  41          3HD2      LEU  41  -1.093  -1.822  -1.532
  313    H    GLY  42           H        GLY  42  -1.282  -1.533   4.048
  314   1HA   GLY  42          2HA       GLY  42  -2.312  -4.028   3.230
  315   2HA   GLY  42          1HA       GLY  42  -1.987  -3.559   4.894
  316    H    LYS  43           H        LYS  43  -3.945  -1.195   4.370
  317    HA   LYS  43           HA       LYS  43  -6.308  -2.604   5.297
  318   1HB   LYS  43          2HB       LYS  43  -5.578  -0.528   6.397
  319   2HB   LYS  43          1HB       LYS  43  -5.776   0.347   4.881
  320   1HG   LYS  43          2HG       LYS  43  -8.206  -1.048   5.337
  321   2HG   LYS  43          1HG       LYS  43  -7.761  -0.281   6.863
  322   1HD   LYS  43          2HD       LYS  43  -7.216   1.566   4.749
  323   2HD   LYS  43          1HD       LYS  43  -8.856   0.951   4.532
  324   1HE   LYS  43          2HE       LYS  43  -8.034   1.708   7.300
  325   2HE   LYS  43          1HE       LYS  43  -8.332   3.017   6.155
  326   1HZ   LYS  43          1HZ       LYS  43 -10.336   2.381   7.371
  327   2HZ   LYS  43          2HZ       LYS  43 -10.223   0.803   6.750
  328   3HZ   LYS  43          3HZ       LYS  43 -10.509   2.112   5.706
  329    H    VAL  44           H        VAL  44  -5.229  -0.827   2.425
  330    HA   VAL  44           HA       VAL  44  -7.846  -0.783   1.214
  331    HB   VAL  44           HB       VAL  44  -6.674   0.047  -0.797
  332   1HG1  VAL  44          1HG1      VAL  44  -6.344   2.154   0.091
  333   2HG1  VAL  44          2HG1      VAL  44  -5.437   1.542   1.475
  334   3HG1  VAL  44          3HG1      VAL  44  -7.194   1.397   1.439
  335   1HG2  VAL  44          1HG2      VAL  44  -4.571  -1.329  -0.356
  336   2HG2  VAL  44          2HG2      VAL  44  -4.143  -0.117   0.852
  337   3HG2  VAL  44          3HG2      VAL  44  -4.296   0.343  -0.843
  338    H    MET  45           H        MET  45  -5.081  -2.949   1.174
  339    HA   MET  45           HA       MET  45  -5.641  -4.416  -1.154
  340   1HB   MET  45          2HB       MET  45  -4.498  -5.524   1.423
  341   2HB   MET  45          1HB       MET  45  -4.335  -6.218  -0.189
  342   1HG   MET  45          2HG       MET  45  -3.443  -3.402   0.113
  343   2HG   MET  45          1HG       MET  45  -2.452  -4.621   0.912
  344   1HE   MET  45          1HE       MET  45  -4.264  -3.421  -1.957
  345   2HE   MET  45          2HE       MET  45  -4.474  -4.998  -2.717
  346   3HE   MET  45          3HE       MET  45  -3.350  -3.835  -3.418
  347    H    ARG  46           H        ARG  46  -7.106  -4.480   2.023
  348    HA   ARG  46           HA       ARG  46  -8.434  -6.980   1.837
  349   1HB   ARG  46          2HB       ARG  46  -9.002  -4.472   3.419
  350   2HB   ARG  46          1HB       ARG  46 -10.033  -5.899   3.525
  351   1HG   ARG  46          2HG       ARG  46  -8.030  -7.258   4.131
  352   2HG   ARG  46          1HG       ARG  46  -7.060  -5.786   4.119
  353   1HD   ARG  46          2HD       ARG  46  -7.603  -5.808   6.350
  354   2HD   ARG  46          1HD       ARG  46  -9.018  -4.952   5.747
  355    HE   ARG  46           HE       ARG  46  -9.724  -7.606   5.617
  356   1HH1  ARG  46          2HH1      ARG  46  -8.539  -5.464   8.109
  357   2HH1  ARG  46          1HH1      ARG  46  -9.337  -6.311   9.389
  358   1HH2  ARG  46          1HH2      ARG  46 -10.760  -8.699   7.312
  359   2HH2  ARG  46          2HH2      ARG  46 -10.590  -8.137   8.941
  360    H    MET  47           H        MET  47  -9.331  -3.698   0.842
  361    HA   MET  47           HA       MET  47 -12.005  -4.314   0.066
  362   1HB   MET  47          2HB       MET  47 -10.129  -2.030  -0.415
  363   2HB   MET  47          1HB       MET  47 -11.580  -2.162  -1.408
  364   1HG   MET  47          2HG       MET  47 -13.005  -2.127   0.532
  365   2HG   MET  47          1HG       MET  47 -11.623  -2.276   1.617
  366   1HE   MET  47          1HE       MET  47 -11.510   1.079   2.801
  367   2HE   MET  47          2HE       MET  47 -10.204  -0.067   2.501
  368   3HE   MET  47          3HE       MET  47 -11.778  -0.654   3.037
  369    H    LEU  48           H        LEU  48  -8.891  -4.403  -1.613
  370    HA   LEU  48           HA       LEU  48 -10.080  -4.882  -4.211
  371   1HB   LEU  48          2HB       LEU  48  -7.302  -4.793  -3.124
  372   2HB   LEU  48          1HB       LEU  48  -7.579  -5.616  -4.644
  373    HG   LEU  48           HG       LEU  48  -8.436  -2.760  -4.157
  374   1HD1  LEU  48          1HD1      LEU  48  -5.977  -3.018  -3.848
  375   2HD1  LEU  48          2HD1      LEU  48  -6.374  -2.084  -5.290
  376   3HD1  LEU  48          3HD1      LEU  48  -5.878  -3.770  -5.440
  377   1HD2  LEU  48          1HD2      LEU  48  -8.440  -2.698  -6.628
  378   2HD2  LEU  48          2HD2      LEU  48  -9.513  -3.965  -6.033
  379   3HD2  LEU  48          3HD2      LEU  48  -7.924  -4.384  -6.673
  380    H    GLY  49           H        GLY  49  -7.851  -6.874  -2.251
  381   1HA   GLY  49          2HA       GLY  49  -9.138  -9.165  -1.793
  382   2HA   GLY  49          1HA       GLY  49  -8.855  -9.306  -3.526
  383    H    GLN  50           H        GLN  50  -6.951  -8.183  -0.719
  384    HA   GLN  50           HA       GLN  50  -4.927 -10.239  -1.205
  385   1HB   GLN  50          2HB       GLN  50  -4.558  -7.363  -1.814
  386   2HB   GLN  50          1HB       GLN  50  -3.261  -8.124  -0.893
  387   1HG   GLN  50          2HG       GLN  50  -2.656  -9.508  -2.619
  388   2HG   GLN  50          1HG       GLN  50  -4.305  -9.648  -3.227
  389   1HE2  GLN  50          1HE2      GLN  50  -5.181  -7.411  -4.148
  390   2HE2  GLN  50          2HE2      GLN  50  -4.077  -6.536  -5.097
  391    H    ASN  51           H        ASN  51  -3.500 -10.542   0.566
  392    HA   ASN  51           HA       ASN  51  -3.869  -8.944   2.973
  393   1HB   ASN  51          2HB       ASN  51  -5.701 -10.814   2.811
  394   2HB   ASN  51          1HB       ASN  51  -4.381 -11.888   3.270
  395   1HD2  ASN  51          1HD2      ASN  51  -4.174 -12.137   5.497
  396   2HD2  ASN  51          2HD2      ASN  51  -4.635 -10.983   6.653
  397    HA   PRO  52           HA       PRO  52   0.328 -10.836   2.575
  398   1HB   PRO  52          2HB       PRO  52   1.701  -8.471   2.504
  399   2HB   PRO  52          1HB       PRO  52   1.042  -9.263   1.066
  400   1HG   PRO  52          2HG       PRO  52   0.107  -6.843   2.470
  401   2HG   PRO  52          1HG       PRO  52  -0.135  -7.332   0.787
  402   1HD   PRO  52          2HD       PRO  52  -2.023  -7.539   2.918
  403   2HD   PRO  52          1HD       PRO  52  -2.191  -8.192   1.273
  404    H    THR  53           H        THR  53   2.433  -9.735   3.881
  405    HA   THR  53           HA       THR  53   1.519  -9.604   6.688
  406    HB   THR  53           HB       THR  53   3.570 -10.537   7.339
  407    HG1  THR  53           HG1      THR  53   5.391 -10.086   6.377
  408   1HG2  THR  53          1HG2      THR  53   2.235 -12.134   5.972
  409   2HG2  THR  53          2HG2      THR  53   3.966 -12.464   5.920
  410   3HG2  THR  53          3HG2      THR  53   3.181 -11.665   4.559
  411    HA   PRO  54           HA       PRO  54   2.995  -5.475   7.141
  412   1HB   PRO  54          2HB       PRO  54   4.535  -5.521   9.409
  413   2HB   PRO  54          1HB       PRO  54   2.765  -5.600   9.409
  414   1HG   PRO  54          2HG       PRO  54   4.757  -7.772   9.834
  415   2HG   PRO  54          1HG       PRO  54   3.138  -7.574  10.523
  416   1HD   PRO  54          2HD       PRO  54   3.773  -9.290   8.423
  417   2HD   PRO  54          1HD       PRO  54   2.136  -8.694   8.783
  418    H    GLU  55           H        GLU  55   5.505  -7.930   7.228
  419    HA   GLU  55           HA       GLU  55   7.661  -6.068   6.640
  420   1HB   GLU  55          2HB       GLU  55   7.792  -9.079   6.453
  421   2HB   GLU  55          1HB       GLU  55   9.114  -7.945   6.722
  422   1HG   GLU  55          2HG       GLU  55   8.023  -7.297   8.897
  423   2HG   GLU  55          1HG       GLU  55   6.860  -8.598   8.637
  424    H    GLU  56           H        GLU  56   5.674  -8.458   4.948
  425    HA   GLU  56           HA       GLU  56   7.101  -8.363   2.477
  426   1HB   GLU  56          2HB       GLU  56   5.483 -10.187   3.248
  427   2HB   GLU  56          1HB       GLU  56   4.186  -9.087   2.780
  428   1HG   GLU  56          2HG       GLU  56   4.594 -10.496   0.881
  429   2HG   GLU  56          1HG       GLU  56   5.301  -8.927   0.497
  430    H    LEU  57           H        LEU  57   4.041  -6.848   3.556
  431    HA   LEU  57           HA       LEU  57   3.524  -5.421   1.186
  432   1HB   LEU  57          2HB       LEU  57   1.659  -5.082   2.343
  433   2HB   LEU  57          1HB       LEU  57   2.430  -5.582   3.826
  434    HG   LEU  57           HG       LEU  57   2.884  -2.787   2.868
  435   1HD1  LEU  57          1HD1      LEU  57   0.437  -3.211   2.629
  436   2HD1  LEU  57          2HD1      LEU  57   0.805  -2.042   3.896
  437   3HD1  LEU  57          3HD1      LEU  57   0.387  -3.703   4.321
  438   1HD2  LEU  57          1HD2      LEU  57   2.198  -3.367   5.671
  439   2HD2  LEU  57          2HD2      LEU  57   3.577  -2.485   5.013
  440   3HD2  LEU  57          3HD2      LEU  57   3.614  -4.247   5.096
  441    H    GLN  58           H        GLN  58   5.496  -4.623   4.008
  442    HA   GLN  58           HA       GLN  58   5.963  -1.908   3.511
  443   1HB   GLN  58          2HB       GLN  58   6.689  -3.354   5.534
  444   2HB   GLN  58          1HB       GLN  58   8.121  -3.719   4.572
  445   1HG   GLN  58          2HG       GLN  58   8.644  -1.806   5.948
  446   2HG   GLN  58          1HG       GLN  58   8.460  -1.229   4.293
  447   1HE2  GLN  58          1HE2      GLN  58   6.601   0.115   3.795
  448   2HE2  GLN  58          2HE2      GLN  58   5.588   0.727   5.012
  449    H    GLU  59           H        GLU  59   7.652  -4.781   2.279
  450    HA   GLU  59           HA       GLU  59   9.719  -3.449   0.891
  451   1HB   GLU  59          2HB       GLU  59   8.391  -6.127   0.464
  452   2HB   GLU  59          1HB       GLU  59   9.717  -5.562  -0.551
  453   1HG   GLU  59          2HG       GLU  59  11.194  -5.390   1.353
  454   2HG   GLU  59          1HG       GLU  59   9.870  -5.721   2.471
  455    H    MET  60           H        MET  60   6.448  -4.418  -0.111
  456    HA   MET  60           HA       MET  60   6.659  -3.688  -2.835
  457   1HB   MET  60          2HB       MET  60   4.283  -3.892  -0.977
  458   2HB   MET  60          1HB       MET  60   4.125  -3.508  -2.692
  459   1HG   MET  60          2HG       MET  60   5.205  -5.605  -3.305
  460   2HG   MET  60          1HG       MET  60   5.516  -5.975  -1.609
  461   1HE   MET  60          1HE       MET  60   3.303  -8.102  -3.690
  462   2HE   MET  60          2HE       MET  60   3.279  -8.649  -2.016
  463   3HE   MET  60          3HE       MET  60   4.765  -7.995  -2.701
  464    H    ILE  61           H        ILE  61   5.532  -1.880   0.017
  465    HA   ILE  61           HA       ILE  61   4.694   0.465  -1.239
  466    HB   ILE  61           HB       ILE  61   5.941   0.013   1.477
  467   1HG1  ILE  61          2HG1      ILE  61   3.089   0.737   1.056
  468   2HG1  ILE  61          1HG1      ILE  61   3.576  -0.878   0.542
  469   1HG2  ILE  61          1HG2      ILE  61   4.708   2.485   0.251
  470   2HG2  ILE  61          2HG2      ILE  61   6.286   2.322   1.025
  471   3HG2  ILE  61          3HG2      ILE  61   4.815   2.244   1.995
  472   1HD1  ILE  61          1HD1      ILE  61   4.442  -1.384   2.738
  473   2HD1  ILE  61          2HD1      ILE  61   2.793  -0.785   2.924
  474   3HD1  ILE  61          3HD1      ILE  61   4.160   0.270   3.283
  475    H    ASP  62           H        ASP  62   7.780   0.167   0.526
  476    HA   ASP  62           HA       ASP  62   9.017   2.447  -0.424
  477   1HB   ASP  62          2HB       ASP  62   9.788   0.613   1.320
  478   2HB   ASP  62          1HB       ASP  62  10.700   0.004  -0.061
  479    H    GLU  63           H        GLU  63   8.793  -0.714  -2.010
  480    HA   GLU  63           HA       GLU  63  10.714  -0.281  -4.040
  481   1HB   GLU  63          2HB       GLU  63   8.389  -2.125  -3.693
  482   2HB   GLU  63          1HB       GLU  63   9.081  -1.951  -5.305
  483   1HG   GLU  63          2HG       GLU  63  11.316  -2.492  -4.402
  484   2HG   GLU  63          1HG       GLU  63  10.617  -2.688  -2.796
  485    H    VAL  64           H        VAL  64   7.152   0.069  -4.148
  486    HA   VAL  64           HA       VAL  64   7.163   1.257  -6.759
  487    HB   VAL  64           HB       VAL  64   4.795   1.650  -6.414
  488   1HG1  VAL  64          1HG1      VAL  64   5.002  -0.926  -4.989
  489   2HG1  VAL  64          2HG1      VAL  64   6.002  -0.806  -6.436
  490   3HG1  VAL  64          3HG1      VAL  64   4.260  -0.554  -6.544
  491   1HG2  VAL  64          1HG2      VAL  64   5.046   2.461  -4.040
  492   2HG2  VAL  64          2HG2      VAL  64   5.223   0.777  -3.543
  493   3HG2  VAL  64          3HG2      VAL  64   3.716   1.327  -4.272
  494    H    ASP  65           H        ASP  65   7.676   2.517  -3.578
  495    HA   ASP  65           HA       ASP  65   6.760   5.175  -4.012
  496   1HB   ASP  65          2HB       ASP  65   7.647   3.791  -1.822
  497   2HB   ASP  65          1HB       ASP  65   9.020   4.845  -2.150
  498    H    GLU  66           H        GLU  66   7.522   5.826  -6.017
  499    HA   GLU  66           HA       GLU  66  10.285   5.776  -6.764
  500   1HB   GLU  66          2HB       GLU  66   7.859   7.190  -7.855
  501   2HB   GLU  66          1HB       GLU  66   9.468   7.490  -8.511
  502   1HG   GLU  66          2HG       GLU  66   8.646   4.641  -8.164
  503   2HG   GLU  66          1HG       GLU  66   7.888   5.547  -9.473
  504    H    ASP  67           H        ASP  67   8.185   8.216  -5.300
  505    HA   ASP  67           HA       ASP  67  10.254  10.255  -5.382
  506   1HB   ASP  67          2HB       ASP  67   8.546  11.527  -3.918
  507   2HB   ASP  67          1HB       ASP  67   8.114  11.196  -5.592
  508    H    GLY  68           H        GLY  68   8.732   8.201  -2.910
  509   1HA   GLY  68          2HA       GLY  68   9.599   7.445  -0.897
  510   2HA   GLY  68          1HA       GLY  68  11.094   8.303  -1.258
  511    H    SER  69           H        SER  69   7.737   9.468  -0.970
  512    HA   SER  69           HA       SER  69   8.663  11.588   0.829
  513   1HB   SER  69          2HB       SER  69   6.424  12.570   0.472
  514   2HB   SER  69          1HB       SER  69   7.255  12.271  -1.051
  515    HG   SER  69           HG       SER  69   5.726  10.929  -1.563
  516    H    GLY  70           H        GLY  70   6.130   9.079   0.715
  517   1HA   GLY  70          2HA       GLY  70   6.193   7.856   3.042
  518   2HA   GLY  70          1HA       GLY  70   5.619   9.428   3.587
  519    H    THR  71           H        THR  71   4.186   9.705   0.896
  520    HA   THR  71           HA       THR  71   1.820   8.096   1.627
  521    HB   THR  71           HB       THR  71   0.495   9.788   0.446
  522    HG1  THR  71           HG1      THR  71   2.914  11.228   0.128
  523   1HG2  THR  71          1HG2      THR  71   0.924  10.170   2.809
  524   2HG2  THR  71          2HG2      THR  71   0.968  11.715   1.960
  525   3HG2  THR  71          3HG2      THR  71   2.473  10.928   2.437
  526    H    VAL  72           H        VAL  72   0.608   7.082  -0.035
  527    HA   VAL  72           HA       VAL  72   2.241   6.403  -2.396
  528    HB   VAL  72           HB       VAL  72  -0.251   5.008  -1.394
  529   1HG1  VAL  72          1HG1      VAL  72   0.660   4.801  -3.841
  530   2HG1  VAL  72          2HG1      VAL  72   0.252   3.333  -2.954
  531   3HG1  VAL  72          3HG1      VAL  72   1.936   3.837  -3.098
  532   1HG2  VAL  72          1HG2      VAL  72   1.418   3.300  -0.545
  533   2HG2  VAL  72          2HG2      VAL  72   1.414   4.823   0.342
  534   3HG2  VAL  72          3HG2      VAL  72   2.684   4.492  -0.836
  535    H    ASP  73           H        ASP  73   1.790   7.405  -4.226
  536    HA   ASP  73           HA       ASP  73  -0.752   8.779  -4.602
  537   1HB   ASP  73          2HB       ASP  73   1.691   8.548  -6.384
  538   2HB   ASP  73          1HB       ASP  73   0.264   9.499  -6.774
  539    H    PHE  74           H        PHE  74  -1.599   8.551  -7.010
  540    HA   PHE  74           HA       PHE  74  -2.693   5.944  -7.230
  541   1HB   PHE  74          2HB       PHE  74  -3.641   8.177  -8.117
  542   2HB   PHE  74          1HB       PHE  74  -2.602   7.907  -9.514
  543    HD1  PHE  74           HD1      PHE  74  -4.242   7.486 -11.180
  544    HD2  PHE  74           HD2      PHE  74  -4.296   5.261  -7.507
  545    HE1  PHE  74           HE1      PHE  74  -5.930   5.943 -12.138
  546    HE2  PHE  74           HE2      PHE  74  -5.980   3.719  -8.468
  547    HZ   PHE  74           HZ       PHE  74  -6.795   4.057 -10.784
  548    H    ASP  75           H        ASP  75   0.084   7.502  -8.744
  549    HA   ASP  75           HA       ASP  75   0.530   5.524 -10.759
  550   1HB   ASP  75          2HB       ASP  75   2.104   7.779  -9.590
  551   2HB   ASP  75          1HB       ASP  75   2.969   6.544 -10.501
  552    H    GLU  76           H        GLU  76   1.764   6.039  -7.476
  553    HA   GLU  76           HA       GLU  76   3.539   3.777  -7.492
  554   1HB   GLU  76          2HB       GLU  76   2.375   5.045  -5.013
  555   2HB   GLU  76          1HB       GLU  76   3.932   4.243  -5.203
  556   1HG   GLU  76          2HG       GLU  76   4.762   6.054  -6.589
  557   2HG   GLU  76          1HG       GLU  76   3.169   6.819  -6.610
  558    H    PHE  77           H        PHE  77   0.177   4.302  -6.859
  559    HA   PHE  77           HA       PHE  77  -0.312   1.908  -5.348
  560   1HB   PHE  77          2HB       PHE  77  -1.765   3.872  -5.142
  561   2HB   PHE  77          1HB       PHE  77  -2.198   3.748  -6.845
  562    HD1  PHE  77           HD1      PHE  77  -2.341   1.928  -3.588
  563    HD2  PHE  77           HD2      PHE  77  -3.933   2.319  -7.561
  564    HE1  PHE  77           HE1      PHE  77  -4.165   0.350  -3.012
  565    HE2  PHE  77           HE2      PHE  77  -5.755   0.739  -6.982
  566    HZ   PHE  77           HZ       PHE  77  -5.871  -0.244  -4.709
  567    H    LEU  78           H        LEU  78  -0.614   2.844  -8.771
  568    HA   LEU  78           HA       LEU  78  -1.820   0.347  -9.556
  569   1HB   LEU  78          2HB       LEU  78  -0.631   2.631 -11.100
  570   2HB   LEU  78          1HB       LEU  78  -1.289   1.205 -11.875
  571    HG   LEU  78           HG       LEU  78  -3.073   2.570  -9.939
  572   1HD1  LEU  78          1HD1      LEU  78  -1.797   4.369 -11.268
  573   2HD1  LEU  78          2HD1      LEU  78  -3.558   4.426 -11.323
  574   3HD1  LEU  78          3HD1      LEU  78  -2.655   3.757 -12.682
  575   1HD2  LEU  78          1HD2      LEU  78  -3.485   0.549 -11.571
  576   2HD2  LEU  78          2HD2      LEU  78  -3.673   1.813 -12.788
  577   3HD2  LEU  78          3HD2      LEU  78  -4.737   1.778 -11.381
  578    H    VAL  79           H        VAL  79   1.468   1.707  -9.711
  579    HA   VAL  79           HA       VAL  79   2.626  -0.309 -11.303
  580    HB   VAL  79           HB       VAL  79   4.796   0.333 -10.182
  581   1HG1  VAL  79          1HG1      VAL  79   2.987   2.418 -11.419
  582   2HG1  VAL  79          2HG1      VAL  79   4.198   1.421 -12.227
  583   3HG1  VAL  79          3HG1      VAL  79   4.701   2.697 -11.119
  584   1HG2  VAL  79          1HG2      VAL  79   4.592   1.277  -8.142
  585   2HG2  VAL  79          2HG2      VAL  79   2.889   1.654  -8.395
  586   3HG2  VAL  79          3HG2      VAL  79   4.133   2.748  -8.995
  587    H    MET  80           H        MET  80   1.739  -0.289  -7.942
  588    HA   MET  80           HA       MET  80   3.307  -2.185  -6.747
  589   1HB   MET  80          2HB       MET  80   0.433  -1.452  -6.509
  590   2HB   MET  80          1HB       MET  80   0.951  -2.950  -5.736
  591   1HG   MET  80          2HG       MET  80   2.531  -1.821  -4.364
  592   2HG   MET  80          1HG       MET  80   2.447  -0.354  -5.342
  593   1HE   MET  80          1HE       MET  80   1.642   1.574  -3.925
  594   2HE   MET  80          2HE       MET  80   2.407   0.472  -2.783
  595   3HE   MET  80          3HE       MET  80   0.885   1.252  -2.359
  596    H    MET  81           H        MET  81   0.699  -2.767  -9.087
  597    HA   MET  81           HA       MET  81   0.720  -5.624  -8.822
  598   1HB   MET  81          2HB       MET  81  -0.489  -3.681 -10.758
  599   2HB   MET  81          1HB       MET  81  -0.430  -5.393 -11.176
  600   1HG   MET  81          2HG       MET  81  -1.479  -4.489  -8.498
  601   2HG   MET  81          1HG       MET  81  -2.525  -4.528  -9.917
  602   1HE   MET  81          1HE       MET  81  -2.563  -7.621  -7.140
  603   2HE   MET  81          2HE       MET  81  -3.745  -6.489  -7.792
  604   3HE   MET  81          3HE       MET  81  -2.268  -5.879  -7.050
  605    H    VAL  82           H        VAL  82   1.838  -3.503 -11.482
  606    HA   VAL  82           HA       VAL  82   3.144  -5.507 -12.968
  607    HB   VAL  82           HB       VAL  82   4.433  -3.605 -14.002
  608   1HG1  VAL  82          1HG1      VAL  82   2.646  -3.210 -15.337
  609   2HG1  VAL  82          2HG1      VAL  82   1.675  -2.585 -14.001
  610   3HG1  VAL  82          3HG1      VAL  82   1.788  -4.324 -14.272
  611   1HG2  VAL  82          1HG2      VAL  82   4.635  -2.098 -12.137
  612   2HG2  VAL  82          2HG2      VAL  82   2.888  -2.059 -11.905
  613   3HG2  VAL  82          3HG2      VAL  82   3.602  -1.305 -13.325
  614    H    ARG  83           H        ARG  83   4.272  -3.550 -10.261
  615    HA   ARG  83           HA       ARG  83   7.044  -4.048 -10.479
  616   1HB   ARG  83          2HB       ARG  83   5.294  -3.447  -8.088
  617   2HB   ARG  83          1HB       ARG  83   7.050  -3.592  -7.982
  618   1HG   ARG  83          2HG       ARG  83   6.116  -1.844 -10.167
  619   2HG   ARG  83          1HG       ARG  83   5.711  -1.260  -8.553
  620   1HD   ARG  83          2HD       ARG  83   8.189  -1.818  -7.984
  621   2HD   ARG  83          1HD       ARG  83   8.426  -1.821  -9.727
  622    HE   ARG  83           HE       ARG  83   7.074   0.551  -9.022
  623   1HH1  ARG  83          2HH1      ARG  83  10.175  -1.002  -8.600
  624   2HH1  ARG  83          1HH1      ARG  83  11.043   0.490  -8.470
  625   1HH2  ARG  83          1HH2      ARG  83   8.233   2.492  -8.846
  626   2HH2  ARG  83          2HH2      ARG  83   9.948   2.462  -8.608
  627    H    CYS  84           H        CYS  84   4.400  -5.977  -9.221
  628    HA   CYS  84           HA       CYS  84   5.978  -7.851  -7.750
  629   1HB   CYS  84          2HB       CYS  84   3.184  -7.966  -8.887
  630   2HB   CYS  84          1HB       CYS  84   3.910  -9.331  -8.038
  631    HG   CYS  84           HG       CYS  84   4.161  -7.764  -5.918
  632    H    MET  85           H        MET  85   5.031  -7.568 -11.128
  633    HA   MET  85           HA       MET  85   5.616 -10.229 -11.931
  634   1HB   MET  85          2HB       MET  85   5.447  -7.605 -13.400
  635   2HB   MET  85          1HB       MET  85   5.959  -9.076 -14.226
  636   1HG   MET  85          2HG       MET  85   3.468  -9.144 -12.556
  637   2HG   MET  85          1HG       MET  85   3.401  -8.414 -14.160
  638   1HE   MET  85          1HE       MET  85   3.184  -9.390 -16.125
  639   2HE   MET  85          2HE       MET  85   3.510 -11.045 -16.634
  640   3HE   MET  85          3HE       MET  85   4.851  -9.952 -16.302
  641    H    LYS  86           H        LYS  86   7.521  -7.288 -12.667
  642    HA   LYS  86           HA       LYS  86   9.777  -6.932 -12.884
  643   1HB   LYS  86          2HB       LYS  86   9.561  -8.903 -10.673
  644   2HB   LYS  86          1HB       LYS  86  11.156  -8.714 -11.401
  645   1HG   LYS  86          2HG       LYS  86   9.628  -6.228 -10.755
  646   2HG   LYS  86          1HG       LYS  86  10.329  -7.131  -9.412
  647   1HD   LYS  86          2HD       LYS  86  12.538  -7.039 -10.462
  648   2HD   LYS  86          1HD       LYS  86  11.860  -6.202 -11.858
  649   1HE   LYS  86          2HE       LYS  86  11.409  -5.036  -9.136
  650   2HE   LYS  86          1HE       LYS  86  12.991  -4.835  -9.886
  651   1HZ   LYS  86          1HZ       LYS  86  11.926  -3.874 -11.821
  652   2HZ   LYS  86          2HZ       LYS  86  11.497  -3.006 -10.424
  653   3HZ   LYS  86          3HZ       LYS  86  10.394  -4.092 -11.124
  654    H    ASP  87           H        ASP  87  11.968  -8.229 -13.277
  655    HA   ASP  87           HA       ASP  87  11.419 -10.445 -15.159
  656   1HB   ASP  87          2HB       ASP  87  12.787  -7.855 -15.663
  657   2HB   ASP  87          1HB       ASP  87  13.552  -9.293 -16.340
  658    H    ASP  88           H        ASP  88  12.142 -12.026 -13.789
  659    HA   ASP  88           HA       ASP  88  14.689 -11.787 -12.417
  660   1HB   ASP  88          2HB       ASP  88  12.835 -14.169 -12.695
  661   2HB   ASP  88          1HB       ASP  88  14.227 -14.068 -11.619
  662    H    SER  89           HN       SER  89  16.436 -11.817 -13.702
  663    HA   SER  89           HA       SER  89  16.630 -13.951 -15.748
  664   1HB   SER  89          2HB       SER  89  18.375 -12.486 -16.802
  665   2HB   SER  89          1HB       SER  89  16.760 -11.788 -16.802
  666    HG   SER  89           HG       SER  89  17.394 -10.312 -15.403
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1   8.476   3.154 -12.907
    2   2H    MET   1          2H        MET   1   7.713   4.638 -13.224
    3   3H    MET   1          3H        MET   1   9.283   4.608 -12.575
    4    HA   MET   1           HA       MET   1   8.440   3.794 -15.304
    5   1HB   MET   1          2HB       MET   1  10.353   5.906 -14.256
    6   2HB   MET   1          1HB       MET   1  10.109   5.528 -15.961
    7   1HG   MET   1          2HG       MET   1   7.587   5.972 -15.445
    8   2HG   MET   1          1HG       MET   1   8.199   6.810 -14.020
    9   1HE   MET   1          1HE       MET   1   9.572   8.891 -13.972
   10   2HE   MET   1          2HE       MET   1  10.412   9.599 -15.350
   11   3HE   MET   1          3HE       MET   1  10.865   7.995 -14.781
   12    H    ASN   2           H        ASN   2   9.192   1.642 -15.112
   13    HA   ASN   2           HA       ASN   2  12.124   1.383 -14.770
   14   1HB   ASN   2          2HB       ASN   2   9.870  -0.264 -13.802
   15   2HB   ASN   2          1HB       ASN   2  11.225  -1.167 -14.478
   16   1HD2  ASN   2          1HD2      ASN   2  11.009   1.844 -12.470
   17   2HD2  ASN   2          2HD2      ASN   2  12.127   1.309 -11.314
   18    H    ASP   3           H        ASP   3   9.730  -0.873 -16.118
   19    HA   ASP   3           HA       ASP   3  10.197  -0.453 -18.843
   20   1HB   ASP   3          2HB       ASP   3  12.500  -1.476 -17.739
   21   2HB   ASP   3          1HB       ASP   3  11.676  -2.933 -18.290
   22    H    ILE   4           H        ILE   4   9.835  -3.023 -16.416
   23    HA   ILE   4           HA       ILE   4   8.164  -4.639 -18.124
   24    HB   ILE   4           HB       ILE   4   7.929  -6.148 -16.301
   25   1HG1  ILE   4          2HG1      ILE   4   7.392  -4.305 -14.621
   26   2HG1  ILE   4          1HG1      ILE   4   8.357  -5.643 -14.008
   27   1HG2  ILE   4          1HG2      ILE   4  10.676  -4.877 -16.268
   28   2HG2  ILE   4          2HG2      ILE   4  10.133  -6.221 -17.271
   29   3HG2  ILE   4          3HG2      ILE   4  10.295  -6.432 -15.528
   30   1HD1  ILE   4          1HD1      ILE   4   9.169  -2.814 -14.576
   31   2HD1  ILE   4          2HD1      ILE   4  10.381  -4.087 -14.736
   32   3HD1  ILE   4          3HD1      ILE   4   9.565  -3.835 -13.193
   33    H    TYR   5           H        TYR   5   7.655  -2.043 -15.872
   34    HA   TYR   5           HA       TYR   5   4.908  -2.556 -15.274
   35   1HB   TYR   5          2HB       TYR   5   6.217   0.171 -15.333
   36   2HB   TYR   5          1HB       TYR   5   4.826  -0.338 -14.386
   37    HD1  TYR   5           HD1      TYR   5   7.452   0.953 -13.384
   38    HD2  TYR   5           HD2      TYR   5   6.137  -3.124 -13.678
   39    HE1  TYR   5           HE1      TYR   5   8.959   0.328 -11.523
   40    HE2  TYR   5           HE2      TYR   5   7.653  -3.746 -11.829
   41    HH   TYR   5           HH       TYR   5  10.090  -2.346 -10.888
   42    H    LYS   6           H        LYS   6   6.635  -0.959 -17.862
   43    HA   LYS   6           HA       LYS   6   4.290   0.269 -19.039
   44   1HB   LYS   6          2HB       LYS   6   6.908  -0.209 -20.459
   45   2HB   LYS   6          1HB       LYS   6   5.735   1.077 -20.729
   46   1HG   LYS   6          2HG       LYS   6   7.629   0.750 -18.392
   47   2HG   LYS   6          1HG       LYS   6   7.530   2.094 -19.528
   48   1HD   LYS   6          2HD       LYS   6   5.419   2.808 -18.628
   49   2HD   LYS   6          1HD       LYS   6   5.267   1.337 -17.666
   50   1HE   LYS   6          2HE       LYS   6   6.825   2.034 -16.098
   51   2HE   LYS   6          1HE       LYS   6   7.687   3.049 -17.253
   52   1HZ   LYS   6          1HZ       LYS   6   6.009   4.686 -17.144
   53   2HZ   LYS   6          2HZ       LYS   6   6.353   4.261 -15.535
   54   3HZ   LYS   6          3HZ       LYS   6   4.952   3.670 -16.291
   55    H    ALA   7           H        ALA   7   6.241  -2.621 -19.565
   56    HA   ALA   7           HA       ALA   7   4.849  -3.437 -21.952
   57   1HB   ALA   7          1HB       ALA   7   6.838  -4.734 -20.112
   58   2HB   ALA   7          2HB       ALA   7   6.994  -4.344 -21.825
   59   3HB   ALA   7          3HB       ALA   7   5.987  -5.700 -21.318
   60    H    ALA   8           H        ALA   8   4.426  -3.913 -18.508
   61    HA   ALA   8           HA       ALA   8   2.494  -6.062 -18.840
   62   1HB   ALA   8          1HB       ALA   8   3.455  -4.559 -16.402
   63   2HB   ALA   8          2HB       ALA   8   3.918  -6.185 -16.905
   64   3HB   ALA   8          3HB       ALA   8   2.272  -5.866 -16.356
   65    H    VAL   9           H        VAL   9   2.459  -2.567 -18.476
   66    HA   VAL   9           HA       VAL   9  -0.101  -2.192 -17.412
   67    HB   VAL   9           HB       VAL   9   1.694  -0.423 -17.904
   68   1HG1  VAL   9          1HG1      VAL   9   1.890   0.502 -20.009
   69   2HG1  VAL   9          2HG1      VAL   9   0.241   0.076 -20.467
   70   3HG1  VAL   9          3HG1      VAL   9   1.501  -1.156 -20.467
   71   1HG2  VAL   9          1HG2      VAL   9  -0.785  -0.131 -17.152
   72   2HG2  VAL   9          2HG2      VAL   9  -1.053   0.417 -18.808
   73   3HG2  VAL   9          3HG2      VAL   9   0.080   1.278 -17.767
   74    H    GLU  10           H        GLU  10   0.874  -2.967 -20.711
   75    HA   GLU  10           HA       GLU  10  -1.730  -2.529 -21.862
   76   1HB   GLU  10          2HB       GLU  10   0.815  -3.812 -22.822
   77   2HB   GLU  10          1HB       GLU  10  -0.675  -3.966 -23.753
   78   1HG   GLU  10          2HG       GLU  10   0.308  -1.272 -22.808
   79   2HG   GLU  10          1HG       GLU  10   0.889  -1.982 -24.314
   80    H    GLN  11           H        GLN  11  -0.200  -5.120 -20.139
   81    HA   GLN  11           HA       GLN  11  -1.886  -7.229 -21.173
   82   1HB   GLN  11          2HB       GLN  11  -0.181  -7.234 -18.670
   83   2HB   GLN  11          1HB       GLN  11  -0.837  -8.643 -19.502
   84   1HG   GLN  11          2HG       GLN  11   1.126  -6.674 -20.719
   85   2HG   GLN  11          1HG       GLN  11   1.560  -8.248 -20.057
   86   1HE2  GLN  11          1HE2      GLN  11   0.415  -6.630 -22.884
   87   2HE2  GLN  11          2HE2      GLN  11   0.065  -8.016 -23.800
   88    H    LEU  12           H        LEU  12  -1.825  -5.157 -18.314
   89    HA   LEU  12           HA       LEU  12  -3.799  -6.441 -16.793
   90   1HB   LEU  12          2HB       LEU  12  -3.015  -3.540 -16.964
   91   2HB   LEU  12          1HB       LEU  12  -4.169  -4.154 -15.799
   92    HG   LEU  12           HG       LEU  12  -1.718  -5.698 -15.713
   93   1HD1  LEU  12          1HD1      LEU  12  -0.693  -3.616 -16.537
   94   2HD1  LEU  12          2HD1      LEU  12  -0.258  -3.901 -14.851
   95   3HD1  LEU  12          3HD1      LEU  12  -1.493  -2.707 -15.253
   96   1HD2  LEU  12          1HD2      LEU  12  -2.859  -3.825 -13.629
   97   2HD2  LEU  12          2HD2      LEU  12  -1.951  -5.316 -13.372
   98   3HD2  LEU  12          3HD2      LEU  12  -3.601  -5.383 -13.991
   99    H    THR  13           H        THR  13  -6.003  -6.007 -16.490
  100    HA   THR  13           HA       THR  13  -7.378  -5.148 -18.945
  101    HB   THR  13           HB       THR  13  -9.394  -6.087 -17.465
  102    HG1  THR  13           HG1      THR  13  -8.385  -6.659 -15.647
  103   1HG2  THR  13          1HG2      THR  13  -7.343  -7.529 -19.123
  104   2HG2  THR  13          2HG2      THR  13  -8.997  -7.080 -19.542
  105   3HG2  THR  13          3HG2      THR  13  -8.701  -8.409 -18.421
  106    H    ASP  14           H        ASP  14  -9.450  -3.983 -18.670
  107    HA   ASP  14           HA       ASP  14  -9.060  -1.527 -17.292
  108   1HB   ASP  14          2HB       ASP  14 -10.445  -1.780 -19.355
  109   2HB   ASP  14          1HB       ASP  14 -11.645  -2.651 -18.400
  110    H    GLU  15           H        GLU  15 -10.730  -4.517 -16.503
  111    HA   GLU  15           HA       GLU  15 -12.326  -3.618 -14.358
  112   1HB   GLU  15          2HB       GLU  15 -11.104  -6.298 -15.008
  113   2HB   GLU  15          1HB       GLU  15 -12.090  -6.048 -13.570
  114   1HG   GLU  15          2HG       GLU  15 -13.774  -6.638 -15.018
  115   2HG   GLU  15          1HG       GLU  15 -13.719  -4.914 -15.385
  116    H    GLN  16           H        GLN  16  -8.963  -4.770 -14.459
  117    HA   GLN  16           HA       GLN  16  -8.478  -4.835 -11.680
  118   1HB   GLN  16          2HB       GLN  16  -6.697  -4.500 -14.086
  119   2HB   GLN  16          1HB       GLN  16  -6.037  -4.365 -12.455
  120   1HG   GLN  16          2HG       GLN  16  -7.738  -6.723 -13.269
  121   2HG   GLN  16          1HG       GLN  16  -5.998  -6.701 -13.559
  122   1HE2  GLN  16          1HE2      GLN  16  -4.570  -6.509 -11.614
  123   2HE2  GLN  16          2HE2      GLN  16  -5.153  -7.000 -10.098
  124    H    LYS  17           H        LYS  17  -7.960  -2.244 -14.074
  125    HA   LYS  17           HA       LYS  17  -6.999  -0.341 -12.176
  126   1HB   LYS  17          2HB       LYS  17  -7.759  -0.312 -15.032
  127   2HB   LYS  17          1HB       LYS  17  -7.943   1.222 -14.181
  128   1HG   LYS  17          2HG       LYS  17  -5.724   1.531 -14.431
  129   2HG   LYS  17          1HG       LYS  17  -5.484   0.208 -13.288
  130   1HD   LYS  17          2HD       LYS  17  -4.324  -0.680 -15.060
  131   2HD   LYS  17          1HD       LYS  17  -5.933  -1.241 -15.514
  132   1HE   LYS  17          2HE       LYS  17  -5.235  -0.222 -17.492
  133   2HE   LYS  17          1HE       LYS  17  -6.091   1.105 -16.709
  134   1HZ   LYS  17          1HZ       LYS  17  -3.989   1.898 -17.471
  135   2HZ   LYS  17          2HZ       LYS  17  -3.161   0.624 -16.710
  136   3HZ   LYS  17          3HZ       LYS  17  -3.927   1.820 -15.777
  137    H    ASN  18           H        ASN  18 -10.192  -1.330 -13.214
  138    HA   ASN  18           HA       ASN  18 -11.640   0.958 -12.339
  139   1HB   ASN  18          2HB       ASN  18 -12.279  -1.778 -13.207
  140   2HB   ASN  18          1HB       ASN  18 -13.396  -1.134 -12.005
  141   1HD2  ASN  18          1HD2      ASN  18 -11.701   0.102 -14.959
  142   2HD2  ASN  18          2HD2      ASN  18 -13.064   0.912 -15.565
  143    H    GLU  19           H        GLU  19 -10.773  -2.119 -10.782
  144    HA   GLU  19           HA       GLU  19 -12.051  -1.556  -8.283
  145   1HB   GLU  19          2HB       GLU  19  -9.715  -3.417  -8.812
  146   2HB   GLU  19          1HB       GLU  19 -10.778  -3.438  -7.405
  147   1HG   GLU  19          2HG       GLU  19 -12.616  -4.220  -8.654
  148   2HG   GLU  19          1HG       GLU  19 -11.896  -3.729 -10.188
  149    H    PHE  20           H        PHE  20  -8.723  -1.297  -9.491
  150    HA   PHE  20           HA       PHE  20  -7.495  -0.361  -7.139
  151   1HB   PHE  20          2HB       PHE  20  -6.841  -0.204 -10.060
  152   2HB   PHE  20          1HB       PHE  20  -5.908   0.765  -8.924
  153    HD1  PHE  20           HD1      PHE  20  -3.897  -0.572  -9.544
  154    HD2  PHE  20           HD2      PHE  20  -7.334  -2.373  -7.703
  155    HE1  PHE  20           HE1      PHE  20  -2.540  -2.553  -8.953
  156    HE2  PHE  20           HE2      PHE  20  -5.976  -4.357  -7.114
  157    HZ   PHE  20           HZ       PHE  20  -3.579  -4.451  -7.735
  158    H    LYS  21           H        LYS  21  -9.045   1.405  -9.817
  159    HA   LYS  21           HA       LYS  21  -8.419   4.018  -8.912
  160   1HB   LYS  21          2HB       LYS  21  -9.223   3.475 -11.220
  161   2HB   LYS  21          1HB       LYS  21 -10.827   3.183 -10.549
  162   1HG   LYS  21          2HG       LYS  21 -10.674   5.475 -11.430
  163   2HG   LYS  21          1HG       LYS  21 -10.877   5.502  -9.678
  164   1HD   LYS  21          2HD       LYS  21  -8.586   6.012  -9.308
  165   2HD   LYS  21          1HD       LYS  21  -8.142   5.586 -10.962
  166   1HE   LYS  21          2HE       LYS  21 -10.130   7.787 -10.494
  167   2HE   LYS  21          1HE       LYS  21  -8.411   8.121 -10.296
  168   1HZ   LYS  21          1HZ       LYS  21  -8.020   7.325 -12.533
  169   2HZ   LYS  21          2HZ       LYS  21  -9.172   8.573 -12.552
  170   3HZ   LYS  21          3HZ       LYS  21  -9.665   6.957 -12.726
  171    H    ALA  22           H        ALA  22 -11.345   2.011  -8.487
  172    HA   ALA  22           HA       ALA  22 -12.776   3.889  -6.916
  173   1HB   ALA  22          1HB       ALA  22 -13.983   2.058  -7.898
  174   2HB   ALA  22          2HB       ALA  22 -14.080   1.874  -6.147
  175   3HB   ALA  22          3HB       ALA  22 -12.965   0.873  -7.078
  176    H    ALA  23           H        ALA  23 -10.632   1.189  -6.057
  177    HA   ALA  23           HA       ALA  23 -10.880   1.418  -3.241
  178   1HB   ALA  23          1HB       ALA  23  -8.700   0.177  -3.195
  179   2HB   ALA  23          2HB       ALA  23  -8.637   0.319  -4.953
  180   3HB   ALA  23          3HB       ALA  23  -9.937  -0.595  -4.188
  181    H    PHE  24           H        PHE  24  -9.117   3.252  -5.606
  182    HA   PHE  24           HA       PHE  24  -7.273   4.424  -3.692
  183   1HB   PHE  24          2HB       PHE  24  -6.915   4.007  -6.257
  184   2HB   PHE  24          1HB       PHE  24  -7.793   5.523  -6.442
  185    HD1  PHE  24           HD1      PHE  24  -4.733   3.932  -5.131
  186    HD2  PHE  24           HD2      PHE  24  -6.838   7.634  -5.695
  187    HE1  PHE  24           HE1      PHE  24  -2.663   5.190  -4.608
  188    HE2  PHE  24           HE2      PHE  24  -4.766   8.890  -5.168
  189    HZ   PHE  24           HZ       PHE  24  -2.681   7.669  -4.623
  190    H    ASP  25           H        ASP  25  -9.901   5.626  -5.787
  191    HA   ASP  25           HA       ASP  25 -10.048   8.231  -4.840
  192   1HB   ASP  25          2HB       ASP  25 -12.008   6.399  -6.158
  193   2HB   ASP  25          1HB       ASP  25 -12.576   7.943  -5.525
  194    H    ILE  26           H        ILE  26 -11.605   5.321  -3.478
  195    HA   ILE  26           HA       ILE  26 -13.386   6.582  -1.724
  196    HB   ILE  26           HB       ILE  26 -13.165   4.538  -0.293
  197   1HG1  ILE  26          2HG1      ILE  26 -11.099   3.768  -2.383
  198   2HG1  ILE  26          1HG1      ILE  26 -10.753   4.133  -0.695
  199   1HG2  ILE  26          1HG2      ILE  26 -14.799   4.175  -1.860
  200   2HG2  ILE  26          2HG2      ILE  26 -13.636   2.983  -2.440
  201   3HG2  ILE  26          3HG2      ILE  26 -13.737   4.563  -3.213
  202   1HD1  ILE  26          1HD1      ILE  26 -12.387   1.830  -1.779
  203   2HD1  ILE  26          2HD1      ILE  26 -12.346   2.265  -0.071
  204   3HD1  ILE  26          3HD1      ILE  26 -10.871   1.741  -0.882
  205    H    PHE  27           H        PHE  27  -9.923   5.976  -1.381
  206    HA   PHE  27           HA       PHE  27  -9.867   7.052   1.324
  207   1HB   PHE  27          2HB       PHE  27  -7.639   6.147  -0.516
  208   2HB   PHE  27          1HB       PHE  27  -7.428   6.657   1.155
  209    HD1  PHE  27           HD1      PHE  27  -9.387   5.489   2.756
  210    HD2  PHE  27           HD2      PHE  27  -7.621   3.840  -0.795
  211    HE1  PHE  27           HE1      PHE  27  -9.985   3.207   3.518
  212    HE2  PHE  27           HE2      PHE  27  -8.221   1.558  -0.032
  213    HZ   PHE  27           HZ       PHE  27  -9.402   1.242   2.124
  214    H    ILE  28           H        ILE  28  -9.222   8.097  -1.965
  215    HA   ILE  28           HA       ILE  28  -8.018  10.612  -1.056
  216    HB   ILE  28           HB       ILE  28  -8.617   9.840  -3.916
  217   1HG1  ILE  28          2HG1      ILE  28  -7.279   8.024  -3.282
  218   2HG1  ILE  28          1HG1      ILE  28  -6.096   9.187  -3.857
  219   1HG2  ILE  28          1HG2      ILE  28  -6.920  11.870  -2.512
  220   2HG2  ILE  28          2HG2      ILE  28  -7.947  12.061  -3.932
  221   3HG2  ILE  28          3HG2      ILE  28  -6.388  11.250  -4.075
  222   1HD1  ILE  28          1HD1      ILE  28  -6.724   8.386  -1.032
  223   2HD1  ILE  28          2HD1      ILE  28  -6.028   9.974  -1.357
  224   3HD1  ILE  28          3HD1      ILE  28  -5.154   8.511  -1.826
  225    H    GLN  29           H        GLN  29 -10.722  10.182  -0.287
  226    HA   GLN  29           HA       GLN  29 -12.482  11.584  -2.086
  227   1HB   GLN  29          2HB       GLN  29 -14.070  11.576  -0.140
  228   2HB   GLN  29          1HB       GLN  29 -13.489   9.975  -0.591
  229   1HG   GLN  29          2HG       GLN  29 -12.079   9.818   1.277
  230   2HG   GLN  29          1HG       GLN  29 -12.052  11.562   1.527
  231   1HE2  GLN  29          1HE2      GLN  29 -13.044   9.052   3.188
  232   2HE2  GLN  29          2HE2      GLN  29 -14.546   9.581   3.773
  233    H    ASP  30           H        ASP  30 -10.423  12.435   0.628
  234    HA   ASP  30           HA       ASP  30 -10.881  15.268   0.043
  235   1HB   ASP  30          2HB       ASP  30 -11.358  13.978   2.733
  236   2HB   ASP  30          1HB       ASP  30 -11.014  15.699   2.565
  237    H    ALA  31           H        ALA  31  -8.652  13.479  -0.471
  238    HA   ALA  31           HA       ALA  31  -6.603  13.833   1.481
  239   1HB   ALA  31          1HB       ALA  31  -6.251  13.333  -1.481
  240   2HB   ALA  31          2HB       ALA  31  -6.597  12.066  -0.305
  241   3HB   ALA  31          3HB       ALA  31  -5.093  12.983  -0.197
  242    H    GLU  32           H        GLU  32  -4.766  15.186   1.379
  243    HA   GLU  32           HA       GLU  32  -5.349  17.871   0.502
  244   1HB   GLU  32          2HB       GLU  32  -3.128  16.570   2.025
  245   2HB   GLU  32          1HB       GLU  32  -2.842  18.148   1.294
  246   1HG   GLU  32          2HG       GLU  32  -5.369  17.751   2.850
  247   2HG   GLU  32          1HG       GLU  32  -3.860  17.949   3.741
  248    H    ASP  33           H        ASP  33  -2.995  15.370  -0.408
  249    HA   ASP  33           HA       ASP  33  -2.151  17.001  -2.710
  250   1HB   ASP  33          2HB       ASP  33  -0.991  14.574  -1.352
  251   2HB   ASP  33          1HB       ASP  33  -0.461  15.067  -2.960
  252    H    GLY  34           H        GLY  34  -3.567  13.851  -1.899
  253   1HA   GLY  34          2HA       GLY  34  -5.370  13.056  -3.394
  254   2HA   GLY  34          1HA       GLY  34  -4.348  13.533  -4.746
  255    H    CYS  35           H        CYS  35  -3.569  11.778  -1.746
  256    HA   CYS  35           HA       CYS  35  -3.180   9.272  -3.155
  257   1HB   CYS  35          2HB       CYS  35  -0.745   9.305  -2.000
  258   2HB   CYS  35          1HB       CYS  35  -1.019   9.791  -3.669
  259    HG   CYS  35           HG       CYS  35  -0.851  11.865  -1.328
  260    H    ILE  36           H        ILE  36  -2.202   7.612  -1.579
  261    HA   ILE  36           HA       ILE  36  -3.565   7.960   1.018
  262    HB   ILE  36           HB       ILE  36  -3.368   5.486   1.212
  263   1HG1  ILE  36          2HG1      ILE  36  -2.823   4.782  -1.476
  264   2HG1  ILE  36          1HG1      ILE  36  -1.545   5.895  -0.995
  265   1HG2  ILE  36          1HG2      ILE  36  -5.270   6.775  -0.022
  266   2HG2  ILE  36          2HG2      ILE  36  -5.163   5.027  -0.228
  267   3HG2  ILE  36          3HG2      ILE  36  -4.553   6.103  -1.487
  268   1HD1  ILE  36          1HD1      ILE  36  -0.631   4.409   0.455
  269   2HD1  ILE  36          2HD1      ILE  36  -1.573   3.202  -0.424
  270   3HD1  ILE  36          3HD1      ILE  36  -2.205   3.903   1.069
  271    H    SER  37           H        SER  37  -2.325   6.318   2.693
  272    HA   SER  37           HA       SER  37   0.304   7.572   3.018
  273   1HB   SER  37          2HB       SER  37  -1.586   7.243   4.866
  274   2HB   SER  37          1HB       SER  37  -0.800   5.678   5.045
  275    HG   SER  37           HG       SER  37   0.203   7.179   6.384
  276    H    THR  38           H        THR  38   2.173   6.527   2.779
  277    HA   THR  38           HA       THR  38   2.362   4.050   1.463
  278    HB   THR  38           HB       THR  38   4.785   4.114   2.174
  279    HG1  THR  38           HG1      THR  38   5.016   5.191   3.969
  280   1HG2  THR  38          1HG2      THR  38   5.096   6.510   1.106
  281   2HG2  THR  38          2HG2      THR  38   3.362   6.370   0.818
  282   3HG2  THR  38          3HG2      THR  38   4.469   5.177   0.139
  283    H    LYS  39           H        LYS  39   2.700   4.886   4.894
  284    HA   LYS  39           HA       LYS  39   3.314   2.262   5.801
  285   1HB   LYS  39          2HB       LYS  39   2.846   3.152   8.037
  286   2HB   LYS  39          1HB       LYS  39   3.825   4.285   7.108
  287   1HG   LYS  39          2HG       LYS  39   2.152   5.844   6.978
  288   2HG   LYS  39          1HG       LYS  39   0.882   4.625   6.882
  289   1HD   LYS  39          2HD       LYS  39   0.492   5.443   9.013
  290   2HD   LYS  39          1HD       LYS  39   1.620   4.142   9.386
  291   1HE   LYS  39          2HE       LYS  39   2.479   6.018  10.555
  292   2HE   LYS  39          1HE       LYS  39   3.478   5.908   9.106
  293   1HZ   LYS  39          1HZ       LYS  39   2.286   7.644   8.086
  294   2HZ   LYS  39          2HZ       LYS  39   2.595   8.177   9.669
  295   3HZ   LYS  39          3HZ       LYS  39   1.052   7.605   9.249
  296    H    GLU  40           H        GLU  40   0.323   3.724   4.819
  297    HA   GLU  40           HA       GLU  40  -1.251   1.719   6.291
  298   1HB   GLU  40          2HB       GLU  40  -1.978   4.283   4.887
  299   2HB   GLU  40          1HB       GLU  40  -3.196   3.096   5.348
  300   1HG   GLU  40          2HG       GLU  40  -2.542   3.248   7.685
  301   2HG   GLU  40          1HG       GLU  40  -1.193   4.306   7.276
  302    H    LEU  41           H        LEU  41   0.372   1.621   3.501
  303    HA   LEU  41           HA       LEU  41  -1.722   0.788   1.691
  304   1HB   LEU  41          2HB       LEU  41   0.360   1.837   0.879
  305   2HB   LEU  41          1HB       LEU  41   1.274   0.472   1.476
  306    HG   LEU  41           HG       LEU  41   0.449  -0.959  -0.206
  307   1HD1  LEU  41          1HD1      LEU  41  -1.690   1.140  -0.670
  308   2HD1  LEU  41          2HD1      LEU  41  -1.926  -0.480  -0.014
  309   3HD1  LEU  41          3HD1      LEU  41  -1.453  -0.269  -1.701
  310   1HD2  LEU  41          1HD2      LEU  41   1.998   0.874  -0.998
  311   2HD2  LEU  41          2HD2      LEU  41   0.574   1.758  -1.546
  312   3HD2  LEU  41          3HD2      LEU  41   0.974   0.199  -2.266
  313    H    GLY  42           H        GLY  42  -2.568  -0.721   3.347
  314   1HA   GLY  42          2HA       GLY  42  -1.660  -3.433   2.782
  315   2HA   GLY  42          1HA       GLY  42  -1.600  -2.943   4.474
  316    H    LYS  43           H        LYS  43  -3.795  -1.462   4.864
  317    HA   LYS  43           HA       LYS  43  -5.921  -3.394   4.868
  318   1HB   LYS  43          2HB       LYS  43  -7.197  -1.636   6.019
  319   2HB   LYS  43          1HB       LYS  43  -5.591  -1.816   6.724
  320   1HG   LYS  43          2HG       LYS  43  -4.792   0.168   5.737
  321   2HG   LYS  43          1HG       LYS  43  -6.092   0.207   4.548
  322   1HD   LYS  43          2HD       LYS  43  -6.800   1.829   6.062
  323   2HD   LYS  43          1HD       LYS  43  -7.641   0.400   6.657
  324   1HE   LYS  43          2HE       LYS  43  -6.668   1.337   8.600
  325   2HE   LYS  43          1HE       LYS  43  -5.566   0.034   8.156
  326   1HZ   LYS  43          1HZ       LYS  43  -5.179   2.823   7.234
  327   2HZ   LYS  43          2HZ       LYS  43  -4.057   1.546   7.219
  328   3HZ   LYS  43          3HZ       LYS  43  -4.527   2.251   8.690
  329    H    VAL  44           H        VAL  44  -4.920  -0.833   2.752
  330    HA   VAL  44           HA       VAL  44  -7.478  -0.303   1.571
  331    HB   VAL  44           HB       VAL  44  -6.214   0.919  -0.130
  332   1HG1  VAL  44          1HG1      VAL  44  -5.294   2.582   1.299
  333   2HG1  VAL  44          2HG1      VAL  44  -4.853   1.394   2.526
  334   3HG1  VAL  44          3HG1      VAL  44  -6.549   1.802   2.262
  335   1HG2  VAL  44          1HG2      VAL  44  -4.344  -0.619  -0.458
  336   2HG2  VAL  44          2HG2      VAL  44  -3.796  -0.351   1.197
  337   3HG2  VAL  44          3HG2      VAL  44  -3.715   0.958   0.016
  338    H    MET  45           H        MET  45  -4.851  -2.571   0.955
  339    HA   MET  45           HA       MET  45  -5.800  -3.437  -1.616
  340   1HB   MET  45          2HB       MET  45  -3.965  -4.872   0.321
  341   2HB   MET  45          1HB       MET  45  -4.182  -5.253  -1.388
  342   1HG   MET  45          2HG       MET  45  -3.393  -2.956  -1.962
  343   2HG   MET  45          1HG       MET  45  -3.083  -2.666  -0.250
  344   1HE   MET  45          1HE       MET  45  -2.114  -4.210   1.140
  345   2HE   MET  45          2HE       MET  45  -0.394  -3.897   0.914
  346   3HE   MET  45          3HE       MET  45  -1.011  -5.540   0.757
  347    H    ARG  46           H        ARG  46  -6.591  -4.196   1.678
  348    HA   ARG  46           HA       ARG  46  -7.622  -6.798   1.422
  349   1HB   ARG  46          2HB       ARG  46  -8.032  -4.540   3.319
  350   2HB   ARG  46          1HB       ARG  46  -9.258  -5.807   3.305
  351   1HG   ARG  46          2HG       ARG  46  -6.842  -7.204   3.232
  352   2HG   ARG  46          1HG       ARG  46  -6.538  -5.880   4.357
  353   1HD   ARG  46          2HD       ARG  46  -8.837  -6.522   5.384
  354   2HD   ARG  46          1HD       ARG  46  -8.641  -8.034   4.507
  355    HE   ARG  46           HE       ARG  46  -6.992  -8.652   6.024
  356   1HH1  ARG  46          2HH1      ARG  46  -7.685  -5.238   6.326
  357   2HH1  ARG  46          1HH1      ARG  46  -6.744  -5.049   7.765
  358   1HH2  ARG  46          1HH2      ARG  46  -5.770  -8.377   7.917
  359   2HH2  ARG  46          2HH2      ARG  46  -5.663  -6.818   8.663
  360    H    MET  47           H        MET  47  -9.138  -3.627   0.906
  361    HA   MET  47           HA       MET  47 -11.767  -4.521   0.405
  362   1HB   MET  47          2HB       MET  47 -10.225  -2.065  -0.407
  363   2HB   MET  47          1HB       MET  47 -11.854  -2.348  -1.023
  364   1HG   MET  47          2HG       MET  47 -12.507  -1.297   0.890
  365   2HG   MET  47          1HG       MET  47 -12.214  -2.868   1.634
  366   1HE   MET  47          1HE       MET  47 -12.401  -1.255   3.494
  367   2HE   MET  47          2HE       MET  47 -11.764   0.361   3.192
  368   3HE   MET  47          3HE       MET  47 -10.968  -0.690   4.362
  369    H    LEU  48           H        LEU  48  -8.917  -4.278  -1.658
  370    HA   LEU  48           HA       LEU  48 -10.245  -4.753  -4.142
  371   1HB   LEU  48          2HB       LEU  48  -7.620  -4.187  -3.291
  372   2HB   LEU  48          1HB       LEU  48  -7.532  -5.732  -4.107
  373    HG   LEU  48           HG       LEU  48  -7.054  -3.955  -5.676
  374   1HD1  LEU  48          1HD1      LEU  48  -9.878  -4.900  -6.218
  375   2HD1  LEU  48          2HD1      LEU  48  -8.472  -5.952  -6.369
  376   3HD1  LEU  48          3HD1      LEU  48  -8.621  -4.528  -7.398
  377   1HD2  LEU  48          1HD2      LEU  48  -8.428  -2.079  -6.024
  378   2HD2  LEU  48          2HD2      LEU  48  -8.501  -2.293  -4.275
  379   3HD2  LEU  48          3HD2      LEU  48  -9.832  -2.853  -5.288
  380    H    GLY  49           H        GLY  49  -8.285  -6.859  -2.025
  381   1HA   GLY  49          2HA       GLY  49  -9.618  -9.100  -1.718
  382   2HA   GLY  49          1HA       GLY  49  -9.284  -9.235  -3.442
  383    H    GLN  50           H        GLN  50  -7.429  -8.239  -0.556
  384    HA   GLN  50           HA       GLN  50  -5.488 -10.381  -1.010
  385   1HB   GLN  50          2HB       GLN  50  -4.976  -7.538  -1.622
  386   2HB   GLN  50          1HB       GLN  50  -3.755  -8.311  -0.609
  387   1HG   GLN  50          2HG       GLN  50  -3.440 -10.080  -2.243
  388   2HG   GLN  50          1HG       GLN  50  -4.773  -9.467  -3.221
  389   1HE2  GLN  50          1HE2      GLN  50  -3.899  -8.473  -5.045
  390   2HE2  GLN  50          2HE2      GLN  50  -2.554  -7.438  -5.034
  391    H    ASN  51           H        ASN  51  -4.250 -10.877   0.817
  392    HA   ASN  51           HA       ASN  51  -4.692  -9.275   3.243
  393   1HB   ASN  51          2HB       ASN  51  -6.444 -11.097   3.113
  394   2HB   ASN  51          1HB       ASN  51  -5.131 -12.268   3.228
  395   1HD2  ASN  51          1HD2      ASN  51  -4.925 -12.990   5.351
  396   2HD2  ASN  51          2HD2      ASN  51  -5.120 -12.022   6.732
  397    HA   PRO  52           HA       PRO  52  -0.370 -10.915   2.948
  398   1HB   PRO  52          2HB       PRO  52   0.878  -8.487   2.828
  399   2HB   PRO  52          1HB       PRO  52   0.294  -9.354   1.403
  400   1HG   PRO  52          2HG       PRO  52  -0.789  -6.944   2.707
  401   2HG   PRO  52          1HG       PRO  52  -0.978  -7.499   1.039
  402   1HD   PRO  52          2HD       PRO  52  -2.886  -7.734   3.156
  403   2HD   PRO  52          1HD       PRO  52  -3.004  -8.432   1.523
  404    H    THR  53           H        THR  53   1.641  -9.723   4.253
  405    HA   THR  53           HA       THR  53   0.669  -9.442   7.031
  406    HB   THR  53           HB       THR  53   2.738 -10.319   7.769
  407    HG1  THR  53           HG1      THR  53   4.479 -10.575   6.213
  408   1HG2  THR  53          1HG2      THR  53   3.084 -12.374   6.442
  409   2HG2  THR  53          2HG2      THR  53   2.107 -11.684   5.145
  410   3HG2  THR  53          3HG2      THR  53   1.370 -12.048   6.706
  411    HA   PRO  54           HA       PRO  54   2.196  -5.316   7.267
  412   1HB   PRO  54          2HB       PRO  54   3.627  -5.249   9.607
  413   2HB   PRO  54          1HB       PRO  54   1.857  -5.284   9.526
  414   1HG   PRO  54          2HG       PRO  54   3.766  -7.475  10.174
  415   2HG   PRO  54          1HG       PRO  54   2.129  -7.188  10.785
  416   1HD   PRO  54          2HD       PRO  54   2.777  -9.059   8.834
  417   2HD   PRO  54          1HD       PRO  54   1.154  -8.371   9.068
  418    H    GLU  55           H        GLU  55   4.650  -7.811   7.652
  419    HA   GLU  55           HA       GLU  55   6.844  -6.005   7.022
  420   1HB   GLU  55          2HB       GLU  55   8.244  -8.053   7.067
  421   2HB   GLU  55          1HB       GLU  55   7.316  -7.836   8.547
  422   1HG   GLU  55          2HG       GLU  55   5.735  -9.518   7.912
  423   2HG   GLU  55          1HG       GLU  55   6.351  -9.569   6.260
  424    H    GLU  56           H        GLU  56   4.798  -8.346   5.383
  425    HA   GLU  56           HA       GLU  56   6.351  -8.556   2.997
  426   1HB   GLU  56          2HB       GLU  56   4.485 -10.139   3.787
  427   2HB   GLU  56          1HB       GLU  56   3.362  -8.945   3.134
  428   1HG   GLU  56          2HG       GLU  56   3.787 -10.592   1.409
  429   2HG   GLU  56          1HG       GLU  56   4.592  -9.095   0.941
  430    H    LEU  57           H        LEU  57   3.318  -6.754   3.713
  431    HA   LEU  57           HA       LEU  57   3.225  -5.364   1.263
  432   1HB   LEU  57          2HB       LEU  57   1.676  -3.860   2.329
  433   2HB   LEU  57          1HB       LEU  57   1.323  -5.505   2.801
  434    HG   LEU  57           HG       LEU  57   2.864  -4.801   4.887
  435   1HD1  LEU  57          1HD1      LEU  57   1.827  -2.377   5.366
  436   2HD1  LEU  57          2HD1      LEU  57   1.921  -2.273   3.609
  437   3HD1  LEU  57          3HD1      LEU  57   3.379  -2.576   4.554
  438   1HD2  LEU  57          1HD2      LEU  57   0.463  -5.631   4.797
  439   2HD2  LEU  57          2HD2      LEU  57  -0.032  -3.943   4.668
  440   3HD2  LEU  57          3HD2      LEU  57   0.815  -4.505   6.108
  441    H    GLN  58           H        GLN  58   5.075  -4.795   4.184
  442    HA   GLN  58           HA       GLN  58   5.744  -2.096   3.885
  443   1HB   GLN  58          2HB       GLN  58   6.573  -4.219   5.540
  444   2HB   GLN  58          1HB       GLN  58   8.039  -3.616   4.770
  445   1HG   GLN  58          2HG       GLN  58   5.994  -1.881   6.187
  446   2HG   GLN  58          1HG       GLN  58   7.521  -2.412   6.888
  447   1HE2  GLN  58          1HE2      GLN  58   6.067  -0.222   4.533
  448   2HE2  GLN  58          2HE2      GLN  58   7.492   0.632   4.179
  449    H    GLU  59           H        GLU  59   7.312  -4.994   2.536
  450    HA   GLU  59           HA       GLU  59   9.425  -3.669   1.199
  451   1HB   GLU  59          2HB       GLU  59   8.058  -6.315   0.677
  452   2HB   GLU  59          1HB       GLU  59   9.446  -5.754  -0.254
  453   1HG   GLU  59          2HG       GLU  59  10.899  -5.908   1.558
  454   2HG   GLU  59          1HG       GLU  59   9.602  -5.749   2.744
  455    H    MET  60           H        MET  60   6.137  -4.537   0.185
  456    HA   MET  60           HA       MET  60   6.368  -3.836  -2.542
  457   1HB   MET  60          2HB       MET  60   4.050  -4.080  -0.643
  458   2HB   MET  60          1HB       MET  60   3.801  -3.453  -2.272
  459   1HG   MET  60          2HG       MET  60   4.802  -5.478  -3.228
  460   2HG   MET  60          1HG       MET  60   5.117  -6.103  -1.609
  461   1HE   MET  60          1HE       MET  60   3.053  -8.076  -0.699
  462   2HE   MET  60          2HE       MET  60   4.304  -8.028  -1.937
  463   3HE   MET  60          3HE       MET  60   2.682  -8.573  -2.355
  464    H    ILE  61           H        ILE  61   5.378  -1.944   0.303
  465    HA   ILE  61           HA       ILE  61   4.585   0.418  -0.946
  466    HB   ILE  61           HB       ILE  61   5.918  -0.074   1.717
  467   1HG1  ILE  61          2HG1      ILE  61   3.098   0.802   1.387
  468   2HG1  ILE  61          1HG1      ILE  61   3.479  -0.844   0.884
  469   1HG2  ILE  61          1HG2      ILE  61   4.968   2.215   2.278
  470   2HG2  ILE  61          2HG2      ILE  61   4.751   2.460   0.543
  471   3HG2  ILE  61          3HG2      ILE  61   6.370   2.216   1.207
  472   1HD1  ILE  61          1HD1      ILE  61   4.268  -1.434   3.034
  473   2HD1  ILE  61          2HD1      ILE  61   2.788  -0.524   3.336
  474   3HD1  ILE  61          3HD1      ILE  61   4.360   0.246   3.556
  475    H    ASP  62           H        ASP  62   7.743  -0.006   0.670
  476    HA   ASP  62           HA       ASP  62   9.007   2.232  -0.378
  477   1HB   ASP  62          2HB       ASP  62  10.217  -0.435   0.392
  478   2HB   ASP  62          1HB       ASP  62  11.151   1.021   0.065
  479    H    GLU  63           H        GLU  63   8.640  -0.988  -1.805
  480    HA   GLU  63           HA       GLU  63  10.462  -0.690  -3.946
  481   1HB   GLU  63          2HB       GLU  63   8.129  -2.469  -3.393
  482   2HB   GLU  63          1HB       GLU  63   8.736  -2.385  -5.046
  483   1HG   GLU  63          2HG       GLU  63  10.673  -2.759  -2.778
  484   2HG   GLU  63          1HG       GLU  63   9.758  -4.142  -3.378
  485    H    VAL  64           H        VAL  64   6.940  -0.091  -3.782
  486    HA   VAL  64           HA       VAL  64   6.845   0.907  -6.493
  487    HB   VAL  64           HB       VAL  64   4.510   1.384  -6.080
  488   1HG1  VAL  64          1HG1      VAL  64   4.710  -0.886  -6.548
  489   2HG1  VAL  64          2HG1      VAL  64   3.885  -0.924  -4.992
  490   3HG1  VAL  64          3HG1      VAL  64   5.620  -1.216  -5.074
  491   1HG2  VAL  64          1HG2      VAL  64   4.963   0.617  -3.186
  492   2HG2  VAL  64          2HG2      VAL  64   3.488   1.253  -3.911
  493   3HG2  VAL  64          3HG2      VAL  64   4.903   2.290  -3.739
  494    H    ASP  65           H        ASP  65   7.540   2.291  -3.403
  495    HA   ASP  65           HA       ASP  65   6.684   4.953  -3.895
  496   1HB   ASP  65          2HB       ASP  65   7.686   3.638  -1.714
  497   2HB   ASP  65          1HB       ASP  65   9.065   4.625  -2.185
  498    H    GLU  66           H        GLU  66   7.326   5.463  -5.994
  499    HA   GLU  66           HA       GLU  66   9.997   5.287  -6.958
  500   1HB   GLU  66          2HB       GLU  66   7.631   6.941  -7.856
  501   2HB   GLU  66          1HB       GLU  66   9.173   6.910  -8.712
  502   1HG   GLU  66          2HG       GLU  66   8.851   4.785  -9.501
  503   2HG   GLU  66          1HG       GLU  66   8.005   4.261  -8.045
  504    H    ASP  67           H        ASP  67   8.188   7.834  -5.322
  505    HA   ASP  67           HA       ASP  67  10.437   9.698  -5.559
  506   1HB   ASP  67          2HB       ASP  67   8.798  11.182  -4.173
  507   2HB   ASP  67          1HB       ASP  67   8.462  10.887  -5.880
  508    H    GLY  68           H        GLY  68   8.644   7.943  -3.035
  509   1HA   GLY  68          2HA       GLY  68   9.348   7.267  -0.931
  510   2HA   GLY  68          1HA       GLY  68  10.942   7.926  -1.296
  511    H    SER  69           H        SER  69   7.729   9.450  -1.240
  512    HA   SER  69           HA       SER  69   8.803  11.628   0.398
  513   1HB   SER  69          2HB       SER  69   6.667  12.768  -0.154
  514   2HB   SER  69          1HB       SER  69   7.563  12.282  -1.590
  515    HG   SER  69           HG       SER  69   5.917  11.092  -2.113
  516    H    GLY  70           H        GLY  70   6.053   9.367   0.388
  517   1HA   GLY  70          2HA       GLY  70   5.918   8.440   2.868
  518   2HA   GLY  70          1HA       GLY  70   5.371  10.089   3.143
  519    H    THR  71           H        THR  71   4.176   9.927   0.268
  520    HA   THR  71           HA       THR  71   1.728   8.463   1.052
  521    HB   THR  71           HB       THR  71   0.467  10.043  -0.342
  522    HG1  THR  71           HG1      THR  71   2.867  11.529  -0.567
  523   1HG2  THR  71          1HG2      THR  71   0.741  10.571   2.022
  524   2HG2  THR  71          2HG2      THR  71   0.802  12.060   1.079
  525   3HG2  THR  71          3HG2      THR  71   2.292  11.345   1.698
  526    H    VAL  72           H        VAL  72   0.628   7.288  -0.516
  527    HA   VAL  72           HA       VAL  72   2.279   6.516  -2.842
  528    HB   VAL  72           HB       VAL  72  -0.025   5.010  -1.573
  529   1HG1  VAL  72          1HG1      VAL  72   0.653   3.180  -2.973
  530   2HG1  VAL  72          2HG1      VAL  72   2.104   4.035  -3.492
  531   3HG1  VAL  72          3HG1      VAL  72   0.516   4.592  -4.018
  532   1HG2  VAL  72          1HG2      VAL  72   2.976   4.686  -1.279
  533   2HG2  VAL  72          2HG2      VAL  72   1.782   3.526  -0.693
  534   3HG2  VAL  72          3HG2      VAL  72   1.841   5.151  -0.011
  535    H    ASP  73           H        ASP  73   1.691   7.504  -4.654
  536    HA   ASP  73           HA       ASP  73  -1.039   8.447  -5.052
  537   1HB   ASP  73          2HB       ASP  73   1.462   8.640  -6.747
  538   2HB   ASP  73          1HB       ASP  73  -0.106   9.270  -7.250
  539    H    PHE  74           H        PHE  74  -1.739   8.067  -7.548
  540    HA   PHE  74           HA       PHE  74  -2.456   5.321  -7.689
  541   1HB   PHE  74          2HB       PHE  74  -3.608   7.430  -8.753
  542   2HB   PHE  74          1HB       PHE  74  -2.557   7.070 -10.123
  543    HD1  PHE  74           HD1      PHE  74  -3.725   5.934 -11.780
  544    HD2  PHE  74           HD2      PHE  74  -4.419   4.931  -7.666
  545    HE1  PHE  74           HE1      PHE  74  -5.267   4.123 -12.482
  546    HE2  PHE  74           HE2      PHE  74  -5.969   3.124  -8.364
  547    HZ   PHE  74           HZ       PHE  74  -6.394   2.719 -10.774
  548    H    ASP  75           H        ASP  75   0.141   7.191  -9.194
  549    HA   ASP  75           HA       ASP  75   0.933   5.256 -11.120
  550   1HB   ASP  75          2HB       ASP  75   2.183   7.655  -9.872
  551   2HB   ASP  75          1HB       ASP  75   3.274   6.476 -10.596
  552    H    GLU  76           H        GLU  76   1.674   5.758  -7.718
  553    HA   GLU  76           HA       GLU  76   3.611   3.593  -7.605
  554   1HB   GLU  76          2HB       GLU  76   2.353   4.941  -5.217
  555   2HB   GLU  76          1HB       GLU  76   3.945   4.196  -5.349
  556   1HG   GLU  76          2HG       GLU  76   4.681   5.965  -6.878
  557   2HG   GLU  76          1HG       GLU  76   3.073   6.687  -6.838
  558    H    PHE  77           H        PHE  77   0.201   4.058  -7.187
  559    HA   PHE  77           HA       PHE  77  -0.296   1.700  -5.600
  560   1HB   PHE  77          2HB       PHE  77  -1.769   3.759  -5.669
  561   2HB   PHE  77          1HB       PHE  77  -2.264   3.268  -7.285
  562    HD1  PHE  77           HD1      PHE  77  -2.106   2.075  -3.736
  563    HD2  PHE  77           HD2      PHE  77  -3.976   1.696  -7.589
  564    HE1  PHE  77           HE1      PHE  77  -3.797   0.539  -2.768
  565    HE2  PHE  77           HE2      PHE  77  -5.668   0.156  -6.618
  566    HZ   PHE  77           HZ       PHE  77  -5.576  -0.419  -4.207
  567    H    LEU  78           H        LEU  78  -0.381   2.533  -9.047
  568    HA   LEU  78           HA       LEU  78  -1.557   0.064  -9.906
  569   1HB   LEU  78          2HB       LEU  78  -0.098   2.252 -11.368
  570   2HB   LEU  78          1HB       LEU  78  -0.709   0.828 -12.176
  571    HG   LEU  78           HG       LEU  78  -2.189   3.166 -11.052
  572   1HD1  LEU  78          1HD1      LEU  78  -1.880   3.077 -13.431
  573   2HD1  LEU  78          2HD1      LEU  78  -3.563   2.648 -13.122
  574   3HD1  LEU  78          3HD1      LEU  78  -2.386   1.388 -13.496
  575   1HD2  LEU  78          1HD2      LEU  78  -3.161   0.306 -11.069
  576   2HD2  LEU  78          2HD2      LEU  78  -4.282   1.660 -11.204
  577   3HD2  LEU  78          3HD2      LEU  78  -3.270   1.494  -9.769
  578    H    VAL  79           H        VAL  79   1.789   1.252  -9.677
  579    HA   VAL  79           HA       VAL  79   3.054  -0.790 -11.120
  580    HB   VAL  79           HB       VAL  79   5.058  -0.314  -9.624
  581   1HG1  VAL  79          1HG1      VAL  79   5.558   1.263 -11.151
  582   2HG1  VAL  79          2HG1      VAL  79   4.300   2.342 -10.548
  583   3HG1  VAL  79          3HG1      VAL  79   3.902   1.097 -11.732
  584   1HG2  VAL  79          1HG2      VAL  79   3.298   1.931  -8.613
  585   2HG2  VAL  79          2HG2      VAL  79   4.940   1.538  -8.105
  586   3HG2  VAL  79          3HG2      VAL  79   3.607   0.461  -7.688
  587    H    MET  80           H        MET  80   1.717  -0.830  -7.904
  588    HA   MET  80           HA       MET  80   3.051  -2.918  -6.671
  589   1HB   MET  80          2HB       MET  80   0.367  -1.732  -6.471
  590   2HB   MET  80          1HB       MET  80   0.463  -3.403  -5.919
  591   1HG   MET  80          2HG       MET  80   2.670  -2.485  -4.724
  592   2HG   MET  80          1HG       MET  80   1.786  -0.963  -4.821
  593   1HE   MET  80          1HE       MET  80  -1.177  -1.864  -4.765
  594   2HE   MET  80          2HE       MET  80  -0.531  -0.513  -3.836
  595   3HE   MET  80          3HE       MET  80  -1.548  -1.714  -3.043
  596    H    MET  81           H        MET  81   0.652  -3.108  -9.252
  597    HA   MET  81           HA       MET  81   0.329  -5.976  -9.029
  598   1HB   MET  81          2HB       MET  81  -0.731  -3.832 -10.804
  599   2HB   MET  81          1HB       MET  81  -0.712  -5.478 -11.439
  600   1HG   MET  81          2HG       MET  81  -1.822  -4.859  -8.701
  601   2HG   MET  81          1HG       MET  81  -2.820  -4.741 -10.150
  602   1HE   MET  81          1HE       MET  81  -2.287  -8.270  -7.653
  603   2HE   MET  81          2HE       MET  81  -2.669  -6.572  -7.380
  604   3HE   MET  81          3HE       MET  81  -0.994  -7.064  -7.619
  605    H    VAL  82           H        VAL  82   1.837  -3.791 -11.415
  606    HA   VAL  82           HA       VAL  82   2.892  -5.874 -13.038
  607    HB   VAL  82           HB       VAL  82   4.331  -4.063 -14.018
  608   1HG1  VAL  82          1HG1      VAL  82   1.463  -3.165 -13.741
  609   2HG1  VAL  82          2HG1      VAL  82   1.889  -4.625 -14.635
  610   3HG1  VAL  82          3HG1      VAL  82   2.514  -3.059 -15.153
  611   1HG2  VAL  82          1HG2      VAL  82   4.439  -2.763 -11.826
  612   2HG2  VAL  82          2HG2      VAL  82   2.785  -2.248 -12.151
  613   3HG2  VAL  82          3HG2      VAL  82   4.081  -1.800 -13.257
  614    H    ARG  83           H        ARG  83   4.181  -4.215 -10.198
  615    HA   ARG  83           HA       ARG  83   6.896  -5.007 -10.547
  616   1HB   ARG  83          2HB       ARG  83   7.194  -4.481  -8.173
  617   2HB   ARG  83          1HB       ARG  83   6.266  -3.216  -8.976
  618   1HG   ARG  83          2HG       ARG  83   4.837  -3.495  -7.223
  619   2HG   ARG  83          1HG       ARG  83   4.256  -4.867  -8.164
  620   1HD   ARG  83          2HD       ARG  83   6.403  -5.974  -6.875
  621   2HD   ARG  83          1HD       ARG  83   5.834  -4.825  -5.669
  622    HE   ARG  83           HE       ARG  83   3.558  -6.129  -6.496
  623   1HH1  ARG  83          2HH1      ARG  83   6.659  -7.108  -5.216
  624   2HH1  ARG  83          1HH1      ARG  83   6.030  -8.523  -4.442
  625   1HH2  ARG  83          1HH2      ARG  83   2.760  -7.985  -5.474
  626   2HH2  ARG  83          2HH2      ARG  83   3.830  -9.019  -4.586
  627    H    CYS  84           H        CYS  84   4.066  -6.672  -9.388
  628    HA   CYS  84           HA       CYS  84   5.345  -8.734  -7.908
  629   1HB   CYS  84          2HB       CYS  84   2.837  -8.127  -7.970
  630   2HB   CYS  84          1HB       CYS  84   2.773  -9.109  -9.434
  631    HG   CYS  84           HG       CYS  84   2.694 -11.091  -7.962
  632    H    MET  85           H        MET  85   4.744  -8.252 -11.345
  633    HA   MET  85           HA       MET  85   5.193 -10.924 -12.206
  634   1HB   MET  85          2HB       MET  85   5.245  -8.238 -13.538
  635   2HB   MET  85          1HB       MET  85   5.876  -9.643 -14.398
  636   1HG   MET  85          2HG       MET  85   3.751 -10.817 -14.110
  637   2HG   MET  85          1HG       MET  85   3.114  -9.480 -13.151
  638   1HE   MET  85          1HE       MET  85   1.219 -10.155 -15.165
  639   2HE   MET  85          2HE       MET  85   0.934  -8.665 -16.060
  640   3HE   MET  85          3HE       MET  85   1.173  -8.603 -14.316
  641    H    LYS  86           H        LYS  86   7.356  -8.085 -12.518
  642    HA   LYS  86           HA       LYS  86   9.642  -7.884 -12.484
  643   1HB   LYS  86          2HB       LYS  86   9.087 -10.083 -10.602
  644   2HB   LYS  86          1HB       LYS  86  10.718 -10.096 -11.273
  645   1HG   LYS  86          2HG       LYS  86   9.622  -7.477 -10.334
  646   2HG   LYS  86          1HG       LYS  86  10.109  -8.650  -9.111
  647   1HD   LYS  86          2HD       LYS  86  12.138  -8.589 -11.132
  648   2HD   LYS  86          1HD       LYS  86  11.781  -6.927 -10.663
  649   1HE   LYS  86          2HE       LYS  86  13.421  -7.580  -9.107
  650   2HE   LYS  86          1HE       LYS  86  11.914  -7.816  -8.222
  651   1HZ   LYS  86          1HZ       LYS  86  13.415  -9.716  -8.020
  652   2HZ   LYS  86          2HZ       LYS  86  13.377  -9.935  -9.704
  653   3HZ   LYS  86          3HZ       LYS  86  11.965 -10.149  -8.785
  654    H    ASP  87           H        ASP  87  11.748  -9.198 -13.035
  655    HA   ASP  87           HA       ASP  87  11.147 -10.968 -15.330
  656   1HB   ASP  87          2HB       ASP  87  13.254 -10.005 -16.362
  657   2HB   ASP  87          1HB       ASP  87  11.886  -8.898 -16.265
  658    H    ASP  88           H        ASP  88  11.701 -11.755 -12.588
  659    HA   ASP  88           HA       ASP  88  12.934 -13.295 -11.430
  660   1HB   ASP  88          2HB       ASP  88  12.842 -14.257 -13.967
  661   2HB   ASP  88          1HB       ASP  88  14.584 -14.131 -13.732
  662    H    SER  89           HN       SER  89  13.934 -10.543 -11.798
  663    HA   SER  89           HA       SER  89  16.524 -10.875 -10.619
  664   1HB   SER  89          2HB       SER  89  16.355 -10.387 -13.517
  665   2HB   SER  89          1HB       SER  89  17.362  -9.229 -12.654
  666    HG   SER  89           HG       SER  89  18.177 -11.476 -13.419
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  15.839   4.419 -18.773
    2   2H    MET   1          2H        MET   1  14.934   3.218 -19.564
    3   3H    MET   1          3H        MET   1  16.276   2.789 -18.615
    4    HA   MET   1           HA       MET   1  15.196   3.393 -16.612
    5   1HB   MET   1          2HB       MET   1  12.912   4.352 -16.640
    6   2HB   MET   1          1HB       MET   1  14.066   5.409 -17.450
    7   1HG   MET   1          2HG       MET   1  13.204   4.957 -19.564
    8   2HG   MET   1          1HG       MET   1  12.574   3.382 -19.086
    9   1HE   MET   1          1HE       MET   1  12.427   6.906 -19.394
   10   2HE   MET   1          2HE       MET   1  11.779   7.358 -17.819
   11   3HE   MET   1          3HE       MET   1  10.734   7.393 -19.236
   12    H    ASN   2           H        ASN   2  12.960   2.408 -15.784
   13    HA   ASN   2           HA       ASN   2  13.004  -0.353 -16.416
   14   1HB   ASN   2          2HB       ASN   2  11.319   1.419 -14.723
   15   2HB   ASN   2          1HB       ASN   2  10.619  -0.128 -15.197
   16   1HD2  ASN   2          1HD2      ASN   2  12.298  -2.065 -14.897
   17   2HD2  ASN   2          2HD2      ASN   2  13.188  -2.027 -13.452
   18    H    ASP   3           H        ASP   3  11.658  -1.635 -17.628
   19    HA   ASP   3           HA       ASP   3   9.749  -0.229 -19.406
   20   1HB   ASP   3          2HB       ASP   3  11.777  -2.362 -20.019
   21   2HB   ASP   3          1HB       ASP   3  10.340  -2.169 -21.025
   22    H    ILE   4           H        ILE   4   9.788  -2.278 -16.847
   23    HA   ILE   4           HA       ILE   4   8.072  -4.383 -17.785
   24    HB   ILE   4           HB       ILE   4   7.864  -5.093 -15.536
   25   1HG1  ILE   4          2HG1      ILE   4   7.255  -2.740 -14.707
   26   2HG1  ILE   4          1HG1      ILE   4   8.182  -3.751 -13.601
   27   1HG2  ILE   4          1HG2      ILE   4  10.182  -5.113 -14.720
   28   2HG2  ILE   4          2HG2      ILE   4  10.586  -3.785 -15.808
   29   3HG2  ILE   4          3HG2      ILE   4  10.129  -5.355 -16.466
   30   1HD1  ILE   4          1HD1      ILE   4  10.261  -2.590 -14.680
   31   2HD1  ILE   4          2HD1      ILE   4   9.310  -1.695 -13.498
   32   3HD1  ILE   4          3HD1      ILE   4   9.097  -1.381 -15.219
   33    H    TYR   5           H        TYR   5   7.606  -1.135 -16.650
   34    HA   TYR   5           HA       TYR   5   4.844  -1.314 -15.954
   35   1HB   TYR   5          2HB       TYR   5   6.338   1.132 -16.941
   36   2HB   TYR   5          1HB       TYR   5   4.861   1.103 -15.980
   37    HD1  TYR   5           HD1      TYR   5   5.103  -0.458 -13.766
   38    HD2  TYR   5           HD2      TYR   5   8.307   1.569 -15.786
   39    HE1  TYR   5           HE1      TYR   5   6.458  -0.527 -11.692
   40    HE2  TYR   5           HE2      TYR   5   9.660   1.497 -13.712
   41    HH   TYR   5           HH       TYR   5   9.431  -0.360 -11.430
   42    H    LYS   6           H        LYS   6   6.643  -0.663 -18.907
   43    HA   LYS   6           HA       LYS   6   4.388   0.110 -20.509
   44   1HB   LYS   6          2HB       LYS   6   6.958  -1.067 -21.578
   45   2HB   LYS   6          1HB       LYS   6   5.870   0.071 -22.368
   46   1HG   LYS   6          2HG       LYS   6   7.767   0.589 -20.070
   47   2HG   LYS   6          1HG       LYS   6   7.715   1.386 -21.642
   48   1HD   LYS   6          2HD       LYS   6   5.677   2.524 -21.101
   49   2HD   LYS   6          1HD       LYS   6   5.436   1.537 -19.658
   50   1HE   LYS   6          2HE       LYS   6   7.055   2.665 -18.441
   51   2HE   LYS   6          1HE       LYS   6   7.960   3.136 -19.879
   52   1HZ   LYS   6          1HZ       LYS   6   6.848   5.039 -18.940
   53   2HZ   LYS   6          2HZ       LYS   6   5.346   4.248 -19.006
   54   3HZ   LYS   6          3HZ       LYS   6   6.152   4.669 -20.442
   55    H    ALA   7           H        ALA   7   6.178  -2.885 -19.959
   56    HA   ALA   7           HA       ALA   7   4.758  -4.483 -21.843
   57   1HB   ALA   7          1HB       ALA   7   6.763  -5.461 -21.149
   58   2HB   ALA   7          2HB       ALA   7   5.567  -6.376 -20.229
   59   3HB   ALA   7          3HB       ALA   7   6.476  -5.079 -19.452
   60    H    ALA   8           H        ALA   8   4.177  -3.526 -18.512
   61    HA   ALA   8           HA       ALA   8   2.066  -5.405 -18.007
   62   1HB   ALA   8          1HB       ALA   8   3.484  -4.247 -16.245
   63   2HB   ALA   8          2HB       ALA   8   1.745  -4.246 -15.952
   64   3HB   ALA   8          3HB       ALA   8   2.536  -2.794 -16.566
   65    H    VAL   9           H        VAL   9   2.268  -2.136 -19.306
   66    HA   VAL   9           HA       VAL   9  -0.301  -1.185 -19.002
   67    HB   VAL   9           HB       VAL   9   1.712  -0.885 -21.213
   68   1HG1  VAL   9          1HG1      VAL   9  -1.079   0.285 -21.099
   69   2HG1  VAL   9          2HG1      VAL   9  -0.372  -0.678 -22.397
   70   3HG1  VAL   9          3HG1      VAL   9   0.213   0.958 -22.093
   71   1HG2  VAL   9          1HG2      VAL   9   2.315   0.985 -20.075
   72   2HG2  VAL   9          2HG2      VAL   9   1.440   0.261 -18.727
   73   3HG2  VAL   9          3HG2      VAL   9   0.641   1.444 -19.761
   74    H    GLU  10           H        GLU  10   0.870  -3.279 -21.650
   75    HA   GLU  10           HA       GLU  10  -1.632  -3.507 -22.974
   76   1HB   GLU  10          2HB       GLU  10   0.811  -5.291 -23.009
   77   2HB   GLU  10          1HB       GLU  10  -0.591  -5.533 -24.051
   78   1HG   GLU  10          2HG       GLU  10   0.011  -3.844 -25.429
   79   2HG   GLU  10          1HG       GLU  10   0.366  -2.766 -24.080
   80    H    GLN  11           H        GLN  11  -0.380  -5.030 -20.123
   81    HA   GLN  11           HA       GLN  11  -2.240  -7.273 -20.254
   82   1HB   GLN  11          2HB       GLN  11  -0.396  -6.488 -17.986
   83   2HB   GLN  11          1HB       GLN  11  -1.204  -8.039 -18.211
   84   1HG   GLN  11          2HG       GLN  11   0.052  -8.261 -20.403
   85   2HG   GLN  11          1HG       GLN  11   0.989  -6.846 -19.923
   86   1HE2  GLN  11          1HE2      GLN  11   1.688  -7.181 -17.345
   87   2HE2  GLN  11          2HE2      GLN  11   2.455  -8.670 -17.073
   88    H    LEU  12           H        LEU  12  -1.973  -4.132 -18.744
   89    HA   LEU  12           HA       LEU  12  -3.770  -4.451 -16.606
   90   1HB   LEU  12          2HB       LEU  12  -3.428  -1.935 -18.226
   91   2HB   LEU  12          1HB       LEU  12  -3.964  -2.067 -16.568
   92    HG   LEU  12           HG       LEU  12  -1.184  -2.369 -17.676
   93   1HD1  LEU  12          1HD1      LEU  12  -2.215  -0.858 -15.266
   94   2HD1  LEU  12          2HD1      LEU  12  -2.134  -0.154 -16.880
   95   3HD1  LEU  12          3HD1      LEU  12  -0.656  -0.669 -16.069
   96   1HD2  LEU  12          1HD2      LEU  12  -0.656  -2.999 -15.195
   97   2HD2  LEU  12          2HD2      LEU  12  -1.229  -4.264 -16.281
   98   3HD2  LEU  12          3HD2      LEU  12  -2.343  -3.512 -15.139
   99    H    THR  13           H        THR  13  -5.901  -4.606 -16.474
  100    HA   THR  13           HA       THR  13  -7.497  -4.202 -18.935
  101    HB   THR  13           HB       THR  13  -9.145  -5.705 -17.439
  102    HG1  THR  13           HG1      THR  13  -7.682  -5.924 -15.736
  103   1HG2  THR  13          1HG2      THR  13  -6.933  -6.439 -19.329
  104   2HG2  THR  13          2HG2      THR  13  -8.677  -6.458 -19.591
  105   3HG2  THR  13          3HG2      THR  13  -7.921  -7.709 -18.605
  106    H    ASP  14           H        ASP  14  -9.822  -3.662 -18.480
  107    HA   ASP  14           HA       ASP  14  -9.973  -1.242 -16.972
  108   1HB   ASP  14          2HB       ASP  14 -12.090  -2.949 -18.294
  109   2HB   ASP  14          1HB       ASP  14 -12.451  -1.429 -17.475
  110    H    GLU  15           H        GLU  15 -10.818  -4.589 -16.359
  111    HA   GLU  15           HA       GLU  15 -12.459  -4.218 -14.082
  112   1HB   GLU  15          2HB       GLU  15 -12.105  -6.569 -13.659
  113   2HB   GLU  15          1HB       GLU  15 -12.266  -6.331 -15.395
  114   1HG   GLU  15          2HG       GLU  15  -9.659  -6.146 -15.360
  115   2HG   GLU  15          1HG       GLU  15  -9.797  -6.963 -13.803
  116    H    GLN  16           H        GLN  16  -8.961  -4.630 -14.460
  117    HA   GLN  16           HA       GLN  16  -8.330  -4.769 -11.684
  118   1HB   GLN  16          2HB       GLN  16  -6.705  -4.060 -14.129
  119   2HB   GLN  16          1HB       GLN  16  -6.015  -4.034 -12.506
  120   1HG   GLN  16          2HG       GLN  16  -6.516  -6.380 -12.183
  121   2HG   GLN  16          1HG       GLN  16  -7.423  -6.441 -13.694
  122   1HE2  GLN  16          1HE2      GLN  16  -4.658  -7.623 -12.599
  123   2HE2  GLN  16          2HE2      GLN  16  -3.634  -7.397 -13.933
  124    H    LYS  17           H        LYS  17  -8.261  -2.089 -14.040
  125    HA   LYS  17           HA       LYS  17  -7.466  -0.110 -12.153
  126   1HB   LYS  17          2HB       LYS  17  -8.457  -0.113 -14.948
  127   2HB   LYS  17          1HB       LYS  17  -8.703   1.374 -14.030
  128   1HG   LYS  17          2HG       LYS  17  -6.563   1.860 -14.605
  129   2HG   LYS  17          1HG       LYS  17  -6.120   0.706 -13.345
  130   1HD   LYS  17          2HD       LYS  17  -5.719  -1.013 -14.873
  131   2HD   LYS  17          1HD       LYS  17  -6.740  -0.286 -16.114
  132   1HE   LYS  17          2HE       LYS  17  -4.762   1.634 -15.635
  133   2HE   LYS  17          1HE       LYS  17  -3.898   0.098 -15.613
  134   1HZ   LYS  17          1HZ       LYS  17  -5.081  -0.439 -17.732
  135   2HZ   LYS  17          2HZ       LYS  17  -3.959   0.832 -17.843
  136   3HZ   LYS  17          3HZ       LYS  17  -5.622   1.168 -17.773
  137    H    ASN  18           H        ASN  18 -10.539  -1.581 -12.880
  138    HA   ASN  18           HA       ASN  18 -12.229   0.512 -11.933
  139   1HB   ASN  18          2HB       ASN  18 -12.634  -2.002 -13.076
  140   2HB   ASN  18          1HB       ASN  18 -13.279  -2.163 -11.442
  141   1HD2  ASN  18          1HD2      ASN  18 -13.464  -0.032 -14.337
  142   2HD2  ASN  18          2HD2      ASN  18 -15.047   0.496 -14.026
  143    H    GLU  19           H        GLU  19 -10.865  -2.402 -10.404
  144    HA   GLU  19           HA       GLU  19 -11.955  -1.864  -7.806
  145   1HB   GLU  19          2HB       GLU  19  -9.576  -3.584  -8.576
  146   2HB   GLU  19          1HB       GLU  19 -10.404  -3.604  -7.019
  147   1HG   GLU  19          2HG       GLU  19 -12.019  -4.022  -9.509
  148   2HG   GLU  19          1HG       GLU  19 -11.038  -5.356  -8.902
  149    H    PHE  20           H        PHE  20  -8.830  -1.333  -9.381
  150    HA   PHE  20           HA       PHE  20  -7.443  -0.259  -7.166
  151   1HB   PHE  20          2HB       PHE  20  -7.083  -0.163 -10.136
  152   2HB   PHE  20          1HB       PHE  20  -6.136   0.933  -9.135
  153    HD1  PHE  20           HD1      PHE  20  -4.071  -0.233  -9.865
  154    HD2  PHE  20           HD2      PHE  20  -7.168  -2.273  -7.694
  155    HE1  PHE  20           HE1      PHE  20  -2.488  -2.064  -9.319
  156    HE2  PHE  20           HE2      PHE  20  -5.587  -4.102  -7.156
  157    HZ   PHE  20           HZ       PHE  20  -3.247  -3.997  -7.967
  158    H    LYS  21           H        LYS  21  -9.362   1.311  -9.724
  159    HA   LYS  21           HA       LYS  21  -8.855   3.985  -8.968
  160   1HB   LYS  21          2HB       LYS  21  -9.832   3.404 -11.148
  161   2HB   LYS  21          1HB       LYS  21 -11.295   2.835 -10.348
  162   1HG   LYS  21          2HG       LYS  21 -11.556   5.146 -11.227
  163   2HG   LYS  21          1HG       LYS  21 -11.725   5.086  -9.473
  164   1HD   LYS  21          2HD       LYS  21  -9.677   6.121  -9.099
  165   2HD   LYS  21          1HD       LYS  21  -9.011   5.592 -10.644
  166   1HE   LYS  21          2HE       LYS  21  -9.420   7.947 -10.855
  167   2HE   LYS  21          1HE       LYS  21 -10.688   7.133 -11.771
  168   1HZ   LYS  21          1HZ       LYS  21 -11.040   7.952  -8.944
  169   2HZ   LYS  21          2HZ       LYS  21 -12.237   7.490 -10.058
  170   3HZ   LYS  21          3HZ       LYS  21 -11.426   8.972 -10.243
  171    H    ALA  22           H        ALA  22 -11.532   1.784  -8.117
  172    HA   ALA  22           HA       ALA  22 -12.893   3.655  -6.459
  173   1HB   ALA  22          1HB       ALA  22 -13.836   1.494  -7.449
  174   2HB   ALA  22          2HB       ALA  22 -14.267   1.848  -5.776
  175   3HB   ALA  22          3HB       ALA  22 -13.014   0.659  -6.131
  176    H    ALA  23           H        ALA  23 -10.540   1.080  -5.773
  177    HA   ALA  23           HA       ALA  23 -10.545   1.370  -2.946
  178   1HB   ALA  23          1HB       ALA  23  -8.252   0.261  -3.139
  179   2HB   ALA  23          2HB       ALA  23  -8.528   0.234  -4.881
  180   3HB   ALA  23          3HB       ALA  23  -9.616  -0.639  -3.801
  181    H    PHE  24           H        PHE  24  -9.029   3.178  -5.504
  182    HA   PHE  24           HA       PHE  24  -7.128   4.482  -3.722
  183   1HB   PHE  24          2HB       PHE  24  -6.825   3.913  -6.272
  184   2HB   PHE  24          1HB       PHE  24  -7.715   5.415  -6.516
  185    HD1  PHE  24           HD1      PHE  24  -4.718   3.944  -4.855
  186    HD2  PHE  24           HD2      PHE  24  -6.660   7.525  -6.224
  187    HE1  PHE  24           HE1      PHE  24  -2.647   5.235  -4.422
  188    HE2  PHE  24           HE2      PHE  24  -4.591   8.817  -5.782
  189    HZ   PHE  24           HZ       PHE  24  -2.584   7.670  -4.880
  190    H    ASP  25           H        ASP  25  -9.884   5.454  -5.777
  191    HA   ASP  25           HA       ASP  25 -10.046   8.127  -5.051
  192   1HB   ASP  25          2HB       ASP  25 -11.376   6.842  -6.841
  193   2HB   ASP  25          1HB       ASP  25 -12.512   6.468  -5.545
  194    H    ILE  26           H        ILE  26 -11.481   5.317  -3.370
  195    HA   ILE  26           HA       ILE  26 -13.112   6.687  -1.561
  196    HB   ILE  26           HB       ILE  26 -12.748   4.748  -0.015
  197   1HG1  ILE  26          2HG1      ILE  26 -10.861   3.848  -2.218
  198   2HG1  ILE  26          1HG1      ILE  26 -10.384   4.315  -0.589
  199   1HG2  ILE  26          1HG2      ILE  26 -14.502   4.201  -1.363
  200   2HG2  ILE  26          2HG2      ILE  26 -13.356   3.061  -2.065
  201   3HG2  ILE  26          3HG2      ILE  26 -13.632   4.621  -2.838
  202   1HD1  ILE  26          1HD1      ILE  26 -12.011   2.486   0.218
  203   2HD1  ILE  26          2HD1      ILE  26 -10.495   1.953  -0.509
  204   3HD1  ILE  26          3HD1      ILE  26 -11.987   1.909  -1.448
  205    H    PHE  27           H        PHE  27  -9.632   6.082  -1.454
  206    HA   PHE  27           HA       PHE  27  -9.343   7.345   1.154
  207   1HB   PHE  27          2HB       PHE  27  -7.449   6.070  -0.800
  208   2HB   PHE  27          1HB       PHE  27  -6.833   7.084   0.504
  209    HD1  PHE  27           HD1      PHE  27  -7.223   6.466   2.878
  210    HD2  PHE  27           HD2      PHE  27  -8.433   3.911  -0.355
  211    HE1  PHE  27           HE1      PHE  27  -7.490   4.580   4.466
  212    HE2  PHE  27           HE2      PHE  27  -8.701   2.026   1.232
  213    HZ   PHE  27           HZ       PHE  27  -8.229   2.361   3.644
  214    H    ILE  28           H        ILE  28  -8.954   8.179  -2.248
  215    HA   ILE  28           HA       ILE  28  -7.723  10.759  -1.587
  216    HB   ILE  28           HB       ILE  28  -8.495   9.832  -4.351
  217   1HG1  ILE  28          2HG1      ILE  28  -7.139   8.029  -3.721
  218   2HG1  ILE  28          1HG1      ILE  28  -5.987   9.151  -4.424
  219   1HG2  ILE  28          1HG2      ILE  28  -6.242  11.190  -4.698
  220   2HG2  ILE  28          2HG2      ILE  28  -6.711  11.914  -3.157
  221   3HG2  ILE  28          3HG2      ILE  28  -7.790  12.026  -4.549
  222   1HD1  ILE  28          1HD1      ILE  28  -4.900   8.597  -2.442
  223   2HD1  ILE  28          2HD1      ILE  28  -6.408   8.451  -1.539
  224   3HD1  ILE  28          3HD1      ILE  28  -5.780  10.046  -1.953
  225    H    GLN  29           H        GLN  29 -10.389  10.345  -0.647
  226    HA   GLN  29           HA       GLN  29 -12.288  11.591  -2.397
  227   1HB   GLN  29          2HB       GLN  29 -13.671  11.825  -0.302
  228   2HB   GLN  29          1HB       GLN  29 -13.156  10.178  -0.656
  229   1HG   GLN  29          2HG       GLN  29 -11.811  10.064   1.181
  230   2HG   GLN  29          1HG       GLN  29 -11.288  11.739   1.030
  231   1HE2  GLN  29          1HE2      GLN  29 -13.954   9.684   2.222
  232   2HE2  GLN  29          2HE2      GLN  29 -14.603  10.856   3.265
  233    H    ASP  30           H        ASP  30  -9.971  12.729  -0.032
  234    HA   ASP  30           HA       ASP  30 -10.279  15.449  -0.956
  235   1HB   ASP  30          2HB       ASP  30 -11.975  14.870   1.047
  236   2HB   ASP  30          1HB       ASP  30 -10.540  15.236   2.003
  237    H    ALA  31           H        ALA  31  -8.147  13.689  -1.168
  238    HA   ALA  31           HA       ALA  31  -6.234  13.965   0.934
  239   1HB   ALA  31          1HB       ALA  31  -6.079  12.142  -0.699
  240   2HB   ALA  31          2HB       ALA  31  -4.613  13.122  -0.728
  241   3HB   ALA  31          3HB       ALA  31  -5.826  13.312  -1.995
  242    H    GLU  32           H        GLU  32  -4.241  15.152   0.840
  243    HA   GLU  32           HA       GLU  32  -4.598  17.894   0.148
  244   1HB   GLU  32          2HB       GLU  32  -2.086  16.396   0.932
  245   2HB   GLU  32          1HB       GLU  32  -2.219  18.150   0.811
  246   1HG   GLU  32          2HG       GLU  32  -4.088  18.059   2.491
  247   2HG   GLU  32          1HG       GLU  32  -3.755  16.339   2.695
  248    H    ASP  33           H        ASP  33  -2.431  15.384  -1.148
  249    HA   ASP  33           HA       ASP  33  -2.019  17.040  -3.558
  250   1HB   ASP  33          2HB       ASP  33  -0.425  14.815  -2.303
  251   2HB   ASP  33          1HB       ASP  33  -0.172  15.288  -3.983
  252    H    GLY  34           H        GLY  34  -3.120  13.877  -2.440
  253   1HA   GLY  34          2HA       GLY  34  -4.991  12.904  -3.747
  254   2HA   GLY  34          1HA       GLY  34  -4.052  13.272  -5.191
  255    H    CYS  35           H        CYS  35  -3.404  11.694  -2.049
  256    HA   CYS  35           HA       CYS  35  -2.753   9.178  -3.349
  257   1HB   CYS  35          2HB       CYS  35  -0.486   9.356  -1.872
  258   2HB   CYS  35          1HB       CYS  35  -0.564   9.730  -3.589
  259    HG   CYS  35           HG       CYS  35  -0.656  11.903  -1.338
  260    H    ILE  36           H        ILE  36  -2.084   7.523  -1.736
  261    HA   ILE  36           HA       ILE  36  -3.610   7.915   0.763
  262    HB   ILE  36           HB       ILE  36  -3.644   5.445   0.894
  263   1HG1  ILE  36          2HG1      ILE  36  -2.906   4.672  -1.704
  264   2HG1  ILE  36          1HG1      ILE  36  -1.613   5.741  -1.166
  265   1HG2  ILE  36          1HG2      ILE  36  -5.362   5.203  -0.654
  266   2HG2  ILE  36          2HG2      ILE  36  -4.498   6.094  -1.907
  267   3HG2  ILE  36          3HG2      ILE  36  -5.249   6.961  -0.569
  268   1HD1  ILE  36          1HD1      ILE  36  -0.852   4.240   0.341
  269   2HD1  ILE  36          2HD1      ILE  36  -1.849   3.061  -0.509
  270   3HD1  ILE  36          3HD1      ILE  36  -2.475   3.877   0.924
  271    H    SER  37           H        SER  37  -2.652   6.266   2.536
  272    HA   SER  37           HA       SER  37   0.087   7.204   3.000
  273   1HB   SER  37          2HB       SER  37  -1.844   7.313   4.743
  274   2HB   SER  37          1HB       SER  37  -1.526   5.595   4.964
  275    HG   SER  37           HG       SER  37   0.078   7.822   5.521
  276    H    THR  38           H        THR  38   1.828   5.884   3.131
  277    HA   THR  38           HA       THR  38   1.857   3.413   1.804
  278    HB   THR  38           HB       THR  38   4.097   3.090   3.003
  279    HG1  THR  38           HG1      THR  38   4.125   4.287   4.747
  280   1HG2  THR  38          1HG2      THR  38   5.069   5.139   1.795
  281   2HG2  THR  38          2HG2      THR  38   3.403   5.517   1.352
  282   3HG2  THR  38          3HG2      THR  38   4.135   4.006   0.817
  283    H    LYS  39           H        LYS  39   1.614   4.159   5.267
  284    HA   LYS  39           HA       LYS  39   1.729   1.466   6.183
  285   1HB   LYS  39          2HB       LYS  39   0.936   2.334   8.307
  286   2HB   LYS  39          1HB       LYS  39   2.134   3.441   7.639
  287   1HG   LYS  39          2HG       LYS  39  -0.152   4.473   6.564
  288   2HG   LYS  39          1HG       LYS  39  -0.763   3.847   8.094
  289   1HD   LYS  39          2HD       LYS  39   1.217   5.036   9.203
  290   2HD   LYS  39          1HD       LYS  39   1.444   5.867   7.663
  291   1HE   LYS  39          2HE       LYS  39  -0.742   6.856   7.776
  292   2HE   LYS  39          1HE       LYS  39  -1.200   5.840   9.141
  293   1HZ   LYS  39          1HZ       LYS  39   0.470   6.931  10.487
  294   2HZ   LYS  39          2HZ       LYS  39  -0.596   8.082   9.837
  295   3HZ   LYS  39          3HZ       LYS  39   0.954   7.887   9.171
  296    H    GLU  40           H        GLU  40  -0.808   3.390   4.779
  297    HA   GLU  40           HA       GLU  40  -2.986   1.763   5.762
  298   1HB   GLU  40          2HB       GLU  40  -2.699   4.227   4.239
  299   2HB   GLU  40          1HB       GLU  40  -3.921   3.165   3.540
  300   1HG   GLU  40          2HG       GLU  40  -5.101   4.443   5.153
  301   2HG   GLU  40          1HG       GLU  40  -4.809   2.894   5.945
  302    H    LEU  41           H        LEU  41  -0.618   1.166   3.472
  303    HA   LEU  41           HA       LEU  41  -1.974   0.108   1.271
  304   1HB   LEU  41          2HB       LEU  41   0.430   0.395   1.264
  305   2HB   LEU  41          1HB       LEU  41   0.612  -0.782   2.546
  306    HG   LEU  41           HG       LEU  41   0.055  -2.588   1.087
  307   1HD1  LEU  41          1HD1      LEU  41  -1.816  -1.458  -0.089
  308   2HD1  LEU  41          2HD1      LEU  41  -0.711  -2.237  -1.223
  309   3HD1  LEU  41          3HD1      LEU  41  -0.648  -0.490  -0.991
  310   1HD2  LEU  41          1HD2      LEU  41   1.678  -2.169  -0.846
  311   2HD2  LEU  41          2HD2      LEU  41   2.330  -1.914   0.773
  312   3HD2  LEU  41          3HD2      LEU  41   1.857  -0.532  -0.216
  313    H    GLY  42           H        GLY  42  -1.096  -1.455   4.358
  314   1HA   GLY  42          2HA       GLY  42  -2.024  -4.052   3.704
  315   2HA   GLY  42          1HA       GLY  42  -1.820  -3.417   5.333
  316    H    LYS  43           H        LYS  43  -3.714  -1.137   4.485
  317    HA   LYS  43           HA       LYS  43  -6.153  -2.444   5.362
  318   1HB   LYS  43          2HB       LYS  43  -5.264  -0.148   6.136
  319   2HB   LYS  43          1HB       LYS  43  -5.884   0.456   4.601
  320   1HG   LYS  43          2HG       LYS  43  -7.731   0.767   5.965
  321   2HG   LYS  43          1HG       LYS  43  -8.068  -0.838   5.323
  322   1HD   LYS  43          2HD       LYS  43  -6.375  -1.063   7.651
  323   2HD   LYS  43          1HD       LYS  43  -7.800  -0.102   8.045
  324   1HE   LYS  43          2HE       LYS  43  -8.283  -2.543   6.423
  325   2HE   LYS  43          1HE       LYS  43  -7.790  -2.809   8.094
  326   1HZ   LYS  43          1HZ       LYS  43 -10.218  -2.618   7.799
  327   2HZ   LYS  43          2HZ       LYS  43 -10.011  -1.017   7.270
  328   3HZ   LYS  43          3HZ       LYS  43  -9.587  -1.454   8.857
  329    H    VAL  44           H        VAL  44  -4.916  -0.863   2.425
  330    HA   VAL  44           HA       VAL  44  -7.433  -0.862   1.066
  331    HB   VAL  44           HB       VAL  44  -6.074  -0.443  -0.991
  332   1HG1  VAL  44          1HG1      VAL  44  -6.811   1.463   0.252
  333   2HG1  VAL  44          2HG1      VAL  44  -5.111   1.743  -0.126
  334   3HG1  VAL  44          3HG1      VAL  44  -5.579   1.213   1.490
  335   1HG2  VAL  44          1HG2      VAL  44  -3.720  -0.422   0.910
  336   2HG2  VAL  44          2HG2      VAL  44  -3.686  -0.180  -0.836
  337   3HG2  VAL  44          3HG2      VAL  44  -4.074  -1.767  -0.174
  338    H    MET  45           H        MET  45  -4.808  -3.186   1.372
  339    HA   MET  45           HA       MET  45  -5.491  -4.895  -0.768
  340   1HB   MET  45          2HB       MET  45  -4.326  -5.774   1.886
  341   2HB   MET  45          1HB       MET  45  -4.194  -6.602   0.335
  342   1HG   MET  45          2HG       MET  45  -3.227  -3.796   0.380
  343   2HG   MET  45          1HG       MET  45  -2.267  -4.956   1.297
  344   1HE   MET  45          1HE       MET  45  -4.295  -5.649  -2.284
  345   2HE   MET  45          2HE       MET  45  -3.147  -4.582  -3.092
  346   3HE   MET  45          3HE       MET  45  -4.047  -4.001  -1.690
  347    H    ARG  46           H        ARG  46  -6.745  -4.565   2.495
  348    HA   ARG  46           HA       ARG  46  -8.273  -6.965   2.569
  349   1HB   ARG  46          2HB       ARG  46  -8.221  -4.421   4.125
  350   2HB   ARG  46          1HB       ARG  46  -9.674  -5.414   4.235
  351   1HG   ARG  46          2HG       ARG  46  -8.335  -7.353   4.900
  352   2HG   ARG  46          1HG       ARG  46  -6.851  -6.416   4.717
  353   1HD   ARG  46          2HD       ARG  46  -7.544  -6.528   7.085
  354   2HD   ARG  46          1HD       ARG  46  -7.587  -4.876   6.484
  355    HE   ARG  46           HE       ARG  46  -9.890  -4.873   6.786
  356   1HH1  ARG  46          2HH1      ARG  46  -8.674  -8.147   6.921
  357   2HH1  ARG  46          1HH1      ARG  46 -10.185  -8.819   7.427
  358   1HH2  ARG  46          1HH2      ARG  46 -11.859  -5.778   7.450
  359   2HH2  ARG  46          2HH2      ARG  46 -11.983  -7.484   7.727
  360    H    MET  47           H        MET  47  -8.956  -3.681   1.435
  361    HA   MET  47           HA       MET  47 -11.742  -4.208   0.882
  362   1HB   MET  47          2HB       MET  47  -9.878  -1.916   0.531
  363   2HB   MET  47          1HB       MET  47 -11.265  -1.989  -0.558
  364   1HG   MET  47          2HG       MET  47 -11.697  -2.442   2.377
  365   2HG   MET  47          1HG       MET  47 -11.487  -0.794   1.787
  366   1HE   MET  47          1HE       MET  47 -14.509  -0.342   2.568
  367   2HE   MET  47          2HE       MET  47 -13.590  -1.638   3.332
  368   3HE   MET  47          3HE       MET  47 -15.176  -1.979   2.644
  369    H    LEU  48           H        LEU  48  -8.731  -4.119  -0.979
  370    HA   LEU  48           HA       LEU  48  -9.850  -4.348  -3.567
  371   1HB   LEU  48          2HB       LEU  48  -7.284  -4.191  -2.477
  372   2HB   LEU  48          1HB       LEU  48  -7.323  -5.752  -3.264
  373    HG   LEU  48           HG       LEU  48  -6.437  -4.132  -4.806
  374   1HD1  LEU  48          1HD1      LEU  48  -7.985  -5.841  -5.727
  375   2HD1  LEU  48          2HD1      LEU  48  -8.032  -4.344  -6.657
  376   3HD1  LEU  48          3HD1      LEU  48  -9.327  -4.716  -5.519
  377   1HD2  LEU  48          1HD2      LEU  48  -7.632  -2.197  -3.580
  378   2HD2  LEU  48          2HD2      LEU  48  -9.011  -2.563  -4.617
  379   3HD2  LEU  48          3HD2      LEU  48  -7.476  -2.068  -5.331
  380    H    GLY  49           H        GLY  49  -8.833  -6.775  -1.191
  381   1HA   GLY  49          2HA       GLY  49 -10.256  -8.821  -1.106
  382   2HA   GLY  49          1HA       GLY  49 -10.088  -8.881  -2.860
  383    H    GLN  50           H        GLN  50  -7.865  -8.416  -0.109
  384    HA   GLN  50           HA       GLN  50  -6.353 -10.808  -0.851
  385   1HB   GLN  50          2HB       GLN  50  -5.403  -8.025  -1.284
  386   2HB   GLN  50          1HB       GLN  50  -4.254  -9.141  -0.546
  387   1HG   GLN  50          2HG       GLN  50  -5.038 -10.763  -2.471
  388   2HG   GLN  50          1HG       GLN  50  -5.538  -9.264  -3.257
  389   1HE2  GLN  50          1HE2      GLN  50  -2.673 -10.817  -1.730
  390   2HE2  GLN  50          2HE2      GLN  50  -1.534  -9.956  -2.648
  391    H    ASN  51           H        ASN  51  -4.576 -11.224   0.739
  392    HA   ASN  51           HA       ASN  51  -5.007  -9.961   3.362
  393   1HB   ASN  51          2HB       ASN  51  -6.374 -12.159   3.014
  394   2HB   ASN  51          1HB       ASN  51  -4.814 -12.958   3.193
  395   1HD2  ASN  51          1HD2      ASN  51  -7.217 -12.881   5.072
  396   2HD2  ASN  51          2HD2      ASN  51  -6.584 -12.331   6.548
  397    HA   PRO  52           HA       PRO  52  -0.537 -10.733   2.449
  398   1HB   PRO  52          2HB       PRO  52   0.263  -8.130   2.696
  399   2HB   PRO  52          1HB       PRO  52  -0.311  -8.834   1.181
  400   1HG   PRO  52          2HG       PRO  52  -1.654  -6.941   3.003
  401   2HG   PRO  52          1HG       PRO  52  -1.903  -7.205   1.272
  402   1HD   PRO  52          2HD       PRO  52  -3.547  -8.164   3.391
  403   2HD   PRO  52          1HD       PRO  52  -3.663  -8.607   1.672
  404    H    THR  53           H        THR  53   1.373  -9.458   3.760
  405    HA   THR  53           HA       THR  53   0.670  -9.628   6.632
  406    HB   THR  53           HB       THR  53   2.663 -10.736   7.089
  407    HG1  THR  53           HG1      THR  53   4.482 -10.241   6.144
  408   1HG2  THR  53          1HG2      THR  53   1.349 -12.233   5.706
  409   2HG2  THR  53          2HG2      THR  53   3.054 -12.443   5.308
  410   3HG2  THR  53          3HG2      THR  53   2.005 -11.510   4.238
  411    HA   PRO  54           HA       PRO  54   2.355  -5.594   7.175
  412   1HB   PRO  54          2HB       PRO  54   4.027  -5.818   9.336
  413   2HB   PRO  54          1HB       PRO  54   2.260  -5.824   9.446
  414   1HG   PRO  54          2HG       PRO  54   4.173  -8.097   9.637
  415   2HG   PRO  54          1HG       PRO  54   2.611  -7.866  10.438
  416   1HD   PRO  54          2HD       PRO  54   3.035  -9.500   8.219
  417   2HD   PRO  54          1HD       PRO  54   1.453  -8.852   8.713
  418    H    GLU  55           H        GLU  55   4.753  -8.158   7.006
  419    HA   GLU  55           HA       GLU  55   6.961  -6.377   6.370
  420   1HB   GLU  55          2HB       GLU  55   6.905  -9.371   5.965
  421   2HB   GLU  55          1HB       GLU  55   8.306  -8.331   6.219
  422   1HG   GLU  55          2HG       GLU  55   7.333  -7.773   8.502
  423   2HG   GLU  55          1HG       GLU  55   6.172  -9.073   8.231
  424    H    GLU  56           H        GLU  56   4.669  -8.465   4.696
  425    HA   GLU  56           HA       GLU  56   5.851  -8.445   2.128
  426   1HB   GLU  56          2HB       GLU  56   3.117  -8.985   3.198
  427   2HB   GLU  56          1HB       GLU  56   3.284  -8.702   1.465
  428   1HG   GLU  56          2HG       GLU  56   5.171 -10.604   2.823
  429   2HG   GLU  56          1HG       GLU  56   3.539 -11.145   2.434
  430    H    LEU  57           H        LEU  57   3.072  -6.505   3.341
  431    HA   LEU  57           HA       LEU  57   2.939  -4.770   1.130
  432   1HB   LEU  57          2HB       LEU  57   1.595  -3.336   2.488
  433   2HB   LEU  57          1HB       LEU  57   1.175  -4.993   2.848
  434    HG   LEU  57           HG       LEU  57   2.981  -4.564   4.807
  435   1HD1  LEU  57          1HD1      LEU  57   1.899  -1.883   3.970
  436   2HD1  LEU  57          2HD1      LEU  57   3.538  -2.311   4.465
  437   3HD1  LEU  57          3HD1      LEU  57   2.252  -2.199   5.668
  438   1HD2  LEU  57          1HD2      LEU  57   0.552  -5.301   4.916
  439   2HD2  LEU  57          2HD2      LEU  57   0.116  -3.594   4.987
  440   3HD2  LEU  57          3HD2      LEU  57   1.089  -4.309   6.272
  441    H    GLN  58           H        GLN  58   5.031  -4.757   3.952
  442    HA   GLN  58           HA       GLN  58   5.938  -2.096   3.879
  443   1HB   GLN  58          2HB       GLN  58   6.582  -4.400   5.345
  444   2HB   GLN  58          1HB       GLN  58   8.082  -3.927   4.548
  445   1HG   GLN  58          2HG       GLN  58   6.321  -2.071   6.180
  446   2HG   GLN  58          1HG       GLN  58   7.815  -2.813   6.754
  447   1HE2  GLN  58          1HE2      GLN  58   6.494  -0.325   4.622
  448   2HE2  GLN  58          2HE2      GLN  58   7.984   0.394   4.239
  449    H    GLU  59           H        GLU  59   7.201  -5.016   2.278
  450    HA   GLU  59           HA       GLU  59   9.369  -3.765   0.951
  451   1HB   GLU  59          2HB       GLU  59   7.817  -6.295   0.440
  452   2HB   GLU  59          1HB       GLU  59   9.083  -5.763  -0.666
  453   1HG   GLU  59          2HG       GLU  59  10.543  -5.537   1.479
  454   2HG   GLU  59          1HG       GLU  59   9.330  -6.582   2.221
  455    H    MET  60           H        MET  60   5.963  -4.174   0.104
  456    HA   MET  60           HA       MET  60   6.127  -3.397  -2.611
  457   1HB   MET  60          2HB       MET  60   3.883  -3.267  -0.591
  458   2HB   MET  60          1HB       MET  60   3.681  -2.741  -2.261
  459   1HG   MET  60          2HG       MET  60   4.591  -5.035  -2.942
  460   2HG   MET  60          1HG       MET  60   4.370  -5.507  -1.257
  461   1HE   MET  60          1HE       MET  60   2.963  -7.277  -1.531
  462   2HE   MET  60          2HE       MET  60   2.737  -7.293  -3.278
  463   3HE   MET  60          3HE       MET  60   1.333  -7.335  -2.215
  464    H    ILE  61           H        ILE  61   5.537  -1.536   0.363
  465    HA   ILE  61           HA       ILE  61   5.043   0.970  -0.726
  466    HB   ILE  61           HB       ILE  61   6.419   0.154   1.832
  467   1HG1  ILE  61          2HG1      ILE  61   3.754   1.459   1.704
  468   2HG1  ILE  61          1HG1      ILE  61   3.853  -0.187   1.083
  469   1HG2  ILE  61          1HG2      ILE  61   5.665   2.888   0.799
  470   2HG2  ILE  61          2HG2      ILE  61   7.202   2.362   1.486
  471   3HG2  ILE  61          3HG2      ILE  61   5.789   2.551   2.526
  472   1HD1  ILE  61          1HD1      ILE  61   3.300  -0.114   3.512
  473   2HD1  ILE  61          2HD1      ILE  61   4.849   0.677   3.811
  474   3HD1  ILE  61          3HD1      ILE  61   4.805  -0.967   3.175
  475    H    ASP  62           H        ASP  62   8.188   0.049   0.682
  476    HA   ASP  62           HA       ASP  62   9.689   2.150  -0.321
  477   1HB   ASP  62          2HB       ASP  62  10.287   0.149   1.309
  478   2HB   ASP  62          1HB       ASP  62  10.984  -0.535  -0.159
  479    H    GLU  63           H        GLU  63   8.838  -0.883  -1.943
  480    HA   GLU  63           HA       GLU  63  10.636  -0.521  -4.149
  481   1HB   GLU  63          2HB       GLU  63   8.296  -2.338  -3.639
  482   2HB   GLU  63          1HB       GLU  63   9.076  -2.280  -5.218
  483   1HG   GLU  63          2HG       GLU  63  10.827  -2.544  -2.810
  484   2HG   GLU  63          1HG       GLU  63   9.912  -3.962  -3.324
  485    H    VAL  64           H        VAL  64   7.159   0.141  -3.689
  486    HA   VAL  64           HA       VAL  64   6.902   1.083  -6.431
  487    HB   VAL  64           HB       VAL  64   4.565   1.362  -5.983
  488   1HG1  VAL  64          1HG1      VAL  64   4.347  -0.992  -4.563
  489   2HG1  VAL  64          2HG1      VAL  64   5.977  -1.100  -5.226
  490   3HG1  VAL  64          3HG1      VAL  64   4.600  -0.877  -6.304
  491   1HG2  VAL  64          1HG2      VAL  64   5.462   1.273  -3.120
  492   2HG2  VAL  64          2HG2      VAL  64   3.837   0.723  -3.527
  493   3HG2  VAL  64          3HG2      VAL  64   4.329   2.375  -3.902
  494    H    ASP  65           H        ASP  65   7.639   2.536  -3.376
  495    HA   ASP  65           HA       ASP  65   6.525   5.110  -3.903
  496   1HB   ASP  65          2HB       ASP  65   7.619   3.953  -1.683
  497   2HB   ASP  65          1HB       ASP  65   8.920   5.032  -2.179
  498    H    GLU  66           H        GLU  66   7.119   5.565  -6.031
  499    HA   GLU  66           HA       GLU  66   9.806   5.683  -6.978
  500   1HB   GLU  66          2HB       GLU  66   7.243   6.953  -7.955
  501   2HB   GLU  66          1HB       GLU  66   8.783   7.131  -8.796
  502   1HG   GLU  66          2HG       GLU  66   8.086   4.350  -8.067
  503   2HG   GLU  66          1HG       GLU  66   7.014   5.094  -9.254
  504    H    ASP  67           H        ASP  67   7.691   8.007  -5.375
  505    HA   ASP  67           HA       ASP  67   9.493  10.242  -5.810
  506   1HB   ASP  67          2HB       ASP  67   7.181  10.123  -3.862
  507   2HB   ASP  67          1HB       ASP  67   7.925  11.556  -4.567
  508    H    GLY  68           H        GLY  68   8.555   8.133  -3.109
  509   1HA   GLY  68          2HA       GLY  68   9.772   7.497  -1.238
  510   2HA   GLY  68          1HA       GLY  68  11.112   8.491  -1.808
  511    H    SER  69           H        SER  69   7.781   9.559  -1.338
  512    HA   SER  69           HA       SER  69   8.710  11.652   0.480
  513   1HB   SER  69          2HB       SER  69   6.345  12.504   0.173
  514   2HB   SER  69          1HB       SER  69   7.319  12.443  -1.291
  515    HG   SER  69           HG       SER  69   5.528  11.425  -1.912
  516    H    GLY  70           H        GLY  70   6.113   9.202   0.361
  517   1HA   GLY  70          2HA       GLY  70   6.253   7.963   2.719
  518   2HA   GLY  70          1HA       GLY  70   5.604   9.519   3.223
  519    H    THR  71           H        THR  71   4.166   9.754   0.571
  520    HA   THR  71           HA       THR  71   1.848   8.080   1.292
  521    HB   THR  71           HB       THR  71   0.541   9.670  -0.079
  522    HG1  THR  71           HG1      THR  71   1.930  10.427  -1.561
  523   1HG2  THR  71          1HG2      THR  71   0.856  11.657   1.387
  524   2HG2  THR  71          2HG2      THR  71   2.357  10.946   1.982
  525   3HG2  THR  71          3HG2      THR  71   0.816  10.147   2.298
  526    H    VAL  72           H        VAL  72   0.632   7.047  -0.408
  527    HA   VAL  72           HA       VAL  72   2.343   6.254  -2.685
  528    HB   VAL  72           HB       VAL  72  -0.069   4.789  -1.593
  529   1HG1  VAL  72          1HG1      VAL  72   0.664   4.437  -4.013
  530   2HG1  VAL  72          2HG1      VAL  72   0.639   2.989  -3.006
  531   3HG1  VAL  72          3HG1      VAL  72   2.170   3.785  -3.367
  532   1HG2  VAL  72          1HG2      VAL  72   1.707   3.199  -0.709
  533   2HG2  VAL  72          2HG2      VAL  72   1.613   4.748   0.129
  534   3HG2  VAL  72          3HG2      VAL  72   2.895   4.459  -1.046
  535    H    ASP  73           H        ASP  73   1.852   7.199  -4.540
  536    HA   ASP  73           HA       ASP  73  -0.777   8.377  -4.987
  537   1HB   ASP  73          2HB       ASP  73   1.651   8.244  -6.800
  538   2HB   ASP  73          1HB       ASP  73   0.197   9.194  -7.098
  539    H    PHE  74           H        PHE  74  -1.623   8.002  -7.379
  540    HA   PHE  74           HA       PHE  74  -2.470   5.299  -7.527
  541   1HB   PHE  74          2HB       PHE  74  -3.354   7.619  -8.659
  542   2HB   PHE  74          1HB       PHE  74  -2.590   6.839 -10.043
  543    HD1  PHE  74           HD1      PHE  74  -5.673   7.269  -8.754
  544    HD2  PHE  74           HD2      PHE  74  -3.018   4.023  -9.677
  545    HE1  PHE  74           HE1      PHE  74  -7.611   5.739  -8.982
  546    HE2  PHE  74           HE2      PHE  74  -4.956   2.498  -9.902
  547    HZ   PHE  74           HZ       PHE  74  -7.249   3.356  -9.558
  548    H    ASP  75           H        ASP  75   0.126   7.090  -9.140
  549    HA   ASP  75           HA       ASP  75   0.834   5.098 -11.037
  550   1HB   ASP  75          2HB       ASP  75   2.130   7.521  -9.890
  551   2HB   ASP  75          1HB       ASP  75   3.196   6.317 -10.613
  552    H    GLU  76           H        GLU  76   1.751   5.708  -7.685
  553    HA   GLU  76           HA       GLU  76   3.683   3.546  -7.578
  554   1HB   GLU  76          2HB       GLU  76   2.471   4.891  -5.172
  555   2HB   GLU  76          1HB       GLU  76   4.084   4.206  -5.359
  556   1HG   GLU  76          2HG       GLU  76   4.556   6.000  -7.074
  557   2HG   GLU  76          1HG       GLU  76   3.011   6.733  -6.642
  558    H    PHE  77           H        PHE  77   0.295   3.934  -7.178
  559    HA   PHE  77           HA       PHE  77  -0.175   1.664  -5.463
  560   1HB   PHE  77          2HB       PHE  77  -1.704   3.636  -5.587
  561   2HB   PHE  77          1HB       PHE  77  -2.114   3.176  -7.237
  562    HD1  PHE  77           HD1      PHE  77  -2.002   1.765  -3.762
  563    HD2  PHE  77           HD2      PHE  77  -3.910   1.726  -7.616
  564    HE1  PHE  77           HE1      PHE  77  -3.721   0.204  -2.896
  565    HE2  PHE  77           HE2      PHE  77  -5.629   0.162  -6.743
  566    HZ   PHE  77           HZ       PHE  77  -5.534  -0.598  -4.385
  567    H    LEU  78           H        LEU  78  -0.310   2.330  -8.943
  568    HA   LEU  78           HA       LEU  78  -1.372  -0.251  -9.653
  569   1HB   LEU  78          2HB       LEU  78  -0.038   1.868 -11.326
  570   2HB   LEU  78          1HB       LEU  78  -0.853   0.453 -11.963
  571    HG   LEU  78           HG       LEU  78  -2.429   2.218 -10.157
  572   1HD1  LEU  78          1HD1      LEU  78  -1.732   2.966 -13.012
  573   2HD1  LEU  78          2HD1      LEU  78  -1.205   3.829 -11.568
  574   3HD1  LEU  78          3HD1      LEU  78  -2.916   3.783 -11.992
  575   1HD2  LEU  78          1HD2      LEU  78  -4.193   1.263 -11.249
  576   2HD2  LEU  78          2HD2      LEU  78  -2.999   0.042 -11.690
  577   3HD2  LEU  78          3HD2      LEU  78  -3.393   1.337 -12.820
  578    H    VAL  79           H        VAL  79   1.870   1.165  -9.494
  579    HA   VAL  79           HA       VAL  79   3.252  -0.841 -10.921
  580    HB   VAL  79           HB       VAL  79   5.252  -0.127  -9.550
  581   1HG1  VAL  79          1HG1      VAL  79   4.769   0.915 -11.694
  582   2HG1  VAL  79          2HG1      VAL  79   5.285   2.163 -10.561
  583   3HG1  VAL  79          3HG1      VAL  79   3.575   1.974 -10.949
  584   1HG2  VAL  79          1HG2      VAL  79   5.039   1.741  -8.055
  585   2HG2  VAL  79          2HG2      VAL  79   3.843   0.546  -7.555
  586   3HG2  VAL  79          3HG2      VAL  79   3.343   1.960  -8.480
  587    H    MET  80           H        MET  80   1.935  -0.818  -7.714
  588    HA   MET  80           HA       MET  80   3.413  -2.673  -6.317
  589   1HB   MET  80          2HB       MET  80   0.513  -1.968  -6.384
  590   2HB   MET  80          1HB       MET  80   0.994  -3.411  -5.491
  591   1HG   MET  80          2HG       MET  80   2.440  -2.165  -4.059
  592   2HG   MET  80          1HG       MET  80   2.364  -0.744  -5.100
  593   1HE   MET  80          1HE       MET  80   0.489   0.916  -2.328
  594   2HE   MET  80          2HE       MET  80   1.604   1.074  -3.683
  595   3HE   MET  80          3HE       MET  80   2.007   0.009  -2.340
  596    H    MET  81           H        MET  81   1.252  -3.251  -9.028
  597    HA   MET  81           HA       MET  81   1.170  -6.118  -8.663
  598   1HB   MET  81          2HB       MET  81   0.299  -4.330 -10.945
  599   2HB   MET  81          1HB       MET  81   0.066  -6.079 -10.918
  600   1HG   MET  81          2HG       MET  81  -0.858  -4.555  -8.526
  601   2HG   MET  81          1HG       MET  81  -1.802  -4.377 -10.004
  602   1HE   MET  81          1HE       MET  81  -3.849  -7.319 -10.344
  603   2HE   MET  81          2HE       MET  81  -2.648  -6.644 -11.443
  604   3HE   MET  81          3HE       MET  81  -3.616  -5.568 -10.439
  605    H    VAL  82           H        VAL  82   2.867  -3.865 -10.855
  606    HA   VAL  82           HA       VAL  82   4.220  -6.026 -12.232
  607    HB   VAL  82           HB       VAL  82   5.367  -4.255 -13.479
  608   1HG1  VAL  82          1HG1      VAL  82   3.190  -4.912 -14.286
  609   2HG1  VAL  82          2HG1      VAL  82   3.304  -3.157 -14.411
  610   3HG1  VAL  82          3HG1      VAL  82   2.386  -3.889 -13.095
  611   1HG2  VAL  82          1HG2      VAL  82   3.816  -2.050 -12.321
  612   2HG2  VAL  82          2HG2      VAL  82   5.522  -2.119 -12.758
  613   3HG2  VAL  82          3HG2      VAL  82   4.990  -2.735 -11.197
  614    H    ARG  83           H        ARG  83   4.912  -4.051  -9.446
  615    HA   ARG  83           HA       ARG  83   7.734  -4.103  -9.511
  616   1HB   ARG  83          2HB       ARG  83   7.653  -3.689  -7.096
  617   2HB   ARG  83          1HB       ARG  83   6.493  -2.670  -7.944
  618   1HG   ARG  83          2HG       ARG  83   4.681  -3.755  -7.054
  619   2HG   ARG  83          1HG       ARG  83   5.498  -5.314  -7.007
  620   1HD   ARG  83          2HD       ARG  83   6.157  -3.012  -5.155
  621   2HD   ARG  83          1HD       ARG  83   5.049  -4.313  -4.738
  622    HE   ARG  83           HE       ARG  83   7.928  -4.450  -4.781
  623   1HH1  ARG  83          2HH1      ARG  83   4.973  -6.286  -5.133
  624   2HH1  ARG  83          1HH1      ARG  83   5.714  -7.792  -4.715
  625   1HH2  ARG  83          1HH2      ARG  83   8.872  -6.434  -4.233
  626   2HH2  ARG  83          2HH2      ARG  83   7.914  -7.877  -4.206
  627    H    CYS  84           H        CYS  84   5.411  -6.585  -8.813
  628    HA   CYS  84           HA       CYS  84   6.991  -8.324  -7.238
  629   1HB   CYS  84          2HB       CYS  84   4.451  -8.447  -7.890
  630   2HB   CYS  84          1HB       CYS  84   5.044  -9.384  -9.262
  631    HG   CYS  84           HG       CYS  84   5.768 -11.242  -7.718
  632    H    MET  85           H        MET  85   6.944  -7.655 -10.688
  633    HA   MET  85           HA       MET  85   8.343  -9.974 -11.569
  634   1HB   MET  85          2HB       MET  85   7.719  -7.291 -12.721
  635   2HB   MET  85          1HB       MET  85   9.000  -8.238 -13.477
  636   1HG   MET  85          2HG       MET  85   7.539 -10.021 -13.997
  637   2HG   MET  85          1HG       MET  85   6.315  -9.465 -12.855
  638   1HE   MET  85          1HE       MET  85   5.289  -9.243 -16.799
  639   2HE   MET  85          2HE       MET  85   4.772 -10.013 -15.302
  640   3HE   MET  85          3HE       MET  85   6.381 -10.338 -15.940
  641    H    LYS  86           H        LYS  86   9.371  -6.894 -10.221
  642    HA   LYS  86           HA       LYS  86  12.066  -6.864 -10.992
  643   1HB   LYS  86          2HB       LYS  86  10.667  -5.797  -8.542
  644   2HB   LYS  86          1HB       LYS  86  12.398  -5.582  -8.802
  645   1HG   LYS  86          2HG       LYS  86  11.657  -4.716 -11.169
  646   2HG   LYS  86          1HG       LYS  86  10.098  -4.470 -10.383
  647   1HD   LYS  86          2HD       LYS  86  11.246  -2.410 -10.099
  648   2HD   LYS  86          1HD       LYS  86  11.407  -3.230  -8.546
  649   1HE   LYS  86          2HE       LYS  86  13.657  -3.727  -8.887
  650   2HE   LYS  86          1HE       LYS  86  13.511  -3.661 -10.642
  651   1HZ   LYS  86          1HZ       LYS  86  13.315  -1.312  -8.835
  652   2HZ   LYS  86          2HZ       LYS  86  13.281  -1.283 -10.533
  653   3HZ   LYS  86          3HZ       LYS  86  14.698  -1.743  -9.717
  654    H    ASP  87           H        ASP  87  10.421  -8.811  -8.596
  655    HA   ASP  87           HA       ASP  87  12.739  -9.562  -7.092
  656   1HB   ASP  87          2HB       ASP  87  10.068 -10.968  -7.382
  657   2HB   ASP  87          1HB       ASP  87  11.300 -11.357  -6.183
  658    H    ASP  88           H        ASP  88  14.188  -9.999  -8.888
  659    HA   ASP  88           HA       ASP  88  13.681 -12.337 -10.540
  660   1HB   ASP  88          2HB       ASP  88  16.041 -10.463 -10.285
  661   2HB   ASP  88          1HB       ASP  88  16.050 -11.881 -11.333
  662    H    SER  89           HN       SER  89  13.757 -14.238  -9.532
  663    HA   SER  89           HA       SER  89  16.018 -14.769  -7.694
  664   1HB   SER  89          2HB       SER  89  13.630 -14.905  -6.779
  665   2HB   SER  89          1HB       SER  89  13.441 -16.337  -7.787
  666    HG   SER  89           HG       SER  89  14.651 -16.091  -5.413
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1  15.453  -0.764 -16.642
    2   2H    MET   1          2H        MET   1  15.562   0.751 -15.882
    3   3H    MET   1          3H        MET   1  16.591   0.373 -17.180
    4    HA   MET   1           HA       MET   1  14.826   1.854 -17.901
    5   1HB   MET   1          2HB       MET   1  15.045  -0.954 -18.912
    6   2HB   MET   1          1HB       MET   1  13.768   0.068 -19.572
    7   1HG   MET   1          2HG       MET   1  15.342   1.705 -20.329
    8   2HG   MET   1          1HG       MET   1  16.656   0.957 -19.421
    9   1HE   MET   1          1HE       MET   1  18.193   0.890 -21.058
   10   2HE   MET   1          2HE       MET   1  18.357  -0.351 -22.298
   11   3HE   MET   1          3HE       MET   1  18.330  -0.812 -20.598
   12    H    ASN   2           H        ASN   2  12.543   2.109 -18.349
   13    HA   ASN   2           HA       ASN   2  10.842   0.695 -16.380
   14   1HB   ASN   2          2HB       ASN   2  10.671   3.509 -17.475
   15   2HB   ASN   2          1HB       ASN   2   9.379   2.752 -16.546
   16   1HD2  ASN   2          1HD2      ASN   2  10.622   1.459 -14.483
   17   2HD2  ASN   2          2HD2      ASN   2  11.582   2.522 -13.577
   18    H    ASP   3           H        ASP   3  11.062  -0.782 -18.495
   19    HA   ASP   3           HA       ASP   3   8.857  -0.116 -20.347
   20   1HB   ASP   3          2HB       ASP   3   9.818  -1.835 -21.833
   21   2HB   ASP   3          1HB       ASP   3  10.988  -0.573 -21.454
   22    H    ILE   4           H        ILE   4   9.319  -1.842 -17.549
   23    HA   ILE   4           HA       ILE   4   7.947  -4.276 -18.231
   24    HB   ILE   4           HB       ILE   4   7.997  -4.835 -15.935
   25   1HG1  ILE   4          2HG1      ILE   4   7.035  -2.577 -15.209
   26   2HG1  ILE   4          1HG1      ILE   4   8.204  -3.310 -14.117
   27   1HG2  ILE   4          1HG2      ILE   4  10.207  -5.117 -16.201
   28   2HG2  ILE   4          2HG2      ILE   4  10.428  -3.560 -15.404
   29   3HG2  ILE   4          3HG2      ILE   4  10.347  -3.647 -17.163
   30   1HD1  ILE   4          1HD1      ILE   4   9.954  -1.877 -15.442
   31   2HD1  ILE   4          2HD1      ILE   4   8.940  -1.085 -14.238
   32   3HD1  ILE   4          3HD1      ILE   4   8.546  -0.945 -15.951
   33    H    TYR   5           H        TYR   5   6.986  -1.069 -17.284
   34    HA   TYR   5           HA       TYR   5   4.368  -1.662 -16.336
   35   1HB   TYR   5          2HB       TYR   5   5.278   0.897 -17.674
   36   2HB   TYR   5          1HB       TYR   5   3.928   0.697 -16.559
   37    HD1  TYR   5           HD1      TYR   5   4.722  -0.652 -14.298
   38    HD2  TYR   5           HD2      TYR   5   7.171   1.879 -16.750
   39    HE1  TYR   5           HE1      TYR   5   6.246  -0.271 -12.380
   40    HE2  TYR   5           HE2      TYR   5   8.696   2.256 -14.837
   41    HH   TYR   5           HH       TYR   5   9.103   0.557 -12.442
   42    H    LYS   6           H        LYS   6   5.753  -1.119 -19.516
   43    HA   LYS   6           HA       LYS   6   3.190  -0.947 -20.864
   44   1HB   LYS   6          2HB       LYS   6   5.837  -1.533 -22.194
   45   2HB   LYS   6          1HB       LYS   6   4.416  -0.751 -22.884
   46   1HG   LYS   6          2HG       LYS   6   6.344   0.367 -20.841
   47   2HG   LYS   6          1HG       LYS   6   5.961   1.013 -22.435
   48   1HD   LYS   6          2HD       LYS   6   3.725   1.611 -21.731
   49   2HD   LYS   6          1HD       LYS   6   3.941   0.782 -20.188
   50   1HE   LYS   6          2HE       LYS   6   5.301   2.444 -19.327
   51   2HE   LYS   6          1HE       LYS   6   5.903   2.921 -20.914
   52   1HZ   LYS   6          1HZ       LYS   6   3.807   3.955 -21.403
   53   2HZ   LYS   6          2HZ       LYS   6   4.389   4.565 -19.928
   54   3HZ   LYS   6          3HZ       LYS   6   3.141   3.414 -19.940
   55    H    ALA   7           H        ALA   7   5.639  -3.380 -20.237
   56    HA   ALA   7           HA       ALA   7   4.419  -5.406 -21.893
   57   1HB   ALA   7          1HB       ALA   7   6.634  -5.386 -19.861
   58   2HB   ALA   7          2HB       ALA   7   6.716  -5.745 -21.586
   59   3HB   ALA   7          3HB       ALA   7   5.995  -6.911 -20.475
   60    H    ALA   8           H        ALA   8   4.097  -4.321 -18.579
   61    HA   ALA   8           HA       ALA   8   2.664  -6.712 -17.736
   62   1HB   ALA   8          1HB       ALA   8   4.040  -5.714 -16.055
   63   2HB   ALA   8          2HB       ALA   8   2.365  -5.404 -15.601
   64   3HB   ALA   8          3HB       ALA   8   3.331  -4.122 -16.331
   65    H    VAL   9           H        VAL   9   1.946  -3.317 -18.533
   66    HA   VAL   9           HA       VAL   9  -0.727  -3.246 -17.709
   67    HB   VAL   9           HB       VAL   9   0.706  -1.309 -18.552
   68   1HG1  VAL   9          1HG1      VAL   9  -0.423  -2.142 -21.233
   69   2HG1  VAL   9          2HG1      VAL   9   1.236  -2.471 -20.742
   70   3HG1  VAL   9          3HG1      VAL   9   0.678  -0.806 -20.898
   71   1HG2  VAL   9          1HG2      VAL   9  -1.780  -1.272 -18.020
   72   2HG2  VAL   9          2HG2      VAL   9  -2.069  -1.477 -19.747
   73   3HG2  VAL   9          3HG2      VAL   9  -1.235  -0.039 -19.158
   74    H    GLU  10           H        GLU  10   0.721  -4.628 -20.600
   75    HA   GLU  10           HA       GLU  10  -1.679  -5.010 -22.082
   76   1HB   GLU  10          2HB       GLU  10   1.064  -6.241 -22.171
   77   2HB   GLU  10          1HB       GLU  10  -0.243  -6.912 -23.146
   78   1HG   GLU  10          2HG       GLU  10  -0.577  -4.820 -24.287
   79   2HG   GLU  10          1HG       GLU  10   0.499  -3.975 -23.175
   80    H    GLN  11           H        GLN  11  -0.129  -6.772 -19.472
   81    HA   GLN  11           HA       GLN  11  -1.735  -9.158 -19.812
   82   1HB   GLN  11          2HB       GLN  11  -0.227  -8.459 -17.301
   83   2HB   GLN  11          1HB       GLN  11  -0.588 -10.051 -17.961
   84   1HG   GLN  11          2HG       GLN  11   1.434  -8.036 -18.963
   85   2HG   GLN  11          1HG       GLN  11   1.726  -9.682 -18.412
   86   1HE2  GLN  11          1HE2      GLN  11  -0.172 -11.155 -19.846
   87   2HE2  GLN  11          2HE2      GLN  11   0.104 -10.984 -21.511
   88    H    LEU  12           H        LEU  12  -1.798  -6.241 -17.840
   89    HA   LEU  12           HA       LEU  12  -3.898  -7.117 -16.095
   90   1HB   LEU  12          2HB       LEU  12  -3.323  -4.233 -16.669
   91   2HB   LEU  12          1HB       LEU  12  -3.888  -4.966 -15.188
   92    HG   LEU  12           HG       LEU  12  -1.088  -4.889 -16.296
   93   1HD1  LEU  12          1HD1      LEU  12  -2.077  -3.082 -14.783
   94   2HD1  LEU  12          2HD1      LEU  12  -0.578  -3.824 -14.225
   95   3HD1  LEU  12          3HD1      LEU  12  -2.119  -4.307 -13.515
   96   1HD2  LEU  12          1HD2      LEU  12  -0.674  -6.328 -14.113
   97   2HD2  LEU  12          2HD2      LEU  12  -1.097  -7.123 -15.629
   98   3HD2  LEU  12          3HD2      LEU  12  -2.333  -6.857 -14.399
   99    H    THR  13           H        THR  13  -6.057  -6.332 -16.043
  100    HA   THR  13           HA       THR  13  -7.130  -5.704 -18.728
  101    HB   THR  13           HB       THR  13  -9.332  -6.432 -17.349
  102    HG1  THR  13           HG1      THR  13  -8.730  -7.296 -15.547
  103   1HG2  THR  13          1HG2      THR  13  -8.048  -7.375 -19.475
  104   2HG2  THR  13          2HG2      THR  13  -9.308  -8.315 -18.677
  105   3HG2  THR  13          3HG2      THR  13  -7.609  -8.658 -18.347
  106    H    ASP  14           H        ASP  14  -9.236  -4.477 -18.664
  107    HA   ASP  14           HA       ASP  14  -8.842  -1.913 -17.539
  108   1HB   ASP  14          2HB       ASP  14 -11.302  -3.249 -18.684
  109   2HB   ASP  14          1HB       ASP  14 -11.278  -1.565 -18.157
  110    H    GLU  15           H        GLU  15 -10.533  -4.777 -16.410
  111    HA   GLU  15           HA       GLU  15 -12.119  -3.660 -14.376
  112   1HB   GLU  15          2HB       GLU  15 -10.994  -6.348 -14.955
  113   2HB   GLU  15          1HB       GLU  15 -11.501  -6.049 -13.293
  114   1HG   GLU  15          2HG       GLU  15 -13.332  -5.237 -15.524
  115   2HG   GLU  15          1HG       GLU  15 -13.239  -6.941 -15.078
  116    H    GLN  16           H        GLN  16  -8.730  -4.731 -14.344
  117    HA   GLN  16           HA       GLN  16  -8.241  -4.444 -11.584
  118   1HB   GLN  16          2HB       GLN  16  -6.548  -4.521 -14.035
  119   2HB   GLN  16          1HB       GLN  16  -5.815  -3.885 -12.563
  120   1HG   GLN  16          2HG       GLN  16  -6.702  -5.978 -11.388
  121   2HG   GLN  16          1HG       GLN  16  -7.036  -6.616 -12.997
  122   1HE2  GLN  16          1HE2      GLN  16  -5.377  -8.095 -13.432
  123   2HE2  GLN  16          2HE2      GLN  16  -3.724  -7.779 -13.209
  124    H    LYS  17           H        LYS  17  -7.690  -2.139 -14.257
  125    HA   LYS  17           HA       LYS  17  -6.807  -0.022 -12.556
  126   1HB   LYS  17          2HB       LYS  17  -7.500  -0.307 -15.429
  127   2HB   LYS  17          1HB       LYS  17  -7.594   1.318 -14.748
  128   1HG   LYS  17          2HG       LYS  17  -5.357   1.287 -15.318
  129   2HG   LYS  17          1HG       LYS  17  -5.245   0.617 -13.690
  130   1HD   LYS  17          2HD       LYS  17  -4.044  -0.985 -14.847
  131   2HD   LYS  17          1HD       LYS  17  -5.661  -1.674 -14.988
  132   1HE   LYS  17          2HE       LYS  17  -4.794  -1.723 -17.198
  133   2HE   LYS  17          1HE       LYS  17  -5.865  -0.322 -17.168
  134   1HZ   LYS  17          1HZ       LYS  17  -3.676   0.117 -18.194
  135   2HZ   LYS  17          2HZ       LYS  17  -2.937  -0.191 -16.695
  136   3HZ   LYS  17          3HZ       LYS  17  -4.003   1.120 -16.868
  137    H    ASN  18           H        ASN  18  -9.966  -1.117 -13.603
  138    HA   ASN  18           HA       ASN  18 -11.385   1.296 -13.025
  139   1HB   ASN  18          2HB       ASN  18 -12.797   0.036 -14.272
  140   2HB   ASN  18          1HB       ASN  18 -12.043  -1.473 -13.784
  141   1HD2  ASN  18          1HD2      ASN  18 -12.972  -2.628 -12.025
  142   2HD2  ASN  18          2HD2      ASN  18 -14.407  -2.144 -11.256
  143    H    GLU  19           H        GLU  19 -10.683  -1.677 -11.215
  144    HA   GLU  19           HA       GLU  19 -12.099  -0.916  -8.842
  145   1HB   GLU  19          2HB       GLU  19  -9.807  -2.879  -9.167
  146   2HB   GLU  19          1HB       GLU  19 -10.850  -2.740  -7.752
  147   1HG   GLU  19          2HG       GLU  19 -12.027  -3.205 -10.482
  148   2HG   GLU  19          1HG       GLU  19 -11.417  -4.553  -9.528
  149    H    PHE  20           H        PHE  20  -8.740  -0.712  -9.922
  150    HA   PHE  20           HA       PHE  20  -7.560   0.286  -7.576
  151   1HB   PHE  20          2HB       PHE  20  -6.877   0.410 -10.490
  152   2HB   PHE  20          1HB       PHE  20  -5.975   1.419  -9.364
  153    HD1  PHE  20           HD1      PHE  20  -7.377  -1.788  -8.226
  154    HD2  PHE  20           HD2      PHE  20  -3.905   0.180  -9.813
  155    HE1  PHE  20           HE1      PHE  20  -5.985  -3.729  -7.581
  156    HE2  PHE  20           HE2      PHE  20  -2.512  -1.760  -9.169
  157    HZ   PHE  20           HZ       PHE  20  -3.548  -3.718  -8.051
  158    H    LYS  21           H        LYS  21  -9.075   1.995 -10.308
  159    HA   LYS  21           HA       LYS  21  -8.475   4.621  -9.469
  160   1HB   LYS  21          2HB       LYS  21  -9.314   4.015 -11.743
  161   2HB   LYS  21          1HB       LYS  21 -10.906   3.735 -11.041
  162   1HG   LYS  21          2HG       LYS  21 -10.687   6.017 -12.023
  163   2HG   LYS  21          1HG       LYS  21 -11.030   6.058 -10.295
  164   1HD   LYS  21          2HD       LYS  21  -8.803   6.633  -9.745
  165   2HD   LYS  21          1HD       LYS  21  -8.194   6.133 -11.323
  166   1HE   LYS  21          2HE       LYS  21  -9.966   8.031 -12.096
  167   2HE   LYS  21          1HE       LYS  21  -9.504   8.673 -10.521
  168   1HZ   LYS  21          1HZ       LYS  21  -7.595   7.863 -12.647
  169   2HZ   LYS  21          2HZ       LYS  21  -7.202   8.584 -11.158
  170   3HZ   LYS  21          3HZ       LYS  21  -8.067   9.460 -12.329
  171    H    ALA  22           H        ALA  22 -11.490   2.737  -9.044
  172    HA   ALA  22           HA       ALA  22 -12.799   4.656  -7.424
  173   1HB   ALA  22          1HB       ALA  22 -14.320   2.843  -6.805
  174   2HB   ALA  22          2HB       ALA  22 -13.191   1.654  -7.456
  175   3HB   ALA  22          3HB       ALA  22 -13.988   2.798  -8.536
  176    H    ALA  23           H        ALA  23 -10.809   1.828  -6.618
  177    HA   ALA  23           HA       ALA  23 -11.089   1.926  -3.814
  178   1HB   ALA  23          1HB       ALA  23  -8.821   0.897  -5.533
  179   2HB   ALA  23          2HB       ALA  23 -10.145  -0.041  -4.841
  180   3HB   ALA  23          3HB       ALA  23  -8.918   0.663  -3.787
  181    H    PHE  24           H        PHE  24  -9.170   3.844  -6.018
  182    HA   PHE  24           HA       PHE  24  -7.447   4.883  -3.916
  183   1HB   PHE  24          2HB       PHE  24  -6.888   4.548  -6.468
  184   2HB   PHE  24          1HB       PHE  24  -7.666   6.119  -6.644
  185    HD1  PHE  24           HD1      PHE  24  -4.883   4.297  -4.994
  186    HD2  PHE  24           HD2      PHE  24  -6.609   8.135  -5.858
  187    HE1  PHE  24           HE1      PHE  24  -2.812   5.408  -4.203
  188    HE2  PHE  24           HE2      PHE  24  -4.540   9.245  -5.067
  189    HZ   PHE  24           HZ       PHE  24  -2.642   7.881  -4.240
  190    H    ASP  25           H        ASP  25  -9.886   6.222  -6.159
  191    HA   ASP  25           HA       ASP  25 -10.034   8.806  -5.172
  192   1HB   ASP  25          2HB       ASP  25 -11.983   7.031  -6.581
  193   2HB   ASP  25          1HB       ASP  25 -12.547   8.573  -5.935
  194    H    ILE  26           H        ILE  26 -11.768   5.924  -3.962
  195    HA   ILE  26           HA       ILE  26 -13.526   7.215  -2.207
  196    HB   ILE  26           HB       ILE  26 -13.511   5.099  -0.887
  197   1HG1  ILE  26          2HG1      ILE  26 -11.367   4.302  -2.886
  198   2HG1  ILE  26          1HG1      ILE  26 -11.109   4.563  -1.164
  199   1HG2  ILE  26          1HG2      ILE  26 -13.955   5.330  -3.807
  200   2HG2  ILE  26          2HG2      ILE  26 -15.068   4.832  -2.533
  201   3HG2  ILE  26          3HG2      ILE  26 -13.898   3.683  -3.180
  202   1HD1  ILE  26          1HD1      ILE  26 -12.917   2.776  -0.789
  203   2HD1  ILE  26          2HD1      ILE  26 -11.357   2.214  -1.390
  204   3HD1  ILE  26          3HD1      ILE  26 -12.718   2.386  -2.498
  205    H    PHE  27           H        PHE  27 -10.117   6.395  -1.797
  206    HA   PHE  27           HA       PHE  27 -10.095   7.294   0.977
  207   1HB   PHE  27          2HB       PHE  27  -8.060   6.100  -0.878
  208   2HB   PHE  27          1HB       PHE  27  -7.534   6.930   0.586
  209    HD1  PHE  27           HD1      PHE  27  -8.991   3.912  -0.778
  210    HD2  PHE  27           HD2      PHE  27  -8.476   6.185   2.830
  211    HE1  PHE  27           HE1      PHE  27  -9.556   1.904   0.566
  212    HE2  PHE  27           HE2      PHE  27  -9.040   4.179   4.174
  213    HZ   PHE  27           HZ       PHE  27  -9.580   2.039   3.043
  214    H    ILE  28           H        ILE  28  -9.294   8.539  -2.211
  215    HA   ILE  28           HA       ILE  28  -7.931  10.878  -1.085
  216    HB   ILE  28           HB       ILE  28  -8.539  10.404  -4.004
  217   1HG1  ILE  28          2HG1      ILE  28  -7.352   8.443  -3.533
  218   2HG1  ILE  28          1HG1      ILE  28  -6.075   9.563  -3.978
  219   1HG2  ILE  28          1HG2      ILE  28  -7.684  12.544  -3.855
  220   2HG2  ILE  28          2HG2      ILE  28  -6.181  11.628  -3.982
  221   3HG2  ILE  28          3HG2      ILE  28  -6.747  12.182  -2.405
  222   1HD1  ILE  28          1HD1      ILE  28  -6.790   8.497  -1.270
  223   2HD1  ILE  28          2HD1      ILE  28  -6.046  10.092  -1.390
  224   3HD1  ILE  28          3HD1      ILE  28  -5.203   8.675  -2.015
  225    H    GLN  29           H        GLN  29 -10.698  10.577  -0.420
  226    HA   GLN  29           HA       GLN  29 -12.310  12.261  -2.093
  227   1HB   GLN  29          2HB       GLN  29 -13.811  12.350   0.000
  228   2HB   GLN  29          1HB       GLN  29 -13.580  10.783  -0.769
  229   1HG   GLN  29          2HG       GLN  29 -12.012  10.088   0.901
  230   2HG   GLN  29          1HG       GLN  29 -11.869  11.723   1.545
  231   1HE2  GLN  29          1HE2      GLN  29 -14.769   9.714   0.729
  232   2HE2  GLN  29          2HE2      GLN  29 -15.477   9.870   2.264
  233    H    ASP  30           H        ASP  30 -10.185  12.762   0.647
  234    HA   ASP  30           HA       ASP  30 -10.199  15.626   0.167
  235   1HB   ASP  30          2HB       ASP  30 -10.473  15.959   2.754
  236   2HB   ASP  30          1HB       ASP  30 -11.903  15.814   1.737
  237    H    ALA  31           H        ALA  31  -8.224  13.769  -0.303
  238    HA   ALA  31           HA       ALA  31  -6.375  13.513   1.866
  239   1HB   ALA  31          1HB       ALA  31  -4.825  12.673   0.216
  240   2HB   ALA  31          2HB       ALA  31  -5.801  13.333  -1.097
  241   3HB   ALA  31          3HB       ALA  31  -6.420  12.000  -0.125
  242    H    GLU  32           H        GLU  32  -4.396  14.563   2.160
  243    HA   GLU  32           HA       GLU  32  -4.451  17.383   1.706
  244   1HB   GLU  32          2HB       GLU  32  -2.254  17.400   2.828
  245   2HB   GLU  32          1HB       GLU  32  -3.451  16.477   3.736
  246   1HG   GLU  32          2HG       GLU  32  -2.553  14.382   2.702
  247   2HG   GLU  32          1HG       GLU  32  -1.296  15.343   1.925
  248    H    ASP  33           H        ASP  33  -2.599  14.710   0.279
  249    HA   ASP  33           HA       ASP  33  -1.599  16.621  -1.749
  250   1HB   ASP  33          2HB       ASP  33  -0.196  14.336  -0.383
  251   2HB   ASP  33          1HB       ASP  33   0.333  14.912  -1.964
  252    H    GLY  34           H        GLY  34  -3.994  14.665  -1.604
  253   1HA   GLY  34          2HA       GLY  34  -5.159  13.383  -3.118
  254   2HA   GLY  34          1HA       GLY  34  -3.998  13.907  -4.332
  255    H    CYS  35           H        CYS  35  -3.557  11.996  -1.352
  256    HA   CYS  35           HA       CYS  35  -3.048   9.562  -2.850
  257   1HB   CYS  35          2HB       CYS  35  -0.747   9.468  -1.471
  258   2HB   CYS  35          1HB       CYS  35  -0.842  10.097  -3.112
  259    HG   CYS  35           HG       CYS  35  -0.791  11.914  -0.565
  260    H    ILE  36           H        ILE  36  -2.254   7.798  -1.300
  261    HA   ILE  36           HA       ILE  36  -3.797   8.052   1.212
  262    HB   ILE  36           HB       ILE  36  -3.841   5.570   1.214
  263   1HG1  ILE  36          2HG1      ILE  36  -3.223   4.980  -1.474
  264   2HG1  ILE  36          1HG1      ILE  36  -1.881   5.958  -0.886
  265   1HG2  ILE  36          1HG2      ILE  36  -5.577   5.389  -0.370
  266   2HG2  ILE  36          2HG2      ILE  36  -4.812   6.534  -1.473
  267   3HG2  ILE  36          3HG2      ILE  36  -5.554   7.109   0.021
  268   1HD1  ILE  36          1HD1      ILE  36  -2.665   4.046   1.134
  269   2HD1  ILE  36          2HD1      ILE  36  -1.100   4.249   0.346
  270   3HD1  ILE  36          3HD1      ILE  36  -2.329   3.219  -0.389
  271    H    SER  37           H        SER  37  -2.863   6.291   2.871
  272    HA   SER  37           HA       SER  37  -0.110   7.152   3.383
  273   1HB   SER  37          2HB       SER  37  -1.920   7.289   5.161
  274   2HB   SER  37          1HB       SER  37  -1.901   5.528   5.201
  275    HG   SER  37           HG       SER  37  -0.213   7.279   6.343
  276    H    THR  38           H        THR  38   1.609   5.786   3.489
  277    HA   THR  38           HA       THR  38   1.603   3.385   2.018
  278    HB   THR  38           HB       THR  38   3.828   2.956   3.196
  279    HG1  THR  38           HG1      THR  38   3.875   4.025   5.018
  280   1HG2  THR  38          1HG2      THR  38   3.899   4.024   1.078
  281   2HG2  THR  38          2HG2      THR  38   4.859   5.056   2.139
  282   3HG2  THR  38          3HG2      THR  38   3.207   5.513   1.720
  283    H    LYS  39           H        LYS  39   1.224   4.015   5.470
  284    HA   LYS  39           HA       LYS  39   1.357   1.334   6.385
  285   1HB   LYS  39          2HB       LYS  39   0.480   3.944   7.466
  286   2HB   LYS  39          1HB       LYS  39  -0.292   2.532   8.189
  287   1HG   LYS  39          2HG       LYS  39   2.698   2.884   7.863
  288   2HG   LYS  39          1HG       LYS  39   1.811   3.168   9.363
  289   1HD   LYS  39          2HD       LYS  39   1.152   0.588   8.175
  290   2HD   LYS  39          1HD       LYS  39   2.877   0.728   8.526
  291   1HE   LYS  39          2HE       LYS  39   2.165   0.024  10.602
  292   2HE   LYS  39          1HE       LYS  39   1.918   1.756  10.816
  293   1HZ   LYS  39          1HZ       LYS  39  -0.144  -0.184   9.915
  294   2HZ   LYS  39          2HZ       LYS  39  -0.380   1.484  10.138
  295   3HZ   LYS  39          3HZ       LYS  39  -0.035   0.486  11.469
  296    H    GLU  40           H        GLU  40  -1.215   3.310   5.070
  297    HA   GLU  40           HA       GLU  40  -3.341   1.469   5.712
  298   1HB   GLU  40          2HB       GLU  40  -3.113   4.060   4.260
  299   2HB   GLU  40          1HB       GLU  40  -4.492   3.029   3.881
  300   1HG   GLU  40          2HG       GLU  40  -4.639   2.852   6.536
  301   2HG   GLU  40          1HG       GLU  40  -3.798   4.400   6.447
  302    H    LEU  41           H        LEU  41  -0.884   1.226   3.472
  303    HA   LEU  41           HA       LEU  41  -2.201   0.472   1.096
  304   1HB   LEU  41          2HB       LEU  41   0.366   0.796   1.686
  305   2HB   LEU  41          1HB       LEU  41   0.295  -0.939   1.909
  306    HG   LEU  41           HG       LEU  41  -0.310   0.607  -0.620
  307   1HD1  LEU  41          1HD1      LEU  41   1.599  -0.691  -1.494
  308   2HD1  LEU  41          2HD1      LEU  41   1.803  -1.453   0.083
  309   3HD1  LEU  41          3HD1      LEU  41   2.079   0.279  -0.101
  310   1HD2  LEU  41          1HD2      LEU  41  -0.602  -1.706  -1.607
  311   2HD2  LEU  41          2HD2      LEU  41  -1.888  -1.223  -0.499
  312   3HD2  LEU  41          3HD2      LEU  41  -0.631  -2.336   0.039
  313    H    GLY  42           H        GLY  42  -1.104  -1.484   3.874
  314   1HA   GLY  42          2HA       GLY  42  -1.972  -3.990   2.888
  315   2HA   GLY  42          1HA       GLY  42  -1.706  -3.597   4.584
  316    H    LYS  43           H        LYS  43  -3.752  -1.296   4.128
  317    HA   LYS  43           HA       LYS  43  -6.072  -2.849   4.930
  318   1HB   LYS  43          2HB       LYS  43  -5.793   0.149   4.629
  319   2HB   LYS  43          1HB       LYS  43  -7.078  -0.710   5.476
  320   1HG   LYS  43          2HG       LYS  43  -4.156  -0.948   6.243
  321   2HG   LYS  43          1HG       LYS  43  -5.244   0.236   6.965
  322   1HD   LYS  43          2HD       LYS  43  -5.783  -1.380   8.451
  323   2HD   LYS  43          1HD       LYS  43  -6.685  -2.131   7.136
  324   1HE   LYS  43          2HE       LYS  43  -4.431  -3.215   6.471
  325   2HE   LYS  43          1HE       LYS  43  -3.889  -2.752   8.082
  326   1HZ   LYS  43          1HZ       LYS  43  -4.875  -5.034   7.873
  327   2HZ   LYS  43          2HZ       LYS  43  -6.378  -4.288   7.607
  328   3HZ   LYS  43          3HZ       LYS  43  -5.558  -4.055   9.078
  329    H    VAL  44           H        VAL  44  -5.008  -0.921   2.155
  330    HA   VAL  44           HA       VAL  44  -7.615  -0.903   0.920
  331    HB   VAL  44           HB       VAL  44  -6.410  -0.011  -1.073
  332   1HG1  VAL  44          1HG1      VAL  44  -7.167   1.711   0.279
  333   2HG1  VAL  44          2HG1      VAL  44  -5.432   2.024   0.312
  334   3HG1  VAL  44          3HG1      VAL  44  -6.203   1.191   1.662
  335   1HG2  VAL  44          1HG2      VAL  44  -3.964  -0.057   0.710
  336   2HG2  VAL  44          2HG2      VAL  44  -4.051   0.458  -0.974
  337   3HG2  VAL  44          3HG2      VAL  44  -4.250  -1.245  -0.562
  338    H    MET  45           H        MET  45  -4.739  -2.933   0.753
  339    HA   MET  45           HA       MET  45  -5.362  -4.353  -1.605
  340   1HB   MET  45          2HB       MET  45  -3.963  -5.505   0.820
  341   2HB   MET  45          1HB       MET  45  -3.841  -6.061  -0.847
  342   1HG   MET  45          2HG       MET  45  -3.151  -3.211  -0.377
  343   2HG   MET  45          1HG       MET  45  -2.029  -4.401   0.280
  344   1HE   MET  45          1HE       MET  45  -4.062  -3.133  -2.416
  345   2HE   MET  45          2HE       MET  45  -4.215  -4.676  -3.253
  346   3HE   MET  45          3HE       MET  45  -3.209  -3.403  -3.944
  347    H    ARG  46           H        ARG  46  -6.362  -4.768   1.749
  348    HA   ARG  46           HA       ARG  46  -7.661  -7.269   1.488
  349   1HB   ARG  46          2HB       ARG  46  -7.788  -5.011   3.436
  350   2HB   ARG  46          1HB       ARG  46  -9.097  -6.192   3.456
  351   1HG   ARG  46          2HG       ARG  46  -7.443  -8.019   3.660
  352   2HG   ARG  46          1HG       ARG  46  -6.141  -6.832   3.668
  353   1HD   ARG  46          2HD       ARG  46  -6.458  -6.366   5.848
  354   2HD   ARG  46          1HD       ARG  46  -8.193  -6.173   5.625
  355    HE   ARG  46           HE       ARG  46  -7.821  -8.888   5.558
  356   1HH1  ARG  46          2HH1      ARG  46  -6.957  -6.341   7.784
  357   2HH1  ARG  46          1HH1      ARG  46  -7.021  -7.365   9.176
  358   1HH2  ARG  46          1HH2      ARG  46  -7.899 -10.211   7.399
  359   2HH2  ARG  46          2HH2      ARG  46  -7.554  -9.547   8.960
  360    H    MET  47           H        MET  47  -8.752  -3.947   0.954
  361    HA   MET  47           HA       MET  47 -11.507  -4.514   0.568
  362   1HB   MET  47          2HB       MET  47  -9.766  -2.254  -0.451
  363   2HB   MET  47          1HB       MET  47 -11.513  -2.320  -0.682
  364   1HG   MET  47          2HG       MET  47 -10.234  -2.547   2.050
  365   2HG   MET  47          1HG       MET  47 -10.699  -0.997   1.350
  366   1HE   MET  47          1HE       MET  47 -13.050  -2.789   4.191
  367   2HE   MET  47          2HE       MET  47 -11.324  -2.638   3.873
  368   3HE   MET  47          3HE       MET  47 -12.169  -4.115   3.418
  369    H    LEU  48           H        LEU  48  -8.698  -4.679  -1.543
  370    HA   LEU  48           HA       LEU  48 -10.250  -5.024  -3.964
  371   1HB   LEU  48          2HB       LEU  48  -7.336  -5.153  -3.284
  372   2HB   LEU  48          1HB       LEU  48  -7.906  -5.781  -4.814
  373    HG   LEU  48           HG       LEU  48  -8.470  -2.951  -3.921
  374   1HD1  LEU  48          1HD1      LEU  48  -6.126  -4.056  -5.493
  375   2HD1  LEU  48          2HD1      LEU  48  -6.061  -3.182  -3.962
  376   3HD1  LEU  48          3HD1      LEU  48  -6.553  -2.347  -5.435
  377   1HD2  LEU  48          1HD2      LEU  48  -8.609  -2.705  -6.466
  378   2HD2  LEU  48          2HD2      LEU  48  -9.899  -3.641  -5.713
  379   3HD2  LEU  48          3HD2      LEU  48  -8.578  -4.467  -6.540
  380    H    GLY  49           H        GLY  49  -8.266  -7.131  -1.858
  381   1HA   GLY  49          2HA       GLY  49  -9.759  -9.379  -1.786
  382   2HA   GLY  49          1HA       GLY  49  -9.009  -9.505  -3.371
  383    H    GLN  50           H        GLN  50  -6.513  -8.158  -2.417
  384    HA   GLN  50           HA       GLN  50  -5.198 -10.546  -1.412
  385   1HB   GLN  50          2HB       GLN  50  -4.312  -7.904  -2.483
  386   2HB   GLN  50          1HB       GLN  50  -3.195  -8.800  -1.454
  387   1HG   GLN  50          2HG       GLN  50  -3.305 -10.733  -2.905
  388   2HG   GLN  50          1HG       GLN  50  -4.585  -9.994  -3.868
  389   1HE2  GLN  50          1HE2      GLN  50  -3.860  -7.650  -4.730
  390   2HE2  GLN  50          2HE2      GLN  50  -2.291  -7.590  -5.375
  391    H    ASN  51           H        ASN  51  -3.703 -10.484   0.417
  392    HA   ASN  51           HA       ASN  51  -4.081  -8.418   2.425
  393   1HB   ASN  51          2HB       ASN  51  -6.033 -10.012   2.698
  394   2HB   ASN  51          1HB       ASN  51  -4.859 -11.253   3.130
  395   1HD2  ASN  51          1HD2      ASN  51  -5.747 -11.330   5.347
  396   2HD2  ASN  51          2HD2      ASN  51  -5.401 -10.091   6.455
  397    HA   PRO  52           HA       PRO  52   0.053 -10.388   2.652
  398   1HB   PRO  52          2HB       PRO  52   1.450  -8.038   2.591
  399   2HB   PRO  52          1HB       PRO  52   0.902  -8.889   1.139
  400   1HG   PRO  52          2HG       PRO  52  -0.129  -6.407   2.362
  401   2HG   PRO  52          1HG       PRO  52  -0.218  -6.956   0.683
  402   1HD   PRO  52          2HD       PRO  52  -2.298  -7.072   2.630
  403   2HD   PRO  52          1HD       PRO  52  -2.315  -7.803   1.008
  404    H    THR  53           H        THR  53   2.042  -9.255   4.096
  405    HA   THR  53           HA       THR  53   0.864  -8.884   6.789
  406    HB   THR  53           HB       THR  53   2.680 -10.020   7.718
  407    HG1  THR  53           HG1      THR  53   4.647  -9.830   6.983
  408   1HG2  THR  53          1HG2      THR  53   2.427 -11.230   4.956
  409   2HG2  THR  53          2HG2      THR  53   1.373 -11.571   6.328
  410   3HG2  THR  53          3HG2      THR  53   3.071 -12.044   6.381
  411    HA   PRO  54           HA       PRO  54   2.805  -4.941   7.147
  412   1HB   PRO  54          2HB       PRO  54   4.081  -4.999   9.571
  413   2HB   PRO  54          1HB       PRO  54   2.326  -4.865   9.378
  414   1HG   PRO  54          2HG       PRO  54   3.966  -7.217  10.170
  415   2HG   PRO  54          1HG       PRO  54   2.316  -6.782  10.642
  416   1HD   PRO  54          2HD       PRO  54   2.982  -8.713   8.737
  417   2HD   PRO  54          1HD       PRO  54   1.393  -7.925   8.875
  418    H    GLU  55           H        GLU  55   4.955  -7.665   7.661
  419    HA   GLU  55           HA       GLU  55   7.382  -6.124   7.211
  420   1HB   GLU  55          2HB       GLU  55   7.150  -9.136   7.203
  421   2HB   GLU  55          1HB       GLU  55   8.567  -8.152   7.566
  422   1HG   GLU  55          2HG       GLU  55   7.054  -7.189   9.492
  423   2HG   GLU  55          1HG       GLU  55   6.147  -8.684   9.264
  424    H    GLU  56           H        GLU  56   5.287  -8.370   5.455
  425    HA   GLU  56           HA       GLU  56   6.950  -8.598   3.137
  426   1HB   GLU  56          2HB       GLU  56   5.056 -10.175   3.897
  427   2HB   GLU  56          1HB       GLU  56   3.965  -9.010   3.148
  428   1HG   GLU  56          2HG       GLU  56   6.265  -9.721   1.457
  429   2HG   GLU  56          1HG       GLU  56   5.210 -11.085   1.822
  430    H    LEU  57           H        LEU  57   3.946  -6.756   3.794
  431    HA   LEU  57           HA       LEU  57   3.833  -5.463   1.293
  432   1HB   LEU  57          2HB       LEU  57   1.915  -4.717   2.109
  433   2HB   LEU  57          1HB       LEU  57   2.298  -5.490   3.624
  434    HG   LEU  57           HG       LEU  57   3.120  -2.656   2.975
  435   1HD1  LEU  57          1HD1      LEU  57   0.769  -3.416   4.695
  436   2HD1  LEU  57          2HD1      LEU  57   0.577  -3.193   2.957
  437   3HD1  LEU  57          3HD1      LEU  57   1.141  -1.857   3.960
  438   1HD2  LEU  57          1HD2      LEU  57   4.118  -2.724   4.996
  439   2HD2  LEU  57          2HD2      LEU  57   3.756  -4.450   5.074
  440   3HD2  LEU  57          3HD2      LEU  57   2.623  -3.280   5.750
  441    H    GLN  58           H        GLN  58   5.790  -4.823   4.110
  442    HA   GLN  58           HA       GLN  58   6.393  -2.117   3.772
  443   1HB   GLN  58          2HB       GLN  58   7.142  -3.723   5.653
  444   2HB   GLN  58          1HB       GLN  58   8.486  -4.126   4.585
  445   1HG   GLN  58          2HG       GLN  58   9.205  -2.338   6.055
  446   2HG   GLN  58          1HG       GLN  58   9.014  -1.669   4.434
  447   1HE2  GLN  58          1HE2      GLN  58   7.181  -0.226   4.043
  448   2HE2  GLN  58          2HE2      GLN  58   6.288   0.429   5.330
  449    H    GLU  59           H        GLU  59   7.864  -4.979   2.262
  450    HA   GLU  59           HA       GLU  59   9.889  -3.611   0.820
  451   1HB   GLU  59          2HB       GLU  59   8.578  -6.294   0.591
  452   2HB   GLU  59          1HB       GLU  59   9.582  -5.720  -0.741
  453   1HG   GLU  59          2HG       GLU  59  11.231  -5.122   1.293
  454   2HG   GLU  59          1HG       GLU  59  10.364  -6.465   2.038
  455    H    MET  60           H        MET  60   6.503  -4.336   0.113
  456    HA   MET  60           HA       MET  60   6.548  -3.576  -2.634
  457   1HB   MET  60          2HB       MET  60   4.229  -3.570  -0.680
  458   2HB   MET  60          1HB       MET  60   4.094  -3.450  -2.434
  459   1HG   MET  60          2HG       MET  60   5.447  -5.774  -1.038
  460   2HG   MET  60          1HG       MET  60   3.743  -5.780  -1.486
  461   1HE   MET  60          1HE       MET  60   5.919  -8.068  -3.962
  462   2HE   MET  60          2HE       MET  60   4.912  -8.068  -2.517
  463   3HE   MET  60          3HE       MET  60   6.581  -7.514  -2.418
  464    H    ILE  61           H        ILE  61   5.656  -1.843   0.353
  465    HA   ILE  61           HA       ILE  61   4.824   0.582  -0.711
  466    HB   ILE  61           HB       ILE  61   6.303  -0.063   1.844
  467   1HG1  ILE  61          2HG1      ILE  61   3.486   0.874   1.730
  468   2HG1  ILE  61          1HG1      ILE  61   3.804  -0.742   1.105
  469   1HG2  ILE  61          1HG2      ILE  61   5.423   2.204   2.588
  470   2HG2  ILE  61          2HG2      ILE  61   5.121   2.553   0.885
  471   3HG2  ILE  61          3HG2      ILE  61   6.766   2.249   1.446
  472   1HD1  ILE  61          1HD1      ILE  61   3.257  -0.678   3.566
  473   2HD1  ILE  61          2HD1      ILE  61   4.756   0.217   3.813
  474   3HD1  ILE  61          3HD1      ILE  61   4.804  -1.428   3.179
  475    H    ASP  62           H        ASP  62   8.065   0.071   0.686
  476    HA   ASP  62           HA       ASP  62   9.288   2.356  -0.292
  477   1HB   ASP  62          2HB       ASP  62  10.407  -0.365   0.365
  478   2HB   ASP  62          1HB       ASP  62  11.439   0.968  -0.145
  479    H    GLU  63           H        GLU  63   8.819  -0.753  -1.932
  480    HA   GLU  63           HA       GLU  63  10.529  -0.269  -4.143
  481   1HB   GLU  63          2HB       GLU  63   8.336  -2.177  -3.528
  482   2HB   GLU  63          1HB       GLU  63   8.716  -1.925  -5.231
  483   1HG   GLU  63          2HG       GLU  63  10.997  -2.335  -3.342
  484   2HG   GLU  63          1HG       GLU  63  10.024  -3.740  -3.775
  485    H    VAL  64           H        VAL  64   6.991   0.144  -3.800
  486    HA   VAL  64           HA       VAL  64   6.715   1.307  -6.419
  487    HB   VAL  64           HB       VAL  64   4.399   1.691  -5.840
  488   1HG1  VAL  64          1HG1      VAL  64   5.568  -0.753  -6.015
  489   2HG1  VAL  64          2HG1      VAL  64   3.828  -0.516  -5.858
  490   3HG1  VAL  64          3HG1      VAL  64   4.798  -0.885  -4.434
  491   1HG2  VAL  64          1HG2      VAL  64   3.540   1.331  -3.588
  492   2HG2  VAL  64          2HG2      VAL  64   4.832   2.531  -3.523
  493   3HG2  VAL  64          3HG2      VAL  64   5.143   0.871  -3.017
  494    H    ASP  65           H        ASP  65   7.526   2.575  -3.293
  495    HA   ASP  65           HA       ASP  65   6.574   5.235  -3.707
  496   1HB   ASP  65          2HB       ASP  65   7.577   3.892  -1.539
  497   2HB   ASP  65          1HB       ASP  65   8.933   4.932  -1.968
  498    H    GLU  66           H        GLU  66   7.238   5.749  -5.805
  499    HA   GLU  66           HA       GLU  66   9.945   5.674  -6.688
  500   1HB   GLU  66          2HB       GLU  66   7.510   7.153  -7.691
  501   2HB   GLU  66          1HB       GLU  66   9.080   7.241  -8.491
  502   1HG   GLU  66          2HG       GLU  66   8.902   5.139  -9.341
  503   2HG   GLU  66          1HG       GLU  66   8.214   4.496  -7.850
  504    H    ASP  67           H        ASP  67   7.958   8.198  -5.189
  505    HA   ASP  67           HA       ASP  67  10.088  10.169  -5.447
  506   1HB   ASP  67          2HB       ASP  67   8.456  11.539  -3.938
  507   2HB   ASP  67          1HB       ASP  67   8.040  11.254  -5.624
  508    H    GLY  68           H        GLY  68   8.640   8.177  -2.905
  509   1HA   GLY  68          2HA       GLY  68   9.559   7.464  -0.902
  510   2HA   GLY  68          1HA       GLY  68  11.028   8.350  -1.302
  511    H    SER  69           H        SER  69   7.662   9.461  -0.983
  512    HA   SER  69           HA       SER  69   8.562  11.626   0.768
  513   1HB   SER  69          2HB       SER  69   6.232  12.483   0.451
  514   2HB   SER  69          1HB       SER  69   7.121  12.287  -1.056
  515    HG   SER  69           HG       SER  69   4.802  11.292  -0.518
  516    H    GLY  70           H        GLY  70   6.015   9.128   0.739
  517   1HA   GLY  70          2HA       GLY  70   6.175   7.935   3.109
  518   2HA   GLY  70          1HA       GLY  70   5.535   9.501   3.602
  519    H    THR  71           H        THR  71   4.061   9.760   1.013
  520    HA   THR  71           HA       THR  71   1.746   8.080   1.725
  521    HB   THR  71           HB       THR  71   0.428   9.707   0.427
  522    HG1  THR  71           HG1      THR  71   1.778  10.457  -1.095
  523   1HG2  THR  71          1HG2      THR  71   0.814  11.679   1.894
  524   2HG2  THR  71          2HG2      THR  71   2.328  10.949   2.434
  525   3HG2  THR  71          3HG2      THR  71   0.790  10.164   2.797
  526    H    VAL  72           H        VAL  72   0.442   7.208  -0.062
  527    HA   VAL  72           HA       VAL  72   2.159   6.389  -2.331
  528    HB   VAL  72           HB       VAL  72  -0.332   4.998  -1.326
  529   1HG1  VAL  72          1HG1      VAL  72   0.485   4.720  -3.750
  530   2HG1  VAL  72          2HG1      VAL  72   0.282   3.241  -2.809
  531   3HG1  VAL  72          3HG1      VAL  72   1.894   3.913  -3.059
  532   1HG2  VAL  72          1HG2      VAL  72   2.603   4.494  -0.752
  533   2HG2  VAL  72          2HG2      VAL  72   1.330   3.315  -0.432
  534   3HG2  VAL  72          3HG2      VAL  72   1.337   4.859   0.420
  535    H    ASP  73           H        ASP  73   1.728   7.387  -4.171
  536    HA   ASP  73           HA       ASP  73  -0.836   8.706  -4.601
  537   1HB   ASP  73          2HB       ASP  73   1.607   8.516  -6.387
  538   2HB   ASP  73          1HB       ASP  73   0.196   9.528  -6.687
  539    H    PHE  74           H        PHE  74  -1.678   8.454  -7.000
  540    HA   PHE  74           HA       PHE  74  -2.678   5.815  -7.244
  541   1HB   PHE  74          2HB       PHE  74  -3.692   8.001  -8.165
  542   2HB   PHE  74          1HB       PHE  74  -2.603   7.778  -9.533
  543    HD1  PHE  74           HD1      PHE  74  -4.150   7.268 -11.262
  544    HD2  PHE  74           HD2      PHE  74  -4.276   5.081  -7.566
  545    HE1  PHE  74           HE1      PHE  74  -5.738   5.653 -12.269
  546    HE2  PHE  74           HE2      PHE  74  -5.859   3.466  -8.575
  547    HZ   PHE  74           HZ       PHE  74  -6.592   3.750 -10.927
  548    H    ASP  75           H        ASP  75   0.051   7.477  -8.741
  549    HA   ASP  75           HA       ASP  75   0.631   5.505 -10.718
  550   1HB   ASP  75          2HB       ASP  75   2.087   7.816  -9.511
  551   2HB   ASP  75          1HB       ASP  75   3.032   6.603 -10.371
  552    H    GLU  76           H        GLU  76   1.665   6.025  -7.373
  553    HA   GLU  76           HA       GLU  76   3.524   3.814  -7.360
  554   1HB   GLU  76          2HB       GLU  76   2.350   5.065  -4.883
  555   2HB   GLU  76          1HB       GLU  76   3.949   4.358  -5.110
  556   1HG   GLU  76          2HG       GLU  76   4.450   6.225  -6.738
  557   2HG   GLU  76          1HG       GLU  76   2.925   6.968  -6.258
  558    H    PHE  77           H        PHE  77   0.139   4.265  -6.838
  559    HA   PHE  77           HA       PHE  77  -0.306   1.867  -5.296
  560   1HB   PHE  77          2HB       PHE  77  -1.824   3.793  -5.109
  561   2HB   PHE  77          1HB       PHE  77  -2.236   3.647  -6.815
  562    HD1  PHE  77           HD1      PHE  77  -3.967   2.215  -7.517
  563    HD2  PHE  77           HD2      PHE  77  -2.308   1.777  -3.574
  564    HE1  PHE  77           HE1      PHE  77  -5.748   0.583  -6.946
  565    HE2  PHE  77           HE2      PHE  77  -4.086   0.143  -3.010
  566    HZ   PHE  77           HZ       PHE  77  -5.805  -0.452  -4.694
  567    H    LEU  78           H        LEU  78  -0.529   2.809  -8.710
  568    HA   LEU  78           HA       LEU  78  -1.690   0.322  -9.570
  569   1HB   LEU  78          2HB       LEU  78  -0.339   2.535 -11.096
  570   2HB   LEU  78          1HB       LEU  78  -1.126   1.161 -11.844
  571    HG   LEU  78           HG       LEU  78  -2.754   2.765  -9.939
  572   1HD1  LEU  78          1HD1      LEU  78  -3.176   4.510 -11.561
  573   2HD1  LEU  78          2HD1      LEU  78  -2.128   3.728 -12.744
  574   3HD1  LEU  78          3HD1      LEU  78  -1.437   4.432 -11.281
  575   1HD2  LEU  78          1HD2      LEU  78  -4.509   1.993 -11.244
  576   2HD2  LEU  78          2HD2      LEU  78  -3.344   0.695 -11.506
  577   3HD2  LEU  78          3HD2      LEU  78  -3.539   1.962 -12.717
  578    H    VAL  79           H        VAL  79   1.613   1.602  -9.379
  579    HA   VAL  79           HA       VAL  79   2.888  -0.286 -11.017
  580    HB   VAL  79           HB       VAL  79   4.938   0.158  -9.602
  581   1HG1  VAL  79          1HG1      VAL  79   4.731   1.481 -11.533
  582   2HG1  VAL  79          2HG1      VAL  79   4.894   2.676 -10.245
  583   3HG1  VAL  79          3HG1      VAL  79   3.304   2.317 -10.919
  584   1HG2  VAL  79          1HG2      VAL  79   4.836   1.864  -7.910
  585   2HG2  VAL  79          2HG2      VAL  79   3.599   0.671  -7.518
  586   3HG2  VAL  79          3HG2      VAL  79   3.144   2.197  -8.272
  587    H    MET  80           H        MET  80   1.712  -0.579  -7.731
  588    HA   MET  80           HA       MET  80   3.119  -2.688  -6.685
  589   1HB   MET  80          2HB       MET  80   0.341  -1.724  -6.449
  590   2HB   MET  80          1HB       MET  80   0.586  -3.408  -5.980
  591   1HG   MET  80          2HG       MET  80   1.449  -2.714  -4.026
  592   2HG   MET  80          1HG       MET  80   2.757  -1.928  -4.907
  593   1HE   MET  80          1HE       MET  80  -1.284  -0.797  -4.853
  594   2HE   MET  80          2HE       MET  80  -1.073  -0.311  -3.174
  595   3HE   MET  80          3HE       MET  80  -0.658  -1.950  -3.665
  596    H    MET  81           H        MET  81   0.614  -2.857  -9.192
  597    HA   MET  81           HA       MET  81   0.523  -5.731  -9.260
  598   1HB   MET  81          2HB       MET  81  -0.518  -3.572 -11.089
  599   2HB   MET  81          1HB       MET  81  -0.641  -5.278 -11.512
  600   1HG   MET  81          2HG       MET  81  -1.580  -4.308  -8.821
  601   2HG   MET  81          1HG       MET  81  -2.625  -4.172 -10.235
  602   1HE   MET  81          1HE       MET  81  -1.389  -5.778  -7.505
  603   2HE   MET  81          2HE       MET  81  -0.605  -7.250  -8.075
  604   3HE   MET  81          3HE       MET  81  -2.232  -7.330  -7.406
  605    H    VAL  82           H        VAL  82   1.769  -3.331 -11.607
  606    HA   VAL  82           HA       VAL  82   3.047  -5.198 -13.296
  607    HB   VAL  82           HB       VAL  82   4.309  -3.249 -14.182
  608   1HG1  VAL  82          1HG1      VAL  82   2.471  -2.623 -15.348
  609   2HG1  VAL  82          2HG1      VAL  82   1.629  -2.078 -13.896
  610   3HG1  VAL  82          3HG1      VAL  82   1.606  -3.784 -14.341
  611   1HG2  VAL  82          1HG2      VAL  82   3.406  -1.006 -13.115
  612   2HG2  VAL  82          2HG2      VAL  82   4.782  -1.840 -12.390
  613   3HG2  VAL  82          3HG2      VAL  82   3.175  -2.020 -11.693
  614    H    ARG  83           H        ARG  83   4.115  -3.700 -10.311
  615    HA   ARG  83           HA       ARG  83   6.895  -4.004 -10.521
  616   1HB   ARG  83          2HB       ARG  83   5.013  -4.058  -8.167
  617   2HB   ARG  83          1HB       ARG  83   6.748  -4.300  -7.957
  618   1HG   ARG  83          2HG       ARG  83   5.941  -1.994  -9.647
  619   2HG   ARG  83          1HG       ARG  83   5.598  -1.855  -7.923
  620   1HD   ARG  83          2HD       ARG  83   7.856  -2.017  -7.326
  621   2HD   ARG  83          1HD       ARG  83   8.300  -2.793  -8.842
  622    HE   ARG  83           HE       ARG  83   7.361  -0.199  -9.422
  623   1HH1  ARG  83          2HH1      ARG  83  10.017  -1.789  -7.805
  624   2HH1  ARG  83          1HH1      ARG  83  11.140  -0.512  -8.124
  625   1HH2  ARG  83          1HH2      ARG  83   8.850   1.462  -9.830
  626   2HH2  ARG  83          2HH2      ARG  83  10.482   1.324  -9.267
  627    H    CYS  84           H        CYS  84   4.364  -6.339  -9.915
  628    HA   CYS  84           HA       CYS  84   5.919  -8.449  -8.840
  629   1HB   CYS  84          2HB       CYS  84   3.380  -8.503 -10.487
  630   2HB   CYS  84          1HB       CYS  84   4.087  -9.928  -9.727
  631    HG   CYS  84           HG       CYS  84   2.495  -7.781  -8.287
  632    H    MET  85           H        MET  85   5.481  -7.263 -12.109
  633    HA   MET  85           HA       MET  85   7.004  -9.544 -13.197
  634   1HB   MET  85          2HB       MET  85   5.007  -7.636 -14.309
  635   2HB   MET  85          1HB       MET  85   6.289  -8.174 -15.396
  636   1HG   MET  85          2HG       MET  85   5.712 -10.560 -14.577
  637   2HG   MET  85          1HG       MET  85   4.222  -9.843 -13.964
  638   1HE   MET  85          1HE       MET  85   2.300 -11.066 -16.787
  639   2HE   MET  85          2HE       MET  85   2.656 -10.981 -15.063
  640   3HE   MET  85          3HE       MET  85   3.573 -12.079 -16.092
  641    H    LYS  86           H        LYS  86   8.597  -8.005 -11.707
  642    HA   LYS  86           HA       LYS  86   9.785  -5.848 -13.239
  643   1HB   LYS  86          2HB       LYS  86  11.440  -5.750 -11.395
  644   2HB   LYS  86          1HB       LYS  86   9.780  -5.675 -10.807
  645   1HG   LYS  86          2HG       LYS  86   9.845  -7.849  -9.945
  646   2HG   LYS  86          1HG       LYS  86  11.169  -8.337 -11.003
  647   1HD   LYS  86          2HD       LYS  86  12.784  -7.395  -9.655
  648   2HD   LYS  86          1HD       LYS  86  11.706  -6.130  -9.067
  649   1HE   LYS  86          2HE       LYS  86  11.831  -7.463  -7.175
  650   2HE   LYS  86          1HE       LYS  86  10.433  -8.187  -7.971
  651   1HZ   LYS  86          1HZ       LYS  86  11.885  -9.841  -8.957
  652   2HZ   LYS  86          2HZ       LYS  86  12.030  -9.861  -7.264
  653   3HZ   LYS  86          3HZ       LYS  86  13.238  -9.137  -8.214
  654    H    ASP  87           H        ASP  87  11.979  -5.807 -13.959
  655    HA   ASP  87           HA       ASP  87  12.943  -8.467 -14.826
  656   1HB   ASP  87          2HB       ASP  87  12.275  -6.572 -16.508
  657   2HB   ASP  87          1HB       ASP  87  13.847  -5.896 -16.081
  658    H    ASP  88           H        ASP  88  14.149  -5.240 -13.864
  659    HA   ASP  88           HA       ASP  88  16.038  -4.576 -12.745
  660   1HB   ASP  88          2HB       ASP  88  15.069  -6.471 -11.178
  661   2HB   ASP  88          1HB       ASP  88  16.498  -7.353 -11.715
  662    H    SER  89           HN       SER  89  16.366  -5.243 -15.412
  663    HA   SER  89           HA       SER  89  19.200  -5.818 -15.490
  664   1HB   SER  89          2HB       SER  89  17.786  -8.070 -15.614
  665   2HB   SER  89          1HB       SER  89  17.605  -7.583 -17.297
  666    HG   SER  89           HG       SER  89  19.532  -8.896 -16.622
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1  13.944  -0.213 -21.667
    2   2H    MET   1          2H        MET   1  15.126   0.843 -22.275
    3   3H    MET   1          3H        MET   1  13.512   1.355 -22.146
    4    HA   MET   1           HA       MET   1  15.444   0.831 -19.960
    5   1HB   MET   1          2HB       MET   1  13.833   3.235 -20.862
    6   2HB   MET   1          1HB       MET   1  14.688   3.168 -19.321
    7   1HG   MET   1          2HG       MET   1  16.789   2.611 -20.631
    8   2HG   MET   1          1HG       MET   1  15.885   2.992 -22.096
    9   1HE   MET   1          1HE       MET   1  17.756   5.559 -22.583
   10   2HE   MET   1          2HE       MET   1  18.220   4.016 -21.869
   11   3HE   MET   1          3HE       MET   1  18.613   5.518 -21.036
   12    H    ASN   2           H        ASN   2  12.063   1.861 -20.560
   13    HA   ASN   2           HA       ASN   2  11.211   0.189 -18.280
   14   1HB   ASN   2          2HB       ASN   2  10.729   3.122 -18.684
   15   2HB   ASN   2          1HB       ASN   2   9.499   2.143 -17.883
   16   1HD2  ASN   2          1HD2      ASN   2  10.502   0.626 -16.074
   17   2HD2  ASN   2          2HD2      ASN   2  11.679   1.348 -15.089
   18    H    ASP   3           H        ASP   3  10.514  -1.305 -19.890
   19    HA   ASP   3           HA       ASP   3   8.084  -0.440 -21.346
   20   1HB   ASP   3          2HB       ASP   3  10.383  -1.458 -22.468
   21   2HB   ASP   3          1HB       ASP   3   9.363  -2.889 -22.324
   22    H    ILE   4           H        ILE   4   8.658  -1.801 -18.572
   23    HA   ILE   4           HA       ILE   4   7.273  -4.336 -18.883
   24    HB   ILE   4           HB       ILE   4   7.634  -4.723 -16.596
   25   1HG1  ILE   4          2HG1      ILE   4   6.720  -2.394 -15.953
   26   2HG1  ILE   4          1HG1      ILE   4   7.955  -3.096 -14.911
   27   1HG2  ILE   4          1HG2      ILE   4   9.942  -3.035 -17.596
   28   2HG2  ILE   4          2HG2      ILE   4   9.714  -4.763 -17.860
   29   3HG2  ILE   4          3HG2      ILE   4  10.021  -4.153 -16.234
   30   1HD1  ILE   4          1HD1      ILE   4   8.179  -0.817 -16.859
   31   2HD1  ILE   4          2HD1      ILE   4   9.612  -1.776 -16.489
   32   3HD1  ILE   4          3HD1      ILE   4   8.764  -0.926 -15.199
   33    H    TYR   5           H        TYR   5   6.506  -1.032 -18.103
   34    HA   TYR   5           HA       TYR   5   3.971  -1.488 -16.864
   35   1HB   TYR   5          2HB       TYR   5   4.812   0.978 -18.408
   36   2HB   TYR   5          1HB       TYR   5   3.592   0.867 -17.141
   37    HD1  TYR   5           HD1      TYR   5   4.643  -0.459 -14.941
   38    HD2  TYR   5           HD2      TYR   5   6.777   2.015 -17.727
   39    HE1  TYR   5           HE1      TYR   5   6.386  -0.028 -13.228
   40    HE2  TYR   5           HE2      TYR   5   8.518   2.443 -16.018
   41    HH   TYR   5           HH       TYR   5   9.251   0.850 -13.703
   42    H    LYS   6           H        LYS   6   5.099  -0.965 -20.161
   43    HA   LYS   6           HA       LYS   6   2.464  -0.862 -21.338
   44   1HB   LYS   6          2HB       LYS   6   5.012  -1.562 -22.806
   45   2HB   LYS   6          1HB       LYS   6   3.558  -0.804 -23.450
   46   1HG   LYS   6          2HG       LYS   6   5.649   0.412 -21.633
   47   2HG   LYS   6          1HG       LYS   6   5.126   0.971 -23.221
   48   1HD   LYS   6          2HD       LYS   6   2.996   1.678 -22.366
   49   2HD   LYS   6          1HD       LYS   6   3.282   0.872 -20.822
   50   1HE   LYS   6          2HE       LYS   6   4.803   2.479 -20.106
   51   2HE   LYS   6          1HE       LYS   6   5.219   2.969 -21.748
   52   1HZ   LYS   6          1HZ       LYS   6   2.995   3.937 -21.958
   53   2HZ   LYS   6          2HZ       LYS   6   3.876   4.650 -20.693
   54   3HZ   LYS   6          3HZ       LYS   6   2.656   3.519 -20.349
   55    H    ALA   7           H        ALA   7   4.985  -3.281 -20.875
   56    HA   ALA   7           HA       ALA   7   3.726  -5.397 -22.304
   57   1HB   ALA   7          1HB       ALA   7   5.893  -5.265 -20.224
   58   2HB   ALA   7          2HB       ALA   7   6.005  -5.757 -21.914
   59   3HB   ALA   7          3HB       ALA   7   5.240  -6.822 -20.735
   60    H    ALA   8           H        ALA   8   3.376  -4.112 -19.055
   61    HA   ALA   8           HA       ALA   8   1.922  -6.390 -18.035
   62   1HB   ALA   8          1HB       ALA   8   1.333  -4.600 -16.216
   63   2HB   ALA   8          2HB       ALA   8   2.603  -3.660 -17.000
   64   3HB   ALA   8          3HB       ALA   8   2.971  -5.242 -16.311
   65    H    VAL   9           H        VAL   9   1.134  -3.212 -19.397
   66    HA   VAL   9           HA       VAL   9  -1.576  -3.053 -18.772
   67    HB   VAL   9           HB       VAL   9   0.024  -2.065 -21.129
   68   1HG1  VAL   9          1HG1      VAL   9  -2.168  -2.431 -22.062
   69   2HG1  VAL   9          2HG1      VAL   9  -2.029  -0.707 -21.713
   70   3HG1  VAL   9          3HG1      VAL   9  -2.950  -1.754 -20.633
   71   1HG2  VAL   9          1HG2      VAL   9   0.217  -0.166 -19.901
   72   2HG2  VAL   9          2HG2      VAL   9  -0.281  -1.165 -18.537
   73   3HG2  VAL   9          3HG2      VAL   9  -1.476  -0.207 -19.408
   74    H    GLU  10           H        GLU  10  -0.079  -4.519 -21.663
   75    HA   GLU  10           HA       GLU  10  -2.488  -5.479 -22.794
   76   1HB   GLU  10          2HB       GLU  10  -1.078  -6.803 -24.254
   77   2HB   GLU  10          1HB       GLU  10  -0.348  -5.213 -24.037
   78   1HG   GLU  10          2HG       GLU  10   1.085  -6.189 -22.222
   79   2HG   GLU  10          1HG       GLU  10   0.449  -7.779 -22.639
   80    H    GLN  11           H        GLN  11  -0.557  -6.657 -20.154
   81    HA   GLN  11           HA       GLN  11  -1.554  -9.376 -20.336
   82   1HB   GLN  11          2HB       GLN  11   0.056  -7.974 -18.191
   83   2HB   GLN  11          1HB       GLN  11  -0.373  -9.684 -18.161
   84   1HG   GLN  11          2HG       GLN  11   0.980  -8.558 -20.591
   85   2HG   GLN  11          1HG       GLN  11   1.946  -8.931 -19.163
   86   1HE2  GLN  11          1HE2      GLN  11   0.076 -10.341 -21.793
   87   2HE2  GLN  11          2HE2      GLN  11   0.455 -11.957 -21.440
   88    H    LEU  12           H        LEU  12  -2.022  -6.544 -18.264
   89    HA   LEU  12           HA       LEU  12  -4.138  -7.847 -16.752
   90   1HB   LEU  12          2HB       LEU  12  -3.570  -4.919 -16.591
   91   2HB   LEU  12          1HB       LEU  12  -4.124  -6.007 -15.347
   92    HG   LEU  12           HG       LEU  12  -1.332  -5.503 -16.315
   93   1HD1  LEU  12          1HD1      LEU  12  -2.709  -5.690 -13.625
   94   2HD1  LEU  12          2HD1      LEU  12  -2.061  -4.242 -14.396
   95   3HD1  LEU  12          3HD1      LEU  12  -0.967  -5.497 -13.819
   96   1HD2  LEU  12          1HD2      LEU  12  -1.160  -7.819 -16.403
   97   2HD2  LEU  12          2HD2      LEU  12  -2.459  -8.063 -15.234
   98   3HD2  LEU  12          3HD2      LEU  12  -0.862  -7.555 -14.685
   99    H    THR  13           H        THR  13  -6.095  -6.174 -16.358
  100    HA   THR  13           HA       THR  13  -7.112  -5.414 -19.038
  101    HB   THR  13           HB       THR  13  -9.408  -5.892 -17.724
  102    HG1  THR  13           HG1      THR  13  -9.127  -7.117 -16.063
  103   1HG2  THR  13          1HG2      THR  13  -9.031  -6.896 -19.824
  104   2HG2  THR  13          2HG2      THR  13  -9.224  -8.260 -18.725
  105   3HG2  THR  13          3HG2      THR  13  -7.612  -7.772 -19.247
  106    H    ASP  14           H        ASP  14  -8.925  -3.829 -18.930
  107    HA   ASP  14           HA       ASP  14  -8.153  -1.481 -17.554
  108   1HB   ASP  14          2HB       ASP  14 -10.693  -2.281 -18.974
  109   2HB   ASP  14          1HB       ASP  14 -10.519  -0.707 -18.198
  110    H    GLU  15           H        GLU  15 -10.380  -4.085 -16.775
  111    HA   GLU  15           HA       GLU  15 -11.840  -2.896 -14.691
  112   1HB   GLU  15          2HB       GLU  15 -11.077  -5.737 -15.314
  113   2HB   GLU  15          1HB       GLU  15 -11.946  -5.345 -13.831
  114   1HG   GLU  15          2HG       GLU  15 -13.488  -3.970 -15.511
  115   2HG   GLU  15          1HG       GLU  15 -12.856  -5.135 -16.675
  116    H    GLN  16           H        GLN  16  -8.680  -4.531 -14.673
  117    HA   GLN  16           HA       GLN  16  -8.282  -4.641 -11.887
  118   1HB   GLN  16          2HB       GLN  16  -6.357  -4.462 -14.205
  119   2HB   GLN  16          1HB       GLN  16  -5.793  -4.522 -12.535
  120   1HG   GLN  16          2HG       GLN  16  -7.813  -6.550 -13.411
  121   2HG   GLN  16          1HG       GLN  16  -6.146  -6.754 -13.946
  122   1HE2  GLN  16          1HE2      GLN  16  -4.946  -8.015 -12.525
  123   2HE2  GLN  16          2HE2      GLN  16  -5.185  -8.090 -10.846
  124    H    LYS  17           H        LYS  17  -7.378  -2.126 -14.248
  125    HA   LYS  17           HA       LYS  17  -6.276  -0.349 -12.299
  126   1HB   LYS  17          2HB       LYS  17  -6.937  -0.214 -15.184
  127   2HB   LYS  17          1HB       LYS  17  -6.942   1.323 -14.319
  128   1HG   LYS  17          2HG       LYS  17  -4.698   1.112 -14.999
  129   2HG   LYS  17          1HG       LYS  17  -4.668   0.527 -13.336
  130   1HD   LYS  17          2HD       LYS  17  -3.512  -1.178 -14.412
  131   2HD   LYS  17          1HD       LYS  17  -5.156  -1.810 -14.473
  132   1HE   LYS  17          2HE       LYS  17  -5.389  -0.714 -16.746
  133   2HE   LYS  17          1HE       LYS  17  -3.661  -0.370 -16.680
  134   1HZ   LYS  17          1HZ       LYS  17  -4.973  -3.031 -16.647
  135   2HZ   LYS  17          2HZ       LYS  17  -3.325  -2.798 -16.304
  136   3HZ   LYS  17          3HZ       LYS  17  -3.941  -2.402 -17.837
  137    H    ASN  18           H        ASN  18  -9.500  -0.938 -13.543
  138    HA   ASN  18           HA       ASN  18 -10.737   1.461 -12.642
  139   1HB   ASN  18          2HB       ASN  18 -11.566  -0.776 -14.070
  140   2HB   ASN  18          1HB       ASN  18 -12.464  -0.897 -12.557
  141   1HD2  ASN  18          1HD2      ASN  18 -11.748   1.378 -15.244
  142   2HD2  ASN  18          2HD2      ASN  18 -13.176   2.278 -15.060
  143    H    GLU  19           H        GLU  19 -10.333  -1.770 -11.203
  144    HA   GLU  19           HA       GLU  19 -11.697  -1.224  -8.762
  145   1HB   GLU  19          2HB       GLU  19  -9.465  -3.213  -9.279
  146   2HB   GLU  19          1HB       GLU  19 -10.552  -3.215  -7.892
  147   1HG   GLU  19          2HG       GLU  19 -12.316  -3.141 -10.009
  148   2HG   GLU  19          1HG       GLU  19 -11.019  -4.156 -10.636
  149    H    PHE  20           H        PHE  20  -8.313  -1.036  -9.787
  150    HA   PHE  20           HA       PHE  20  -7.155  -0.308  -7.320
  151   1HB   PHE  20          2HB       PHE  20  -6.373   0.032 -10.195
  152   2HB   PHE  20          1HB       PHE  20  -5.461   0.885  -8.954
  153    HD1  PHE  20           HD1      PHE  20  -3.453  -0.438  -9.526
  154    HD2  PHE  20           HD2      PHE  20  -7.041  -2.313  -8.091
  155    HE1  PHE  20           HE1      PHE  20  -2.178  -2.499  -9.039
  156    HE2  PHE  20           HE2      PHE  20  -5.765  -4.378  -7.605
  157    HZ   PHE  20           HZ       PHE  20  -3.331  -4.475  -8.076
  158    H    LYS  21           H        LYS  21  -8.607   1.630  -9.917
  159    HA   LYS  21           HA       LYS  21  -7.958   4.182  -8.851
  160   1HB   LYS  21          2HB       LYS  21  -8.727   3.742 -11.212
  161   2HB   LYS  21          1HB       LYS  21 -10.354   3.503 -10.576
  162   1HG   LYS  21          2HG       LYS  21 -10.059   5.819 -11.370
  163   2HG   LYS  21          1HG       LYS  21 -10.319   5.785  -9.626
  164   1HD   LYS  21          2HD       LYS  21  -8.027   6.182  -9.162
  165   2HD   LYS  21          1HD       LYS  21  -7.539   5.778 -10.809
  166   1HE   LYS  21          2HE       LYS  21  -8.587   7.779 -11.680
  167   2HE   LYS  21          1HE       LYS  21  -9.299   8.144 -10.109
  168   1HZ   LYS  21          1HZ       LYS  21  -7.127   8.482  -9.192
  169   2HZ   LYS  21          2HZ       LYS  21  -7.275   9.435 -10.591
  170   3HZ   LYS  21          3HZ       LYS  21  -6.379   7.992 -10.634
  171    H    ALA  22           H        ALA  22 -10.783   2.052  -8.491
  172    HA   ALA  22           HA       ALA  22 -12.325   3.845  -6.899
  173   1HB   ALA  22          1HB       ALA  22 -12.394   0.870  -7.353
  174   2HB   ALA  22          2HB       ALA  22 -13.574   2.089  -7.832
  175   3HB   ALA  22          3HB       ALA  22 -13.429   1.621  -6.139
  176    H    ALA  23           H        ALA  23 -10.087   1.197  -6.127
  177    HA   ALA  23           HA       ALA  23 -10.336   1.286  -3.310
  178   1HB   ALA  23          1HB       ALA  23  -8.318   0.200  -5.231
  179   2HB   ALA  23          2HB       ALA  23  -9.243  -0.633  -3.982
  180   3HB   ALA  23          3HB       ALA  23  -7.855   0.359  -3.536
  181    H    PHE  24           H        PHE  24  -8.619   3.284  -5.586
  182    HA   PHE  24           HA       PHE  24  -6.879   4.500  -3.607
  183   1HB   PHE  24          2HB       PHE  24  -6.485   4.175  -6.193
  184   2HB   PHE  24          1HB       PHE  24  -7.410   5.668  -6.323
  185    HD1  PHE  24           HD1      PHE  24  -4.289   4.131  -5.120
  186    HD2  PHE  24           HD2      PHE  24  -6.546   7.775  -5.420
  187    HE1  PHE  24           HE1      PHE  24  -2.263   5.436  -4.538
  188    HE2  PHE  24           HE2      PHE  24  -4.523   9.079  -4.833
  189    HZ   PHE  24           HZ       PHE  24  -2.380   7.909  -4.392
  190    H    ASP  25           H        ASP  25  -9.526   5.630  -5.721
  191    HA   ASP  25           HA       ASP  25  -9.858   8.192  -4.739
  192   1HB   ASP  25          2HB       ASP  25 -11.034   7.026  -6.716
  193   2HB   ASP  25          1HB       ASP  25 -12.227   6.512  -5.524
  194    H    ILE  26           H        ILE  26 -11.339   5.195  -3.453
  195    HA   ILE  26           HA       ILE  26 -13.088   6.360  -1.612
  196    HB   ILE  26           HB       ILE  26 -12.852   4.253  -0.290
  197   1HG1  ILE  26          2HG1      ILE  26 -10.766   3.611  -2.401
  198   2HG1  ILE  26          1HG1      ILE  26 -10.447   3.878  -0.690
  199   1HG2  ILE  26          1HG2      ILE  26 -13.274   2.802  -2.545
  200   2HG2  ILE  26          2HG2      ILE  26 -13.465   4.434  -3.185
  201   3HG2  ILE  26          3HG2      ILE  26 -14.478   3.886  -1.849
  202   1HD1  ILE  26          1HD1      ILE  26 -10.541   1.516  -0.940
  203   2HD1  ILE  26          2HD1      ILE  26 -11.975   1.606  -1.961
  204   3HD1  ILE  26          3HD1      ILE  26 -12.094   1.968  -0.239
  205    H    PHE  27           H        PHE  27  -9.616   5.779  -1.354
  206    HA   PHE  27           HA       PHE  27  -9.519   6.677   1.414
  207   1HB   PHE  27          2HB       PHE  27  -7.541   5.599  -0.549
  208   2HB   PHE  27          1HB       PHE  27  -6.939   6.582   0.786
  209    HD1  PHE  27           HD1      PHE  27  -7.073   5.814   3.085
  210    HD2  PHE  27           HD2      PHE  27  -8.746   3.486  -0.114
  211    HE1  PHE  27           HE1      PHE  27  -7.322   3.880   4.617
  212    HE2  PHE  27           HE2      PHE  27  -8.993   1.555   1.420
  213    HZ   PHE  27           HZ       PHE  27  -8.280   1.751   3.786
  214    H    ILE  28           H        ILE  28  -8.989   7.991  -1.801
  215    HA   ILE  28           HA       ILE  28  -7.824  10.460  -0.733
  216    HB   ILE  28           HB       ILE  28  -8.508   9.924  -3.622
  217   1HG1  ILE  28          2HG1      ILE  28  -7.120   8.078  -3.195
  218   2HG1  ILE  28          1HG1      ILE  28  -5.985   9.310  -3.722
  219   1HG2  ILE  28          1HG2      ILE  28  -6.262  11.362  -3.678
  220   2HG2  ILE  28          2HG2      ILE  28  -6.847  11.875  -2.094
  221   3HG2  ILE  28          3HG2      ILE  28  -7.844  12.129  -3.527
  222   1HD1  ILE  28          1HD1      ILE  28  -5.812   9.885  -1.175
  223   2HD1  ILE  28          2HD1      ILE  28  -4.944   8.481  -1.798
  224   3HD1  ILE  28          3HD1      ILE  28  -6.472   8.264  -0.948
  225    H    GLN  29           H        GLN  29 -10.478   9.912   0.094
  226    HA   GLN  29           HA       GLN  29 -12.322  11.434  -1.524
  227   1HB   GLN  29          2HB       GLN  29 -13.841  11.203   0.480
  228   2HB   GLN  29          1HB       GLN  29 -13.286   9.678  -0.206
  229   1HG   GLN  29          2HG       GLN  29 -12.084   9.134   1.649
  230   2HG   GLN  29          1HG       GLN  29 -11.525  10.786   1.892
  231   1HE2  GLN  29          1HE2      GLN  29 -12.990   8.646   3.687
  232   2HE2  GLN  29          2HE2      GLN  29 -14.222   9.560   4.417
  233    H    ASP  30           H        ASP  30 -10.186  12.057   1.188
  234    HA   ASP  30           HA       ASP  30 -10.681  14.921   0.897
  235   1HB   ASP  30          2HB       ASP  30 -11.056  15.311   3.253
  236   2HB   ASP  30          1HB       ASP  30 -12.255  14.159   2.672
  237    H    ALA  31           H        ALA  31  -8.470  13.138   0.254
  238    HA   ALA  31           HA       ALA  31  -6.384  13.311   2.169
  239   1HB   ALA  31          1HB       ALA  31  -6.127  13.133  -0.839
  240   2HB   ALA  31          2HB       ALA  31  -6.363  11.753   0.232
  241   3HB   ALA  31          3HB       ALA  31  -4.890  12.719   0.348
  242    H    GLU  32           H        GLU  32  -4.547  14.647   2.204
  243    HA   GLU  32           HA       GLU  32  -5.095  17.429   1.693
  244   1HB   GLU  32          2HB       GLU  32  -2.571  16.057   2.656
  245   2HB   GLU  32          1HB       GLU  32  -2.820  17.803   2.612
  246   1HG   GLU  32          2HG       GLU  32  -4.944  17.329   4.023
  247   2HG   GLU  32          1HG       GLU  32  -4.217  15.751   4.324
  248    H    ASP  33           H        ASP  33  -2.747  15.070   0.438
  249    HA   ASP  33           HA       ASP  33  -2.008  16.937  -1.714
  250   1HB   ASP  33          2HB       ASP  33  -0.271  15.681  -0.300
  251   2HB   ASP  33          1HB       ASP  33  -0.759  14.242  -1.196
  252    H    GLY  34           H        GLY  34  -3.588  13.854  -1.142
  253   1HA   GLY  34          2HA       GLY  34  -5.310  13.123  -2.692
  254   2HA   GLY  34          1HA       GLY  34  -4.313  13.732  -4.008
  255    H    CYS  35           H        CYS  35  -3.215  11.831  -1.231
  256    HA   CYS  35           HA       CYS  35  -2.824   9.462  -2.927
  257   1HB   CYS  35          2HB       CYS  35  -0.590  10.445  -1.162
  258   2HB   CYS  35          1HB       CYS  35  -0.524   9.261  -2.462
  259    HG   CYS  35           HG       CYS  35  -0.828  11.225  -4.184
  260    H    ILE  36           H        ILE  36  -2.000   7.584  -1.513
  261    HA   ILE  36           HA       ILE  36  -3.536   7.640   1.006
  262    HB   ILE  36           HB       ILE  36  -3.441   5.175   0.901
  263   1HG1  ILE  36          2HG1      ILE  36  -2.674   4.676  -1.748
  264   2HG1  ILE  36          1HG1      ILE  36  -1.436   5.766  -1.124
  265   1HG2  ILE  36          1HG2      ILE  36  -5.206   6.614  -0.303
  266   2HG2  ILE  36          2HG2      ILE  36  -5.061   4.932  -0.812
  267   3HG2  ILE  36          3HG2      ILE  36  -4.343   6.214  -1.787
  268   1HD1  ILE  36          1HD1      ILE  36  -1.761   2.979  -0.582
  269   2HD1  ILE  36          2HD1      ILE  36  -2.029   3.868   0.922
  270   3HD1  ILE  36          3HD1      ILE  36  -0.521   4.075   0.031
  271    H    SER  37           H        SER  37  -2.548   6.047   2.707
  272    HA   SER  37           HA       SER  37   0.190   6.977   3.185
  273   1HB   SER  37          2HB       SER  37  -1.747   7.084   4.920
  274   2HB   SER  37          1HB       SER  37  -1.428   5.367   5.139
  275    HG   SER  37           HG       SER  37   0.441   5.825   6.042
  276    H    THR  38           H        THR  38   1.856   5.562   3.802
  277    HA   THR  38           HA       THR  38   2.084   3.193   2.284
  278    HB   THR  38           HB       THR  38   4.123   2.751   3.631
  279    HG1  THR  38           HG1      THR  38   4.371   3.677   5.492
  280   1HG2  THR  38          1HG2      THR  38   3.571   5.000   1.990
  281   2HG2  THR  38          2HG2      THR  38   5.129   4.225   2.273
  282   3HG2  THR  38          3HG2      THR  38   4.610   5.559   3.301
  283    H    LYS  39           H        LYS  39   1.439   3.711   5.746
  284    HA   LYS  39           HA       LYS  39   1.193   0.940   6.403
  285   1HB   LYS  39          2HB       LYS  39   0.175   3.411   7.829
  286   2HB   LYS  39          1HB       LYS  39   0.138   1.779   8.500
  287   1HG   LYS  39          2HG       LYS  39   2.222   2.161   9.274
  288   2HG   LYS  39          1HG       LYS  39   2.768   2.091   7.599
  289   1HD   LYS  39          2HD       LYS  39   2.206   4.556   7.416
  290   2HD   LYS  39          1HD       LYS  39   1.951   4.554   9.161
  291   1HE   LYS  39          2HE       LYS  39   4.277   3.672   9.449
  292   2HE   LYS  39          1HE       LYS  39   4.517   3.842   7.711
  293   1HZ   LYS  39          1HZ       LYS  39   4.177   6.180   7.866
  294   2HZ   LYS  39          2HZ       LYS  39   5.326   5.751   9.041
  295   3HZ   LYS  39          3HZ       LYS  39   3.722   6.075   9.497
  296    H    GLU  40           H        GLU  40  -0.947   3.224   4.914
  297    HA   GLU  40           HA       GLU  40  -3.398   1.873   5.628
  298   1HB   GLU  40          2HB       GLU  40  -2.744   4.073   3.668
  299   2HB   GLU  40          1HB       GLU  40  -4.362   3.393   3.829
  300   1HG   GLU  40          2HG       GLU  40  -3.101   4.108   6.397
  301   2HG   GLU  40          1HG       GLU  40  -3.395   5.481   5.332
  302    H    LEU  41           H        LEU  41  -0.923   1.055   3.509
  303    HA   LEU  41           HA       LEU  41  -2.294   0.200   1.199
  304   1HB   LEU  41          2HB       LEU  41   0.273   0.322   1.782
  305   2HB   LEU  41          1HB       LEU  41   0.032  -1.341   2.265
  306    HG   LEU  41           HG       LEU  41   0.897  -1.049  -0.063
  307   1HD1  LEU  41          1HD1      LEU  41  -0.622  -2.985   0.816
  308   2HD1  LEU  41          2HD1      LEU  41  -0.358  -2.836  -0.920
  309   3HD1  LEU  41          3HD1      LEU  41  -1.860  -2.251  -0.204
  310   1HD2  LEU  41          1HD2      LEU  41  -0.569  -0.198  -1.794
  311   2HD2  LEU  41          2HD2      LEU  41  -0.470   1.023  -0.525
  312   3HD2  LEU  41          3HD2      LEU  41  -1.894  -0.011  -0.644
  313    H    GLY  42           H        GLY  42  -1.610  -1.451   4.275
  314   1HA   GLY  42          2HA       GLY  42  -2.662  -3.986   3.534
  315   2HA   GLY  42          1HA       GLY  42  -2.442  -3.405   5.181
  316    H    LYS  43           H        LYS  43  -4.202  -0.987   4.288
  317    HA   LYS  43           HA       LYS  43  -6.715  -2.176   5.140
  318   1HB   LYS  43          2HB       LYS  43  -6.068   0.709   4.486
  319   2HB   LYS  43          1HB       LYS  43  -7.518   0.122   5.296
  320   1HG   LYS  43          2HG       LYS  43  -4.752  -0.421   6.389
  321   2HG   LYS  43          1HG       LYS  43  -5.646   1.040   6.801
  322   1HD   LYS  43          2HD       LYS  43  -7.584  -0.713   7.315
  323   2HD   LYS  43          1HD       LYS  43  -6.214  -1.801   7.542
  324   1HE   LYS  43          2HE       LYS  43  -6.300   0.915   8.860
  325   2HE   LYS  43          1HE       LYS  43  -7.044  -0.496   9.612
  326   1HZ   LYS  43          1HZ       LYS  43  -4.751  -0.145  10.348
  327   2HZ   LYS  43          2HZ       LYS  43  -4.205  -0.324   8.749
  328   3HZ   LYS  43          3HZ       LYS  43  -4.935  -1.632   9.553
  329    H    VAL  44           H        VAL  44  -5.344  -0.680   2.226
  330    HA   VAL  44           HA       VAL  44  -7.822  -0.537   0.808
  331    HB   VAL  44           HB       VAL  44  -6.404  -0.230  -1.219
  332   1HG1  VAL  44          1HG1      VAL  44  -5.969   1.382   1.279
  333   2HG1  VAL  44          2HG1      VAL  44  -6.910   1.789  -0.156
  334   3HG1  VAL  44          3HG1      VAL  44  -5.149   1.828  -0.217
  335   1HG2  VAL  44          1HG2      VAL  44  -4.016  -0.206  -1.073
  336   2HG2  VAL  44          2HG2      VAL  44  -4.532  -1.723  -0.339
  337   3HG2  VAL  44          3HG2      VAL  44  -4.056  -0.365   0.681
  338    H    MET  45           H        MET  45  -5.345  -3.005   1.194
  339    HA   MET  45           HA       MET  45  -6.102  -4.715  -0.920
  340   1HB   MET  45          2HB       MET  45  -4.990  -5.593   1.756
  341   2HB   MET  45          1HB       MET  45  -4.897  -6.460   0.225
  342   1HG   MET  45          2HG       MET  45  -3.788  -3.703   0.228
  343   2HG   MET  45          1HG       MET  45  -2.888  -4.904   1.152
  344   1HE   MET  45          1HE       MET  45  -3.763  -4.542  -3.246
  345   2HE   MET  45          2HE       MET  45  -4.627  -3.892  -1.851
  346   3HE   MET  45          3HE       MET  45  -4.967  -5.530  -2.405
  347    H    ARG  46           H        ARG  46  -7.357  -4.281   2.337
  348    HA   ARG  46           HA       ARG  46  -8.929  -6.613   2.530
  349   1HB   ARG  46          2HB       ARG  46  -9.033  -3.909   3.812
  350   2HB   ARG  46          1HB       ARG  46 -10.405  -4.998   4.009
  351   1HG   ARG  46          2HG       ARG  46  -8.318  -6.698   4.493
  352   2HG   ARG  46          1HG       ARG  46  -7.676  -5.184   5.130
  353   1HD   ARG  46          2HD       ARG  46 -10.312  -5.232   6.036
  354   2HD   ARG  46          1HD       ARG  46  -9.781  -6.901   6.199
  355    HE   ARG  46           HE       ARG  46  -7.732  -5.394   7.272
  356   1HH1  ARG  46          2HH1      ARG  46 -11.162  -5.748   7.829
  357   2HH1  ARG  46          1HH1      ARG  46 -11.054  -5.368   9.514
  358   1HH2  ARG  46          1HH2      ARG  46  -7.615  -4.898   9.483
  359   2HH2  ARG  46          2HH2      ARG  46  -9.054  -4.889  10.448
  360    H    MET  47           H        MET  47  -9.624  -3.434   1.113
  361    HA   MET  47           HA       MET  47 -12.351  -4.155   0.427
  362   1HB   MET  47          2HB       MET  47 -10.625  -1.737  -0.047
  363   2HB   MET  47          1HB       MET  47 -12.161  -1.931  -0.892
  364   1HG   MET  47          2HG       MET  47 -13.409  -1.686   1.025
  365   2HG   MET  47          1HG       MET  47 -12.168  -2.403   2.051
  366   1HE   MET  47          1HE       MET  47 -12.577  -0.390   3.925
  367   2HE   MET  47          2HE       MET  47 -13.900  -0.112   2.795
  368   3HE   MET  47          3HE       MET  47 -12.917   1.244   3.339
  369    H    LEU  48           H        LEU  48  -9.228  -3.891  -1.222
  370    HA   LEU  48           HA       LEU  48 -10.187  -4.190  -3.876
  371   1HB   LEU  48          2HB       LEU  48  -7.668  -3.950  -2.577
  372   2HB   LEU  48          1HB       LEU  48  -7.597  -5.361  -3.610
  373    HG   LEU  48           HG       LEU  48  -8.386  -2.584  -4.525
  374   1HD1  LEU  48          1HD1      LEU  48  -6.170  -2.568  -5.604
  375   2HD1  LEU  48          2HD1      LEU  48  -5.808  -4.143  -4.899
  376   3HD1  LEU  48          3HD1      LEU  48  -6.009  -2.734  -3.856
  377   1HD2  LEU  48          1HD2      LEU  48  -9.338  -4.557  -5.786
  378   2HD2  LEU  48          2HD2      LEU  48  -7.682  -5.058  -6.132
  379   3HD2  LEU  48          3HD2      LEU  48  -8.287  -3.522  -6.753
  380    H    GLY  49           H        GLY  49  -8.650  -6.569  -1.699
  381   1HA   GLY  49          2HA       GLY  49 -10.081  -8.735  -1.643
  382   2HA   GLY  49          1HA       GLY  49  -9.711  -8.760  -3.366
  383    H    GLN  50           H        GLN  50  -7.835  -8.048  -0.419
  384    HA   GLN  50           HA       GLN  50  -6.080 -10.331  -0.836
  385   1HB   GLN  50          2HB       GLN  50  -5.311  -7.565  -1.572
  386   2HB   GLN  50          1HB       GLN  50  -4.140  -8.445  -0.591
  387   1HG   GLN  50          2HG       GLN  50  -3.680  -9.952  -2.250
  388   2HG   GLN  50          1HG       GLN  50  -5.337  -9.957  -2.848
  389   1HE2  GLN  50          1HE2      GLN  50  -2.195  -8.418  -3.180
  390   2HE2  GLN  50          2HE2      GLN  50  -2.619  -7.410  -4.477
  391    H    ASN  51           H        ASN  51  -4.440 -10.483   0.923
  392    HA   ASN  51           HA       ASN  51  -4.926  -8.845   3.288
  393   1HB   ASN  51          2HB       ASN  51  -6.576 -10.887   3.184
  394   2HB   ASN  51          1HB       ASN  51  -5.158 -11.811   3.676
  395   1HD2  ASN  51          1HD2      ASN  51  -7.760 -10.771   5.141
  396   2HD2  ASN  51          2HD2      ASN  51  -7.136 -10.135   6.585
  397    HA   PRO  52           HA       PRO  52  -0.576 -10.369   2.916
  398   1HB   PRO  52          2HB       PRO  52   0.587  -7.901   2.766
  399   2HB   PRO  52          1HB       PRO  52  -0.001  -8.786   1.355
  400   1HG   PRO  52          2HG       PRO  52  -1.145  -6.424   2.702
  401   2HG   PRO  52          1HG       PRO  52  -1.331  -6.964   1.027
  402   1HD   PRO  52          2HD       PRO  52  -3.218  -7.282   3.139
  403   2HD   PRO  52          1HD       PRO  52  -3.303  -8.008   1.516
  404    H    THR  53           H        THR  53   1.421  -9.138   4.177
  405    HA   THR  53           HA       THR  53   0.501  -8.856   6.972
  406    HB   THR  53           HB       THR  53   2.630  -9.662   7.664
  407    HG1  THR  53           HG1      THR  53   4.311  -9.944   6.096
  408   1HG2  THR  53          1HG2      THR  53   1.711 -11.104   5.177
  409   2HG2  THR  53          2HG2      THR  53   1.303 -11.483   6.853
  410   3HG2  THR  53          3HG2      THR  53   2.946 -11.743   6.263
  411    HA   PRO  54           HA       PRO  54   1.917  -4.693   7.132
  412   1HB   PRO  54          2HB       PRO  54   3.313  -4.576   9.490
  413   2HB   PRO  54          1HB       PRO  54   1.547  -4.627   9.384
  414   1HG   PRO  54          2HG       PRO  54   3.465  -6.798  10.082
  415   2HG   PRO  54          1HG       PRO  54   1.825  -6.509  10.681
  416   1HD   PRO  54          2HD       PRO  54   2.472  -8.413   8.773
  417   2HD   PRO  54          1HD       PRO  54   0.854  -7.695   8.960
  418    H    GLU  55           H        GLU  55   4.384  -7.156   7.544
  419    HA   GLU  55           HA       GLU  55   6.576  -5.332   6.969
  420   1HB   GLU  55          2HB       GLU  55   7.983  -7.376   7.002
  421   2HB   GLU  55          1HB       GLU  55   7.033  -7.188   8.472
  422   1HG   GLU  55          2HG       GLU  55   5.418  -8.828   7.707
  423   2HG   GLU  55          1HG       GLU  55   6.194  -8.917   6.127
  424    H    GLU  56           H        GLU  56   4.579  -7.677   5.263
  425    HA   GLU  56           HA       GLU  56   6.184  -7.808   2.898
  426   1HB   GLU  56          2HB       GLU  56   3.396  -8.639   3.616
  427   2HB   GLU  56          1HB       GLU  56   3.872  -8.587   1.918
  428   1HG   GLU  56          2HG       GLU  56   5.908  -9.974   2.572
  429   2HG   GLU  56          1HG       GLU  56   5.132 -10.210   4.139
  430    H    LEU  57           H        LEU  57   3.063  -6.148   3.577
  431    HA   LEU  57           HA       LEU  57   2.891  -4.788   1.136
  432   1HB   LEU  57          2HB       LEU  57   1.360  -3.258   2.241
  433   2HB   LEU  57          1HB       LEU  57   1.012  -4.918   2.660
  434    HG   LEU  57           HG       LEU  57   2.574  -4.256   4.761
  435   1HD1  LEU  57          1HD1      LEU  57   1.013  -1.720   4.368
  436   2HD1  LEU  57          2HD1      LEU  57   2.611  -1.866   3.639
  437   3HD1  LEU  57          3HD1      LEU  57   2.424  -2.014   5.384
  438   1HD2  LEU  57          1HD2      LEU  57   0.506  -3.981   6.003
  439   2HD2  LEU  57          2HD2      LEU  57   0.227  -5.168   4.729
  440   3HD2  LEU  57          3HD2      LEU  57  -0.359  -3.515   4.539
  441    H    GLN  58           H        GLN  58   4.555  -3.894   4.128
  442    HA   GLN  58           HA       GLN  58   5.202  -1.238   3.524
  443   1HB   GLN  58          2HB       GLN  58   5.582  -2.500   5.722
  444   2HB   GLN  58          1HB       GLN  58   7.073  -3.091   4.991
  445   1HG   GLN  58          2HG       GLN  58   7.669  -1.116   6.208
  446   2HG   GLN  58          1HG       GLN  58   7.656  -0.656   4.507
  447   1HE2  GLN  58          1HE2      GLN  58   5.853   0.694   3.742
  448   2HE2  GLN  58          2HE2      GLN  58   4.855   1.514   4.844
  449    H    GLU  59           H        GLU  59   6.972  -4.234   2.777
  450    HA   GLU  59           HA       GLU  59   9.222  -3.038   1.566
  451   1HB   GLU  59          2HB       GLU  59   7.939  -5.747   1.202
  452   2HB   GLU  59          1HB       GLU  59   9.421  -5.278   0.368
  453   1HG   GLU  59          2HG       GLU  59  10.582  -4.943   2.450
  454   2HG   GLU  59          1HG       GLU  59   9.091  -5.115   3.375
  455    H    MET  60           H        MET  60   6.117  -4.114   0.197
  456    HA   MET  60           HA       MET  60   6.734  -3.635  -2.522
  457   1HB   MET  60          2HB       MET  60   4.158  -3.808  -0.979
  458   2HB   MET  60          1HB       MET  60   4.155  -3.354  -2.684
  459   1HG   MET  60          2HG       MET  60   5.550  -5.439  -3.118
  460   2HG   MET  60          1HG       MET  60   5.193  -5.919  -1.459
  461   1HE   MET  60          1HE       MET  60   4.535  -8.005  -2.784
  462   2HE   MET  60          2HE       MET  60   2.814  -8.349  -2.944
  463   3HE   MET  60          3HE       MET  60   3.469  -7.876  -1.378
  464    H    ILE  61           H        ILE  61   5.233  -1.572  -0.040
  465    HA   ILE  61           HA       ILE  61   4.607   0.646  -1.625
  466    HB   ILE  61           HB       ILE  61   5.442   0.470   1.275
  467   1HG1  ILE  61          2HG1      ILE  61   2.680   1.115   0.403
  468   2HG1  ILE  61          1HG1      ILE  61   3.226  -0.533   0.098
  469   1HG2  ILE  61          1HG2      ILE  61   5.832   2.719   0.766
  470   2HG2  ILE  61          2HG2      ILE  61   4.156   2.730   1.319
  471   3HG2  ILE  61          3HG2      ILE  61   4.516   2.788  -0.407
  472   1HD1  ILE  61          1HD1      ILE  61   2.183  -0.383   2.313
  473   2HD1  ILE  61          2HD1      ILE  61   3.314   0.892   2.768
  474   3HD1  ILE  61          3HD1      ILE  61   3.902  -0.740   2.460
  475    H    ASP  62           H        ASP  62   7.378   0.517   0.616
  476    HA   ASP  62           HA       ASP  62   8.797   2.687  -0.301
  477   1HB   ASP  62          2HB       ASP  62   9.743   0.078   0.876
  478   2HB   ASP  62          1HB       ASP  62  10.867   1.375   0.472
  479    H    GLU  63           H        GLU  63   8.744  -0.580  -1.680
  480    HA   GLU  63           HA       GLU  63  10.911  -0.331  -3.468
  481   1HB   GLU  63          2HB       GLU  63   8.485  -2.066  -3.314
  482   2HB   GLU  63          1HB       GLU  63   9.371  -2.015  -4.838
  483   1HG   GLU  63          2HG       GLU  63  11.454  -2.594  -3.643
  484   2HG   GLU  63          1HG       GLU  63  10.563  -2.656  -2.124
  485    H    VAL  64           H        VAL  64   7.419   0.204  -4.005
  486    HA   VAL  64           HA       VAL  64   7.834   1.214  -6.676
  487    HB   VAL  64           HB       VAL  64   5.444   1.640  -6.704
  488   1HG1  VAL  64          1HG1      VAL  64   4.759  -0.588  -6.627
  489   2HG1  VAL  64          2HG1      VAL  64   5.708  -0.936  -5.183
  490   3HG1  VAL  64          3HG1      VAL  64   6.509  -0.759  -6.744
  491   1HG2  VAL  64          1HG2      VAL  64   5.406   0.817  -3.789
  492   2HG2  VAL  64          2HG2      VAL  64   4.050   1.396  -4.753
  493   3HG2  VAL  64          3HG2      VAL  64   5.358   2.497  -4.324
  494    H    ASP  65           H        ASP  65   7.827   2.632  -3.510
  495    HA   ASP  65           HA       ASP  65   7.001   5.258  -4.212
  496   1HB   ASP  65          2HB       ASP  65   7.566   4.003  -1.845
  497   2HB   ASP  65          1HB       ASP  65   8.979   5.039  -2.035
  498    H    GLU  66           H        GLU  66   8.030   5.820  -6.112
  499    HA   GLU  66           HA       GLU  66  10.847   5.710  -6.522
  500   1HB   GLU  66          2HB       GLU  66   8.576   7.114  -7.891
  501   2HB   GLU  66          1HB       GLU  66  10.241   7.509  -8.322
  502   1HG   GLU  66          2HG       GLU  66  10.615   4.989  -8.594
  503   2HG   GLU  66          1HG       GLU  66   8.861   4.823  -8.511
  504    H    ASP  67           H        ASP  67   8.677   8.268  -5.382
  505    HA   ASP  67           HA       ASP  67  10.810  10.222  -5.207
  506   1HB   ASP  67          2HB       ASP  67   8.995  11.563  -3.962
  507   2HB   ASP  67          1HB       ASP  67   8.728  11.215  -5.669
  508    H    GLY  68           H        GLY  68   8.952   8.234  -2.913
  509   1HA   GLY  68          2HA       GLY  68   9.525   7.509  -0.788
  510   2HA   GLY  68          1HA       GLY  68  11.103   8.267  -1.001
  511    H    SER  69           H        SER  69   7.757   9.500  -0.998
  512    HA   SER  69           HA       SER  69   8.593  11.742   0.689
  513   1HB   SER  69          2HB       SER  69   6.324  12.636   0.182
  514   2HB   SER  69          1HB       SER  69   7.273  12.308  -1.266
  515    HG   SER  69           HG       SER  69   5.115  11.492  -1.382
  516    H    GLY  70           H        GLY  70   6.122   9.183   0.646
  517   1HA   GLY  70          2HA       GLY  70   6.079   8.162   3.078
  518   2HA   GLY  70          1HA       GLY  70   5.407   9.751   3.435
  519    H    THR  71           H        THR  71   4.095   9.924   0.789
  520    HA   THR  71           HA       THR  71   1.788   8.184   1.376
  521    HB   THR  71           HB       THR  71   0.433   9.772   0.161
  522    HG1  THR  71           HG1      THR  71   2.812  11.238  -0.326
  523   1HG2  THR  71          1HG2      THR  71   2.388  11.129   2.033
  524   2HG2  THR  71          2HG2      THR  71   0.859  10.367   2.472
  525   3HG2  THR  71          3HG2      THR  71   0.864  11.840   1.503
  526    H    VAL  72           H        VAL  72   0.741   7.068  -0.317
  527    HA   VAL  72           HA       VAL  72   2.530   6.430  -2.575
  528    HB   VAL  72           HB       VAL  72   0.086   4.894  -1.674
  529   1HG1  VAL  72          1HG1      VAL  72   0.935   4.541  -4.006
  530   2HG1  VAL  72          2HG1      VAL  72   1.050   3.098  -3.000
  531   3HG1  VAL  72          3HG1      VAL  72   2.490   4.063  -3.325
  532   1HG2  VAL  72          1HG2      VAL  72   1.603   4.859   0.189
  533   2HG2  VAL  72          2HG2      VAL  72   2.995   4.634  -0.870
  534   3HG2  VAL  72          3HG2      VAL  72   1.824   3.332  -0.665
  535    H    ASP  73           H        ASP  73   2.085   7.318  -4.461
  536    HA   ASP  73           HA       ASP  73  -0.503   8.547  -4.980
  537   1HB   ASP  73          2HB       ASP  73   2.069   8.395  -6.567
  538   2HB   ASP  73          1HB       ASP  73   0.605   9.145  -7.190
  539    H    PHE  74           H        PHE  74  -1.173   8.185  -7.469
  540    HA   PHE  74           HA       PHE  74  -2.074   5.468  -7.602
  541   1HB   PHE  74          2HB       PHE  74  -3.212   7.604  -8.560
  542   2HB   PHE  74          1HB       PHE  74  -2.164   7.338  -9.954
  543    HD1  PHE  74           HD1      PHE  74  -3.387   6.358 -11.677
  544    HD2  PHE  74           HD2      PHE  74  -3.969   4.996  -7.649
  545    HE1  PHE  74           HE1      PHE  74  -4.929   4.594 -12.495
  546    HE2  PHE  74           HE2      PHE  74  -5.515   3.237  -8.463
  547    HZ   PHE  74           HZ       PHE  74  -5.996   3.034 -10.888
  548    H    ASP  75           H        ASP  75   0.585   7.266  -9.037
  549    HA   ASP  75           HA       ASP  75   1.262   5.390 -11.071
  550   1HB   ASP  75          2HB       ASP  75   2.582   7.716  -9.777
  551   2HB   ASP  75          1HB       ASP  75   3.652   6.522 -10.510
  552    H    GLU  76           H        GLU  76   2.131   5.776  -7.675
  553    HA   GLU  76           HA       GLU  76   4.015   3.578  -7.650
  554   1HB   GLU  76          2HB       GLU  76   2.707   4.835  -5.232
  555   2HB   GLU  76          1HB       GLU  76   4.271   4.025  -5.328
  556   1HG   GLU  76          2HG       GLU  76   5.210   5.822  -6.628
  557   2HG   GLU  76          1HG       GLU  76   3.626   6.569  -6.840
  558    H    PHE  77           H        PHE  77   0.611   4.083  -7.091
  559    HA   PHE  77           HA       PHE  77   0.086   1.638  -5.686
  560   1HB   PHE  77          2HB       PHE  77  -1.365   3.704  -5.652
  561   2HB   PHE  77          1HB       PHE  77  -1.853   3.312  -7.299
  562    HD1  PHE  77           HD1      PHE  77  -3.697   1.944  -7.640
  563    HD2  PHE  77           HD2      PHE  77  -1.610   1.747  -3.889
  564    HE1  PHE  77           HE1      PHE  77  -5.411   0.375  -6.768
  565    HE2  PHE  77           HE2      PHE  77  -3.322   0.179  -3.019
  566    HZ   PHE  77           HZ       PHE  77  -5.223  -0.506  -4.458
  567    H    LEU  78           H        LEU  78   0.011   2.645  -9.082
  568    HA   LEU  78           HA       LEU  78  -1.119   0.175 -10.045
  569   1HB   LEU  78          2HB       LEU  78   0.172   2.525 -11.412
  570   2HB   LEU  78          1HB       LEU  78  -0.391   1.119 -12.289
  571    HG   LEU  78           HG       LEU  78  -1.940   3.324 -11.020
  572   1HD1  LEU  78          1HD1      LEU  78  -2.857   1.636 -13.308
  573   2HD1  LEU  78          2HD1      LEU  78  -1.455   2.674 -13.563
  574   3HD1  LEU  78          3HD1      LEU  78  -2.994   3.379 -13.071
  575   1HD2  LEU  78          1HD2      LEU  78  -2.819   0.429 -11.104
  576   2HD2  LEU  78          2HD2      LEU  78  -3.971   1.763 -11.068
  577   3HD2  LEU  78          3HD2      LEU  78  -2.846   1.534  -9.728
  578    H    VAL  79           H        VAL  79   2.154   1.598  -9.987
  579    HA   VAL  79           HA       VAL  79   3.446  -0.397 -11.494
  580    HB   VAL  79           HB       VAL  79   5.530   0.300 -10.304
  581   1HG1  VAL  79          1HG1      VAL  79   3.656   2.193 -11.664
  582   2HG1  VAL  79          2HG1      VAL  79   5.208   1.564 -12.216
  583   3HG1  VAL  79          3HG1      VAL  79   5.157   2.835 -10.995
  584   1HG2  VAL  79          1HG2      VAL  79   5.288   2.336  -8.824
  585   2HG2  VAL  79          2HG2      VAL  79   4.692   0.834  -8.121
  586   3HG2  VAL  79          3HG2      VAL  79   3.558   2.008  -8.778
  587    H    MET  80           H        MET  80   2.411  -0.391  -8.162
  588    HA   MET  80           HA       MET  80   3.986  -2.279  -6.941
  589   1HB   MET  80          2HB       MET  80   1.159  -1.458  -6.685
  590   2HB   MET  80          1HB       MET  80   1.547  -3.044  -6.018
  591   1HG   MET  80          2HG       MET  80   3.284  -2.105  -4.622
  592   2HG   MET  80          1HG       MET  80   3.118  -0.529  -5.396
  593   1HE   MET  80          1HE       MET  80   2.541  -0.735  -1.861
  594   2HE   MET  80          2HE       MET  80   1.881   0.808  -2.399
  595   3HE   MET  80          3HE       MET  80   3.304   0.141  -3.195
  596    H    MET  81           H        MET  81   1.484  -2.856  -9.374
  597    HA   MET  81           HA       MET  81   1.584  -5.734  -9.077
  598   1HB   MET  81          2HB       MET  81   0.198  -3.863 -10.981
  599   2HB   MET  81          1HB       MET  81   0.236  -5.599 -11.285
  600   1HG   MET  81          2HG       MET  81  -0.581  -4.591  -8.573
  601   2HG   MET  81          1HG       MET  81  -1.747  -4.571  -9.896
  602   1HE   MET  81          1HE       MET  81  -2.171  -6.660 -11.447
  603   2HE   MET  81          2HE       MET  81  -3.329  -6.344 -10.157
  604   3HE   MET  81          3HE       MET  81  -2.833  -8.000 -10.500
  605    H    VAL  82           H        VAL  82   2.754  -3.381 -11.506
  606    HA   VAL  82           HA       VAL  82   3.938  -5.417 -13.159
  607    HB   VAL  82           HB       VAL  82   4.807  -3.603 -14.502
  608   1HG1  VAL  82          1HG1      VAL  82   2.155  -2.522 -13.639
  609   2HG1  VAL  82          2HG1      VAL  82   2.227  -4.170 -14.262
  610   3HG1  VAL  82          3HG1      VAL  82   2.770  -2.824 -15.265
  611   1HG2  VAL  82          1HG2      VAL  82   4.504  -2.125 -11.979
  612   2HG2  VAL  82          2HG2      VAL  82   3.921  -1.243 -13.388
  613   3HG2  VAL  82          3HG2      VAL  82   5.586  -1.823 -13.335
  614    H    ARG  83           H        ARG  83   5.102  -3.493 -10.467
  615    HA   ARG  83           HA       ARG  83   7.874  -3.622 -11.002
  616   1HB   ARG  83          2HB       ARG  83   8.210  -3.149  -8.627
  617   2HB   ARG  83          1HB       ARG  83   6.930  -2.131  -9.281
  618   1HG   ARG  83          2HG       ARG  83   5.339  -3.077  -7.965
  619   2HG   ARG  83          1HG       ARG  83   5.976  -4.702  -8.198
  620   1HD   ARG  83          2HD       ARG  83   7.950  -3.455  -6.695
  621   2HD   ARG  83          1HD       ARG  83   6.461  -2.803  -6.025
  622    HE   ARG  83           HE       ARG  83   5.901  -4.939  -5.250
  623   1HH1  ARG  83          2HH1      ARG  83   8.721  -5.053  -7.313
  624   2HH1  ARG  83          1HH1      ARG  83   9.124  -6.677  -6.879
  625   1HH2  ARG  83          1HH2      ARG  83   6.450  -7.067  -4.703
  626   2HH2  ARG  83          2HH2      ARG  83   7.843  -7.815  -5.407
  627    H    CYS  84           H        CYS  84   5.649  -6.031  -9.858
  628    HA   CYS  84           HA       CYS  84   7.537  -7.752  -8.585
  629   1HB   CYS  84          2HB       CYS  84   4.909  -7.747  -8.501
  630   2HB   CYS  84          1HB       CYS  84   5.063  -8.815  -9.896
  631    HG   CYS  84           HG       CYS  84   6.609 -10.371  -8.346
  632    H    MET  85           H        MET  85   6.849  -7.079 -11.916
  633    HA   MET  85           HA       MET  85   7.607  -9.598 -13.017
  634   1HB   MET  85          2HB       MET  85   7.455  -8.580 -15.113
  635   2HB   MET  85          1HB       MET  85   6.337  -7.629 -14.141
  636   1HG   MET  85          2HG       MET  85   7.523  -5.898 -15.091
  637   2HG   MET  85          1HG       MET  85   8.564  -6.192 -13.700
  638   1HE   MET  85          1HE       MET  85   9.138  -7.036 -18.089
  639   2HE   MET  85          2HE       MET  85   7.665  -6.704 -17.183
  640   3HE   MET  85          3HE       MET  85   8.283  -8.351 -17.272
  641    H    LYS  86           H        LYS  86   9.421  -6.835 -11.870
  642    HA   LYS  86           HA       LYS  86  11.867  -7.382 -13.226
  643   1HB   LYS  86          2HB       LYS  86  10.906  -5.436 -11.384
  644   2HB   LYS  86          1HB       LYS  86  12.372  -6.135 -10.701
  645   1HG   LYS  86          2HG       LYS  86  13.700  -5.232 -12.309
  646   2HG   LYS  86          1HG       LYS  86  12.538  -5.573 -13.591
  647   1HD   LYS  86          2HD       LYS  86  12.635  -3.195 -13.434
  648   2HD   LYS  86          1HD       LYS  86  11.133  -3.661 -12.636
  649   1HE   LYS  86          2HE       LYS  86  13.381  -3.680 -10.779
  650   2HE   LYS  86          1HE       LYS  86  13.174  -2.099 -11.533
  651   1HZ   LYS  86          1HZ       LYS  86  11.010  -3.654 -10.218
  652   2HZ   LYS  86          2HZ       LYS  86  10.870  -2.094 -10.877
  653   3HZ   LYS  86          3HZ       LYS  86  11.844  -2.358  -9.510
  654    H    ASP  87           H        ASP  87  13.741  -8.375 -12.488
  655    HA   ASP  87           HA       ASP  87  13.382 -10.253 -10.224
  656   1HB   ASP  87          2HB       ASP  87  14.992 -11.747 -11.441
  657   2HB   ASP  87          1HB       ASP  87  13.457 -11.524 -12.275
  658    H    ASP  88           H        ASP  88  14.370  -7.612  -9.896
  659    HA   ASP  88           HA       ASP  88  16.094  -6.449  -8.926
  660   1HB   ASP  88          2HB       ASP  88  15.949  -8.720  -7.539
  661   2HB   ASP  88          1HB       ASP  88  17.547  -8.968  -8.244
  662    H    SER  89           HN       SER  89  16.301  -6.795 -11.673
  663    HA   SER  89           HA       SER  89  19.176  -6.515 -12.036
  664   1HB   SER  89          2HB       SER  89  18.329  -9.011 -12.435
  665   2HB   SER  89          1HB       SER  89  17.863  -8.342 -13.996
  666    HG   SER  89           HG       SER  89  19.916  -8.021 -14.483
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  13.602   2.541 -16.649
    2   2H    MET   1          2H        MET   1  13.423   2.035 -18.262
    3   3H    MET   1          3H        MET   1  14.457   3.328 -17.885
    4    HA   MET   1           HA       MET   1  15.980   1.659 -18.134
    5   1HB   MET   1          2HB       MET   1  15.064   1.852 -15.278
    6   2HB   MET   1          1HB       MET   1  16.350   0.721 -15.704
    7   1HG   MET   1          2HG       MET   1  17.524   2.655 -16.855
    8   2HG   MET   1          1HG       MET   1  16.326   3.720 -16.119
    9   1HE   MET   1          1HE       MET   1  19.517   2.994 -16.139
   10   2HE   MET   1          2HE       MET   1  19.528   1.399 -15.392
   11   3HE   MET   1          3HE       MET   1  20.199   2.776 -14.522
   12    H    ASN   2           H        ASN   2  13.278   0.327 -16.193
   13    HA   ASN   2           HA       ASN   2  13.867  -2.359 -17.236
   14   1HB   ASN   2          2HB       ASN   2  12.979  -1.443 -14.741
   15   2HB   ASN   2          1HB       ASN   2  11.567  -2.206 -15.471
   16   1HD2  ASN   2          1HD2      ASN   2  15.121  -2.908 -15.296
   17   2HD2  ASN   2          2HD2      ASN   2  14.914  -4.556 -14.950
   18    H    ASP   3           H        ASP   3  12.539  -3.463 -18.588
   19    HA   ASP   3           HA       ASP   3  10.340  -1.932 -19.805
   20   1HB   ASP   3          2HB       ASP   3  12.357  -3.205 -21.035
   21   2HB   ASP   3          1HB       ASP   3  11.196  -4.530 -20.963
   22    H    ILE   4           H        ILE   4  10.535  -4.028 -17.302
   23    HA   ILE   4           HA       ILE   4   8.555  -5.980 -17.981
   24    HB   ILE   4           HB       ILE   4   8.441  -6.472 -15.599
   25   1HG1  ILE   4          2HG1      ILE   4  10.134  -5.011 -14.168
   26   2HG1  ILE   4          1HG1      ILE   4   9.752  -3.783 -15.375
   27   1HG2  ILE   4          1HG2      ILE   4  10.872  -6.898 -15.192
   28   2HG2  ILE   4          2HG2      ILE   4  11.242  -5.893 -16.592
   29   3HG2  ILE   4          3HG2      ILE   4  10.336  -7.392 -16.798
   30   1HD1  ILE   4          1HD1      ILE   4   7.430  -5.252 -14.269
   31   2HD1  ILE   4          2HD1      ILE   4   7.609  -3.537 -14.633
   32   3HD1  ILE   4          3HD1      ILE   4   8.271  -4.195 -13.136
   33    H    TYR   5           H        TYR   5   8.449  -2.685 -16.897
   34    HA   TYR   5           HA       TYR   5   5.754  -2.687 -15.924
   35   1HB   TYR   5          2HB       TYR   5   7.530  -0.418 -16.862
   36   2HB   TYR   5          1HB       TYR   5   5.981  -0.217 -16.039
   37    HD1  TYR   5           HD1      TYR   5   9.513  -0.849 -15.627
   38    HD2  TYR   5           HD2      TYR   5   5.682  -1.253 -13.741
   39    HE1  TYR   5           HE1      TYR   5  10.629  -1.155 -13.435
   40    HE2  TYR   5           HE2      TYR   5   6.788  -1.547 -11.542
   41    HH   TYR   5           HH       TYR   5   9.329  -2.469 -10.878
   42    H    LYS   6           H        LYS   6   7.299  -2.193 -19.025
   43    HA   LYS   6           HA       LYS   6   4.962  -1.123 -20.341
   44   1HB   LYS   6          2HB       LYS   6   7.307  -2.443 -21.714
   45   2HB   LYS   6          1HB       LYS   6   6.230  -1.201 -22.350
   46   1HG   LYS   6          2HG       LYS   6   8.384  -0.907 -20.247
   47   2HG   LYS   6          1HG       LYS   6   8.227  -0.041 -21.776
   48   1HD   LYS   6          2HD       LYS   6   6.479   1.309 -20.981
   49   2HD   LYS   6          1HD       LYS   6   6.067   0.179 -19.691
   50   1HE   LYS   6          2HE       LYS   6   7.174   1.900 -18.538
   51   2HE   LYS   6          1HE       LYS   6   8.447   0.704 -18.776
   52   1HZ   LYS   6          1HZ       LYS   6   8.020   2.801 -20.800
   53   2HZ   LYS   6          2HZ       LYS   6   9.439   1.950 -20.415
   54   3HZ   LYS   6          3HZ       LYS   6   8.871   3.172 -19.380
   55    H    ALA   7           H        ALA   7   6.529  -4.263 -20.051
   56    HA   ALA   7           HA       ALA   7   4.683  -5.637 -21.787
   57   1HB   ALA   7          1HB       ALA   7   6.787  -6.679 -21.603
   58   2HB   ALA   7          2HB       ALA   7   5.729  -7.687 -20.615
   59   3HB   ALA   7          3HB       ALA   7   6.807  -6.523 -19.846
   60    H    ALA   8           H        ALA   8   4.778  -4.794 -18.397
   61    HA   ALA   8           HA       ALA   8   2.724  -6.705 -17.638
   62   1HB   ALA   8          1HB       ALA   8   4.050  -4.466 -16.094
   63   2HB   ALA   8          2HB       ALA   8   4.425  -6.188 -15.996
   64   3HB   ALA   8          3HB       ALA   8   2.871  -5.592 -15.419
   65    H    VAL   9           H        VAL   9   2.945  -3.235 -18.362
   66    HA   VAL   9           HA       VAL   9   0.419  -2.475 -17.368
   67    HB   VAL   9           HB       VAL   9   2.374  -1.003 -18.295
   68   1HG1  VAL   9          1HG1      VAL   9   2.096  -2.055 -20.622
   69   2HG1  VAL   9          2HG1      VAL   9   2.201  -0.296 -20.556
   70   3HG1  VAL   9          3HG1      VAL   9   0.634  -1.079 -20.764
   71   1HG2  VAL   9          1HG2      VAL   9  -0.508  -0.268 -18.886
   72   2HG2  VAL   9          2HG2      VAL   9   0.818   0.851 -18.566
   73   3HG2  VAL   9          3HG2      VAL   9   0.228  -0.208 -17.284
   74    H    GLU  10           H        GLU  10   1.356  -4.043 -20.371
   75    HA   GLU  10           HA       GLU  10  -1.152  -3.702 -21.716
   76   1HB   GLU  10          2HB       GLU  10   1.208  -5.532 -22.138
   77   2HB   GLU  10          1HB       GLU  10  -0.256  -5.673 -23.111
   78   1HG   GLU  10          2HG       GLU  10   0.003  -3.523 -24.041
   79   2HG   GLU  10          1HG       GLU  10   1.113  -3.009 -22.770
   80    H    GLN  11           H        GLN  11   0.048  -5.925 -19.308
   81    HA   GLN  11           HA       GLN  11  -1.951  -7.964 -19.797
   82   1HB   GLN  11          2HB       GLN  11  -0.205  -7.585 -17.353
   83   2HB   GLN  11          1HB       GLN  11  -1.074  -9.048 -17.817
   84   1HG   GLN  11          2HG       GLN  11   0.276  -9.122 -19.925
   85   2HG   GLN  11          1HG       GLN  11   1.204  -7.746 -19.334
   86   1HE2  GLN  11          1HE2      GLN  11   1.863  -8.247 -16.780
   87   2HE2  GLN  11          2HE2      GLN  11   2.622  -9.753 -16.591
   88    H    LEU  12           H        LEU  12  -1.633  -5.107 -17.798
   89    HA   LEU  12           HA       LEU  12  -3.634  -5.653 -15.886
   90   1HB   LEU  12          2HB       LEU  12  -3.028  -2.918 -16.983
   91   2HB   LEU  12          1HB       LEU  12  -3.647  -3.329 -15.402
   92    HG   LEU  12           HG       LEU  12  -0.837  -3.563 -16.448
   93   1HD1  LEU  12          1HD1      LEU  12  -0.531  -2.549 -14.058
   94   2HD1  LEU  12          2HD1      LEU  12  -2.262  -2.226 -14.159
   95   3HD1  LEU  12          3HD1      LEU  12  -1.162  -1.520 -15.344
   96   1HD2  LEU  12          1HD2      LEU  12  -0.490  -4.695 -14.092
   97   2HD2  LEU  12          2HD2      LEU  12  -0.971  -5.682 -15.472
   98   3HD2  LEU  12          3HD2      LEU  12  -2.176  -5.173 -14.289
   99    H    THR  13           H        THR  13  -5.766  -5.785 -16.046
  100    HA   THR  13           HA       THR  13  -7.061  -5.118 -18.584
  101    HB   THR  13           HB       THR  13  -9.084  -6.082 -17.077
  102    HG1  THR  13           HG1      THR  13  -7.818  -6.389 -15.247
  103   1HG2  THR  13          1HG2      THR  13  -8.570  -7.097 -19.143
  104   2HG2  THR  13          2HG2      THR  13  -8.310  -8.381 -17.962
  105   3HG2  THR  13          3HG2      THR  13  -6.933  -7.508 -18.634
  106    H    ASP  14           H        ASP  14  -9.281  -4.108 -18.445
  107    HA   ASP  14           HA       ASP  14  -9.076  -1.520 -17.263
  108   1HB   ASP  14          2HB       ASP  14 -11.376  -2.988 -18.568
  109   2HB   ASP  14          1HB       ASP  14 -11.517  -1.338 -17.959
  110    H    GLU  15           H        GLU  15 -10.574  -4.539 -16.323
  111    HA   GLU  15           HA       GLU  15 -12.244  -3.587 -14.247
  112   1HB   GLU  15          2HB       GLU  15 -12.368  -5.891 -13.532
  113   2HB   GLU  15          1HB       GLU  15 -12.385  -5.850 -15.292
  114   1HG   GLU  15          2HG       GLU  15  -9.807  -6.143 -15.097
  115   2HG   GLU  15          1HG       GLU  15 -10.152  -6.686 -13.455
  116    H    GLN  16           H        GLN  16  -8.868  -4.698 -14.288
  117    HA   GLN  16           HA       GLN  16  -8.465  -4.594 -11.480
  118   1HB   GLN  16          2HB       GLN  16  -6.240  -5.075 -11.895
  119   2HB   GLN  16          1HB       GLN  16  -6.980  -5.670 -13.376
  120   1HG   GLN  16          2HG       GLN  16  -5.384  -4.393 -14.383
  121   2HG   GLN  16          1HG       GLN  16  -6.508  -3.076 -14.072
  122   1HE2  GLN  16          1HE2      GLN  16  -3.589  -4.690 -12.782
  123   2HE2  GLN  16          2HE2      GLN  16  -3.084  -3.372 -11.839
  124    H    LYS  17           H        LYS  17  -8.229  -2.179 -14.033
  125    HA   LYS  17           HA       LYS  17  -7.053  -0.160 -12.331
  126   1HB   LYS  17          2HB       LYS  17  -7.987  -0.320 -15.147
  127   2HB   LYS  17          1HB       LYS  17  -8.040   1.272 -14.391
  128   1HG   LYS  17          2HG       LYS  17  -5.840   1.437 -14.884
  129   2HG   LYS  17          1HG       LYS  17  -5.571   0.262 -13.595
  130   1HD   LYS  17          2HD       LYS  17  -4.502  -0.709 -15.463
  131   2HD   LYS  17          1HD       LYS  17  -6.061  -1.529 -15.403
  132   1HE   LYS  17          2HE       LYS  17  -5.968  -0.936 -17.652
  133   2HE   LYS  17          1HE       LYS  17  -6.824   0.451 -16.979
  134   1HZ   LYS  17          1HZ       LYS  17  -4.754   1.656 -16.855
  135   2HZ   LYS  17          2HZ       LYS  17  -4.991   1.102 -18.443
  136   3HZ   LYS  17          3HZ       LYS  17  -3.888   0.311 -17.420
  137    H    ASN  18           H        ASN  18 -10.276  -1.155 -13.319
  138    HA   ASN  18           HA       ASN  18 -11.717   1.143 -12.501
  139   1HB   ASN  18          2HB       ASN  18 -12.348  -1.643 -13.230
  140   2HB   ASN  18          1HB       ASN  18 -13.470  -0.931 -12.070
  141   1HD2  ASN  18          1HD2      ASN  18 -12.796  -1.164 -15.388
  142   2HD2  ASN  18          2HD2      ASN  18 -13.716   0.161 -15.917
  143    H    GLU  19           H        GLU  19 -10.835  -1.859 -10.814
  144    HA   GLU  19           HA       GLU  19 -12.104  -1.180  -8.336
  145   1HB   GLU  19          2HB       GLU  19  -9.827  -3.117  -8.849
  146   2HB   GLU  19          1HB       GLU  19 -10.823  -3.045  -7.394
  147   1HG   GLU  19          2HG       GLU  19 -12.797  -3.673  -8.623
  148   2HG   GLU  19          1HG       GLU  19 -11.951  -3.511 -10.162
  149    H    PHE  20           H        PHE  20  -8.822  -0.925  -9.616
  150    HA   PHE  20           HA       PHE  20  -7.543  -0.005  -7.275
  151   1HB   PHE  20          2HB       PHE  20  -6.919   0.101 -10.201
  152   2HB   PHE  20          1HB       PHE  20  -5.966   1.086  -9.094
  153    HD1  PHE  20           HD1      PHE  20  -7.374  -1.938  -7.666
  154    HD2  PHE  20           HD2      PHE  20  -4.017  -0.357  -9.826
  155    HE1  PHE  20           HE1      PHE  20  -6.039  -3.922  -7.038
  156    HE2  PHE  20           HE2      PHE  20  -2.679  -2.335  -9.199
  157    HZ   PHE  20           HZ       PHE  20  -3.686  -4.127  -7.803
  158    H    LYS  21           H        LYS  21  -9.178   1.741  -9.897
  159    HA   LYS  21           HA       LYS  21  -8.474   4.352  -8.990
  160   1HB   LYS  21          2HB       LYS  21  -9.232   3.882 -11.308
  161   2HB   LYS  21          1HB       LYS  21 -10.842   3.519 -10.688
  162   1HG   LYS  21          2HG       LYS  21 -10.663   5.854 -11.539
  163   2HG   LYS  21          1HG       LYS  21 -11.060   5.798  -9.822
  164   1HD   LYS  21          2HD       LYS  21  -8.797   6.310  -9.195
  165   2HD   LYS  21          1HD       LYS  21  -8.224   6.088 -10.849
  166   1HE   LYS  21          2HE       LYS  21  -9.070   8.115 -11.563
  167   2HE   LYS  21          1HE       LYS  21 -10.380   8.104 -10.383
  168   1HZ   LYS  21          1HZ       LYS  21  -8.698   9.759  -9.845
  169   2HZ   LYS  21          2HZ       LYS  21  -7.508   8.549  -9.764
  170   3HZ   LYS  21          3HZ       LYS  21  -8.783   8.567  -8.641
  171    H    ALA  22           H        ALA  22 -11.276   2.240  -8.451
  172    HA   ALA  22           HA       ALA  22 -12.776   4.150  -6.942
  173   1HB   ALA  22          1HB       ALA  22 -14.213   2.291  -6.349
  174   2HB   ALA  22          2HB       ALA  22 -12.988   1.132  -6.864
  175   3HB   ALA  22          3HB       ALA  22 -13.787   2.158  -8.055
  176    H    ALA  23           H        ALA  23 -10.650   1.436  -6.050
  177    HA   ALA  23           HA       ALA  23 -10.949   1.682  -3.240
  178   1HB   ALA  23          1HB       ALA  23  -8.632   0.569  -4.841
  179   2HB   ALA  23          2HB       ALA  23 -10.016  -0.342  -4.239
  180   3HB   ALA  23          3HB       ALA  23  -8.862   0.358  -3.105
  181    H    PHE  24           H        PHE  24  -9.075   3.467  -5.564
  182    HA   PHE  24           HA       PHE  24  -7.285   4.629  -3.587
  183   1HB   PHE  24          2HB       PHE  24  -6.785   4.172  -6.104
  184   2HB   PHE  24          1HB       PHE  24  -7.675   5.666  -6.387
  185    HD1  PHE  24           HD1      PHE  24  -6.830   7.830  -5.512
  186    HD2  PHE  24           HD2      PHE  24  -4.625   4.172  -5.015
  187    HE1  PHE  24           HE1      PHE  24  -4.800   9.127  -4.935
  188    HE2  PHE  24           HE2      PHE  24  -2.599   5.476  -4.433
  189    HZ   PHE  24           HZ       PHE  24  -2.688   7.953  -4.393
  190    H    ASP  25           H        ASP  25  -9.844   5.807  -5.776
  191    HA   ASP  25           HA       ASP  25  -9.959   8.447  -4.900
  192   1HB   ASP  25          2HB       ASP  25 -11.201   7.153  -6.855
  193   2HB   ASP  25          1HB       ASP  25 -12.508   7.101  -5.672
  194    H    ILE  26           H        ILE  26 -11.677   5.604  -3.563
  195    HA   ILE  26           HA       ILE  26 -13.458   6.929  -1.877
  196    HB   ILE  26           HB       ILE  26 -13.338   4.905  -0.409
  197   1HG1  ILE  26          2HG1      ILE  26 -11.221   4.051  -2.413
  198   2HG1  ILE  26          1HG1      ILE  26 -10.927   4.431  -0.718
  199   1HG2  ILE  26          1HG2      ILE  26 -13.661   3.381  -2.693
  200   2HG2  ILE  26          2HG2      ILE  26 -13.944   5.020  -3.277
  201   3HG2  ILE  26          3HG2      ILE  26 -14.910   4.379  -1.949
  202   1HD1  ILE  26          1HD1      ILE  26 -12.545   2.142  -1.847
  203   2HD1  ILE  26          2HD1      ILE  26 -12.630   2.619  -0.151
  204   3HD1  ILE  26          3HD1      ILE  26 -11.106   2.052  -0.833
  205    H    PHE  27           H        PHE  27 -10.027   6.242  -1.391
  206    HA   PHE  27           HA       PHE  27 -10.027   7.330   1.307
  207   1HB   PHE  27          2HB       PHE  27  -7.912   6.209  -0.517
  208   2HB   PHE  27          1HB       PHE  27  -7.466   7.094   0.940
  209    HD1  PHE  27           HD1      PHE  27  -8.949   4.029  -0.395
  210    HD2  PHE  27           HD2      PHE  27  -8.124   6.257   3.181
  211    HE1  PHE  27           HE1      PHE  27  -9.396   2.004   0.965
  212    HE2  PHE  27           HE2      PHE  27  -8.570   4.234   4.543
  213    HZ   PHE  27           HZ       PHE  27  -9.207   2.108   3.436
  214    H    ILE  28           H        ILE  28  -9.295   8.388  -1.962
  215    HA   ILE  28           HA       ILE  28  -8.148  10.918  -1.016
  216    HB   ILE  28           HB       ILE  28  -8.614  10.110  -3.887
  217   1HG1  ILE  28          2HG1      ILE  28  -7.259   8.334  -3.219
  218   2HG1  ILE  28          1HG1      ILE  28  -6.069   9.532  -3.702
  219   1HG2  ILE  28          1HG2      ILE  28  -6.434  11.557  -4.017
  220   2HG2  ILE  28          2HG2      ILE  28  -6.977  12.175  -2.456
  221   3HG2  ILE  28          3HG2      ILE  28  -8.001  12.353  -3.880
  222   1HD1  ILE  28          1HD1      ILE  28  -5.249   8.818  -1.625
  223   2HD1  ILE  28          2HD1      ILE  28  -6.862   8.688  -0.925
  224   3HD1  ILE  28          3HD1      ILE  28  -6.147  10.277  -1.201
  225    H    GLN  29           H        GLN  29 -10.974  10.316  -0.510
  226    HA   GLN  29           HA       GLN  29 -12.611  11.768  -2.350
  227   1HB   GLN  29          2HB       GLN  29 -14.302  11.747  -0.497
  228   2HB   GLN  29          1HB       GLN  29 -13.681  10.151  -0.909
  229   1HG   GLN  29          2HG       GLN  29 -12.209  10.148   1.004
  230   2HG   GLN  29          1HG       GLN  29 -12.573  11.839   1.351
  231   1HE2  GLN  29          1HE2      GLN  29 -14.442  12.293   2.597
  232   2HE2  GLN  29          2HE2      GLN  29 -15.522  11.098   3.133
  233    H    ASP  30           H        ASP  30 -10.718  12.614   0.480
  234    HA   ASP  30           HA       ASP  30 -10.983  15.439  -0.158
  235   1HB   ASP  30          2HB       ASP  30 -12.769  14.455   1.670
  236   2HB   ASP  30          1HB       ASP  30 -11.438  14.952   2.714
  237    H    ALA  31           H        ALA  31  -8.782  13.717  -0.370
  238    HA   ALA  31           HA       ALA  31  -7.080  13.855   1.936
  239   1HB   ALA  31          1HB       ALA  31  -6.463  13.318  -0.978
  240   2HB   ALA  31          2HB       ALA  31  -6.708  12.115   0.288
  241   3HB   ALA  31          3HB       ALA  31  -5.291  13.166   0.332
  242    H    GLU  32           H        GLU  32  -5.201  15.118   2.211
  243    HA   GLU  32           HA       GLU  32  -5.490  17.867   1.450
  244   1HB   GLU  32          2HB       GLU  32  -3.322  16.350   2.901
  245   2HB   GLU  32          1HB       GLU  32  -3.176  18.067   2.525
  246   1HG   GLU  32          2HG       GLU  32  -4.609  18.652   4.172
  247   2HG   GLU  32          1HG       GLU  32  -5.772  17.413   3.701
  248    H    ASP  33           H        ASP  33  -3.073  15.369   0.682
  249    HA   ASP  33           HA       ASP  33  -1.968  17.045  -1.453
  250   1HB   ASP  33          2HB       ASP  33  -1.115  14.364  -0.335
  251   2HB   ASP  33          1HB       ASP  33  -0.309  15.175  -1.677
  252    H    GLY  34           H        GLY  34  -3.704  13.994  -1.005
  253   1HA   GLY  34          2HA       GLY  34  -5.358  13.333  -2.664
  254   2HA   GLY  34          1HA       GLY  34  -4.281  13.957  -3.909
  255    H    CYS  35           H        CYS  35  -3.544  11.897  -1.106
  256    HA   CYS  35           HA       CYS  35  -3.184   9.535  -2.751
  257   1HB   CYS  35          2HB       CYS  35  -0.722   9.506  -1.547
  258   2HB   CYS  35          1HB       CYS  35  -1.012   9.968  -3.222
  259    HG   CYS  35           HG       CYS  35  -0.522  11.963  -0.880
  260    H    ILE  36           H        ILE  36  -2.295   7.690  -1.361
  261    HA   ILE  36           HA       ILE  36  -3.569   7.885   1.295
  262    HB   ILE  36           HB       ILE  36  -3.544   5.384   1.235
  263   1HG1  ILE  36          2HG1      ILE  36  -3.225   5.030  -1.588
  264   2HG1  ILE  36          1HG1      ILE  36  -1.793   5.861  -0.982
  265   1HG2  ILE  36          1HG2      ILE  36  -4.857   6.515  -1.244
  266   2HG2  ILE  36          2HG2      ILE  36  -5.449   6.867   0.380
  267   3HG2  ILE  36          3HG2      ILE  36  -5.430   5.205  -0.210
  268   1HD1  ILE  36          1HD1      ILE  36  -1.878   4.087   0.931
  269   2HD1  ILE  36          2HD1      ILE  36  -1.240   3.612  -0.646
  270   3HD1  ILE  36          3HD1      ILE  36  -2.888   3.176  -0.193
  271    H    SER  37           H        SER  37  -2.438   6.090   2.827
  272    HA   SER  37           HA       SER  37   0.325   7.032   3.080
  273   1HB   SER  37          2HB       SER  37  -1.439   6.963   5.009
  274   2HB   SER  37          1HB       SER  37  -1.029   5.252   5.082
  275    HG   SER  37           HG       SER  37   0.387   7.428   5.894
  276    H    THR  38           H        THR  38   2.085   5.694   3.136
  277    HA   THR  38           HA       THR  38   2.114   3.390   1.541
  278    HB   THR  38           HB       THR  38   4.348   2.934   2.699
  279    HG1  THR  38           HG1      THR  38   4.803   4.074   4.390
  280   1HG2  THR  38          1HG2      THR  38   3.559   5.405   1.220
  281   2HG2  THR  38          2HG2      THR  38   4.620   4.089   0.719
  282   3HG2  THR  38          3HG2      THR  38   5.202   5.308   1.853
  283    H    LYS  39           H        LYS  39   2.094   3.698   5.094
  284    HA   LYS  39           HA       LYS  39   2.030   0.902   5.628
  285   1HB   LYS  39          2HB       LYS  39   1.440   1.534   7.905
  286   2HB   LYS  39          1HB       LYS  39   2.711   2.596   7.304
  287   1HG   LYS  39          2HG       LYS  39   0.693   4.123   6.565
  288   2HG   LYS  39          1HG       LYS  39  -0.192   3.206   7.784
  289   1HD   LYS  39          2HD       LYS  39   0.650   5.010   9.024
  290   2HD   LYS  39          1HD       LYS  39   1.845   3.750   9.324
  291   1HE   LYS  39          2HE       LYS  39   3.329   4.671   7.639
  292   2HE   LYS  39          1HE       LYS  39   2.105   5.837   7.139
  293   1HZ   LYS  39          1HZ       LYS  39   3.884   6.671   8.697
  294   2HZ   LYS  39          2HZ       LYS  39   3.151   5.731   9.907
  295   3HZ   LYS  39          3HZ       LYS  39   2.283   6.985   9.159
  296    H    GLU  40           H        GLU  40  -0.414   3.198   4.692
  297    HA   GLU  40           HA       GLU  40  -2.662   1.643   5.634
  298   1HB   GLU  40          2HB       GLU  40  -2.469   4.236   5.128
  299   2HB   GLU  40          1HB       GLU  40  -2.957   3.723   3.514
  300   1HG   GLU  40          2HG       GLU  40  -4.890   2.501   4.556
  301   2HG   GLU  40          1HG       GLU  40  -4.442   3.211   6.107
  302    H    LEU  41           H        LEU  41  -0.520   1.131   3.116
  303    HA   LEU  41           HA       LEU  41  -2.183   0.509   0.932
  304   1HB   LEU  41          2HB       LEU  41   0.215   0.646   0.657
  305   2HB   LEU  41          1HB       LEU  41   0.461  -0.683   1.769
  306    HG   LEU  41           HG       LEU  41  -0.484  -2.251   0.189
  307   1HD1  LEU  41          1HD1      LEU  41  -1.256  -1.478  -2.046
  308   2HD1  LEU  41          2HD1      LEU  41  -1.050   0.192  -1.517
  309   3HD1  LEU  41          3HD1      LEU  41  -2.253  -0.837  -0.740
  310   1HD2  LEU  41          1HD2      LEU  41   1.106  -1.930  -1.719
  311   2HD2  LEU  41          2HD2      LEU  41   1.871  -1.724  -0.144
  312   3HD2  LEU  41          3HD2      LEU  41   1.449  -0.311  -1.111
  313    H    GLY  42           H        GLY  42  -1.243  -1.367   3.783
  314   1HA   GLY  42          2HA       GLY  42  -2.285  -3.872   2.967
  315   2HA   GLY  42          1HA       GLY  42  -2.012  -3.366   4.630
  316    H    LYS  43           H        LYS  43  -3.841  -0.946   3.984
  317    HA   LYS  43           HA       LYS  43  -6.301  -2.243   4.834
  318   1HB   LYS  43          2HB       LYS  43  -5.753   0.694   4.345
  319   2HB   LYS  43          1HB       LYS  43  -7.137   0.012   5.198
  320   1HG   LYS  43          2HG       LYS  43  -4.290  -0.486   6.090
  321   2HG   LYS  43          1HG       LYS  43  -5.228   0.893   6.662
  322   1HD   LYS  43          2HD       LYS  43  -6.672  -0.419   7.894
  323   2HD   LYS  43          1HD       LYS  43  -6.509  -1.802   6.810
  324   1HE   LYS  43          2HE       LYS  43  -4.051  -1.893   7.673
  325   2HE   LYS  43          1HE       LYS  43  -4.649  -0.897   8.999
  326   1HZ   LYS  43          1HZ       LYS  43  -4.819  -3.172   9.632
  327   2HZ   LYS  43          2HZ       LYS  43  -5.627  -3.582   8.195
  328   3HZ   LYS  43          3HZ       LYS  43  -6.392  -2.602   9.355
  329    H    VAL  44           H        VAL  44  -5.128  -0.363   2.040
  330    HA   VAL  44           HA       VAL  44  -7.661  -0.291   0.720
  331    HB   VAL  44           HB       VAL  44  -6.364   0.401  -1.285
  332   1HG1  VAL  44          1HG1      VAL  44  -5.160   1.947   0.961
  333   2HG1  VAL  44          2HG1      VAL  44  -6.918   1.837   0.909
  334   3HG1  VAL  44          3HG1      VAL  44  -6.038   2.522  -0.456
  335   1HG2  VAL  44          1HG2      VAL  44  -3.973  -0.001   0.538
  336   2HG2  VAL  44          2HG2      VAL  44  -3.930   0.727  -1.065
  337   3HG2  VAL  44          3HG2      VAL  44  -4.348  -0.975  -0.883
  338    H    MET  45           H        MET  45  -4.890  -2.503   0.590
  339    HA   MET  45           HA       MET  45  -5.856  -4.043  -1.619
  340   1HB   MET  45          2HB       MET  45  -3.925  -4.799   0.586
  341   2HB   MET  45          1HB       MET  45  -4.202  -5.729  -0.887
  342   1HG   MET  45          2HG       MET  45  -3.529  -3.728  -2.222
  343   2HG   MET  45          1HG       MET  45  -3.139  -2.897  -0.719
  344   1HE   MET  45          1HE       MET  45  -1.276  -5.499   1.034
  345   2HE   MET  45          2HE       MET  45  -2.063  -3.924   1.045
  346   3HE   MET  45          3HE       MET  45  -0.326  -4.033   0.766
  347    H    ARG  46           H        ARG  46  -6.323  -4.128   1.855
  348    HA   ARG  46           HA       ARG  46  -7.459  -6.688   2.144
  349   1HB   ARG  46          2HB       ARG  46  -7.469  -4.167   3.697
  350   2HB   ARG  46          1HB       ARG  46  -8.820  -5.256   4.005
  351   1HG   ARG  46          2HG       ARG  46  -7.357  -7.050   4.613
  352   2HG   ARG  46          1HG       ARG  46  -5.943  -6.191   4.002
  353   1HD   ARG  46          2HD       ARG  46  -6.238  -4.463   5.732
  354   2HD   ARG  46          1HD       ARG  46  -7.658  -5.302   6.338
  355    HE   ARG  46           HE       ARG  46  -4.872  -6.089   6.715
  356   1HH1  ARG  46          2HH1      ARG  46  -8.247  -6.977   6.917
  357   2HH1  ARG  46          1HH1      ARG  46  -7.973  -8.236   8.071
  358   1HH2  ARG  46          1HH2      ARG  46  -4.541  -7.747   8.227
  359   2HH2  ARG  46          2HH2      ARG  46  -5.884  -8.672   8.810
  360    H    MET  47           H        MET  47  -8.907  -3.556   1.327
  361    HA   MET  47           HA       MET  47 -11.607  -4.496   1.232
  362   1HB   MET  47          2HB       MET  47 -10.215  -2.021   0.222
  363   2HB   MET  47          1HB       MET  47 -11.908  -2.335  -0.157
  364   1HG   MET  47          2HG       MET  47 -11.006  -2.584   2.690
  365   2HG   MET  47          1HG       MET  47 -11.253  -0.973   2.018
  366   1HE   MET  47          1HE       MET  47 -14.851  -0.580   1.285
  367   2HE   MET  47          2HE       MET  47 -13.263  -0.418   0.540
  368   3HE   MET  47          3HE       MET  47 -13.526   0.185   2.174
  369    H    LEU  48           H        LEU  48  -8.998  -4.202  -1.133
  370    HA   LEU  48           HA       LEU  48 -10.532  -4.664  -3.472
  371   1HB   LEU  48          2HB       LEU  48  -7.647  -4.866  -2.757
  372   2HB   LEU  48          1HB       LEU  48  -8.183  -5.644  -4.230
  373    HG   LEU  48           HG       LEU  48  -8.802  -2.746  -3.690
  374   1HD1  LEU  48          1HD1      LEU  48  -6.357  -3.064  -3.460
  375   2HD1  LEU  48          2HD1      LEU  48  -6.757  -2.168  -4.925
  376   3HD1  LEU  48          3HD1      LEU  48  -6.323  -3.874  -5.026
  377   1HD2  LEU  48          1HD2      LEU  48  -8.645  -2.805  -6.264
  378   2HD2  LEU  48          2HD2      LEU  48 -10.030  -3.615  -5.532
  379   3HD2  LEU  48          3HD2      LEU  48  -8.655  -4.561  -6.103
  380    H    GLY  49           H        GLY  49  -8.447  -6.920  -1.622
  381   1HA   GLY  49          2HA       GLY  49  -9.973  -9.062  -1.207
  382   2HA   GLY  49          1HA       GLY  49  -9.710  -9.209  -2.941
  383    H    GLN  50           H        GLN  50  -7.632  -8.323  -0.163
  384    HA   GLN  50           HA       GLN  50  -5.978 -10.680  -0.527
  385   1HB   GLN  50          2HB       GLN  50  -5.173  -8.040  -1.585
  386   2HB   GLN  50          1HB       GLN  50  -3.958  -8.860  -0.604
  387   1HG   GLN  50          2HG       GLN  50  -4.706 -10.955  -2.073
  388   2HG   GLN  50          1HG       GLN  50  -5.162  -9.688  -3.212
  389   1HE2  GLN  50          1HE2      GLN  50  -2.580 -11.641  -2.304
  390   2HE2  GLN  50          2HE2      GLN  50  -1.312 -10.695  -2.919
  391    H    ASN  51           H        ASN  51  -4.576 -11.067   1.233
  392    HA   ASN  51           HA       ASN  51  -4.743  -9.140   3.464
  393   1HB   ASN  51          2HB       ASN  51  -6.431 -11.134   3.571
  394   2HB   ASN  51          1HB       ASN  51  -5.012 -12.079   4.019
  395   1HD2  ASN  51          1HD2      ASN  51  -7.525 -10.530   5.447
  396   2HD2  ASN  51          2HD2      ASN  51  -6.781 -10.005   6.879
  397    HA   PRO  52           HA       PRO  52  -0.425 -10.722   3.071
  398   1HB   PRO  52          2HB       PRO  52   0.753  -8.272   2.777
  399   2HB   PRO  52          1HB       PRO  52   0.129  -9.222   1.424
  400   1HG   PRO  52          2HG       PRO  52  -0.958  -6.777   2.658
  401   2HG   PRO  52          1HG       PRO  52  -1.214  -7.424   1.032
  402   1HD   PRO  52          2HD       PRO  52  -3.008  -7.595   3.255
  403   2HD   PRO  52          1HD       PRO  52  -3.189  -8.376   1.666
  404    H    THR  53           H        THR  53   1.614  -9.386   4.217
  405    HA   THR  53           HA       THR  53   0.726  -8.857   6.994
  406    HB   THR  53           HB       THR  53   2.566 -10.008   7.823
  407    HG1  THR  53           HG1      THR  53   4.457  -9.708   6.998
  408   1HG2  THR  53          1HG2      THR  53   2.842 -12.096   6.549
  409   2HG2  THR  53          2HG2      THR  53   2.110 -11.331   5.138
  410   3HG2  THR  53          3HG2      THR  53   1.149 -11.601   6.592
  411    HA   PRO  54           HA       PRO  54   2.761  -4.950   6.812
  412   1HB   PRO  54          2HB       PRO  54   4.240  -4.831   9.114
  413   2HB   PRO  54          1HB       PRO  54   2.478  -4.671   9.061
  414   1HG   PRO  54          2HG       PRO  54   4.141  -6.984   9.914
  415   2HG   PRO  54          1HG       PRO  54   2.546  -6.470  10.486
  416   1HD   PRO  54          2HD       PRO  54   3.009  -8.574   8.708
  417   2HD   PRO  54          1HD       PRO  54   1.452  -7.739   8.916
  418    H    GLU  55           H        GLU  55   4.872  -7.685   7.349
  419    HA   GLU  55           HA       GLU  55   7.308  -6.276   6.628
  420   1HB   GLU  55          2HB       GLU  55   6.981  -9.274   6.777
  421   2HB   GLU  55          1HB       GLU  55   8.444  -8.321   7.011
  422   1HG   GLU  55          2HG       GLU  55   6.026  -8.337   8.845
  423   2HG   GLU  55          1HG       GLU  55   7.574  -9.113   9.174
  424    H    GLU  56           H        GLU  56   5.017  -8.538   5.145
  425    HA   GLU  56           HA       GLU  56   6.511  -8.921   2.733
  426   1HB   GLU  56          2HB       GLU  56   3.616  -9.411   3.443
  427   2HB   GLU  56          1HB       GLU  56   4.278  -9.758   1.844
  428   1HG   GLU  56          2HG       GLU  56   5.586 -10.831   4.346
  429   2HG   GLU  56          1HG       GLU  56   4.258 -11.689   3.566
  430    H    LEU  57           H        LEU  57   3.597  -6.963   3.482
  431    HA   LEU  57           HA       LEU  57   3.393  -5.729   0.957
  432   1HB   LEU  57          2HB       LEU  57   1.542  -4.967   1.914
  433   2HB   LEU  57          1HB       LEU  57   2.095  -5.511   3.478
  434    HG   LEU  57           HG       LEU  57   3.086  -2.870   2.469
  435   1HD1  LEU  57          1HD1      LEU  57   0.325  -3.375   3.615
  436   2HD1  LEU  57          2HD1      LEU  57   0.687  -2.785   1.993
  437   3HD1  LEU  57          3HD1      LEU  57   1.056  -1.785   3.397
  438   1HD2  LEU  57          1HD2      LEU  57   3.436  -4.286   4.785
  439   2HD2  LEU  57          2HD2      LEU  57   2.063  -3.266   5.219
  440   3HD2  LEU  57          3HD2      LEU  57   3.572  -2.531   4.675
  441    H    GLN  58           H        GLN  58   5.456  -5.029   3.707
  442    HA   GLN  58           HA       GLN  58   6.221  -2.411   3.247
  443   1HB   GLN  58          2HB       GLN  58   6.988  -4.188   5.059
  444   2HB   GLN  58          1HB       GLN  58   8.353  -4.377   3.961
  445   1HG   GLN  58          2HG       GLN  58   8.783  -2.652   5.703
  446   2HG   GLN  58          1HG       GLN  58   8.821  -1.979   4.075
  447   1HE2  GLN  58          1HE2      GLN  58   7.266  -0.366   3.543
  448   2HE2  GLN  58          2HE2      GLN  58   6.076   0.173   4.627
  449    H    GLU  59           H        GLU  59   7.380  -5.344   1.627
  450    HA   GLU  59           HA       GLU  59   9.507  -4.201   0.171
  451   1HB   GLU  59          2HB       GLU  59   7.724  -6.581  -0.319
  452   2HB   GLU  59          1HB       GLU  59   8.946  -6.100  -1.496
  453   1HG   GLU  59          2HG       GLU  59  10.516  -6.043   0.640
  454   2HG   GLU  59          1HG       GLU  59   9.306  -7.151   1.288
  455    H    MET  60           H        MET  60   6.067  -4.610  -0.666
  456    HA   MET  60           HA       MET  60   6.177  -3.517  -3.264
  457   1HB   MET  60          2HB       MET  60   3.929  -3.650  -1.246
  458   2HB   MET  60          1HB       MET  60   3.716  -3.019  -2.879
  459   1HG   MET  60          2HG       MET  60   4.781  -5.245  -3.662
  460   2HG   MET  60          1HG       MET  60   4.440  -5.823  -2.032
  461   1HE   MET  60          1HE       MET  60   1.130  -4.558  -1.435
  462   2HE   MET  60          2HE       MET  60   2.532  -5.461  -0.867
  463   3HE   MET  60          3HE       MET  60   1.121  -6.327  -1.467
  464    H    ILE  61           H        ILE  61   5.613  -1.990  -0.100
  465    HA   ILE  61           HA       ILE  61   4.945   0.583  -0.864
  466    HB   ILE  61           HB       ILE  61   6.602  -0.388   1.474
  467   1HG1  ILE  61          2HG1      ILE  61   4.405  -1.246   1.664
  468   2HG1  ILE  61          1HG1      ILE  61   4.383   0.210   2.652
  469   1HG2  ILE  61          1HG2      ILE  61   5.532   2.361   0.828
  470   2HG2  ILE  61          2HG2      ILE  61   7.179   1.901   1.262
  471   3HG2  ILE  61          3HG2      ILE  61   5.902   1.859   2.479
  472   1HD1  ILE  61          1HD1      ILE  61   3.349  -0.081  -0.180
  473   2HD1  ILE  61          2HD1      ILE  61   3.460   1.459   0.674
  474   3HD1  ILE  61          3HD1      ILE  61   2.387   0.193   1.271
  475    H    ASP  62           H        ASP  62   8.240  -0.269   0.203
  476    HA   ASP  62           HA       ASP  62   9.496   2.005  -0.837
  477   1HB   ASP  62          2HB       ASP  62  10.313  -0.169   0.638
  478   2HB   ASP  62          1HB       ASP  62  11.183  -0.395  -0.879
  479    H    GLU  63           H        GLU  63   8.759  -1.079  -2.411
  480    HA   GLU  63           HA       GLU  63  10.393  -0.721  -4.707
  481   1HB   GLU  63          2HB       GLU  63   8.074  -2.466  -4.011
  482   2HB   GLU  63          1HB       GLU  63   8.522  -2.311  -5.709
  483   1HG   GLU  63          2HG       GLU  63  10.860  -2.929  -5.125
  484   2HG   GLU  63          1HG       GLU  63  10.362  -3.156  -3.450
  485    H    VAL  64           H        VAL  64   6.988   0.130  -4.063
  486    HA   VAL  64           HA       VAL  64   6.696   1.220  -6.758
  487    HB   VAL  64           HB       VAL  64   4.381   1.553  -6.240
  488   1HG1  VAL  64          1HG1      VAL  64   4.307  -0.658  -6.698
  489   2HG1  VAL  64          2HG1      VAL  64   4.108  -0.879  -4.960
  490   3HG1  VAL  64          3HG1      VAL  64   5.710  -1.003  -5.687
  491   1HG2  VAL  64          1HG2      VAL  64   5.277   1.104  -3.390
  492   2HG2  VAL  64          2HG2      VAL  64   3.592   0.906  -3.869
  493   3HG2  VAL  64          3HG2      VAL  64   4.384   2.471  -4.055
  494    H    ASP  65           H        ASP  65   7.499   2.417  -3.607
  495    HA   ASP  65           HA       ASP  65   6.516   5.077  -3.982
  496   1HB   ASP  65          2HB       ASP  65   7.464   3.713  -1.815
  497   2HB   ASP  65          1HB       ASP  65   8.836   4.753  -2.190
  498    H    GLU  66           H        GLU  66   7.226   5.605  -6.073
  499    HA   GLU  66           HA       GLU  66   9.977   5.631  -6.848
  500   1HB   GLU  66          2HB       GLU  66   7.570   7.077  -7.977
  501   2HB   GLU  66          1HB       GLU  66   9.159   7.039  -8.742
  502   1HG   GLU  66          2HG       GLU  66   8.901   4.891  -9.457
  503   2HG   GLU  66          1HG       GLU  66   8.099   4.391  -7.968
  504    H    ASP  67           H        ASP  67   7.831   7.975  -5.325
  505    HA   ASP  67           HA       ASP  67   9.680  10.187  -5.639
  506   1HB   ASP  67          2HB       ASP  67   7.324  10.087  -3.751
  507   2HB   ASP  67          1HB       ASP  67   8.082  11.507  -4.472
  508    H    GLY  68           H        GLY  68   8.629   8.044  -3.002
  509   1HA   GLY  68          2HA       GLY  68   9.777   7.381  -1.096
  510   2HA   GLY  68          1HA       GLY  68  11.146   8.360  -1.617
  511    H    SER  69           H        SER  69   7.814   9.473  -1.231
  512    HA   SER  69           HA       SER  69   8.736  11.533   0.630
  513   1HB   SER  69          2HB       SER  69   6.442  12.483   0.264
  514   2HB   SER  69          1HB       SER  69   7.403  12.338  -1.203
  515    HG   SER  69           HG       SER  69   5.805  11.186  -1.923
  516    H    GLY  70           H        GLY  70   6.154   9.070   0.433
  517   1HA   GLY  70          2HA       GLY  70   6.172   7.829   2.764
  518   2HA   GLY  70          1HA       GLY  70   5.588   9.402   3.295
  519    H    THR  71           H        THR  71   4.145   9.812   0.703
  520    HA   THR  71           HA       THR  71   1.778   8.185   1.358
  521    HB   THR  71           HB       THR  71   0.470   9.843   0.169
  522    HG1  THR  71           HG1      THR  71   2.920  11.167  -0.382
  523   1HG2  THR  71          1HG2      THR  71   0.944  10.437   2.455
  524   2HG2  THR  71          2HG2      THR  71   1.101  11.904   1.487
  525   3HG2  THR  71          3HG2      THR  71   2.544  11.040   2.022
  526    H    VAL  72           H        VAL  72   0.592   7.134  -0.269
  527    HA   VAL  72           HA       VAL  72   2.208   6.393  -2.621
  528    HB   VAL  72           HB       VAL  72  -0.220   4.999  -1.473
  529   1HG1  VAL  72          1HG1      VAL  72   1.845   3.884  -3.372
  530   2HG1  VAL  72          2HG1      VAL  72   0.426   4.746  -3.965
  531   3HG1  VAL  72          3HG1      VAL  72   0.229   3.269  -3.023
  532   1HG2  VAL  72          1HG2      VAL  72   1.585   4.847   0.129
  533   2HG2  VAL  72          2HG2      VAL  72   2.750   4.484  -1.144
  534   3HG2  VAL  72          3HG2      VAL  72   1.504   3.307  -0.727
  535    H    ASP  73           H        ASP  73   1.723   7.441  -4.415
  536    HA   ASP  73           HA       ASP  73  -0.900   8.656  -4.804
  537   1HB   ASP  73          2HB       ASP  73   1.569   8.620  -6.566
  538   2HB   ASP  73          1HB       ASP  73   0.099   9.534  -6.902
  539    H    PHE  74           H        PHE  74  -1.686   8.399  -7.252
  540    HA   PHE  74           HA       PHE  74  -2.540   5.696  -7.505
  541   1HB   PHE  74          2HB       PHE  74  -3.669   7.873  -8.399
  542   2HB   PHE  74          1HB       PHE  74  -2.639   7.623  -9.809
  543    HD1  PHE  74           HD1      PHE  74  -3.875   6.679 -11.541
  544    HD2  PHE  74           HD2      PHE  74  -4.469   5.265  -7.532
  545    HE1  PHE  74           HE1      PHE  74  -5.437   4.947 -12.382
  546    HE2  PHE  74           HE2      PHE  74  -6.036   3.536  -8.372
  547    HZ   PHE  74           HZ       PHE  74  -6.521   3.378 -10.798
  548    H    ASP  75           H        ASP  75   0.067   7.558  -8.988
  549    HA   ASP  75           HA       ASP  75   0.740   5.710 -11.045
  550   1HB   ASP  75          2HB       ASP  75   2.041   8.042  -9.747
  551   2HB   ASP  75          1HB       ASP  75   3.135   6.862 -10.469
  552    H    GLU  76           H        GLU  76   1.587   5.993  -7.640
  553    HA   GLU  76           HA       GLU  76   3.501   3.802  -7.723
  554   1HB   GLU  76          2HB       GLU  76   2.357   5.042  -5.225
  555   2HB   GLU  76          1HB       GLU  76   3.931   4.278  -5.451
  556   1HG   GLU  76          2HG       GLU  76   4.569   6.117  -7.005
  557   2HG   GLU  76          1HG       GLU  76   3.017   6.892  -6.689
  558    H    PHE  77           H        PHE  77   0.125   4.291  -7.183
  559    HA   PHE  77           HA       PHE  77  -0.365   1.873  -5.691
  560   1HB   PHE  77          2HB       PHE  77  -1.820   3.925  -5.604
  561   2HB   PHE  77          1HB       PHE  77  -2.335   3.566  -7.249
  562    HD1  PHE  77           HD1      PHE  77  -2.049   1.950  -3.870
  563    HD2  PHE  77           HD2      PHE  77  -4.180   2.190  -7.594
  564    HE1  PHE  77           HE1      PHE  77  -3.747   0.366  -3.001
  565    HE2  PHE  77           HE2      PHE  77  -5.879   0.606  -6.722
  566    HZ   PHE  77           HZ       PHE  77  -5.663  -0.305  -4.426
  567    H    LEU  78           H        LEU  78  -0.455   2.858  -9.088
  568    HA   LEU  78           HA       LEU  78  -1.659   0.408 -10.021
  569   1HB   LEU  78          2HB       LEU  78  -0.349   2.726 -11.416
  570   2HB   LEU  78          1HB       LEU  78  -0.911   1.316 -12.283
  571    HG   LEU  78           HG       LEU  78  -2.456   3.544 -11.057
  572   1HD1  LEU  78          1HD1      LEU  78  -3.901   2.989 -13.046
  573   2HD1  LEU  78          2HD1      LEU  78  -2.742   1.727 -13.464
  574   3HD1  LEU  78          3HD1      LEU  78  -2.241   3.419 -13.456
  575   1HD2  LEU  78          1HD2      LEU  78  -3.468   0.683 -11.182
  576   2HD2  LEU  78          2HD2      LEU  78  -4.482   2.100 -10.899
  577   3HD2  LEU  78          3HD2      LEU  78  -3.249   1.648  -9.721
  578    H    VAL  79           H        VAL  79   1.641   1.681  -9.776
  579    HA   VAL  79           HA       VAL  79   2.918  -0.273 -11.367
  580    HB   VAL  79           HB       VAL  79   4.970   0.253  -9.970
  581   1HG1  VAL  79          1HG1      VAL  79   4.846   2.769 -10.759
  582   2HG1  VAL  79          2HG1      VAL  79   3.350   2.234 -11.525
  583   3HG1  VAL  79          3HG1      VAL  79   4.880   1.463 -11.944
  584   1HG2  VAL  79          1HG2      VAL  79   3.084   2.289  -8.756
  585   2HG2  VAL  79          2HG2      VAL  79   4.822   2.192  -8.475
  586   3HG2  VAL  79          3HG2      VAL  79   3.762   0.901  -7.908
  587    H    MET  80           H        MET  80   1.682  -0.391  -8.131
  588    HA   MET  80           HA       MET  80   3.109  -2.374  -6.887
  589   1HB   MET  80          2HB       MET  80   0.211  -1.632  -6.870
  590   2HB   MET  80          1HB       MET  80   0.733  -3.074  -5.998
  591   1HG   MET  80          2HG       MET  80   2.120  -1.845  -4.547
  592   2HG   MET  80          1HG       MET  80   2.176  -0.456  -5.632
  593   1HE   MET  80          1HE       MET  80   1.926   0.326  -3.017
  594   2HE   MET  80          2HE       MET  80   0.422   1.187  -2.705
  595   3HE   MET  80          3HE       MET  80   1.349   1.548  -4.159
  596    H    MET  81           H        MET  81   0.738  -2.785  -9.487
  597    HA   MET  81           HA       MET  81   0.736  -5.672  -9.273
  598   1HB   MET  81          2HB       MET  81  -0.493  -3.698 -11.175
  599   2HB   MET  81          1HB       MET  81  -0.461  -5.417 -11.568
  600   1HG   MET  81          2HG       MET  81  -1.388  -4.633  -8.837
  601   2HG   MET  81          1HG       MET  81  -2.481  -4.346 -10.190
  602   1HE   MET  81          1HE       MET  81  -4.344  -6.979 -10.602
  603   2HE   MET  81          2HE       MET  81  -4.122  -5.425  -9.803
  604   3HE   MET  81          3HE       MET  81  -4.240  -6.894  -8.839
  605    H    VAL  82           H        VAL  82   2.007  -3.311 -11.630
  606    HA   VAL  82           HA       VAL  82   3.276  -5.278 -13.270
  607    HB   VAL  82           HB       VAL  82   4.453  -3.306 -14.294
  608   1HG1  VAL  82          1HG1      VAL  82   1.676  -2.371 -14.226
  609   2HG1  VAL  82          2HG1      VAL  82   1.806  -4.113 -14.468
  610   3HG1  VAL  82          3HG1      VAL  82   2.614  -3.006 -15.577
  611   1HG2  VAL  82          1HG2      VAL  82   2.740  -1.715 -12.364
  612   2HG2  VAL  82          2HG2      VAL  82   3.859  -1.072 -13.564
  613   3HG2  VAL  82          3HG2      VAL  82   4.476  -1.953 -12.166
  614    H    ARG  83           H        ARG  83   4.356  -3.458 -10.452
  615    HA   ARG  83           HA       ARG  83   7.143  -3.766 -10.784
  616   1HB   ARG  83          2HB       ARG  83   7.348  -3.273  -8.431
  617   2HB   ARG  83          1HB       ARG  83   6.059  -2.269  -9.092
  618   1HG   ARG  83          2HG       ARG  83   4.791  -3.068  -7.394
  619   2HG   ARG  83          1HG       ARG  83   4.708  -4.560  -8.327
  620   1HD   ARG  83          2HD       ARG  83   7.033  -5.037  -7.159
  621   2HD   ARG  83          1HD       ARG  83   6.430  -3.889  -5.969
  622    HE   ARG  83           HE       ARG  83   4.346  -5.577  -6.175
  623   1HH1  ARG  83          2HH1      ARG  83   7.775  -6.174  -5.861
  624   2HH1  ARG  83          1HH1      ARG  83   7.563  -7.663  -5.008
  625   1HH2  ARG  83          1HH2      ARG  83   4.098  -7.534  -5.056
  626   2HH2  ARG  83          2HH2      ARG  83   5.491  -8.431  -4.555
  627    H    CYS  84           H        CYS  84   4.690  -6.059  -9.940
  628    HA   CYS  84           HA       CYS  84   6.169  -7.936  -8.452
  629   1HB   CYS  84          2HB       CYS  84   3.853  -8.308 -10.362
  630   2HB   CYS  84          1HB       CYS  84   4.518  -9.609  -9.376
  631    HG   CYS  84           HG       CYS  84   2.836  -7.247  -8.332
  632    H    MET  85           H        MET  85   6.107  -7.238 -11.903
  633    HA   MET  85           HA       MET  85   7.344  -9.654 -12.788
  634   1HB   MET  85          2HB       MET  85   6.753  -6.988 -13.950
  635   2HB   MET  85          1HB       MET  85   8.080  -7.886 -14.688
  636   1HG   MET  85          2HG       MET  85   6.322  -9.887 -14.548
  637   2HG   MET  85          1HG       MET  85   5.170  -8.553 -14.578
  638   1HE   MET  85          1HE       MET  85   8.759  -9.174 -16.732
  639   2HE   MET  85          2HE       MET  85   7.816 -10.304 -17.701
  640   3HE   MET  85          3HE       MET  85   7.858 -10.479 -15.949
  641    H    LYS  86           H        LYS  86   8.565  -6.516 -11.700
  642    HA   LYS  86           HA       LYS  86  11.260  -6.776 -12.429
  643   1HB   LYS  86          2HB       LYS  86   9.734  -4.910 -11.036
  644   2HB   LYS  86          1HB       LYS  86  10.895  -5.482  -9.838
  645   1HG   LYS  86          2HG       LYS  86  11.804  -4.740 -12.614
  646   2HG   LYS  86          1HG       LYS  86  11.584  -3.498 -11.381
  647   1HD   LYS  86          2HD       LYS  86  13.140  -5.944 -10.654
  648   2HD   LYS  86          1HD       LYS  86  13.921  -4.737 -11.673
  649   1HE   LYS  86          2HE       LYS  86  13.890  -3.116 -10.017
  650   2HE   LYS  86          1HE       LYS  86  12.465  -3.796  -9.234
  651   1HZ   LYS  86          1HZ       LYS  86  15.203  -4.945  -9.197
  652   2HZ   LYS  86          2HZ       LYS  86  13.833  -5.671  -8.502
  653   3HZ   LYS  86          3HZ       LYS  86  14.414  -4.193  -7.899
  654    H    ASP  87           H        ASP  87  12.962  -7.849 -11.594
  655    HA   ASP  87           HA       ASP  87  12.485  -9.967  -9.700
  656   1HB   ASP  87          2HB       ASP  87  15.006  -9.000 -11.067
  657   2HB   ASP  87          1HB       ASP  87  14.950 -10.394  -9.988
  658    H    ASP  88           H        ASP  88  12.133  -9.341  -7.651
  659    HA   ASP  88           HA       ASP  88  13.947  -7.365  -6.428
  660   1HB   ASP  88          2HB       ASP  88  12.242  -7.609  -4.465
  661   2HB   ASP  88          1HB       ASP  88  11.782  -6.679  -5.886
  662    H    SER  89           HN       SER  89  15.760  -8.653  -6.139
  663    HA   SER  89           HA       SER  89  15.477 -10.735  -4.055
  664   1HB   SER  89          2HB       SER  89  17.158 -10.795  -6.562
  665   2HB   SER  89          1HB       SER  89  17.502 -11.827  -5.176
  666    HG   SER  89           HG       SER  89  15.825 -13.006  -5.663
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1  11.263   6.416 -17.039
    2   2H    MET   1          2H        MET   1  11.218   5.293 -15.766
    3   3H    MET   1          3H        MET   1  10.389   4.973 -17.213
    4    HA   MET   1           HA       MET   1  12.654   5.116 -18.344
    5   1HB   MET   1          2HB       MET   1  13.381   4.909 -15.417
    6   2HB   MET   1          1HB       MET   1  14.468   4.353 -16.690
    7   1HG   MET   1          2HG       MET   1  13.888   6.778 -17.689
    8   2HG   MET   1          1HG       MET   1  13.645   7.130 -15.979
    9   1HE   MET   1          1HE       MET   1  15.547   5.973 -14.157
   10   2HE   MET   1          2HE       MET   1  15.261   7.689 -14.436
   11   3HE   MET   1          3HE       MET   1  16.912   7.085 -14.325
   12    H    ASN   2           H        ASN   2  11.436   3.200 -15.584
   13    HA   ASN   2           HA       ASN   2  12.349   0.677 -16.476
   14   1HB   ASN   2          2HB       ASN   2  10.561   1.678 -14.400
   15   2HB   ASN   2          1HB       ASN   2   9.994   0.158 -15.090
   16   1HD2  ASN   2          1HD2      ASN   2  12.086  -1.427 -15.486
   17   2HD2  ASN   2          2HD2      ASN   2  13.086  -1.569 -14.121
   18    H    ASP   3           H        ASP   3  11.361  -0.966 -17.629
   19    HA   ASP   3           HA       ASP   3   9.003  -0.156 -19.227
   20   1HB   ASP   3          2HB       ASP   3  11.353  -0.486 -20.346
   21   2HB   ASP   3          1HB       ASP   3  10.962  -2.200 -20.206
   22    H    ILE   4           H        ILE   4   9.607  -2.005 -16.650
   23    HA   ILE   4           HA       ILE   4   8.449  -4.511 -17.559
   24    HB   ILE   4           HB       ILE   4   8.700  -5.338 -15.372
   25   1HG1  ILE   4          2HG1      ILE   4   7.576  -3.271 -14.329
   26   2HG1  ILE   4          1HG1      ILE   4   8.828  -4.061 -13.378
   27   1HG2  ILE   4          1HG2      ILE   4  11.010  -4.720 -14.735
   28   2HG2  ILE   4          2HG2      ILE   4  10.932  -3.342 -15.831
   29   3HG2  ILE   4          3HG2      ILE   4  10.847  -4.983 -16.471
   30   1HD1  ILE   4          1HD1      ILE   4   8.870  -1.407 -14.747
   31   2HD1  ILE   4          2HD1      ILE   4  10.384  -2.304 -14.659
   32   3HD1  ILE   4          3HD1      ILE   4   9.529  -1.872 -13.180
   33    H    TYR   5           H        TYR   5   7.364  -1.517 -16.158
   34    HA   TYR   5           HA       TYR   5   4.815  -2.418 -15.229
   35   1HB   TYR   5          2HB       TYR   5   5.539   0.387 -16.107
   36   2HB   TYR   5          1HB       TYR   5   4.264  -0.092 -14.990
   37    HD1  TYR   5           HD1      TYR   5   5.313  -1.834 -13.077
   38    HD2  TYR   5           HD2      TYR   5   7.362   1.376 -15.061
   39    HE1  TYR   5           HE1      TYR   5   6.907  -1.685 -11.189
   40    HE2  TYR   5           HE2      TYR   5   8.963   1.517 -13.176
   41    HH   TYR   5           HH       TYR   5   8.646   0.717 -10.428
   42    H    LYS   6           H        LYS   6   6.077  -1.194 -18.275
   43    HA   LYS   6           HA       LYS   6   3.494  -0.911 -19.542
   44   1HB   LYS   6          2HB       LYS   6   6.132  -1.159 -20.989
   45   2HB   LYS   6          1HB       LYS   6   4.676  -0.311 -21.507
   46   1HG   LYS   6          2HG       LYS   6   6.618   0.486 -19.326
   47   2HG   LYS   6          1HG       LYS   6   6.183   1.391 -20.776
   48   1HD   LYS   6          2HD       LYS   6   4.008   1.888 -19.939
   49   2HD   LYS   6          1HD       LYS   6   4.144   0.678 -18.663
   50   1HE   LYS   6          2HE       LYS   6   4.481   2.852 -17.656
   51   2HE   LYS   6          1HE       LYS   6   6.035   2.021 -17.684
   52   1HZ   LYS   6          1HZ       LYS   6   5.991   4.416 -18.465
   53   2HZ   LYS   6          2HZ       LYS   6   5.199   3.851 -19.857
   54   3HZ   LYS   6          3HZ       LYS   6   6.763   3.302 -19.483
   55    H    ALA   7           H        ALA   7   6.071  -3.305 -19.445
   56    HA   ALA   7           HA       ALA   7   4.915  -5.057 -21.406
   57   1HB   ALA   7          1HB       ALA   7   7.216  -5.378 -21.139
   58   2HB   ALA   7          2HB       ALA   7   6.531  -6.736 -20.243
   59   3HB   ALA   7          3HB       ALA   7   7.118  -5.315 -19.379
   60    H    ALA   8           H        ALA   8   4.603  -4.632 -17.939
   61    HA   ALA   8           HA       ALA   8   3.212  -7.154 -17.550
   62   1HB   ALA   8          1HB       ALA   8   3.799  -4.844 -15.690
   63   2HB   ALA   8          2HB       ALA   8   4.597  -6.416 -15.733
   64   3HB   ALA   8          3HB       ALA   8   2.918  -6.295 -15.209
   65    H    VAL   9           H        VAL   9   2.371  -3.792 -18.144
   66    HA   VAL   9           HA       VAL   9  -0.248  -3.781 -17.113
   67    HB   VAL   9           HB       VAL   9   1.130  -1.807 -18.051
   68   1HG1  VAL   9          1HG1      VAL   9   1.171  -1.392 -20.306
   69   2HG1  VAL   9          2HG1      VAL   9  -0.385  -2.172 -20.585
   70   3HG1  VAL   9          3HG1      VAL   9   1.067  -3.149 -20.387
   71   1HG2  VAL   9          1HG2      VAL   9  -0.846  -0.525 -18.263
   72   2HG2  VAL   9          2HG2      VAL   9  -1.327  -1.880 -17.243
   73   3HG2  VAL   9          3HG2      VAL   9  -1.748  -1.871 -18.956
   74    H    GLU  10           H        GLU  10   1.052  -5.195 -20.044
   75    HA   GLU  10           HA       GLU  10  -1.383  -5.512 -21.476
   76   1HB   GLU  10          2HB       GLU  10   1.264  -6.958 -21.573
   77   2HB   GLU  10          1HB       GLU  10  -0.093  -7.425 -22.600
   78   1HG   GLU  10          2HG       GLU  10   0.015  -5.499 -23.861
   79   2HG   GLU  10          1HG       GLU  10   0.622  -4.528 -22.518
   80    H    GLN  11           H        GLN  11   0.091  -7.270 -18.831
   81    HA   GLN  11           HA       GLN  11  -1.558  -9.626 -19.125
   82   1HB   GLN  11          2HB       GLN  11   0.065  -8.722 -16.732
   83   2HB   GLN  11          1HB       GLN  11  -0.591 -10.337 -17.006
   84   1HG   GLN  11          2HG       GLN  11   0.815 -10.594 -19.003
   85   2HG   GLN  11          1HG       GLN  11   1.444  -8.960 -18.786
   86   1HE2  GLN  11          1HE2      GLN  11   2.363  -8.630 -16.377
   87   2HE2  GLN  11          2HE2      GLN  11   3.337  -9.901 -15.815
   88    H    LEU  12           H        LEU  12  -1.656  -6.606 -17.339
   89    HA   LEU  12           HA       LEU  12  -3.826  -7.371 -15.609
   90   1HB   LEU  12          2HB       LEU  12  -3.200  -4.522 -16.258
   91   2HB   LEU  12          1HB       LEU  12  -3.748  -5.219 -14.753
   92    HG   LEU  12           HG       LEU  12  -0.957  -5.263 -15.906
   93   1HD1  LEU  12          1HD1      LEU  12  -1.043  -3.322 -14.693
   94   2HD1  LEU  12          2HD1      LEU  12  -0.757  -4.422 -13.345
   95   3HD1  LEU  12          3HD1      LEU  12  -2.394  -3.875 -13.706
   96   1HD2  LEU  12          1HD2      LEU  12  -2.229  -6.948 -13.760
   97   2HD2  LEU  12          2HD2      LEU  12  -0.533  -6.486 -13.616
   98   3HD2  LEU  12          3HD2      LEU  12  -1.075  -7.424 -15.008
   99    H    THR  13           H        THR  13  -5.947  -6.402 -15.646
  100    HA   THR  13           HA       THR  13  -6.911  -5.936 -18.406
  101    HB   THR  13           HB       THR  13  -9.190  -6.442 -17.078
  102    HG1  THR  13           HG1      THR  13  -8.643  -7.064 -15.147
  103   1HG2  THR  13          1HG2      THR  13  -8.319  -7.609 -19.079
  104   2HG2  THR  13          2HG2      THR  13  -9.014  -8.734 -17.912
  105   3HG2  THR  13          3HG2      THR  13  -7.263  -8.570 -18.043
  106    H    ASP  14           H        ASP  14  -8.848  -4.534 -18.576
  107    HA   ASP  14           HA       ASP  14  -8.352  -1.960 -17.500
  108   1HB   ASP  14          2HB       ASP  14 -10.714  -3.158 -18.946
  109   2HB   ASP  14          1HB       ASP  14 -10.716  -1.486 -18.384
  110    H    GLU  15           H        GLU  15 -10.430  -4.624 -16.515
  111    HA   GLU  15           HA       GLU  15 -12.101  -3.290 -14.689
  112   1HB   GLU  15          2HB       GLU  15 -11.171  -6.110 -15.013
  113   2HB   GLU  15          1HB       GLU  15 -11.950  -5.661 -13.496
  114   1HG   GLU  15          2HG       GLU  15 -13.172  -4.991 -16.179
  115   2HG   GLU  15          1HG       GLU  15 -13.488  -6.522 -15.363
  116    H    GLN  16           H        GLN  16  -8.864  -4.708 -14.267
  117    HA   GLN  16           HA       GLN  16  -8.628  -4.388 -11.482
  118   1HB   GLN  16          2HB       GLN  16  -6.620  -4.497 -13.719
  119   2HB   GLN  16          1HB       GLN  16  -6.100  -4.152 -12.070
  120   1HG   GLN  16          2HG       GLN  16  -7.669  -6.275 -11.564
  121   2HG   GLN  16          1HG       GLN  16  -7.211  -6.667 -13.222
  122   1HE2  GLN  16          1HE2      GLN  16  -4.875  -6.946 -13.679
  123   2HE2  GLN  16          2HE2      GLN  16  -3.791  -7.277 -12.416
  124    H    LYS  17           H        LYS  17  -7.681  -2.193 -14.132
  125    HA   LYS  17           HA       LYS  17  -6.752  -0.094 -12.449
  126   1HB   LYS  17          2HB       LYS  17  -7.459  -0.354 -15.337
  127   2HB   LYS  17          1HB       LYS  17  -7.365   1.270 -14.654
  128   1HG   LYS  17          2HG       LYS  17  -5.127   1.172 -14.859
  129   2HG   LYS  17          1HG       LYS  17  -5.117  -0.111 -13.650
  130   1HD   LYS  17          2HD       LYS  17  -4.012  -1.007 -15.576
  131   2HD   LYS  17          1HD       LYS  17  -5.616  -1.738 -15.549
  132   1HE   LYS  17          2HE       LYS  17  -5.248  -1.038 -17.808
  133   2HE   LYS  17          1HE       LYS  17  -6.359   0.138 -17.111
  134   1HZ   LYS  17          1HZ       LYS  17  -4.443   1.081 -18.396
  135   2HZ   LYS  17          2HZ       LYS  17  -3.420   0.530 -17.157
  136   3HZ   LYS  17          3HZ       LYS  17  -4.619   1.685 -16.821
  137    H    ASN  18           H        ASN  18  -9.911  -0.890 -13.819
  138    HA   ASN  18           HA       ASN  18 -11.251   1.531 -13.252
  139   1HB   ASN  18          2HB       ASN  18 -12.045  -1.255 -13.870
  140   2HB   ASN  18          1HB       ASN  18 -13.235  -0.307 -12.978
  141   1HD2  ASN  18          1HD2      ASN  18 -11.107  -0.056 -15.886
  142   2HD2  ASN  18          2HD2      ASN  18 -12.193   0.904 -16.770
  143    H    GLU  19           H        GLU  19 -10.797  -1.427 -11.334
  144    HA   GLU  19           HA       GLU  19 -12.302  -0.517  -9.068
  145   1HB   GLU  19          2HB       GLU  19 -10.148  -2.650  -9.190
  146   2HB   GLU  19          1HB       GLU  19 -11.314  -2.421  -7.886
  147   1HG   GLU  19          2HG       GLU  19 -12.192  -2.886 -10.737
  148   2HG   GLU  19          1HG       GLU  19 -11.867  -4.224  -9.637
  149    H    PHE  20           H        PHE  20  -8.888  -0.535  -9.982
  150    HA   PHE  20           HA       PHE  20  -7.763   0.379  -7.575
  151   1HB   PHE  20          2HB       PHE  20  -6.934   0.483 -10.452
  152   2HB   PHE  20          1HB       PHE  20  -6.030   1.424  -9.270
  153    HD1  PHE  20           HD1      PHE  20  -4.017   0.069  -9.627
  154    HD2  PHE  20           HD2      PHE  20  -7.676  -1.710  -8.251
  155    HE1  PHE  20           HE1      PHE  20  -2.776  -1.960  -8.954
  156    HE2  PHE  20           HE2      PHE  20  -6.432  -3.741  -7.574
  157    HZ   PHE  20           HZ       PHE  20  -3.981  -3.868  -7.923
  158    H    LYS  21           H        LYS  21  -9.067   2.180 -10.357
  159    HA   LYS  21           HA       LYS  21  -8.358   4.770  -9.474
  160   1HB   LYS  21          2HB       LYS  21  -9.146   4.209 -11.788
  161   2HB   LYS  21          1HB       LYS  21 -10.777   4.035 -11.142
  162   1HG   LYS  21          2HG       LYS  21 -10.382   6.297 -12.109
  163   2HG   LYS  21          1HG       LYS  21 -10.764   6.364 -10.389
  164   1HD   LYS  21          2HD       LYS  21  -8.495   6.750  -9.790
  165   2HD   LYS  21          1HD       LYS  21  -7.912   6.276 -11.386
  166   1HE   LYS  21          2HE       LYS  21  -8.717   8.260 -12.397
  167   2HE   LYS  21          1HE       LYS  21  -9.766   8.632 -11.030
  168   1HZ   LYS  21          1HZ       LYS  21  -7.721   9.987 -11.108
  169   2HZ   LYS  21          2HZ       LYS  21  -6.800   8.575 -10.894
  170   3HZ   LYS  21          3HZ       LYS  21  -7.868   9.089  -9.676
  171    H    ALA  22           H        ALA  22 -11.424   2.968  -9.131
  172    HA   ALA  22           HA       ALA  22 -12.746   4.935  -7.574
  173   1HB   ALA  22          1HB       ALA  22 -13.911   3.059  -8.727
  174   2HB   ALA  22          2HB       ALA  22 -14.343   3.191  -7.022
  175   3HB   ALA  22          3HB       ALA  22 -13.214   1.944  -7.552
  176    H    ALA  23           H        ALA  23 -10.827   2.075  -6.702
  177    HA   ALA  23           HA       ALA  23 -11.172   2.187  -3.906
  178   1HB   ALA  23          1HB       ALA  23 -10.210   0.211  -4.878
  179   2HB   ALA  23          2HB       ALA  23  -8.988   0.930  -3.831
  180   3HB   ALA  23          3HB       ALA  23  -8.882   1.136  -5.579
  181    H    PHE  24           H        PHE  24  -9.128   4.023  -6.078
  182    HA   PHE  24           HA       PHE  24  -7.443   5.082  -3.975
  183   1HB   PHE  24          2HB       PHE  24  -6.896   4.774  -6.526
  184   2HB   PHE  24          1HB       PHE  24  -7.699   6.333  -6.693
  185    HD1  PHE  24           HD1      PHE  24  -4.823   4.550  -5.212
  186    HD2  PHE  24           HD2      PHE  24  -6.718   8.371  -5.771
  187    HE1  PHE  24           HE1      PHE  24  -2.755   5.691  -4.457
  188    HE2  PHE  24           HE2      PHE  24  -4.650   9.505  -5.015
  189    HZ   PHE  24           HZ       PHE  24  -2.669   8.168  -4.359
  190    H    ASP  25           H        ASP  25  -9.863   6.472  -6.209
  191    HA   ASP  25           HA       ASP  25 -10.000   9.030  -5.158
  192   1HB   ASP  25          2HB       ASP  25 -11.972   7.315  -6.623
  193   2HB   ASP  25          1HB       ASP  25 -12.476   8.884  -5.998
  194    H    ILE  26           H        ILE  26 -11.807   6.144  -4.058
  195    HA   ILE  26           HA       ILE  26 -13.551   7.448  -2.284
  196    HB   ILE  26           HB       ILE  26 -13.658   5.288  -1.052
  197   1HG1  ILE  26          2HG1      ILE  26 -11.501   4.469  -3.025
  198   2HG1  ILE  26          1HG1      ILE  26 -11.280   4.656  -1.288
  199   1HG2  ILE  26          1HG2      ILE  26 -14.020   5.627  -3.973
  200   2HG2  ILE  26          2HG2      ILE  26 -15.187   5.148  -2.741
  201   3HG2  ILE  26          3HG2      ILE  26 -14.056   3.963  -3.392
  202   1HD1  ILE  26          1HD1      ILE  26 -12.934   2.598  -2.746
  203   2HD1  ILE  26          2HD1      ILE  26 -13.176   2.937  -1.032
  204   3HD1  ILE  26          3HD1      ILE  26 -11.620   2.331  -1.600
  205    H    PHE  27           H        PHE  27 -10.188   6.459  -1.880
  206    HA   PHE  27           HA       PHE  27 -10.113   7.198   0.929
  207   1HB   PHE  27          2HB       PHE  27  -8.189   6.052  -1.038
  208   2HB   PHE  27          1HB       PHE  27  -7.519   6.947   0.326
  209    HD1  PHE  27           HD1      PHE  27  -9.542   4.016  -0.670
  210    HD2  PHE  27           HD2      PHE  27  -7.738   6.136   2.602
  211    HE1  PHE  27           HE1      PHE  27  -9.933   2.065   0.809
  212    HE2  PHE  27           HE2      PHE  27  -8.130   4.186   4.081
  213    HZ   PHE  27           HZ       PHE  27  -9.227   2.150   3.186
  214    H    ILE  28           H        ILE  28  -9.342   8.637  -2.182
  215    HA   ILE  28           HA       ILE  28  -8.059  10.955  -0.915
  216    HB   ILE  28           HB       ILE  28  -8.536  10.590  -3.870
  217   1HG1  ILE  28          2HG1      ILE  28  -7.362   8.610  -3.439
  218   2HG1  ILE  28          1HG1      ILE  28  -6.074   9.749  -3.791
  219   1HG2  ILE  28          1HG2      ILE  28  -7.737  12.751  -3.478
  220   2HG2  ILE  28          2HG2      ILE  28  -6.259  11.845  -3.808
  221   3HG2  ILE  28          3HG2      ILE  28  -6.704  12.231  -2.144
  222   1HD1  ILE  28          1HD1      ILE  28  -6.145  10.169  -1.180
  223   2HD1  ILE  28          2HD1      ILE  28  -5.266   8.785  -1.836
  224   3HD1  ILE  28          3HD1      ILE  28  -6.879   8.565  -1.159
  225    H    GLN  29           H        GLN  29 -10.933  10.419  -0.537
  226    HA   GLN  29           HA       GLN  29 -12.472  12.162  -2.186
  227   1HB   GLN  29          2HB       GLN  29 -14.183  12.010  -0.365
  228   2HB   GLN  29          1HB       GLN  29 -13.622  10.442  -0.939
  229   1HG   GLN  29          2HG       GLN  29 -12.516   9.963   1.026
  230   2HG   GLN  29          1HG       GLN  29 -12.154  11.654   1.361
  231   1HE2  GLN  29          1HE2      GLN  29 -15.028   9.470   1.145
  232   2HE2  GLN  29          2HE2      GLN  29 -15.859  10.213   2.426
  233    H    ASP  30           H        ASP  30 -10.552  12.617   0.711
  234    HA   ASP  30           HA       ASP  30 -10.630  15.488   0.372
  235   1HB   ASP  30          2HB       ASP  30 -12.673  14.690   1.847
  236   2HB   ASP  30          1HB       ASP  30 -11.444  14.564   3.104
  237    H    ALA  31           H        ALA  31  -8.535  13.658   0.130
  238    HA   ALA  31           HA       ALA  31  -7.009  13.418   2.538
  239   1HB   ALA  31          1HB       ALA  31  -6.583  11.886   0.712
  240   2HB   ALA  31          2HB       ALA  31  -5.132  12.847   0.993
  241   3HB   ALA  31          3HB       ALA  31  -6.189  13.223  -0.368
  242    H    GLU  32           H        GLU  32  -5.146  14.542   3.148
  243    HA   GLU  32           HA       GLU  32  -5.251  17.363   2.792
  244   1HB   GLU  32          2HB       GLU  32  -3.188  17.428   4.131
  245   2HB   GLU  32          1HB       GLU  32  -4.390  16.367   4.861
  246   1HG   GLU  32          2HG       GLU  32  -3.177  14.488   3.480
  247   2HG   GLU  32          1HG       GLU  32  -1.842  15.640   3.433
  248    H    ASP  33           H        ASP  33  -3.192  14.838   1.416
  249    HA   ASP  33           HA       ASP  33  -1.836  16.857  -0.258
  250   1HB   ASP  33          2HB       ASP  33  -0.469  15.232   1.136
  251   2HB   ASP  33          1HB       ASP  33  -1.064  13.955   0.075
  252    H    GLY  34           H        GLY  34  -3.851  13.977  -0.357
  253   1HA   GLY  34          2HA       GLY  34  -5.419  13.726  -2.204
  254   2HA   GLY  34          1HA       GLY  34  -4.166  14.336  -3.278
  255    H    CYS  35           H        CYS  35  -3.398  12.070  -0.728
  256    HA   CYS  35           HA       CYS  35  -3.425   9.765  -2.535
  257   1HB   CYS  35          2HB       CYS  35  -0.913  10.741  -1.153
  258   2HB   CYS  35          1HB       CYS  35  -1.070   9.229  -2.037
  259    HG   CYS  35           HG       CYS  35  -0.620  11.944  -3.296
  260    H    ILE  36           H        ILE  36  -2.352   7.838  -1.171
  261    HA   ILE  36           HA       ILE  36  -3.735   7.894   1.443
  262    HB   ILE  36           HB       ILE  36  -3.692   5.429   1.336
  263   1HG1  ILE  36          2HG1      ILE  36  -3.151   4.893  -1.353
  264   2HG1  ILE  36          1HG1      ILE  36  -1.856   5.982  -0.862
  265   1HG2  ILE  36          1HG2      ILE  36  -5.343   5.179  -0.452
  266   2HG2  ILE  36          2HG2      ILE  36  -4.812   6.694  -1.182
  267   3HG2  ILE  36          3HG2      ILE  36  -5.603   6.705   0.394
  268   1HD1  ILE  36          1HD1      ILE  36  -2.134   3.208  -0.257
  269   2HD1  ILE  36          2HD1      ILE  36  -2.288   4.104   1.258
  270   3HD1  ILE  36          3HD1      ILE  36  -0.854   4.307   0.253
  271    H    SER  37           H        SER  37  -2.632   6.274   3.055
  272    HA   SER  37           HA       SER  37   0.142   7.181   3.309
  273   1HB   SER  37          2HB       SER  37  -1.665   7.239   5.198
  274   2HB   SER  37          1HB       SER  37  -1.282   5.529   5.374
  275    HG   SER  37           HG       SER  37   0.055   7.599   6.311
  276    H    THR  38           H        THR  38   1.880   5.861   3.285
  277    HA   THR  38           HA       THR  38   1.776   3.381   1.944
  278    HB   THR  38           HB       THR  38   4.133   3.074   2.801
  279    HG1  THR  38           HG1      THR  38   3.866   5.684   3.828
  280   1HG2  THR  38          1HG2      THR  38   4.942   5.260   1.667
  281   2HG2  THR  38          2HG2      THR  38   3.229   5.585   1.403
  282   3HG2  THR  38          3HG2      THR  38   3.969   4.143   0.709
  283    H    LYS  39           H        LYS  39   1.767   4.212   5.376
  284    HA   LYS  39           HA       LYS  39   2.098   1.590   6.409
  285   1HB   LYS  39          2HB       LYS  39   1.233   2.541   8.514
  286   2HB   LYS  39          1HB       LYS  39   2.452   3.583   7.784
  287   1HG   LYS  39          2HG       LYS  39   0.994   5.288   7.617
  288   2HG   LYS  39          1HG       LYS  39  -0.176   4.271   6.781
  289   1HD   LYS  39          2HD       LYS  39  -1.403   4.697   8.677
  290   2HD   LYS  39          1HD       LYS  39  -0.500   3.300   9.265
  291   1HE   LYS  39          2HE       LYS  39   1.172   4.763  10.283
  292   2HE   LYS  39          1HE       LYS  39   0.364   6.186   9.623
  293   1HZ   LYS  39          1HZ       LYS  39  -0.190   5.708  11.974
  294   2HZ   LYS  39          2HZ       LYS  39  -0.921   4.257  11.478
  295   3HZ   LYS  39          3HZ       LYS  39  -1.545   5.749  10.956
  296    H    GLU  40           H        GLU  40  -0.669   3.293   5.095
  297    HA   GLU  40           HA       GLU  40  -2.498   1.204   6.084
  298   1HB   GLU  40          2HB       GLU  40  -2.877   3.998   5.075
  299   2HB   GLU  40          1HB       GLU  40  -4.204   2.844   4.935
  300   1HG   GLU  40          2HG       GLU  40  -4.313   2.509   7.280
  301   2HG   GLU  40          1HG       GLU  40  -2.727   3.237   7.539
  302    H    LEU  41           H        LEU  41  -0.478   1.326   3.609
  303    HA   LEU  41           HA       LEU  41  -2.069   1.018   1.290
  304   1HB   LEU  41          2HB       LEU  41   0.380   1.467   1.309
  305   2HB   LEU  41          1HB       LEU  41   0.644  -0.173   1.859
  306    HG   LEU  41           HG       LEU  41  -0.008  -1.087  -0.215
  307   1HD1  LEU  41          1HD1      LEU  41  -1.040   0.324  -2.011
  308   2HD1  LEU  41          2HD1      LEU  41  -1.136   1.655  -0.858
  309   3HD1  LEU  41          3HD1      LEU  41  -2.057   0.176  -0.578
  310   1HD2  LEU  41          1HD2      LEU  41   1.734  -0.321  -1.482
  311   2HD2  LEU  41          2HD2      LEU  41   2.091   0.646  -0.051
  312   3HD2  LEU  41          3HD2      LEU  41   1.192   1.355  -1.392
  313    H    GLY  42           H        GLY  42  -1.037  -1.221   3.812
  314   1HA   GLY  42          2HA       GLY  42  -1.787  -3.624   2.453
  315   2HA   GLY  42          1HA       GLY  42  -1.492  -3.455   4.179
  316    H    LYS  43           H        LYS  43  -3.567  -1.159   4.113
  317    HA   LYS  43           HA       LYS  43  -5.850  -2.844   4.714
  318   1HB   LYS  43          2HB       LYS  43  -5.241  -1.029   6.239
  319   2HB   LYS  43          1HB       LYS  43  -5.443   0.147   4.943
  320   1HG   LYS  43          2HG       LYS  43  -7.835  -1.367   5.013
  321   2HG   LYS  43          1HG       LYS  43  -7.442  -0.976   6.688
  322   1HD   LYS  43          2HD       LYS  43  -7.043   1.239   4.779
  323   2HD   LYS  43          1HD       LYS  43  -8.722   0.734   4.980
  324   1HE   LYS  43          2HE       LYS  43  -8.448   0.927   7.453
  325   2HE   LYS  43          1HE       LYS  43  -6.812   1.532   7.198
  326   1HZ   LYS  43          1HZ       LYS  43  -7.722   3.371   5.930
  327   2HZ   LYS  43          2HZ       LYS  43  -8.392   3.335   7.491
  328   3HZ   LYS  43          3HZ       LYS  43  -9.297   2.787   6.162
  329    H    VAL  44           H        VAL  44  -4.895  -0.447   2.259
  330    HA   VAL  44           HA       VAL  44  -7.508  -0.200   1.120
  331    HB   VAL  44           HB       VAL  44  -6.333   0.813  -0.831
  332   1HG1  VAL  44          1HG1      VAL  44  -5.580   1.751   1.948
  333   2HG1  VAL  44          2HG1      VAL  44  -6.964   2.265   0.982
  334   3HG1  VAL  44          3HG1      VAL  44  -5.332   2.718   0.492
  335   1HG2  VAL  44          1HG2      VAL  44  -3.934   1.112  -0.788
  336   2HG2  VAL  44          2HG2      VAL  44  -4.264  -0.612  -0.617
  337   3HG2  VAL  44          3HG2      VAL  44  -3.822   0.347   0.796
  338    H    MET  45           H        MET  45  -4.761  -2.355   0.527
  339    HA   MET  45           HA       MET  45  -5.789  -3.509  -1.877
  340   1HB   MET  45          2HB       MET  45  -3.834  -4.644   0.136
  341   2HB   MET  45          1HB       MET  45  -4.148  -5.308  -1.468
  342   1HG   MET  45          2HG       MET  45  -3.459  -3.125  -2.462
  343   2HG   MET  45          1HG       MET  45  -3.044  -2.556  -0.848
  344   1HE   MET  45          1HE       MET  45  -0.321  -3.266   0.234
  345   2HE   MET  45          2HE       MET  45  -0.607  -4.989   0.472
  346   3HE   MET  45          3HE       MET  45  -1.925  -3.843   0.711
  347    H    ARG  46           H        ARG  46  -6.263  -4.113   1.537
  348    HA   ARG  46           HA       ARG  46  -7.327  -6.699   1.498
  349   1HB   ARG  46          2HB       ARG  46  -7.410  -4.408   3.328
  350   2HB   ARG  46          1HB       ARG  46  -8.859  -5.407   3.404
  351   1HG   ARG  46          2HG       ARG  46  -6.049  -6.535   3.540
  352   2HG   ARG  46          1HG       ARG  46  -7.000  -6.126   4.966
  353   1HD   ARG  46          2HD       ARG  46  -7.819  -8.097   2.814
  354   2HD   ARG  46          1HD       ARG  46  -7.205  -8.525   4.406
  355    HE   ARG  46           HE       ARG  46  -9.377  -6.923   4.929
  356   1HH1  ARG  46          2HH1      ARG  46  -8.813  -9.830   3.076
  357   2HH1  ARG  46          1HH1      ARG  46 -10.421 -10.431   3.295
  358   1HH2  ARG  46          1HH2      ARG  46 -11.480  -7.732   5.203
  359   2HH2  ARG  46          2HH2      ARG  46 -11.927  -9.248   4.496
  360    H    MET  47           H        MET  47  -8.940  -3.565   0.990
  361    HA   MET  47           HA       MET  47 -11.565  -4.621   0.645
  362   1HB   MET  47          2HB       MET  47 -10.232  -2.011   0.006
  363   2HB   MET  47          1HB       MET  47 -11.821  -2.358  -0.676
  364   1HG   MET  47          2HG       MET  47 -12.843  -2.480   1.429
  365   2HG   MET  47          1HG       MET  47 -11.318  -2.790   2.259
  366   1HE   MET  47          1HE       MET  47 -12.926  -1.268   3.608
  367   2HE   MET  47          2HE       MET  47 -12.703   0.478   3.692
  368   3HE   MET  47          3HE       MET  47 -11.387  -0.594   4.162
  369    H    LEU  48           H        LEU  48  -8.867  -3.992  -1.551
  370    HA   LEU  48           HA       LEU  48 -10.243  -4.372  -3.998
  371   1HB   LEU  48          2HB       LEU  48  -7.626  -3.788  -3.219
  372   2HB   LEU  48          1HB       LEU  48  -7.499  -5.320  -4.051
  373    HG   LEU  48           HG       LEU  48  -7.099  -3.566  -5.639
  374   1HD1  LEU  48          1HD1      LEU  48  -8.524  -5.499  -6.367
  375   2HD1  LEU  48          2HD1      LEU  48  -8.816  -4.025  -7.291
  376   3HD1  LEU  48          3HD1      LEU  48  -9.951  -4.517  -6.034
  377   1HD2  LEU  48          1HD2      LEU  48  -9.675  -2.407  -4.551
  378   2HD2  LEU  48          2HD2      LEU  48  -8.972  -1.882  -6.082
  379   3HD2  LEU  48          3HD2      LEU  48  -8.077  -1.660  -4.579
  380    H    GLY  49           H        GLY  49  -8.511  -6.626  -1.852
  381   1HA   GLY  49          2HA       GLY  49  -9.905  -8.858  -1.934
  382   2HA   GLY  49          1HA       GLY  49  -9.257  -8.892  -3.569
  383    H    GLN  50           H        GLN  50  -6.690  -7.648  -2.747
  384    HA   GLN  50           HA       GLN  50  -5.363 -10.096  -1.915
  385   1HB   GLN  50          2HB       GLN  50  -4.557  -7.545  -3.156
  386   2HB   GLN  50          1HB       GLN  50  -3.374  -8.229  -2.041
  387   1HG   GLN  50          2HG       GLN  50  -2.776  -9.324  -3.996
  388   2HG   GLN  50          1HG       GLN  50  -3.938 -10.475  -3.337
  389   1HE2  GLN  50          1HE2      GLN  50  -6.153 -10.455  -4.276
  390   2HE2  GLN  50          2HE2      GLN  50  -6.413  -9.798  -5.820
  391    H    ASN  51           H        ASN  51  -3.962 -10.296  -0.139
  392    HA   ASN  51           HA       ASN  51  -3.951  -8.243   1.925
  393   1HB   ASN  51          2HB       ASN  51  -6.065  -9.555   2.285
  394   2HB   ASN  51          1HB       ASN  51  -5.070 -10.988   2.533
  395   1HD2  ASN  51          1HD2      ASN  51  -5.185 -11.342   4.776
  396   2HD2  ASN  51          2HD2      ASN  51  -4.835 -10.163   5.945
  397    HA   PRO  52           HA       PRO  52  -0.078 -10.702   1.792
  398   1HB   PRO  52          2HB       PRO  52   1.580  -8.527   1.826
  399   2HB   PRO  52          1HB       PRO  52   0.881  -9.204   0.351
  400   1HG   PRO  52          2HG       PRO  52   0.173  -6.728   1.804
  401   2HG   PRO  52          1HG       PRO  52  -0.008  -7.118   0.087
  402   1HD   PRO  52          2HD       PRO  52  -2.064  -7.149   2.040
  403   2HD   PRO  52          1HD       PRO  52  -2.167  -7.813   0.392
  404    H    THR  53           H        THR  53   2.095  -9.933   3.174
  405    HA   THR  53           HA       THR  53   1.154  -9.818   5.968
  406    HB   THR  53           HB       THR  53   3.111 -10.967   6.583
  407    HG1  THR  53           HG1      THR  53   4.967 -10.641   5.644
  408   1HG2  THR  53          1HG2      THR  53   3.275 -12.875   5.126
  409   2HG2  THR  53          2HG2      THR  53   2.664 -11.945   3.759
  410   3HG2  THR  53          3HG2      THR  53   1.598 -12.327   5.112
  411    HA   PRO  54           HA       PRO  54   3.054  -5.899   6.712
  412   1HB   PRO  54          2HB       PRO  54   4.632  -6.259   8.922
  413   2HB   PRO  54          1HB       PRO  54   2.864  -6.170   8.969
  414   1HG   PRO  54          2HG       PRO  54   4.645  -8.542   9.189
  415   2HG   PRO  54          1HG       PRO  54   3.060  -8.247   9.924
  416   1HD   PRO  54          2HD       PRO  54   3.511  -9.851   7.689
  417   2HD   PRO  54          1HD       PRO  54   1.938  -9.151   8.135
  418    H    GLU  55           H        GLU  55   5.310  -8.577   6.528
  419    HA   GLU  55           HA       GLU  55   7.629  -6.890   6.029
  420   1HB   GLU  55          2HB       GLU  55   7.471  -9.872   5.570
  421   2HB   GLU  55          1HB       GLU  55   8.895  -8.896   5.919
  422   1HG   GLU  55          2HG       GLU  55   6.597  -9.407   7.837
  423   2HG   GLU  55          1HG       GLU  55   8.183 -10.173   7.912
  424    H    GLU  56           H        GLU  56   5.402  -8.965   4.220
  425    HA   GLU  56           HA       GLU  56   6.708  -8.812   1.702
  426   1HB   GLU  56          2HB       GLU  56   4.866 -10.448   2.416
  427   2HB   GLU  56          1HB       GLU  56   3.731  -9.143   2.073
  428   1HG   GLU  56          2HG       GLU  56   3.780  -9.768  -0.090
  429   2HG   GLU  56          1HG       GLU  56   5.455  -9.219  -0.150
  430    H    LEU  57           H        LEU  57   3.903  -7.027   3.021
  431    HA   LEU  57           HA       LEU  57   3.518  -5.319   0.822
  432   1HB   LEU  57          2HB       LEU  57   1.739  -4.881   2.082
  433   2HB   LEU  57          1HB       LEU  57   2.491  -5.597   3.486
  434    HG   LEU  57           HG       LEU  57   3.203  -2.791   2.714
  435   1HD1  LEU  57          1HD1      LEU  57   1.313  -1.925   3.957
  436   2HD1  LEU  57          2HD1      LEU  57   0.782  -3.556   4.365
  437   3HD1  LEU  57          3HD1      LEU  57   0.700  -2.993   2.696
  438   1HD2  LEU  57          1HD2      LEU  57   2.778  -3.263   5.507
  439   2HD2  LEU  57          2HD2      LEU  57   4.298  -2.923   4.679
  440   3HD2  LEU  57          3HD2      LEU  57   3.747  -4.590   4.865
  441    H    GLN  58           H        GLN  58   5.725  -5.141   3.561
  442    HA   GLN  58           HA       GLN  58   6.491  -2.461   3.431
  443   1HB   GLN  58          2HB       GLN  58   7.208  -4.232   5.145
  444   2HB   GLN  58          1HB       GLN  58   8.451  -4.687   3.981
  445   1HG   GLN  58          2HG       GLN  58   9.390  -3.069   5.543
  446   2HG   GLN  58          1HG       GLN  58   9.235  -2.309   3.960
  447   1HE2  GLN  58          1HE2      GLN  58   7.531  -0.679   3.678
  448   2HE2  GLN  58          2HE2      GLN  58   6.754   0.012   5.020
  449    H    GLU  59           H        GLU  59   7.760  -5.264   1.645
  450    HA   GLU  59           HA       GLU  59   9.766  -3.860   0.210
  451   1HB   GLU  59          2HB       GLU  59   8.410  -6.501  -0.067
  452   2HB   GLU  59          1HB       GLU  59   9.247  -5.865  -1.482
  453   1HG   GLU  59          2HG       GLU  59  10.520  -6.070   1.262
  454   2HG   GLU  59          1HG       GLU  59  10.685  -7.306   0.015
  455    H    MET  60           H        MET  60   6.329  -4.430  -0.381
  456    HA   MET  60           HA       MET  60   6.250  -3.543  -3.077
  457   1HB   MET  60          2HB       MET  60   4.049  -3.420  -0.995
  458   2HB   MET  60          1HB       MET  60   3.836  -3.286  -2.740
  459   1HG   MET  60          2HG       MET  60   4.958  -5.585  -2.902
  460   2HG   MET  60          1HG       MET  60   4.734  -5.700  -1.157
  461   1HE   MET  60          1HE       MET  60   2.069  -7.664  -0.978
  462   2HE   MET  60          2HE       MET  60   3.797  -7.605  -1.316
  463   3HE   MET  60          3HE       MET  60   2.680  -8.145  -2.567
  464    H    ILE  61           H        ILE  61   5.644  -1.867   0.010
  465    HA   ILE  61           HA       ILE  61   4.915   0.638  -0.931
  466    HB   ILE  61           HB       ILE  61   6.494  -0.158   1.520
  467   1HG1  ILE  61          2HG1      ILE  61   3.717   0.887   1.610
  468   2HG1  ILE  61          1HG1      ILE  61   3.926  -0.710   0.893
  469   1HG2  ILE  61          1HG2      ILE  61   7.020   2.149   1.150
  470   2HG2  ILE  61          2HG2      ILE  61   5.755   2.114   2.380
  471   3HG2  ILE  61          3HG2      ILE  61   5.353   2.527   0.712
  472   1HD1  ILE  61          1HD1      ILE  61   5.018  -1.535   2.874
  473   2HD1  ILE  61          2HD1      ILE  61   3.523  -0.749   3.380
  474   3HD1  ILE  61          3HD1      ILE  61   5.067   0.078   3.584
  475    H    ASP  62           H        ASP  62   8.185  -0.076   0.298
  476    HA   ASP  62           HA       ASP  62   9.480   2.159  -0.691
  477   1HB   ASP  62          2HB       ASP  62  10.379   0.325   0.866
  478   2HB   ASP  62          1HB       ASP  62  10.829  -0.533  -0.607
  479    H    GLU  63           H        GLU  63   8.793  -0.881  -2.388
  480    HA   GLU  63           HA       GLU  63  10.424  -0.394  -4.659
  481   1HB   GLU  63          2HB       GLU  63   8.125  -2.218  -4.077
  482   2HB   GLU  63          1HB       GLU  63   8.643  -2.004  -5.749
  483   1HG   GLU  63          2HG       GLU  63  10.765  -2.498  -3.706
  484   2HG   GLU  63          1HG       GLU  63   9.744  -3.861  -4.165
  485    H    VAL  64           H        VAL  64   6.915   0.140  -4.150
  486    HA   VAL  64           HA       VAL  64   6.580   1.324  -6.755
  487    HB   VAL  64           HB       VAL  64   4.301   1.766  -6.119
  488   1HG1  VAL  64          1HG1      VAL  64   3.586  -0.494  -5.502
  489   2HG1  VAL  64          2HG1      VAL  64   5.213  -0.875  -4.942
  490   3HG1  VAL  64          3HG1      VAL  64   4.919  -0.572  -6.652
  491   1HG2  VAL  64          1HG2      VAL  64   3.498   1.400  -3.824
  492   2HG2  VAL  64          2HG2      VAL  64   4.758   2.633  -3.841
  493   3HG2  VAL  64          3HG2      VAL  64   5.133   0.996  -3.303
  494    H    ASP  65           H        ASP  65   7.384   2.578  -3.586
  495    HA   ASP  65           HA       ASP  65   6.566   5.268  -4.094
  496   1HB   ASP  65          2HB       ASP  65   7.402   3.935  -1.851
  497   2HB   ASP  65          1HB       ASP  65   8.820   4.908  -2.232
  498    H    GLU  66           H        GLU  66   7.352   5.704  -6.166
  499    HA   GLU  66           HA       GLU  66  10.124   5.523  -6.864
  500   1HB   GLU  66          2HB       GLU  66   7.706   6.782  -8.114
  501   2HB   GLU  66          1HB       GLU  66   9.312   7.148  -8.744
  502   1HG   GLU  66          2HG       GLU  66   9.641   4.551  -8.706
  503   2HG   GLU  66          1HG       GLU  66   7.879   4.505  -8.654
  504    H    ASP  67           H        ASP  67   8.076   8.101  -5.585
  505    HA   ASP  67           HA       ASP  67  10.230  10.060  -5.820
  506   1HB   ASP  67          2HB       ASP  67   8.466  11.486  -4.477
  507   2HB   ASP  67          1HB       ASP  67   8.249  11.186  -6.198
  508    H    GLY  68           H        GLY  68   8.559   8.234  -3.285
  509   1HA   GLY  68          2HA       GLY  68   9.299   7.651  -1.168
  510   2HA   GLY  68          1HA       GLY  68  10.819   8.475  -1.513
  511    H    SER  69           H        SER  69   7.453   9.642  -1.497
  512    HA   SER  69           HA       SER  69   8.264  11.961   0.078
  513   1HB   SER  69          2HB       SER  69   5.892  12.696  -0.340
  514   2HB   SER  69          1HB       SER  69   6.839  12.435  -1.800
  515    HG   SER  69           HG       SER  69   4.549  11.365  -1.240
  516    H    GLY  70           H        GLY  70   5.855   9.343   0.275
  517   1HA   GLY  70          2HA       GLY  70   6.003   8.410   2.741
  518   2HA   GLY  70          1HA       GLY  70   5.307   9.992   3.082
  519    H    THR  71           H        THR  71   3.800  10.065   0.564
  520    HA   THR  71           HA       THR  71   1.599   8.262   1.342
  521    HB   THR  71           HB       THR  71   0.110   9.790   0.213
  522    HG1  THR  71           HG1      THR  71   2.370  11.346  -0.485
  523   1HG2  THR  71          1HG2      THR  71   2.177  11.250   1.879
  524   2HG2  THR  71          2HG2      THR  71   0.715  10.455   2.469
  525   3HG2  THR  71          3HG2      THR  71   0.589  11.900   1.466
  526    H    VAL  72           H        VAL  72   0.445   7.102  -0.271
  527    HA   VAL  72           HA       VAL  72   2.130   6.359  -2.559
  528    HB   VAL  72           HB       VAL  72  -0.435   5.051  -1.637
  529   1HG1  VAL  72          1HG1      VAL  72   0.355   3.174  -2.981
  530   2HG1  VAL  72          2HG1      VAL  72   1.856   4.027  -3.342
  531   3HG1  VAL  72          3HG1      VAL  72   0.326   4.626  -3.984
  532   1HG2  VAL  72          1HG2      VAL  72   2.456   4.493  -0.911
  533   2HG2  VAL  72          2HG2      VAL  72   1.143   3.350  -0.630
  534   3HG2  VAL  72          3HG2      VAL  72   1.142   4.912   0.190
  535    H    ASP  73           H        ASP  73   1.780   7.247  -4.464
  536    HA   ASP  73           HA       ASP  73  -0.691   8.695  -5.008
  537   1HB   ASP  73          2HB       ASP  73   1.462   8.266  -7.063
  538   2HB   ASP  73          1HB       ASP  73   0.407   9.658  -6.833
  539    H    PHE  74           H        PHE  74  -1.628   8.371  -7.308
  540    HA   PHE  74           HA       PHE  74  -2.718   5.774  -7.475
  541   1HB   PHE  74          2HB       PHE  74  -3.650   7.961  -8.463
  542   2HB   PHE  74          1HB       PHE  74  -2.570   7.665  -9.824
  543    HD1  PHE  74           HD1      PHE  74  -4.075   7.113 -11.567
  544    HD2  PHE  74           HD2      PHE  74  -4.397   5.130  -7.769
  545    HE1  PHE  74           HE1      PHE  74  -5.720   5.528 -12.530
  546    HE2  PHE  74           HE2      PHE  74  -6.038   3.548  -8.733
  547    HZ   PHE  74           HZ       PHE  74  -6.702   3.744 -11.114
  548    H    ASP  75           H        ASP  75   0.075   7.255  -9.060
  549    HA   ASP  75           HA       ASP  75   0.532   5.182 -10.964
  550   1HB   ASP  75          2HB       ASP  75   2.074   7.496  -9.904
  551   2HB   ASP  75          1HB       ASP  75   3.004   6.187 -10.632
  552    H    GLU  76           H        GLU  76   1.650   5.778  -7.657
  553    HA   GLU  76           HA       GLU  76   3.390   3.471  -7.581
  554   1HB   GLU  76          2HB       GLU  76   2.330   4.878  -5.142
  555   2HB   GLU  76          1HB       GLU  76   3.890   4.089  -5.371
  556   1HG   GLU  76          2HG       GLU  76   4.444   5.871  -7.074
  557   2HG   GLU  76          1HG       GLU  76   2.962   6.697  -6.602
  558    H    PHE  77           H        PHE  77   0.045   4.112  -7.027
  559    HA   PHE  77           HA       PHE  77  -0.499   1.850  -5.328
  560   1HB   PHE  77          2HB       PHE  77  -1.911   3.858  -5.275
  561   2HB   PHE  77          1HB       PHE  77  -2.344   3.617  -6.963
  562    HD1  PHE  77           HD1      PHE  77  -2.542   2.044  -3.573
  563    HD2  PHE  77           HD2      PHE  77  -4.114   2.184  -7.576
  564    HE1  PHE  77           HE1      PHE  77  -4.416   0.566  -2.893
  565    HE2  PHE  77           HE2      PHE  77  -5.986   0.704  -6.890
  566    HZ   PHE  77           HZ       PHE  77  -6.135  -0.103  -4.548
  567    H    LEU  78           H        LEU  78  -0.831   2.569  -8.803
  568    HA   LEU  78           HA       LEU  78  -2.040   0.034  -9.432
  569   1HB   LEU  78          2HB       LEU  78  -0.802   2.183 -11.128
  570   2HB   LEU  78          1HB       LEU  78  -1.508   0.728 -11.796
  571    HG   LEU  78           HG       LEU  78  -3.272   2.217  -9.960
  572   1HD1  LEU  78          1HD1      LEU  78  -2.801   4.239 -10.856
  573   2HD1  LEU  78          2HD1      LEU  78  -3.643   3.645 -12.288
  574   3HD1  LEU  78          3HD1      LEU  78  -1.885   3.538 -12.188
  575   1HD2  LEU  78          1HD2      LEU  78  -3.789   0.208 -11.495
  576   2HD2  LEU  78          2HD2      LEU  78  -3.735   1.367 -12.824
  577   3HD2  LEU  78          3HD2      LEU  78  -4.923   1.558 -11.535
  578    H    VAL  79           H        VAL  79   1.266   1.336  -9.596
  579    HA   VAL  79           HA       VAL  79   2.444  -0.722 -11.092
  580    HB   VAL  79           HB       VAL  79   4.577  -0.138  -9.888
  581   1HG1  VAL  79          1HG1      VAL  79   4.431   1.101 -11.807
  582   2HG1  VAL  79          2HG1      VAL  79   4.271   2.423 -10.650
  583   3HG1  VAL  79          3HG1      VAL  79   2.834   1.733 -11.405
  584   1HG2  VAL  79          1HG2      VAL  79   3.590   0.517  -7.736
  585   2HG2  VAL  79          2HG2      VAL  79   2.761   1.861  -8.514
  586   3HG2  VAL  79          3HG2      VAL  79   4.520   1.849  -8.419
  587    H    MET  80           H        MET  80   1.489  -0.638  -7.727
  588    HA   MET  80           HA       MET  80   2.950  -2.589  -6.503
  589   1HB   MET  80          2HB       MET  80   0.159  -1.664  -6.281
  590   2HB   MET  80          1HB       MET  80   0.467  -3.269  -5.619
  591   1HG   MET  80          2HG       MET  80   2.587  -2.037  -4.575
  592   2HG   MET  80          1HG       MET  80   1.551  -0.621  -4.754
  593   1HE   MET  80          1HE       MET  80  -1.602  -1.442  -2.795
  594   2HE   MET  80          2HE       MET  80  -1.425  -2.177  -4.386
  595   3HE   MET  80          3HE       MET  80  -0.833  -0.541  -4.108
  596    H    MET  81           H        MET  81   0.457  -3.113  -8.963
  597    HA   MET  81           HA       MET  81   0.425  -5.984  -8.608
  598   1HB   MET  81          2HB       MET  81  -0.753  -4.168 -10.716
  599   2HB   MET  81          1HB       MET  81  -0.930  -5.922 -10.743
  600   1HG   MET  81          2HG       MET  81  -1.703  -4.244  -8.347
  601   2HG   MET  81          1HG       MET  81  -2.837  -4.638  -9.638
  602   1HE   MET  81          1HE       MET  81  -2.597  -6.845  -6.009
  603   2HE   MET  81          2HE       MET  81  -3.473  -5.453  -6.641
  604   3HE   MET  81          3HE       MET  81  -1.735  -5.344  -6.375
  605    H    VAL  82           H        VAL  82   1.765  -3.751 -11.048
  606    HA   VAL  82           HA       VAL  82   2.924  -5.903 -12.592
  607    HB   VAL  82           HB       VAL  82   3.994  -4.020 -13.888
  608   1HG1  VAL  82          1HG1      VAL  82   1.582  -5.073 -14.141
  609   2HG1  VAL  82          2HG1      VAL  82   2.034  -3.651 -15.082
  610   3HG1  VAL  82          3HG1      VAL  82   1.058  -3.471 -13.623
  611   1HG2  VAL  82          1HG2      VAL  82   3.431  -1.761 -13.400
  612   2HG2  VAL  82          2HG2      VAL  82   3.909  -2.451 -11.850
  613   3HG2  VAL  82          3HG2      VAL  82   2.200  -2.238 -12.231
  614    H    ARG  83           H        ARG  83   4.093  -3.747 -10.064
  615    HA   ARG  83           HA       ARG  83   6.876  -4.078 -10.552
  616   1HB   ARG  83          2HB       ARG  83   7.199  -3.289  -8.241
  617   2HB   ARG  83          1HB       ARG  83   6.045  -2.279  -9.107
  618   1HG   ARG  83          2HG       ARG  83   4.771  -2.602  -7.238
  619   2HG   ARG  83          1HG       ARG  83   4.353  -4.115  -8.038
  620   1HD   ARG  83          2HD       ARG  83   6.705  -4.781  -6.791
  621   2HD   ARG  83          1HD       ARG  83   6.004  -3.647  -5.641
  622    HE   ARG  83           HE       ARG  83   3.927  -5.329  -6.241
  623   1HH1  ARG  83          2HH1      ARG  83   7.215  -5.786  -5.148
  624   2HH1  ARG  83          1HH1      ARG  83   6.853  -7.237  -4.278
  625   1HH2  ARG  83          1HH2      ARG  83   3.480  -7.229  -5.092
  626   2HH2  ARG  83          2HH2      ARG  83   4.746  -8.052  -4.245
  627    H    CYS  84           H        CYS  84   4.501  -6.187  -9.199
  628    HA   CYS  84           HA       CYS  84   6.170  -7.775  -7.535
  629   1HB   CYS  84          2HB       CYS  84   3.591  -7.720  -7.650
  630   2HB   CYS  84          1HB       CYS  84   3.765  -8.840  -9.001
  631    HG   CYS  84           HG       CYS  84   4.725 -10.610  -7.435
  632    H    MET  85           H        MET  85   5.801  -7.585 -10.988
  633    HA   MET  85           HA       MET  85   6.489 -10.176 -11.795
  634   1HB   MET  85          2HB       MET  85   6.766  -7.458 -13.006
  635   2HB   MET  85          1HB       MET  85   7.631  -8.797 -13.759
  636   1HG   MET  85          2HG       MET  85   4.703  -9.014 -13.060
  637   2HG   MET  85          1HG       MET  85   5.234  -8.322 -14.591
  638   1HE   MET  85          1HE       MET  85   3.669 -10.936 -13.269
  639   2HE   MET  85          2HE       MET  85   5.024 -11.646 -12.396
  640   3HE   MET  85          3HE       MET  85   4.337 -12.491 -13.780
  641    H    LYS  86           H        LYS  86   8.777  -7.421 -11.816
  642    HA   LYS  86           HA       LYS  86  10.808  -8.947 -10.432
  643   1HB   LYS  86          2HB       LYS  86  12.440  -8.920 -12.252
  644   2HB   LYS  86          1HB       LYS  86  11.008  -9.832 -12.725
  645   1HG   LYS  86          2HG       LYS  86  10.580  -7.088 -13.420
  646   2HG   LYS  86          1HG       LYS  86  12.160  -7.573 -14.036
  647   1HD   LYS  86          2HD       LYS  86  10.665  -9.765 -14.683
  648   2HD   LYS  86          1HD       LYS  86   9.462  -8.485 -14.838
  649   1HE   LYS  86          2HE       LYS  86  10.416  -8.488 -16.968
  650   2HE   LYS  86          1HE       LYS  86  11.364  -7.239 -16.159
  651   1HZ   LYS  86          1HZ       LYS  86  13.103  -8.794 -15.747
  652   2HZ   LYS  86          2HZ       LYS  86  12.706  -8.896 -17.396
  653   3HZ   LYS  86          3HZ       LYS  86  12.172 -10.092 -16.316
  654    H    ASP  87           H        ASP  87  12.850  -7.693 -10.212
  655    HA   ASP  87           HA       ASP  87  12.240  -4.936  -9.587
  656   1HB   ASP  87          2HB       ASP  87  14.721  -6.635  -9.295
  657   2HB   ASP  87          1HB       ASP  87  14.714  -4.912  -8.919
  658    H    ASP  88           H        ASP  88  15.026  -6.286 -11.367
  659    HA   ASP  88           HA       ASP  88  14.570  -4.763 -13.739
  660   1HB   ASP  88          2HB       ASP  88  15.416  -3.062 -11.916
  661   2HB   ASP  88          1HB       ASP  88  16.988  -3.787 -12.249
  662    H    SER  89           HN       SER  89  14.974  -7.387 -13.506
  663    HA   SER  89           HA       SER  89  17.542  -7.779 -14.847
  664   1HB   SER  89          2HB       SER  89  16.908  -8.827 -12.141
  665   2HB   SER  89          1HB       SER  89  17.659  -9.957 -13.265
  666    HG   SER  89           HG       SER  89  18.766  -7.927 -11.915
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1  18.193  -1.385 -19.902
    2   2H    MET   1          2H        MET   1  17.366  -2.865 -19.786
    3   3H    MET   1          3H        MET   1  18.004  -2.132 -18.393
    4    HA   MET   1           HA       MET   1  16.418  -0.453 -18.363
    5   1HB   MET   1          2HB       MET   1  14.902  -0.019 -20.255
    6   2HB   MET   1          1HB       MET   1  16.584   0.112 -20.766
    7   1HG   MET   1          2HG       MET   1  16.220  -2.484 -21.316
    8   2HG   MET   1          1HG       MET   1  14.544  -1.956 -21.459
    9   1HE   MET   1          1HE       MET   1  14.402   0.857 -23.522
   10   2HE   MET   1          2HE       MET   1  13.643  -0.451 -22.619
   11   3HE   MET   1          3HE       MET   1  13.897  -0.619 -24.353
   12    H    ASN   2           H        ASN   2  14.321  -0.719 -17.560
   13    HA   ASN   2           HA       ASN   2  13.580  -3.458 -16.987
   14   1HB   ASN   2          2HB       ASN   2  12.394  -0.792 -16.205
   15   2HB   ASN   2          1HB       ASN   2  11.651  -2.329 -15.761
   16   1HD2  ASN   2          1HD2      ASN   2  13.534  -3.963 -14.871
   17   2HD2  ASN   2          2HD2      ASN   2  14.529  -3.261 -13.690
   18    H    ASP   3           H        ASP   3  12.111  -4.662 -18.004
   19    HA   ASP   3           HA       ASP   3  10.244  -3.331 -19.881
   20   1HB   ASP   3          2HB       ASP   3  11.850  -5.859 -20.273
   21   2HB   ASP   3          1HB       ASP   3  10.451  -5.451 -21.268
   22    H    ILE   4           H        ILE   4  10.111  -4.579 -16.999
   23    HA   ILE   4           HA       ILE   4   8.170  -6.709 -17.379
   24    HB   ILE   4           HB       ILE   4   8.078  -6.869 -14.980
   25   1HG1  ILE   4          2HG1      ILE   4   9.632  -5.154 -13.704
   26   2HG1  ILE   4          1HG1      ILE   4   9.301  -4.123 -15.097
   27   1HG2  ILE   4          1HG2      ILE   4  10.301  -7.503 -14.556
   28   2HG2  ILE   4          2HG2      ILE   4  10.961  -6.190 -15.531
   29   3HG2  ILE   4          3HG2      ILE   4  10.194  -7.571 -16.315
   30   1HD1  ILE   4          1HD1      ILE   4   6.926  -5.462 -13.962
   31   2HD1  ILE   4          2HD1      ILE   4   7.132  -3.791 -14.485
   32   3HD1  ILE   4          3HD1      ILE   4   7.693  -4.291 -12.890
   33    H    TYR   5           H        TYR   5   8.183  -3.270 -16.852
   34    HA   TYR   5           HA       TYR   5   5.501  -2.996 -15.912
   35   1HB   TYR   5          2HB       TYR   5   7.291  -1.000 -17.325
   36   2HB   TYR   5          1HB       TYR   5   5.779  -0.611 -16.506
   37    HD1  TYR   5           HD1      TYR   5   9.303  -1.008 -16.115
   38    HD2  TYR   5           HD2      TYR   5   5.572  -1.359 -14.019
   39    HE1  TYR   5           HE1      TYR   5  10.507  -0.873 -13.952
   40    HE2  TYR   5           HE2      TYR   5   6.775  -1.218 -11.853
   41    HH   TYR   5           HH       TYR   5   9.602  -1.855 -11.281
   42    H    LYS   6           H        LYS   6   6.997  -3.224 -19.067
   43    HA   LYS   6           HA       LYS   6   4.645  -2.380 -20.533
   44   1HB   LYS   6          2HB       LYS   6   6.956  -3.949 -21.677
   45   2HB   LYS   6          1HB       LYS   6   5.889  -2.815 -22.501
   46   1HG   LYS   6          2HG       LYS   6   8.050  -2.186 -20.476
   47   2HG   LYS   6          1HG       LYS   6   7.946  -1.642 -22.151
   48   1HD   LYS   6          2HD       LYS   6   6.060  -0.232 -21.663
   49   2HD   LYS   6          1HD       LYS   6   5.881  -0.933 -20.052
   50   1HE   LYS   6          2HE       LYS   6   7.635   0.274 -19.183
   51   2HE   LYS   6          1HE       LYS   6   8.527   0.279 -20.705
   52   1HZ   LYS   6          1HZ       LYS   6   7.660   2.477 -20.113
   53   2HZ   LYS   6          2HZ       LYS   6   6.075   1.870 -20.168
   54   3HZ   LYS   6          3HZ       LYS   6   7.019   1.917 -21.580
   55    H    ALA   7           H        ALA   7   6.168  -5.397 -19.573
   56    HA   ALA   7           HA       ALA   7   4.339  -7.086 -21.034
   57   1HB   ALA   7          1HB       ALA   7   6.787  -7.545 -20.052
   58   2HB   ALA   7          2HB       ALA   7   5.616  -8.842 -20.296
   59   3HB   ALA   7          3HB       ALA   7   5.839  -8.145 -18.691
   60    H    ALA   8           H        ALA   8   4.426  -5.590 -17.874
   61    HA   ALA   8           HA       ALA   8   2.324  -7.288 -16.794
   62   1HB   ALA   8          1HB       ALA   8   2.505  -5.800 -14.810
   63   2HB   ALA   8          2HB       ALA   8   3.724  -4.854 -15.668
   64   3HB   ALA   8          3HB       ALA   8   4.040  -6.542 -15.258
   65    H    VAL   9           H        VAL   9   2.704  -3.952 -17.989
   66    HA   VAL   9           HA       VAL   9   0.165  -2.993 -17.252
   67    HB   VAL   9           HB       VAL   9   2.162  -1.684 -18.218
   68   1HG1  VAL   9          1HG1      VAL   9   2.265  -1.377 -20.579
   69   2HG1  VAL   9          2HG1      VAL   9   0.749  -2.243 -20.832
   70   3HG1  VAL   9          3HG1      VAL   9   2.193  -3.120 -20.330
   71   1HG2  VAL   9          1HG2      VAL   9   0.656   0.064 -19.075
   72   2HG2  VAL   9          2HG2      VAL   9  -0.032  -0.692 -17.638
   73   3HG2  VAL   9          3HG2      VAL   9  -0.640  -1.121 -19.238
   74    H    GLU  10           H        GLU  10   1.196  -4.944 -19.998
   75    HA   GLU  10           HA       GLU  10  -1.238  -4.751 -21.483
   76   1HB   GLU  10          2HB       GLU  10   1.124  -6.607 -21.534
   77   2HB   GLU  10          1HB       GLU  10  -0.325  -7.002 -22.458
   78   1HG   GLU  10          2HG       GLU  10   0.946  -4.273 -22.667
   79   2HG   GLU  10          1HG       GLU  10   1.530  -5.623 -23.641
   80    H    GLN  11           H        GLN  11  -0.202  -6.660 -18.743
   81    HA   GLN  11           HA       GLN  11  -2.277  -8.664 -19.016
   82   1HB   GLN  11          2HB       GLN  11  -0.539  -8.009 -16.622
   83   2HB   GLN  11          1HB       GLN  11  -1.517  -9.460 -16.835
   84   1HG   GLN  11          2HG       GLN  11   0.437  -8.812 -18.993
   85   2HG   GLN  11          1HG       GLN  11   1.092  -9.398 -17.465
   86   1HE2  GLN  11          1HE2      GLN  11  -1.028 -10.267 -20.191
   87   2HE2  GLN  11          2HE2      GLN  11  -1.059 -11.931 -19.850
   88    H    LEU  12           H        LEU  12  -1.818  -5.618 -17.335
   89    HA   LEU  12           HA       LEU  12  -3.990  -5.808 -15.525
   90   1HB   LEU  12          2HB       LEU  12  -3.033  -3.233 -16.742
   91   2HB   LEU  12          1HB       LEU  12  -3.740  -3.489 -15.165
   92    HG   LEU  12           HG       LEU  12  -0.941  -4.094 -16.094
   93   1HD1  LEU  12          1HD1      LEU  12  -0.478  -2.858 -13.914
   94   2HD1  LEU  12          2HD1      LEU  12  -2.203  -2.494 -13.858
   95   3HD1  LEU  12          3HD1      LEU  12  -1.218  -1.895 -15.193
   96   1HD2  LEU  12          1HD2      LEU  12  -1.350  -6.090 -14.946
   97   2HD2  LEU  12          2HD2      LEU  12  -2.512  -5.338 -13.851
   98   3HD2  LEU  12          3HD2      LEU  12  -0.786  -5.044 -13.641
   99    H    THR  13           H        THR  13  -6.113  -5.591 -15.800
  100    HA   THR  13           HA       THR  13  -7.112  -4.873 -18.484
  101    HB   THR  13           HB       THR  13  -9.313  -5.797 -17.244
  102    HG1  THR  13           HG1      THR  13  -8.623  -6.477 -15.359
  103   1HG2  THR  13          1HG2      THR  13  -9.067  -7.661 -18.584
  104   2HG2  THR  13          2HG2      THR  13  -7.362  -7.860 -18.177
  105   3HG2  THR  13          3HG2      THR  13  -7.860  -6.601 -19.307
  106    H    ASP  14           H        ASP  14  -9.260  -3.751 -18.510
  107    HA   ASP  14           HA       ASP  14  -9.087  -1.236 -17.231
  108   1HB   ASP  14          2HB       ASP  14 -10.549  -2.185 -19.318
  109   2HB   ASP  14          1HB       ASP  14 -11.784  -2.123 -18.061
  110    H    GLU  15           H        GLU  15 -10.724  -4.237 -16.399
  111    HA   GLU  15           HA       GLU  15 -12.433  -3.276 -14.364
  112   1HB   GLU  15          2HB       GLU  15 -11.176  -5.952 -14.920
  113   2HB   GLU  15          1HB       GLU  15 -12.125  -5.689 -13.458
  114   1HG   GLU  15          2HG       GLU  15 -14.092  -5.205 -14.681
  115   2HG   GLU  15          1HG       GLU  15 -13.197  -4.942 -16.179
  116    H    GLN  16           H        GLN  16  -9.078  -4.474 -14.258
  117    HA   GLN  16           HA       GLN  16  -8.711  -4.336 -11.462
  118   1HB   GLN  16          2HB       GLN  16  -6.902  -4.389 -13.835
  119   2HB   GLN  16          1HB       GLN  16  -6.217  -3.869 -12.296
  120   1HG   GLN  16          2HG       GLN  16  -7.588  -6.044 -11.460
  121   2HG   GLN  16          1HG       GLN  16  -7.229  -6.542 -13.113
  122   1HE2  GLN  16          1HE2      GLN  16  -4.920  -6.689 -13.740
  123   2HE2  GLN  16          2HE2      GLN  16  -3.719  -6.824 -12.547
  124    H    LYS  17           H        LYS  17  -8.033  -1.951 -14.028
  125    HA   LYS  17           HA       LYS  17  -7.082   0.074 -12.256
  126   1HB   LYS  17          2HB       LYS  17  -7.885  -0.037 -15.126
  127   2HB   LYS  17          1HB       LYS  17  -7.852   1.545 -14.348
  128   1HG   LYS  17          2HG       LYS  17  -5.642   1.466 -14.952
  129   2HG   LYS  17          1HG       LYS  17  -5.502   0.562 -13.442
  130   1HD   LYS  17          2HD       LYS  17  -5.271  -1.470 -14.517
  131   2HD   LYS  17          1HD       LYS  17  -6.222  -0.961 -15.912
  132   1HE   LYS  17          2HE       LYS  17  -4.017   0.747 -15.949
  133   2HE   LYS  17          1HE       LYS  17  -3.337  -0.814 -15.490
  134   1HZ   LYS  17          1HZ       LYS  17  -4.453  -1.813 -17.394
  135   2HZ   LYS  17          2HZ       LYS  17  -3.406  -0.568 -17.885
  136   3HZ   LYS  17          3HZ       LYS  17  -5.083  -0.301 -17.838
  137    H    ASN  18           H        ASN  18 -10.269  -0.883 -13.379
  138    HA   ASN  18           HA       ASN  18 -11.698   1.465 -12.684
  139   1HB   ASN  18          2HB       ASN  18 -12.392  -1.372 -13.251
  140   2HB   ASN  18          1HB       ASN  18 -13.564  -0.449 -12.312
  141   1HD2  ASN  18          1HD2      ASN  18 -13.410  -1.396 -15.302
  142   2HD2  ASN  18          2HD2      ASN  18 -13.825   0.008 -16.162
  143    H    GLU  19           H        GLU  19 -10.979  -1.528 -10.901
  144    HA   GLU  19           HA       GLU  19 -12.300  -0.713  -8.487
  145   1HB   GLU  19          2HB       GLU  19 -10.119  -2.793  -8.824
  146   2HB   GLU  19          1HB       GLU  19 -11.220  -2.638  -7.455
  147   1HG   GLU  19          2HG       GLU  19 -12.180  -3.089 -10.289
  148   2HG   GLU  19          1HG       GLU  19 -11.860  -4.407  -9.165
  149    H    PHE  20           H        PHE  20  -9.002  -0.575  -9.731
  150    HA   PHE  20           HA       PHE  20  -7.704   0.284  -7.369
  151   1HB   PHE  20          2HB       PHE  20  -7.069   0.379 -10.290
  152   2HB   PHE  20          1HB       PHE  20  -6.111   1.369  -9.193
  153    HD1  PHE  20           HD1      PHE  20  -7.625  -1.803  -8.068
  154    HD2  PHE  20           HD2      PHE  20  -4.074   0.084  -9.579
  155    HE1  PHE  20           HE1      PHE  20  -6.294  -3.787  -7.417
  156    HE2  PHE  20           HE2      PHE  20  -2.742  -1.899  -8.921
  157    HZ   PHE  20           HZ       PHE  20  -3.851  -3.837  -7.840
  158    H    LYS  21           H        LYS  21  -9.258   2.083 -10.011
  159    HA   LYS  21           HA       LYS  21  -8.526   4.681  -9.137
  160   1HB   LYS  21          2HB       LYS  21  -9.384   4.214 -11.415
  161   2HB   LYS  21          1HB       LYS  21 -10.966   3.847 -10.733
  162   1HG   LYS  21          2HG       LYS  21 -10.866   6.172 -11.585
  163   2HG   LYS  21          1HG       LYS  21 -11.131   6.137  -9.842
  164   1HD   LYS  21          2HD       LYS  21  -8.840   6.678  -9.389
  165   2HD   LYS  21          1HD       LYS  21  -8.378   6.408 -11.071
  166   1HE   LYS  21          2HE       LYS  21  -8.543   8.736 -11.003
  167   2HE   LYS  21          1HE       LYS  21 -10.151   8.286 -11.567
  168   1HZ   LYS  21          1HZ       LYS  21  -9.405   8.832  -8.743
  169   2HZ   LYS  21          2HZ       LYS  21 -10.957   8.421  -9.300
  170   3HZ   LYS  21          3HZ       LYS  21 -10.249   9.894  -9.760
  171    H    ALA  22           H        ALA  22 -11.425   2.690  -8.564
  172    HA   ALA  22           HA       ALA  22 -12.773   4.615  -6.949
  173   1HB   ALA  22          1HB       ALA  22 -13.826   2.593  -8.083
  174   2HB   ALA  22          2HB       ALA  22 -14.313   2.876  -6.411
  175   3HB   ALA  22          3HB       ALA  22 -13.134   1.619  -6.787
  176    H    ALA  23           H        ALA  23 -10.668   1.848  -6.222
  177    HA   ALA  23           HA       ALA  23 -10.833   1.935  -3.406
  178   1HB   ALA  23          1HB       ALA  23  -8.571   1.011  -5.196
  179   2HB   ALA  23          2HB       ALA  23  -9.858   0.010  -4.523
  180   3HB   ALA  23          3HB       ALA  23  -8.650   0.727  -3.457
  181    H    PHE  24           H        PHE  24  -9.093   3.903  -5.697
  182    HA   PHE  24           HA       PHE  24  -7.287   5.022  -3.719
  183   1HB   PHE  24          2HB       PHE  24  -6.889   4.711  -6.290
  184   2HB   PHE  24          1HB       PHE  24  -7.790   6.218  -6.431
  185    HD1  PHE  24           HD1      PHE  24  -6.894   8.321  -5.525
  186    HD2  PHE  24           HD2      PHE  24  -4.703   4.637  -5.205
  187    HE1  PHE  24           HE1      PHE  24  -4.848   9.589  -4.934
  188    HE2  PHE  24           HE2      PHE  24  -2.658   5.907  -4.615
  189    HZ   PHE  24           HZ       PHE  24  -2.730   8.381  -4.478
  190    H    ASP  25           H        ASP  25  -9.907   6.292  -5.796
  191    HA   ASP  25           HA       ASP  25 -10.086   8.852  -4.738
  192   1HB   ASP  25          2HB       ASP  25 -11.383   7.594  -6.720
  193   2HB   ASP  25          1HB       ASP  25 -12.650   7.556  -5.492
  194    H    ILE  26           H        ILE  26 -11.637   5.881  -3.505
  195    HA   ILE  26           HA       ILE  26 -13.420   7.051  -1.698
  196    HB   ILE  26           HB       ILE  26 -13.184   4.950  -0.354
  197   1HG1  ILE  26          2HG1      ILE  26 -11.114   4.286  -2.474
  198   2HG1  ILE  26          1HG1      ILE  26 -10.773   4.572  -0.770
  199   1HG2  ILE  26          1HG2      ILE  26 -13.581   3.520  -2.655
  200   2HG2  ILE  26          2HG2      ILE  26 -13.844   5.167  -3.223
  201   3HG2  ILE  26          3HG2      ILE  26 -14.807   4.530  -1.890
  202   1HD1  ILE  26          1HD1      ILE  26 -12.343   2.299  -1.992
  203   2HD1  ILE  26          2HD1      ILE  26 -12.410   2.674  -0.270
  204   3HD1  ILE  26          3HD1      ILE  26 -10.881   2.203  -1.011
  205    H    PHE  27           H        PHE  27  -9.954   6.421  -1.355
  206    HA   PHE  27           HA       PHE  27  -9.896   7.370   1.394
  207   1HB   PHE  27          2HB       PHE  27  -7.801   6.422  -0.551
  208   2HB   PHE  27          1HB       PHE  27  -7.349   7.215   0.955
  209    HD1  PHE  27           HD1      PHE  27  -8.427   6.283   3.143
  210    HD2  PHE  27           HD2      PHE  27  -8.272   4.124  -0.565
  211    HE1  PHE  27           HE1      PHE  27  -8.779   4.155   4.366
  212    HE2  PHE  27           HE2      PHE  27  -8.625   1.994   0.656
  213    HZ   PHE  27           HZ       PHE  27  -8.879   2.012   3.124
  214    H    ILE  28           H        ILE  28  -9.273   8.602  -1.842
  215    HA   ILE  28           HA       ILE  28  -8.168  11.113  -0.804
  216    HB   ILE  28           HB       ILE  28  -8.705  10.481  -3.704
  217   1HG1  ILE  28          2HG1      ILE  28  -7.366   8.633  -3.134
  218   2HG1  ILE  28          1HG1      ILE  28  -6.193   9.828  -3.665
  219   1HG2  ILE  28          1HG2      ILE  28  -8.075  12.727  -3.499
  220   2HG2  ILE  28          2HG2      ILE  28  -6.538  11.920  -3.820
  221   3HG2  ILE  28          3HG2      ILE  28  -6.962  12.391  -2.173
  222   1HD1  ILE  28          1HD1      ILE  28  -6.799   8.889  -0.880
  223   2HD1  ILE  28          2HD1      ILE  28  -6.156  10.513  -1.126
  224   3HD1  ILE  28          3HD1      ILE  28  -5.236   9.108  -1.665
  225    H    GLN  29           H        GLN  29 -10.864  10.582  -0.095
  226    HA   GLN  29           HA       GLN  29 -12.641  12.003  -1.861
  227   1HB   GLN  29          2HB       GLN  29 -14.226  11.924   0.109
  228   2HB   GLN  29          1HB       GLN  29 -13.665  10.353  -0.458
  229   1HG   GLN  29          2HG       GLN  29 -12.083  10.179   1.353
  230   2HG   GLN  29          1HG       GLN  29 -12.366  11.850   1.835
  231   1HE2  GLN  29          1HE2      GLN  29 -13.237   8.675   2.567
  232   2HE2  GLN  29          2HE2      GLN  29 -14.694   8.992   3.379
  233    H    ASP  30           H        ASP  30 -10.659  12.791   0.929
  234    HA   ASP  30           HA       ASP  30 -10.974  15.626   0.362
  235   1HB   ASP  30          2HB       ASP  30 -11.362  16.041   2.892
  236   2HB   ASP  30          1HB       ASP  30 -12.739  15.593   1.893
  237    H    ALA  31           H        ALA  31  -8.794  13.862   0.057
  238    HA   ALA  31           HA       ALA  31  -6.978  14.029   2.266
  239   1HB   ALA  31          1HB       ALA  31  -5.272  13.311   0.618
  240   2HB   ALA  31          2HB       ALA  31  -6.458  13.515  -0.672
  241   3HB   ALA  31          3HB       ALA  31  -6.711  12.290   0.571
  242    H    GLU  32           H        GLU  32  -5.125  15.322   2.469
  243    HA   GLU  32           HA       GLU  32  -5.469  18.055   1.634
  244   1HB   GLU  32          2HB       GLU  32  -3.161  16.701   3.053
  245   2HB   GLU  32          1HB       GLU  32  -3.312  18.441   2.810
  246   1HG   GLU  32          2HG       GLU  32  -5.412  18.459   4.087
  247   2HG   GLU  32          1HG       GLU  32  -5.312  16.710   4.298
  248    H    ASP  33           H        ASP  33  -3.059  15.530   0.954
  249    HA   ASP  33           HA       ASP  33  -1.862  17.134  -1.177
  250   1HB   ASP  33          2HB       ASP  33  -0.438  15.780   0.368
  251   2HB   ASP  33          1HB       ASP  33  -1.181  14.319  -0.281
  252    H    GLY  34           H        GLY  34  -3.977  14.361  -0.762
  253   1HA   GLY  34          2HA       GLY  34  -5.587  13.758  -2.434
  254   2HA   GLY  34          1HA       GLY  34  -4.471  14.330  -3.670
  255    H    CYS  35           H        CYS  35  -3.479  12.326  -0.953
  256    HA   CYS  35           HA       CYS  35  -3.361   9.923  -2.636
  257   1HB   CYS  35          2HB       CYS  35  -0.942  10.991  -1.165
  258   2HB   CYS  35          1HB       CYS  35  -1.018   9.540  -2.157
  259    HG   CYS  35           HG       CYS  35  -1.379  11.061  -4.262
  260    H    ILE  36           H        ILE  36  -2.322   8.082  -1.208
  261    HA   ILE  36           HA       ILE  36  -3.706   8.182   1.403
  262    HB   ILE  36           HB       ILE  36  -3.613   5.690   1.303
  263   1HG1  ILE  36          2HG1      ILE  36  -3.197   5.372  -1.507
  264   2HG1  ILE  36          1HG1      ILE  36  -1.812   6.247  -0.855
  265   1HG2  ILE  36          1HG2      ILE  36  -4.876   6.659  -1.245
  266   2HG2  ILE  36          2HG2      ILE  36  -5.474   7.246   0.306
  267   3HG2  ILE  36          3HG2      ILE  36  -5.504   5.520  -0.055
  268   1HD1  ILE  36          1HD1      ILE  36  -2.606   3.459  -0.450
  269   2HD1  ILE  36          2HD1      ILE  36  -2.268   4.305   1.061
  270   3HD1  ILE  36          3HD1      ILE  36  -1.040   4.227  -0.201
  271    H    SER  37           H        SER  37  -2.574   6.378   2.918
  272    HA   SER  37           HA       SER  37   0.151   7.378   3.307
  273   1HB   SER  37          2HB       SER  37  -1.638   7.237   5.166
  274   2HB   SER  37          1HB       SER  37  -1.311   5.507   5.161
  275    HG   SER  37           HG       SER  37   0.014   6.633   6.649
  276    H    THR  38           H        THR  38   1.944   6.080   3.406
  277    HA   THR  38           HA       THR  38   2.104   3.845   1.718
  278    HB   THR  38           HB       THR  38   4.318   3.425   2.954
  279    HG1  THR  38           HG1      THR  38   4.373   4.408   4.803
  280   1HG2  THR  38          1HG2      THR  38   4.420   4.622   0.919
  281   2HG2  THR  38          2HG2      THR  38   5.232   5.674   2.079
  282   3HG2  THR  38          3HG2      THR  38   3.568   6.009   1.598
  283    H    LYS  39           H        LYS  39   1.922   4.001   5.281
  284    HA   LYS  39           HA       LYS  39   2.043   1.213   5.743
  285   1HB   LYS  39          2HB       LYS  39   1.149   1.714   7.964
  286   2HB   LYS  39          1HB       LYS  39   2.385   2.890   7.521
  287   1HG   LYS  39          2HG       LYS  39   0.707   4.536   6.939
  288   2HG   LYS  39          1HG       LYS  39  -0.587   3.358   7.149
  289   1HD   LYS  39          2HD       LYS  39   1.262   3.871   9.450
  290   2HD   LYS  39          1HD       LYS  39   0.011   5.061   9.090
  291   1HE   LYS  39          2HE       LYS  39  -1.686   3.220   9.140
  292   2HE   LYS  39          1HE       LYS  39  -0.413   2.112   9.649
  293   1HZ   LYS  39          1HZ       LYS  39  -0.022   3.512  11.585
  294   2HZ   LYS  39          2HZ       LYS  39  -1.631   2.963  11.544
  295   3HZ   LYS  39          3HZ       LYS  39  -1.265   4.561  11.100
  296    H    GLU  40           H        GLU  40  -0.574   3.295   4.723
  297    HA   GLU  40           HA       GLU  40  -2.643   1.332   5.314
  298   1HB   GLU  40          2HB       GLU  40  -2.568   4.134   4.328
  299   2HB   GLU  40          1HB       GLU  40  -3.934   3.144   3.813
  300   1HG   GLU  40          2HG       GLU  40  -4.028   2.477   6.365
  301   2HG   GLU  40          1HG       GLU  40  -3.144   3.988   6.583
  302    H    LEU  41           H        LEU  41  -0.355   1.532   2.897
  303    HA   LEU  41           HA       LEU  41  -1.922   1.052   0.568
  304   1HB   LEU  41          2HB       LEU  41   0.454   1.817   0.572
  305   2HB   LEU  41          1HB       LEU  41   0.925   0.215   1.089
  306    HG   LEU  41           HG       LEU  41   0.369  -0.743  -0.985
  307   1HD1  LEU  41          1HD1      LEU  41  -1.270   1.757  -1.374
  308   2HD1  LEU  41          2HD1      LEU  41  -1.784   0.072  -1.477
  309   3HD1  LEU  41          3HD1      LEU  41  -0.789   0.771  -2.755
  310   1HD2  LEU  41          1HD2      LEU  41   2.392   0.410  -1.328
  311   2HD2  LEU  41          2HD2      LEU  41   1.612   1.989  -1.258
  312   3HD2  LEU  41          3HD2      LEU  41   1.392   0.960  -2.672
  313    H    GLY  42           H        GLY  42  -0.618  -1.039   3.093
  314   1HA   GLY  42          2HA       GLY  42  -1.100  -3.505   1.690
  315   2HA   GLY  42          1HA       GLY  42  -0.754  -3.333   3.407
  316    H    LYS  43           H        LYS  43  -3.147  -1.230   3.170
  317    HA   LYS  43           HA       LYS  43  -5.174  -3.108   4.065
  318   1HB   LYS  43          2HB       LYS  43  -4.635  -0.828   5.130
  319   2HB   LYS  43          1HB       LYS  43  -5.505  -0.127   3.767
  320   1HG   LYS  43          2HG       LYS  43  -7.240  -0.368   5.273
  321   2HG   LYS  43          1HG       LYS  43  -7.338  -1.922   4.446
  322   1HD   LYS  43          2HD       LYS  43  -6.505  -3.090   6.244
  323   2HD   LYS  43          1HD       LYS  43  -5.493  -1.749   6.782
  324   1HE   LYS  43          2HE       LYS  43  -7.594  -0.545   7.485
  325   2HE   LYS  43          1HE       LYS  43  -8.492  -2.018   7.121
  326   1HZ   LYS  43          1HZ       LYS  43  -7.880  -1.865   9.467
  327   2HZ   LYS  43          2HZ       LYS  43  -6.236  -1.821   9.044
  328   3HZ   LYS  43          3HZ       LYS  43  -7.160  -3.210   8.724
  329    H    VAL  44           H        VAL  44  -4.583  -0.940   1.323
  330    HA   VAL  44           HA       VAL  44  -7.185  -1.115   0.195
  331    HB   VAL  44           HB       VAL  44  -6.138  -0.278  -1.881
  332   1HG1  VAL  44          1HG1      VAL  44  -5.297   1.838  -0.932
  333   2HG1  VAL  44          2HG1      VAL  44  -5.138   1.066   0.647
  334   3HG1  VAL  44          3HG1      VAL  44  -6.735   1.287  -0.070
  335   1HG2  VAL  44          1HG2      VAL  44  -3.901  -0.374  -2.295
  336   2HG2  VAL  44          2HG2      VAL  44  -3.890  -1.615  -1.047
  337   3HG2  VAL  44          3HG2      VAL  44  -3.484   0.049  -0.636
  338    H    MET  45           H        MET  45  -4.328  -3.151  -0.018
  339    HA   MET  45           HA       MET  45  -5.104  -4.714  -2.250
  340   1HB   MET  45          2HB       MET  45  -3.472  -5.689   0.106
  341   2HB   MET  45          1HB       MET  45  -3.451  -6.308  -1.544
  342   1HG   MET  45          2HG       MET  45  -2.836  -3.414  -1.243
  343   2HG   MET  45          1HG       MET  45  -1.629  -4.532  -0.612
  344   1HE   MET  45          1HE       MET  45  -3.890  -3.477  -3.221
  345   2HE   MET  45          2HE       MET  45  -4.036  -5.067  -3.968
  346   3HE   MET  45          3HE       MET  45  -3.130  -3.796  -4.789
  347    H    ARG  46           H        ARG  46  -5.766  -4.911   1.199
  348    HA   ARG  46           HA       ARG  46  -7.110  -7.442   1.120
  349   1HB   ARG  46          2HB       ARG  46  -6.643  -5.321   3.122
  350   2HB   ARG  46          1HB       ARG  46  -8.142  -6.225   3.329
  351   1HG   ARG  46          2HG       ARG  46  -6.083  -8.099   2.689
  352   2HG   ARG  46          1HG       ARG  46  -5.475  -7.050   3.969
  353   1HD   ARG  46          2HD       ARG  46  -6.649  -8.965   4.945
  354   2HD   ARG  46          1HD       ARG  46  -7.525  -7.479   5.284
  355    HE   ARG  46           HE       ARG  46  -8.455  -8.818   2.898
  356   1HH1  ARG  46          2HH1      ARG  46  -8.670  -8.685   6.382
  357   2HH1  ARG  46          1HH1      ARG  46 -10.266  -9.351   6.434
  358   1HH2  ARG  46          1HH2      ARG  46 -10.550  -9.690   2.993
  359   2HH2  ARG  46          2HH2      ARG  46 -11.327  -9.918   4.524
  360    H    MET  47           H        MET  47  -8.089  -4.083   0.746
  361    HA   MET  47           HA       MET  47 -10.910  -4.530   0.886
  362   1HB   MET  47          2HB       MET  47  -9.225  -2.290   0.705
  363   2HB   MET  47          1HB       MET  47 -10.188  -2.262  -0.772
  364   1HG   MET  47          2HG       MET  47 -11.586  -2.837   1.812
  365   2HG   MET  47          1HG       MET  47 -11.102  -1.175   1.477
  366   1HE   MET  47          1HE       MET  47 -13.351  -4.159   0.608
  367   2HE   MET  47          2HE       MET  47 -14.775  -3.211   0.184
  368   3HE   MET  47          3HE       MET  47 -13.975  -2.942   1.731
  369    H    LEU  48           H        LEU  48  -8.529  -4.524  -1.730
  370    HA   LEU  48           HA       LEU  48 -10.455  -4.658  -3.858
  371   1HB   LEU  48          2HB       LEU  48  -7.505  -5.256  -3.742
  372   2HB   LEU  48          1HB       LEU  48  -8.447  -5.404  -5.209
  373    HG   LEU  48           HG       LEU  48  -8.537  -2.797  -3.753
  374   1HD1  LEU  48          1HD1      LEU  48  -6.465  -2.141  -5.090
  375   2HD1  LEU  48          2HD1      LEU  48  -6.180  -3.865  -5.322
  376   3HD1  LEU  48          3HD1      LEU  48  -6.175  -3.182  -3.697
  377   1HD2  LEU  48          1HD2      LEU  48  -9.880  -3.205  -5.792
  378   2HD2  LEU  48          2HD2      LEU  48  -8.408  -3.600  -6.681
  379   3HD2  LEU  48          3HD2      LEU  48  -8.660  -1.963  -6.076
  380    H    GLY  49           H        GLY  49  -8.142  -7.092  -2.605
  381   1HA   GLY  49          2HA       GLY  49  -9.760  -9.233  -2.177
  382   2HA   GLY  49          1HA       GLY  49  -9.550  -9.255  -3.925
  383    H    GLN  50           H        GLN  50  -7.498  -8.735  -1.050
  384    HA   GLN  50           HA       GLN  50  -5.754 -10.942  -1.827
  385   1HB   GLN  50          2HB       GLN  50  -5.005  -8.082  -2.121
  386   2HB   GLN  50          1HB       GLN  50  -3.804  -9.131  -1.369
  387   1HG   GLN  50          2HG       GLN  50  -4.256 -10.742  -3.341
  388   2HG   GLN  50          1HG       GLN  50  -5.036  -9.361  -4.114
  389   1HE2  GLN  50          1HE2      GLN  50  -1.918 -10.592  -2.931
  390   2HE2  GLN  50          2HE2      GLN  50  -0.969  -9.427  -3.721
  391    H    ASN  51           H        ASN  51  -3.930 -11.157  -0.162
  392    HA   ASN  51           HA       ASN  51  -4.487 -10.000   2.446
  393   1HB   ASN  51          2HB       ASN  51  -5.978 -12.135   2.020
  394   2HB   ASN  51          1HB       ASN  51  -4.481 -12.996   2.376
  395   1HD2  ASN  51          1HD2      ASN  51  -7.134 -12.468   3.976
  396   2HD2  ASN  51          2HD2      ASN  51  -6.563 -11.978   5.498
  397    HA   PRO  52           HA       PRO  52  -0.053 -11.088   1.724
  398   1HB   PRO  52          2HB       PRO  52   0.912  -8.545   2.005
  399   2HB   PRO  52          1HB       PRO  52   0.345  -9.209   0.468
  400   1HG   PRO  52          2HG       PRO  52  -0.937  -7.231   2.247
  401   2HG   PRO  52          1HG       PRO  52  -1.129  -7.469   0.504
  402   1HD   PRO  52          2HD       PRO  52  -2.925  -8.320   2.542
  403   2HD   PRO  52          1HD       PRO  52  -2.991  -8.756   0.817
  404    H    THR  53           H        THR  53   1.886  -9.900   3.161
  405    HA   THR  53           HA       THR  53   0.999 -10.152   5.976
  406    HB   THR  53           HB       THR  53   2.980 -11.241   6.521
  407    HG1  THR  53           HG1      THR  53   4.830 -10.629   5.750
  408   1HG2  THR  53          1HG2      THR  53   1.740 -12.672   4.975
  409   2HG2  THR  53          2HG2      THR  53   3.475 -12.908   4.765
  410   3HG2  THR  53          3HG2      THR  53   2.570 -11.935   3.604
  411    HA   PRO  54           HA       PRO  54   2.565  -6.128   6.849
  412   1HB   PRO  54          2HB       PRO  54   4.087  -6.458   9.108
  413   2HB   PRO  54          1HB       PRO  54   2.317  -6.494   9.094
  414   1HG   PRO  54          2HG       PRO  54   4.253  -8.750   9.278
  415   2HG   PRO  54          1HG       PRO  54   2.639  -8.587   9.989
  416   1HD   PRO  54          2HD       PRO  54   3.221 -10.082   7.718
  417   2HD   PRO  54          1HD       PRO  54   1.605  -9.471   8.137
  418    H    GLU  55           H        GLU  55   5.014  -8.640   6.697
  419    HA   GLU  55           HA       GLU  55   7.213  -6.772   6.305
  420   1HB   GLU  55          2HB       GLU  55   7.301  -9.749   5.807
  421   2HB   GLU  55          1HB       GLU  55   8.629  -8.671   6.231
  422   1HG   GLU  55          2HG       GLU  55   7.397  -8.239   8.430
  423   2HG   GLU  55          1HG       GLU  55   6.358  -9.598   7.999
  424    H    GLU  56           H        GLU  56   5.104  -8.854   4.408
  425    HA   GLU  56           HA       GLU  56   6.513  -8.642   1.934
  426   1HB   GLU  56          2HB       GLU  56   4.664 -10.339   2.686
  427   2HB   GLU  56          1HB       GLU  56   3.554  -9.115   2.074
  428   1HG   GLU  56          2HG       GLU  56   4.374  -9.283  -0.123
  429   2HG   GLU  56          1HG       GLU  56   5.886 -10.027   0.400
  430    H    LEU  57           H        LEU  57   3.478  -7.086   3.079
  431    HA   LEU  57           HA       LEU  57   3.251  -5.379   0.833
  432   1HB   LEU  57          2HB       LEU  57   1.333  -4.704   1.746
  433   2HB   LEU  57          1HB       LEU  57   1.587  -6.035   2.838
  434    HG   LEU  57           HG       LEU  57   0.869  -4.215   4.158
  435   1HD1  LEU  57          1HD1      LEU  57   3.372  -5.350   4.568
  436   2HD1  LEU  57          2HD1      LEU  57   2.430  -4.447   5.753
  437   3HD1  LEU  57          3HD1      LEU  57   3.651  -3.623   4.785
  438   1HD2  LEU  57          1HD2      LEU  57   2.938  -2.246   3.587
  439   2HD2  LEU  57          2HD2      LEU  57   1.184  -2.055   3.611
  440   3HD2  LEU  57          3HD2      LEU  57   1.988  -2.629   2.150
  441    H    GLN  58           H        GLN  58   5.263  -5.178   3.644
  442    HA   GLN  58           HA       GLN  58   5.693  -2.362   3.679
  443   1HB   GLN  58          2HB       GLN  58   6.542  -4.495   5.240
  444   2HB   GLN  58          1HB       GLN  58   8.022  -3.945   4.462
  445   1HG   GLN  58          2HG       GLN  58   6.076  -2.144   5.937
  446   2HG   GLN  58          1HG       GLN  58   7.583  -2.761   6.613
  447   1HE2  GLN  58          1HE2      GLN  58   6.212  -0.411   4.377
  448   2HE2  GLN  58          2HE2      GLN  58   7.675   0.363   4.004
  449    H    GLU  59           H        GLU  59   7.318  -5.059   2.022
  450    HA   GLU  59           HA       GLU  59   9.429  -3.548   0.869
  451   1HB   GLU  59          2HB       GLU  59   8.103  -6.145   0.082
  452   2HB   GLU  59          1HB       GLU  59   9.407  -5.438  -0.871
  453   1HG   GLU  59          2HG       GLU  59  10.661  -5.294   1.424
  454   2HG   GLU  59          1HG       GLU  59   9.490  -6.510   1.938
  455    H    MET  60           H        MET  60   6.136  -4.286  -0.177
  456    HA   MET  60           HA       MET  60   6.254  -3.270  -2.796
  457   1HB   MET  60          2HB       MET  60   3.942  -3.341  -0.845
  458   2HB   MET  60          1HB       MET  60   3.787  -2.974  -2.563
  459   1HG   MET  60          2HG       MET  60   5.077  -5.235  -2.888
  460   2HG   MET  60          1HG       MET  60   4.537  -5.572  -1.244
  461   1HE   MET  60          1HE       MET  60   1.426  -7.267  -1.843
  462   2HE   MET  60          2HE       MET  60   2.165  -6.281  -0.585
  463   3HE   MET  60          3HE       MET  60   3.151  -7.430  -1.487
  464    H    ILE  61           H        ILE  61   5.810  -1.676   0.321
  465    HA   ILE  61           HA       ILE  61   4.932   0.849  -0.499
  466    HB   ILE  61           HB       ILE  61   6.765   0.091   1.792
  467   1HG1  ILE  61          2HG1      ILE  61   4.703  -0.988   2.159
  468   2HG1  ILE  61          1HG1      ILE  61   4.547   0.513   3.060
  469   1HG2  ILE  61          1HG2      ILE  61   5.362   2.677   1.119
  470   2HG2  ILE  61          2HG2      ILE  61   7.074   2.415   1.458
  471   3HG2  ILE  61          3HG2      ILE  61   5.887   2.282   2.757
  472   1HD1  ILE  61          1HD1      ILE  61   2.511   0.117   1.771
  473   2HD1  ILE  61          2HD1      ILE  61   3.448  -0.031   0.287
  474   3HD1  ILE  61          3HD1      ILE  61   3.354   1.522   1.118
  475    H    ASP  62           H        ASP  62   8.281   0.234   0.540
  476    HA   ASP  62           HA       ASP  62   9.430   2.470  -0.666
  477   1HB   ASP  62          2HB       ASP  62  10.686  -0.221  -0.065
  478   2HB   ASP  62          1HB       ASP  62  11.586   1.236  -0.480
  479    H    GLU  63           H        GLU  63   8.663  -0.685  -2.040
  480    HA   GLU  63           HA       GLU  63  10.255  -0.536  -4.375
  481   1HB   GLU  63          2HB       GLU  63   7.827  -2.085  -3.571
  482   2HB   GLU  63          1HB       GLU  63   8.284  -2.058  -5.275
  483   1HG   GLU  63          2HG       GLU  63  10.511  -2.534  -3.378
  484   2HG   GLU  63          1HG       GLU  63   9.307  -3.819  -3.465
  485    H    VAL  64           H        VAL  64   6.872   0.446  -3.777
  486    HA   VAL  64           HA       VAL  64   6.684   1.564  -6.473
  487    HB   VAL  64           HB       VAL  64   4.358   1.963  -6.001
  488   1HG1  VAL  64          1HG1      VAL  64   4.786  -0.663  -4.635
  489   2HG1  VAL  64          2HG1      VAL  64   5.402  -0.463  -6.274
  490   3HG1  VAL  64          3HG1      VAL  64   3.684  -0.247  -5.947
  491   1HG2  VAL  64          1HG2      VAL  64   4.486   2.799  -3.729
  492   2HG2  VAL  64          2HG2      VAL  64   5.093   1.250  -3.145
  493   3HG2  VAL  64          3HG2      VAL  64   3.433   1.384  -3.728
  494    H    ASP  65           H        ASP  65   7.568   2.667  -3.348
  495    HA   ASP  65           HA       ASP  65   6.679   5.390  -3.717
  496   1HB   ASP  65          2HB       ASP  65   7.018   4.232  -1.460
  497   2HB   ASP  65          1HB       ASP  65   8.746   4.451  -1.723
  498    H    GLU  66           H        GLU  66   7.643   5.565  -5.865
  499    HA   GLU  66           HA       GLU  66  10.513   5.676  -6.142
  500   1HB   GLU  66          2HB       GLU  66   8.220   6.469  -7.938
  501   2HB   GLU  66          1HB       GLU  66   9.904   6.746  -8.383
  502   1HG   GLU  66          2HG       GLU  66  10.235   4.566  -8.881
  503   2HG   GLU  66          1HG       GLU  66   9.459   4.032  -7.390
  504    H    ASP  67           H        ASP  67   8.101   7.879  -5.049
  505    HA   ASP  67           HA       ASP  67   9.608  10.281  -5.700
  506   1HB   ASP  67          2HB       ASP  67   7.206  10.060  -3.879
  507   2HB   ASP  67          1HB       ASP  67   7.802  11.497  -4.706
  508    H    GLY  68           H        GLY  68   8.723   8.444  -2.780
  509   1HA   GLY  68          2HA       GLY  68   9.891   8.208  -0.783
  510   2HA   GLY  68          1HA       GLY  68  11.142   9.271  -1.420
  511    H    SER  69           H        SER  69   7.693  10.003  -1.292
  512    HA   SER  69           HA       SER  69   8.253  12.411   0.265
  513   1HB   SER  69          2HB       SER  69   5.818  12.901  -0.267
  514   2HB   SER  69          1HB       SER  69   6.893  12.794  -1.657
  515    HG   SER  69           HG       SER  69   5.552  11.324  -2.332
  516    H    GLY  70           H        GLY  70   5.945   9.688   0.344
  517   1HA   GLY  70          2HA       GLY  70   5.998   8.668   2.757
  518   2HA   GLY  70          1HA       GLY  70   5.352  10.254   3.168
  519    H    THR  71           H        THR  71   3.911  10.394   0.543
  520    HA   THR  71           HA       THR  71   1.605   8.727   1.314
  521    HB   THR  71           HB       THR  71   0.231  10.283   0.069
  522    HG1  THR  71           HG1      THR  71   1.080  11.818  -1.204
  523   1HG2  THR  71          1HG2      THR  71   0.853  10.933   2.362
  524   2HG2  THR  71          2HG2      THR  71   0.666  12.353   1.333
  525   3HG2  THR  71          3HG2      THR  71   2.279  11.765   1.741
  526    H    VAL  72           H        VAL  72   0.458   7.540  -0.259
  527    HA   VAL  72           HA       VAL  72   2.136   6.714  -2.534
  528    HB   VAL  72           HB       VAL  72  -0.363   5.359  -1.509
  529   1HG1  VAL  72          1HG1      VAL  72   1.947   4.263  -3.131
  530   2HG1  VAL  72          2HG1      VAL  72   0.476   4.904  -3.863
  531   3HG1  VAL  72          3HG1      VAL  72   0.395   3.488  -2.813
  532   1HG2  VAL  72          1HG2      VAL  72   2.553   4.954  -0.782
  533   2HG2  VAL  72          2HG2      VAL  72   1.297   3.761  -0.453
  534   3HG2  VAL  72          3HG2      VAL  72   1.224   5.348   0.309
  535    H    ASP  73           H        ASP  73   1.747   7.641  -4.395
  536    HA   ASP  73           HA       ASP  73  -0.810   8.899  -4.993
  537   1HB   ASP  73          2HB       ASP  73   1.804   8.697  -6.510
  538   2HB   ASP  73          1HB       ASP  73   0.370   9.476  -7.169
  539    H    PHE  74           H        PHE  74  -1.391   8.533  -7.512
  540    HA   PHE  74           HA       PHE  74  -2.374   5.851  -7.668
  541   1HB   PHE  74          2HB       PHE  74  -3.340   8.054  -8.715
  542   2HB   PHE  74          1HB       PHE  74  -2.275   7.653 -10.063
  543    HD1  PHE  74           HD1      PHE  74  -3.465   6.644 -11.782
  544    HD2  PHE  74           HD2      PHE  74  -4.356   5.597  -7.720
  545    HE1  PHE  74           HE1      PHE  74  -5.107   4.961 -12.578
  546    HE2  PHE  74           HE2      PHE  74  -6.006   3.920  -8.509
  547    HZ   PHE  74           HZ       PHE  74  -6.381   3.600 -10.940
  548    H    ASP  75           H        ASP  75   0.413   7.528  -8.993
  549    HA   ASP  75           HA       ASP  75   1.125   5.633 -10.990
  550   1HB   ASP  75          2HB       ASP  75   2.483   7.869  -9.573
  551   2HB   ASP  75          1HB       ASP  75   3.532   6.633 -10.266
  552    H    GLU  76           H        GLU  76   1.826   5.958  -7.549
  553    HA   GLU  76           HA       GLU  76   3.552   3.632  -7.446
  554   1HB   GLU  76          2HB       GLU  76   2.266   4.985  -5.074
  555   2HB   GLU  76          1HB       GLU  76   3.787   4.095  -5.136
  556   1HG   GLU  76          2HG       GLU  76   4.854   5.839  -6.401
  557   2HG   GLU  76          1HG       GLU  76   3.318   6.659  -6.679
  558    H    PHE  77           H        PHE  77   0.185   4.382  -7.118
  559    HA   PHE  77           HA       PHE  77  -0.628   2.048  -5.667
  560   1HB   PHE  77          2HB       PHE  77  -1.889   4.261  -5.891
  561   2HB   PHE  77          1HB       PHE  77  -2.336   3.731  -7.509
  562    HD1  PHE  77           HD1      PHE  77  -2.394   2.613  -3.934
  563    HD2  PHE  77           HD2      PHE  77  -4.213   2.377  -7.816
  564    HE1  PHE  77           HE1      PHE  77  -4.253   1.280  -2.980
  565    HE2  PHE  77           HE2      PHE  77  -6.070   1.036  -6.863
  566    HZ   PHE  77           HZ       PHE  77  -6.091   0.488  -4.445
  567    H    LEU  78           H        LEU  78  -0.423   2.941  -9.092
  568    HA   LEU  78           HA       LEU  78  -1.642   0.513 -10.045
  569   1HB   LEU  78          2HB       LEU  78  -0.108   2.709 -11.417
  570   2HB   LEU  78          1HB       LEU  78  -0.752   1.325 -12.269
  571    HG   LEU  78           HG       LEU  78  -2.167   3.689 -11.119
  572   1HD1  LEU  78          1HD1      LEU  78  -1.586   2.989 -13.623
  573   2HD1  LEU  78          2HD1      LEU  78  -3.094   3.812 -13.227
  574   3HD1  LEU  78          3HD1      LEU  78  -3.078   2.063 -13.456
  575   1HD2  LEU  78          1HD2      LEU  78  -3.289   0.881 -11.252
  576   2HD2  LEU  78          2HD2      LEU  78  -4.318   2.312 -11.277
  577   3HD2  LEU  78          3HD2      LEU  78  -3.294   1.986  -9.878
  578    H    VAL  79           H        VAL  79   1.708   1.738  -9.860
  579    HA   VAL  79           HA       VAL  79   2.945  -0.384 -11.213
  580    HB   VAL  79           HB       VAL  79   4.999   0.194  -9.897
  581   1HG1  VAL  79          1HG1      VAL  79   3.398   2.271 -11.381
  582   2HG1  VAL  79          2HG1      VAL  79   4.751   1.301 -11.965
  583   3HG1  VAL  79          3HG1      VAL  79   5.033   2.607 -10.813
  584   1HG2  VAL  79          1HG2      VAL  79   4.592   2.534  -8.697
  585   2HG2  VAL  79          2HG2      VAL  79   4.388   1.014  -7.829
  586   3HG2  VAL  79          3HG2      VAL  79   2.980   1.863  -8.460
  587    H    MET  80           H        MET  80   1.709  -0.217  -7.957
  588    HA   MET  80           HA       MET  80   3.085  -2.155  -6.587
  589   1HB   MET  80          2HB       MET  80   0.415  -1.021  -6.451
  590   2HB   MET  80          1HB       MET  80   0.425  -2.714  -5.959
  591   1HG   MET  80          2HG       MET  80   2.699  -1.696  -4.746
  592   2HG   MET  80          1HG       MET  80   1.540  -0.377  -4.596
  593   1HE   MET  80          1HE       MET  80  -0.806  -0.687  -4.068
  594   2HE   MET  80          2HE       MET  80  -1.439  -1.755  -2.817
  595   3HE   MET  80          3HE       MET  80  -1.334  -2.325  -4.480
  596    H    MET  81           H        MET  81   0.703  -2.675  -9.149
  597    HA   MET  81           HA       MET  81   0.602  -5.540  -8.741
  598   1HB   MET  81          2HB       MET  81  -0.462  -3.736 -10.918
  599   2HB   MET  81          1HB       MET  81  -0.633  -5.491 -10.962
  600   1HG   MET  81          2HG       MET  81  -1.529  -3.830  -8.596
  601   2HG   MET  81          1HG       MET  81  -2.596  -4.214  -9.947
  602   1HE   MET  81          1HE       MET  81  -0.877  -5.013  -6.927
  603   2HE   MET  81          2HE       MET  81  -1.365  -6.626  -6.414
  604   3HE   MET  81          3HE       MET  81  -2.555  -5.329  -6.468
  605    H    VAL  82           H        VAL  82   2.006  -3.393 -11.223
  606    HA   VAL  82           HA       VAL  82   3.198  -5.511 -12.724
  607    HB   VAL  82           HB       VAL  82   4.459  -3.702 -13.873
  608   1HG1  VAL  82          1HG1      VAL  82   1.853  -2.426 -13.843
  609   2HG1  VAL  82          2HG1      VAL  82   1.688  -4.182 -13.843
  610   3HG1  VAL  82          3HG1      VAL  82   2.610  -3.383 -15.118
  611   1HG2  VAL  82          1HG2      VAL  82   3.923  -1.351 -13.236
  612   2HG2  VAL  82          2HG2      VAL  82   4.813  -2.201 -11.972
  613   3HG2  VAL  82          3HG2      VAL  82   3.075  -1.956 -11.817
  614    H    ARG  83           H        ARG  83   4.357  -3.548 -10.021
  615    HA   ARG  83           HA       ARG  83   7.118  -4.087 -10.293
  616   1HB   ARG  83          2HB       ARG  83   7.330  -3.461  -7.947
  617   2HB   ARG  83          1HB       ARG  83   6.229  -2.356  -8.766
  618   1HG   ARG  83          2HG       ARG  83   4.406  -3.088  -7.591
  619   2HG   ARG  83          1HG       ARG  83   4.985  -4.750  -7.518
  620   1HD   ARG  83          2HD       ARG  83   6.233  -2.494  -5.937
  621   2HD   ARG  83          1HD       ARG  83   4.951  -3.517  -5.297
  622    HE   ARG  83           HE       ARG  83   7.727  -4.236  -5.635
  623   1HH1  ARG  83          2HH1      ARG  83   4.453  -5.443  -5.464
  624   2HH1  ARG  83          1HH1      ARG  83   4.932  -7.025  -4.955
  625   1HH2  ARG  83          1HH2      ARG  83   8.329  -6.315  -4.965
  626   2HH2  ARG  83          2HH2      ARG  83   7.119  -7.519  -4.673
  627    H    CYS  84           H        CYS  84   4.510  -6.127  -9.288
  628    HA   CYS  84           HA       CYS  84   5.949  -7.953  -7.657
  629   1HB   CYS  84          2HB       CYS  84   3.368  -7.674  -8.030
  630   2HB   CYS  84          1HB       CYS  84   3.627  -8.826  -9.339
  631    HG   CYS  84           HG       CYS  84   4.216 -10.630  -7.675
  632    H    MET  85           H        MET  85   5.917  -7.451 -11.097
  633    HA   MET  85           HA       MET  85   6.432 -10.018 -12.079
  634   1HB   MET  85          2HB       MET  85   6.370  -7.478 -13.167
  635   2HB   MET  85          1HB       MET  85   8.059  -7.945 -13.360
  636   1HG   MET  85          2HG       MET  85   6.015 -10.003 -14.039
  637   2HG   MET  85          1HG       MET  85   6.159  -8.632 -15.139
  638   1HE   MET  85          1HE       MET  85   8.695  -9.720 -17.430
  639   2HE   MET  85          2HE       MET  85   7.491  -8.538 -16.922
  640   3HE   MET  85          3HE       MET  85   7.013 -10.212 -17.190
  641    H    LYS  86           H        LYS  86   8.710  -7.590 -10.795
  642    HA   LYS  86           HA       LYS  86  10.933  -9.485 -11.016
  643   1HB   LYS  86          2HB       LYS  86  10.791  -6.602 -10.111
  644   2HB   LYS  86          1HB       LYS  86  12.265  -7.566 -10.062
  645   1HG   LYS  86          2HG       LYS  86  12.350  -7.778 -12.414
  646   2HG   LYS  86          1HG       LYS  86  10.661  -7.306 -12.603
  647   1HD   LYS  86          2HD       LYS  86  11.823  -5.360 -13.230
  648   2HD   LYS  86          1HD       LYS  86  11.407  -5.048 -11.546
  649   1HE   LYS  86          2HE       LYS  86  13.955  -6.485 -11.898
  650   2HE   LYS  86          1HE       LYS  86  13.946  -4.864 -12.587
  651   1HZ   LYS  86          1HZ       LYS  86  13.319  -5.631  -9.791
  652   2HZ   LYS  86          2HZ       LYS  86  13.039  -4.078 -10.423
  653   3HZ   LYS  86          3HZ       LYS  86  14.621  -4.691 -10.334
  654    H    ASP  87           H        ASP  87  11.905 -10.489  -9.322
  655    HA   ASP  87           HA       ASP  87  10.606 -10.187  -6.682
  656   1HB   ASP  87          2HB       ASP  87  11.354 -12.482  -6.201
  657   2HB   ASP  87          1HB       ASP  87  10.332 -12.426  -7.634
  658    H    ASP  88           H        ASP  88  13.751 -10.544  -8.305
  659    HA   ASP  88           HA       ASP  88  15.901 -10.129  -7.610
  660   1HB   ASP  88          2HB       ASP  88  14.458  -8.078  -5.905
  661   2HB   ASP  88          1HB       ASP  88  16.198  -8.112  -6.191
  662    H    SER  89           HN       SER  89  15.026 -12.374  -6.470
  663    HA   SER  89           HA       SER  89  15.952 -12.198  -3.661
  664   1HB   SER  89          2HB       SER  89  13.919 -14.114  -4.830
  665   2HB   SER  89          1HB       SER  89  14.534 -14.164  -3.180
  666    HG   SER  89           HG       SER  89  12.769 -12.938  -2.982
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  16.945  -5.937 -15.780
    2   2H    MET   1          2H        MET   1  17.989  -6.185 -17.094
    3   3H    MET   1          3H        MET   1  16.513  -7.020 -17.010
    4    HA   MET   1           HA       MET   1  16.857  -4.089 -17.358
    5   1HB   MET   1          2HB       MET   1  16.236  -6.379 -19.197
    6   2HB   MET   1          1HB       MET   1  15.508  -4.804 -19.518
    7   1HG   MET   1          2HG       MET   1  17.632  -3.748 -19.734
    8   2HG   MET   1          1HG       MET   1  18.473  -5.128 -19.026
    9   1HE   MET   1          1HE       MET   1  19.894  -5.114 -22.484
   10   2HE   MET   1          2HE       MET   1  20.166  -6.144 -21.081
   11   3HE   MET   1          3HE       MET   1  19.921  -4.413 -20.861
   12    H    ASN   2           H        ASN   2  15.042  -2.865 -17.094
   13    HA   ASN   2           HA       ASN   2  12.768  -4.147 -15.781
   14   1HB   ASN   2          2HB       ASN   2  13.806  -1.365 -16.006
   15   2HB   ASN   2          1HB       ASN   2  12.065  -1.559 -15.788
   16   1HD2  ASN   2          1HD2      ASN   2  14.845  -3.458 -14.455
   17   2HD2  ASN   2          2HD2      ASN   2  14.373  -3.267 -12.839
   18    H    ASP   3           H        ASP   3  12.045  -5.276 -17.695
   19    HA   ASP   3           HA       ASP   3  10.605  -3.541 -19.618
   20   1HB   ASP   3          2HB       ASP   3  10.693  -5.541 -21.152
   21   2HB   ASP   3          1HB       ASP   3  12.254  -4.797 -20.815
   22    H    ILE   4           H        ILE   4   9.974  -5.205 -16.912
   23    HA   ILE   4           HA       ILE   4   7.797  -6.890 -17.704
   24    HB   ILE   4           HB       ILE   4   7.243  -7.006 -15.323
   25   1HG1  ILE   4          2HG1      ILE   4   9.029  -5.686 -13.845
   26   2HG1  ILE   4          1HG1      ILE   4   9.012  -4.590 -15.229
   27   1HG2  ILE   4          1HG2      ILE   4   9.167  -8.167 -14.665
   28   2HG2  ILE   4          2HG2      ILE   4  10.249  -7.017 -15.453
   29   3HG2  ILE   4          3HG2      ILE   4   9.315  -8.157 -16.422
   30   1HD1  ILE   4          1HD1      ILE   4   6.807  -3.984 -14.899
   31   2HD1  ILE   4          2HD1      ILE   4   7.282  -4.298 -13.229
   32   3HD1  ILE   4          3HD1      ILE   4   6.388  -5.518 -14.138
   33    H    TYR   5           H        TYR   5   8.121  -3.484 -17.001
   34    HA   TYR   5           HA       TYR   5   5.382  -2.908 -16.461
   35   1HB   TYR   5          2HB       TYR   5   7.467  -1.070 -17.669
   36   2HB   TYR   5          1HB       TYR   5   5.967  -0.584 -16.880
   37    HD1  TYR   5           HD1      TYR   5   5.619  -1.504 -14.430
   38    HD2  TYR   5           HD2      TYR   5   9.424  -1.192 -16.407
   39    HE1  TYR   5           HE1      TYR   5   6.771  -1.552 -12.235
   40    HE2  TYR   5           HE2      TYR   5  10.568  -1.238 -14.215
   41    HH   TYR   5           HH       TYR   5   9.601  -0.520 -11.620
   42    H    LYS   6           H        LYS   6   7.304  -3.206 -19.380
   43    HA   LYS   6           HA       LYS   6   5.270  -2.156 -21.150
   44   1HB   LYS   6          2HB       LYS   6   7.585  -3.910 -21.979
   45   2HB   LYS   6          1HB       LYS   6   6.737  -2.699 -22.937
   46   1HG   LYS   6          2HG       LYS   6   8.653  -2.249 -20.641
   47   2HG   LYS   6          1HG       LYS   6   8.789  -1.667 -22.300
   48   1HD   LYS   6          2HD       LYS   6   6.955  -0.135 -21.996
   49   2HD   LYS   6          1HD       LYS   6   6.558  -0.839 -20.428
   50   1HE   LYS   6          2HE       LYS   6   8.349   0.168 -19.362
   51   2HE   LYS   6          1HE       LYS   6   9.321   0.235 -20.832
   52   1HZ   LYS   6          1HZ       LYS   6   7.927   1.989 -21.672
   53   2HZ   LYS   6          2HZ       LYS   6   8.510   2.426 -20.137
   54   3HZ   LYS   6          3HZ       LYS   6   6.908   1.891 -20.319
   55    H    ALA   7           H        ALA   7   6.397  -5.318 -20.095
   56    HA   ALA   7           HA       ALA   7   4.665  -6.820 -21.837
   57   1HB   ALA   7          1HB       ALA   7   6.538  -8.036 -21.125
   58   2HB   ALA   7          2HB       ALA   7   5.243  -8.681 -20.117
   59   3HB   ALA   7          3HB       ALA   7   6.370  -7.498 -19.454
   60    H    ALA   8           H        ALA   8   4.381  -5.363 -18.663
   61    HA   ALA   8           HA       ALA   8   1.995  -6.844 -17.947
   62   1HB   ALA   8          1HB       ALA   8   1.975  -5.196 -16.015
   63   2HB   ALA   8          2HB       ALA   8   3.492  -4.561 -16.656
   64   3HB   ALA   8          3HB       ALA   8   3.392  -6.240 -16.120
   65    H    VAL   9           H        VAL   9   2.791  -3.705 -19.364
   66    HA   VAL   9           HA       VAL   9   0.387  -2.352 -18.914
   67    HB   VAL   9           HB       VAL   9   2.573  -1.496 -20.010
   68   1HG1  VAL   9          1HG1      VAL   9   1.113  -1.978 -22.586
   69   2HG1  VAL   9          2HG1      VAL   9   2.162  -3.241 -21.946
   70   3HG1  VAL   9          3HG1      VAL   9   2.824  -1.651 -22.319
   71   1HG2  VAL   9          1HG2      VAL   9   1.374   0.364 -20.976
   72   2HG2  VAL   9          2HG2      VAL   9   0.446  -0.202 -19.587
   73   3HG2  VAL   9          3HG2      VAL   9  -0.065  -0.626 -21.220
   74    H    GLU  10           H        GLU  10   1.136  -4.857 -21.268
   75    HA   GLU  10           HA       GLU  10  -1.247  -4.501 -22.835
   76   1HB   GLU  10          2HB       GLU  10   0.667  -6.835 -22.600
   77   2HB   GLU  10          1HB       GLU  10  -0.660  -6.752 -23.758
   78   1HG   GLU  10          2HG       GLU  10   1.437  -4.582 -23.580
   79   2HG   GLU  10          1HG       GLU  10   1.654  -6.005 -24.598
   80    H    GLN  11           H        GLN  11  -0.473  -6.141 -19.867
   81    HA   GLN  11           HA       GLN  11  -2.815  -7.868 -19.938
   82   1HB   GLN  11          2HB       GLN  11  -0.897  -7.337 -17.656
   83   2HB   GLN  11          1HB       GLN  11  -2.073  -8.647 -17.757
   84   1HG   GLN  11          2HG       GLN  11  -0.879  -9.362 -19.905
   85   2HG   GLN  11          1HG       GLN  11   0.401  -8.240 -19.446
   86   1HE2  GLN  11          1HE2      GLN  11   1.449  -8.647 -17.265
   87   2HE2  GLN  11          2HE2      GLN  11   1.504 -10.237 -16.677
   88    H    LEU  12           H        LEU  12  -1.841  -4.801 -18.529
   89    HA   LEU  12           HA       LEU  12  -3.815  -4.529 -16.551
   90   1HB   LEU  12          2HB       LEU  12  -2.878  -2.209 -18.210
   91   2HB   LEU  12          1HB       LEU  12  -3.365  -2.222 -16.533
   92    HG   LEU  12           HG       LEU  12  -0.768  -3.183 -17.728
   93   1HD1  LEU  12          1HD1      LEU  12  -1.060  -0.770 -17.143
   94   2HD1  LEU  12          2HD1      LEU  12   0.193  -1.564 -16.188
   95   3HD1  LEU  12          3HD1      LEU  12  -1.391  -1.250 -15.479
   96   1HD2  LEU  12          1HD2      LEU  12  -0.569  -4.717 -16.090
   97   2HD2  LEU  12          2HD2      LEU  12  -2.168  -4.300 -15.478
   98   3HD2  LEU  12          3HD2      LEU  12  -0.749  -3.437 -14.891
   99    H    THR  13           H        THR  13  -5.944  -4.464 -16.695
  100    HA   THR  13           HA       THR  13  -7.175  -3.602 -19.251
  101    HB   THR  13           HB       THR  13  -9.189  -4.932 -18.065
  102    HG1  THR  13           HG1      THR  13  -8.230  -5.713 -16.304
  103   1HG2  THR  13          1HG2      THR  13  -8.473  -6.906 -19.411
  104   2HG2  THR  13          2HG2      THR  13  -6.907  -6.133 -19.649
  105   3HG2  THR  13          3HG2      THR  13  -8.366  -5.388 -20.299
  106    H    ASP  14           H        ASP  14  -9.439  -2.750 -18.966
  107    HA   ASP  14           HA       ASP  14  -9.431  -0.433 -17.352
  108   1HB   ASP  14          2HB       ASP  14 -10.854  -0.979 -19.458
  109   2HB   ASP  14          1HB       ASP  14 -11.968  -1.733 -18.318
  110    H    GLU  15           H        GLU  15 -10.575  -3.703 -16.802
  111    HA   GLU  15           HA       GLU  15 -12.230  -3.229 -14.553
  112   1HB   GLU  15          2HB       GLU  15 -10.759  -5.640 -15.585
  113   2HB   GLU  15          1HB       GLU  15 -11.599  -5.694 -14.035
  114   1HG   GLU  15          2HG       GLU  15 -13.699  -5.075 -15.089
  115   2HG   GLU  15          1HG       GLU  15 -12.894  -4.837 -16.639
  116    H    GLN  16           H        GLN  16  -8.772  -4.147 -14.779
  117    HA   GLN  16           HA       GLN  16  -8.335  -4.253 -11.983
  118   1HB   GLN  16          2HB       GLN  16  -6.094  -4.580 -12.453
  119   2HB   GLN  16          1HB       GLN  16  -6.827  -5.089 -13.970
  120   1HG   GLN  16          2HG       GLN  16  -6.130  -3.173 -15.104
  121   2HG   GLN  16          1HG       GLN  16  -6.008  -2.214 -13.632
  122   1HE2  GLN  16          1HE2      GLN  16  -3.817  -1.674 -13.464
  123   2HE2  GLN  16          2HE2      GLN  16  -2.545  -2.793 -13.572
  124    H    LYS  17           H        LYS  17  -8.217  -1.597 -14.302
  125    HA   LYS  17           HA       LYS  17  -7.133   0.287 -12.393
  126   1HB   LYS  17          2HB       LYS  17  -8.039   0.390 -15.219
  127   2HB   LYS  17          1HB       LYS  17  -8.169   1.887 -14.296
  128   1HG   LYS  17          2HG       LYS  17  -5.980   2.168 -14.846
  129   2HG   LYS  17          1HG       LYS  17  -5.682   1.013 -13.547
  130   1HD   LYS  17          2HD       LYS  17  -4.625  -0.190 -15.164
  131   2HD   LYS  17          1HD       LYS  17  -6.258  -0.672 -15.624
  132   1HE   LYS  17          2HE       LYS  17  -4.980   1.833 -16.726
  133   2HE   LYS  17          1HE       LYS  17  -4.744   0.262 -17.490
  134   1HZ   LYS  17          1HZ       LYS  17  -6.587   1.285 -18.534
  135   2HZ   LYS  17          2HZ       LYS  17  -7.307   1.689 -17.049
  136   3HZ   LYS  17          3HZ       LYS  17  -7.219   0.064 -17.540
  137    H    ASN  18           H        ASN  18 -10.282  -0.873 -13.317
  138    HA   ASN  18           HA       ASN  18 -11.857   1.298 -12.363
  139   1HB   ASN  18          2HB       ASN  18 -12.330  -1.518 -13.165
  140   2HB   ASN  18          1HB       ASN  18 -13.482  -0.856 -12.005
  141   1HD2  ASN  18          1HD2      ASN  18 -13.460  -1.406 -15.130
  142   2HD2  ASN  18          2HD2      ASN  18 -14.164   0.012 -15.744
  143    H    GLU  19           H        GLU  19 -10.702  -1.727 -10.909
  144    HA   GLU  19           HA       GLU  19 -11.898  -1.272  -8.338
  145   1HB   GLU  19          2HB       GLU  19  -9.533  -3.053  -8.995
  146   2HB   GLU  19          1HB       GLU  19 -10.580  -3.158  -7.581
  147   1HG   GLU  19          2HG       GLU  19 -12.406  -3.953  -8.833
  148   2HG   GLU  19          1HG       GLU  19 -11.732  -3.372 -10.355
  149    H    PHE  20           H        PHE  20  -8.716  -0.741  -9.783
  150    HA   PHE  20           HA       PHE  20  -7.370   0.104  -7.435
  151   1HB   PHE  20          2HB       PHE  20  -6.870   0.337 -10.372
  152   2HB   PHE  20          1HB       PHE  20  -5.938   1.362  -9.284
  153    HD1  PHE  20           HD1      PHE  20  -3.867   0.171  -9.942
  154    HD2  PHE  20           HD2      PHE  20  -7.137  -1.875  -8.054
  155    HE1  PHE  20           HE1      PHE  20  -2.373  -1.727  -9.411
  156    HE2  PHE  20           HE2      PHE  20  -5.644  -3.772  -7.520
  157    HZ   PHE  20           HZ       PHE  20  -3.260  -3.702  -8.196
  158    H    LYS  21           H        LYS  21  -9.121   1.904  -9.957
  159    HA   LYS  21           HA       LYS  21  -8.514   4.494  -8.956
  160   1HB   LYS  21          2HB       LYS  21  -9.365   4.046 -11.263
  161   2HB   LYS  21          1HB       LYS  21 -10.941   3.669 -10.570
  162   1HG   LYS  21          2HG       LYS  21 -10.838   6.016 -11.356
  163   2HG   LYS  21          1HG       LYS  21 -11.077   5.933  -9.611
  164   1HD   LYS  21          2HD       LYS  21  -8.812   6.494  -9.162
  165   2HD   LYS  21          1HD       LYS  21  -8.322   6.177 -10.828
  166   1HE   LYS  21          2HE       LYS  21 -10.188   8.077 -11.276
  167   2HE   LYS  21          1HE       LYS  21  -9.654   8.570  -9.670
  168   1HZ   LYS  21          1HZ       LYS  21  -7.907   8.126 -12.030
  169   2HZ   LYS  21          2HZ       LYS  21  -7.366   8.551 -10.477
  170   3HZ   LYS  21          3HZ       LYS  21  -8.327   9.629 -11.370
  171    H    ALA  22           H        ALA  22 -11.269   2.294  -8.449
  172    HA   ALA  22           HA       ALA  22 -12.747   4.074  -6.784
  173   1HB   ALA  22          1HB       ALA  22 -13.653   2.005  -7.952
  174   2HB   ALA  22          2HB       ALA  22 -14.143   2.211  -6.270
  175   3HB   ALA  22          3HB       ALA  22 -12.875   1.057  -6.685
  176    H    ALA  23           H        ALA  23 -10.487   1.409  -6.104
  177    HA   ALA  23           HA       ALA  23 -10.631   1.518  -3.281
  178   1HB   ALA  23          1HB       ALA  23  -9.633  -0.409  -4.304
  179   2HB   ALA  23          2HB       ALA  23  -8.370   0.399  -3.377
  180   3HB   ALA  23          3HB       ALA  23  -8.430   0.581  -5.130
  181    H    PHE  24           H        PHE  24  -8.967   3.503  -5.617
  182    HA   PHE  24           HA       PHE  24  -7.174   4.698  -3.662
  183   1HB   PHE  24          2HB       PHE  24  -6.774   4.349  -6.235
  184   2HB   PHE  24          1HB       PHE  24  -7.695   5.842  -6.392
  185    HD1  PHE  24           HD1      PHE  24  -4.611   4.311  -5.060
  186    HD2  PHE  24           HD2      PHE  24  -6.802   7.967  -5.604
  187    HE1  PHE  24           HE1      PHE  24  -2.586   5.615  -4.471
  188    HE2  PHE  24           HE2      PHE  24  -4.776   9.268  -5.014
  189    HZ   PHE  24           HZ       PHE  24  -2.669   8.093  -4.448
  190    H    ASP  25           H        ASP  25  -9.839   5.829  -5.750
  191    HA   ASP  25           HA       ASP  25 -10.094   8.415  -4.783
  192   1HB   ASP  25          2HB       ASP  25 -11.279   7.335  -6.773
  193   2HB   ASP  25          1HB       ASP  25 -12.468   6.747  -5.611
  194    H    ILE  26           H        ILE  26 -11.562   5.439  -3.446
  195    HA   ILE  26           HA       ILE  26 -13.332   6.626  -1.634
  196    HB   ILE  26           HB       ILE  26 -13.062   4.558  -0.256
  197   1HG1  ILE  26          2HG1      ILE  26 -10.980   3.877  -2.359
  198   2HG1  ILE  26          1HG1      ILE  26 -10.649   4.211  -0.662
  199   1HG2  ILE  26          1HG2      ILE  26 -13.448   3.053  -2.502
  200   2HG2  ILE  26          2HG2      ILE  26 -13.722   4.675  -3.135
  201   3HG2  ILE  26          3HG2      ILE  26 -14.683   4.084  -1.780
  202   1HD1  ILE  26          1HD1      ILE  26 -10.710   1.840  -0.829
  203   2HD1  ILE  26          2HD1      ILE  26 -12.158   1.875  -1.835
  204   3HD1  ILE  26          3HD1      ILE  26 -12.262   2.293  -0.126
  205    H    PHE  27           H        PHE  27  -9.855   6.075  -1.371
  206    HA   PHE  27           HA       PHE  27  -9.745   7.064   1.364
  207   1HB   PHE  27          2HB       PHE  27  -7.735   6.003  -0.597
  208   2HB   PHE  27          1HB       PHE  27  -7.186   6.926   0.802
  209    HD1  PHE  27           HD1      PHE  27  -7.590   6.110   3.098
  210    HD2  PHE  27           HD2      PHE  27  -8.752   3.812  -0.341
  211    HE1  PHE  27           HE1      PHE  27  -7.876   4.106   4.530
  212    HE2  PHE  27           HE2      PHE  27  -9.036   1.808   1.092
  213    HZ   PHE  27           HZ       PHE  27  -8.598   1.956   3.529
  214    H    ILE  28           H        ILE  28  -9.230   8.267  -1.900
  215    HA   ILE  28           HA       ILE  28  -8.075  10.778  -0.917
  216    HB   ILE  28           HB       ILE  28  -8.700  10.108  -3.793
  217   1HG1  ILE  28          2HG1      ILE  28  -7.307   8.303  -3.260
  218   2HG1  ILE  28          1HG1      ILE  28  -6.163   9.522  -3.798
  219   1HG2  ILE  28          1HG2      ILE  28  -8.066  12.326  -3.780
  220   2HG2  ILE  28          2HG2      ILE  28  -6.476  11.570  -3.885
  221   3HG2  ILE  28          3HG2      ILE  28  -7.079  12.146  -2.330
  222   1HD1  ILE  28          1HD1      ILE  28  -6.751   8.615  -0.989
  223   2HD1  ILE  28          2HD1      ILE  28  -6.048  10.206  -1.287
  224   3HD1  ILE  28          3HD1      ILE  28  -5.192   8.750  -1.804
  225    H    GLN  29           H        GLN  29 -10.932   9.991  -0.406
  226    HA   GLN  29           HA       GLN  29 -12.627  11.583  -2.051
  227   1HB   GLN  29          2HB       GLN  29 -14.301  11.333  -0.252
  228   2HB   GLN  29          1HB       GLN  29 -13.560   9.789  -0.665
  229   1HG   GLN  29          2HG       GLN  29 -12.100   9.910   1.276
  230   2HG   GLN  29          1HG       GLN  29 -12.675  11.535   1.651
  231   1HE2  GLN  29          1HE2      GLN  29 -13.218   8.225   2.292
  232   2HE2  GLN  29          2HE2      GLN  29 -14.752   8.376   3.001
  233    H    ASP  30           H        ASP  30 -10.800  12.198   0.903
  234    HA   ASP  30           HA       ASP  30 -11.137  15.081   0.489
  235   1HB   ASP  30          2HB       ASP  30 -11.775  13.671   3.096
  236   2HB   ASP  30          1HB       ASP  30 -11.579  15.415   2.931
  237    H    ALA  31           H        ALA  31  -8.911  13.415  -0.044
  238    HA   ALA  31           HA       ALA  31  -7.023  13.365   2.084
  239   1HB   ALA  31          1HB       ALA  31  -6.850  11.969   0.026
  240   2HB   ALA  31          2HB       ALA  31  -5.374  12.869   0.372
  241   3HB   ALA  31          3HB       ALA  31  -6.471  13.425  -0.892
  242    H    GLU  32           H        GLU  32  -5.050  14.617   2.211
  243    HA   GLU  32           HA       GLU  32  -5.570  17.448   2.026
  244   1HB   GLU  32          2HB       GLU  32  -3.020  16.014   2.803
  245   2HB   GLU  32          1HB       GLU  32  -3.364  17.724   3.051
  246   1HG   GLU  32          2HG       GLU  32  -4.222  17.148   5.058
  247   2HG   GLU  32          1HG       GLU  32  -5.566  16.422   4.176
  248    H    ASP  33           H        ASP  33  -3.233  15.223   0.525
  249    HA   ASP  33           HA       ASP  33  -2.548  17.320  -1.437
  250   1HB   ASP  33          2HB       ASP  33  -1.122  14.791  -0.601
  251   2HB   ASP  33          1HB       ASP  33  -0.635  15.754  -1.996
  252    H    GLY  34           H        GLY  34  -3.741  14.007  -1.135
  253   1HA   GLY  34          2HA       GLY  34  -5.457  13.366  -2.815
  254   2HA   GLY  34          1HA       GLY  34  -4.372  14.023  -4.034
  255    H    CYS  35           H        CYS  35  -3.694  11.952  -1.219
  256    HA   CYS  35           HA       CYS  35  -3.176   9.626  -2.875
  257   1HB   CYS  35          2HB       CYS  35  -0.793   9.617  -1.561
  258   2HB   CYS  35          1HB       CYS  35  -0.998  10.174  -3.218
  259    HG   CYS  35           HG       CYS  35  -0.897  12.606  -2.429
  260    H    ILE  36           H        ILE  36  -2.274   7.794  -1.447
  261    HA   ILE  36           HA       ILE  36  -3.716   7.920   1.132
  262    HB   ILE  36           HB       ILE  36  -3.683   5.455   1.075
  263   1HG1  ILE  36          2HG1      ILE  36  -3.043   4.829  -1.561
  264   2HG1  ILE  36          1HG1      ILE  36  -1.779   5.961  -1.086
  265   1HG2  ILE  36          1HG2      ILE  36  -5.438   6.947  -0.135
  266   2HG2  ILE  36          2HG2      ILE  36  -5.404   5.225  -0.512
  267   3HG2  ILE  36          3HG2      ILE  36  -4.667   6.383  -1.618
  268   1HD1  ILE  36          1HD1      ILE  36  -0.788   4.402   0.201
  269   2HD1  ILE  36          2HD1      ILE  36  -1.942   3.222  -0.420
  270   3HD1  ILE  36          3HD1      ILE  36  -2.294   4.100   1.069
  271    H    SER  37           H        SER  37  -2.679   6.306   2.797
  272    HA   SER  37           HA       SER  37   0.084   7.210   3.152
  273   1HB   SER  37          2HB       SER  37  -1.709   7.338   4.991
  274   2HB   SER  37          1HB       SER  37  -1.521   5.592   5.129
  275    HG   SER  37           HG       SER  37   0.328   5.899   6.086
  276    H    THR  38           H        THR  38   1.818   5.881   3.203
  277    HA   THR  38           HA       THR  38   1.784   3.433   1.824
  278    HB   THR  38           HB       THR  38   4.073   3.096   2.922
  279    HG1  THR  38           HG1      THR  38   4.627   4.434   4.434
  280   1HG2  THR  38          1HG2      THR  38   3.347   5.595   1.381
  281   2HG2  THR  38          2HG2      THR  38   3.957   4.071   0.740
  282   3HG2  THR  38          3HG2      THR  38   5.016   5.115   1.688
  283    H    LYS  39           H        LYS  39   1.575   4.166   5.274
  284    HA   LYS  39           HA       LYS  39   1.801   1.521   6.262
  285   1HB   LYS  39          2HB       LYS  39   0.924   4.146   7.303
  286   2HB   LYS  39          1HB       LYS  39   0.209   2.744   8.103
  287   1HG   LYS  39          2HG       LYS  39   3.175   3.106   7.621
  288   2HG   LYS  39          1HG       LYS  39   2.363   3.468   9.147
  289   1HD   LYS  39          2HD       LYS  39   2.055   1.260   9.667
  290   2HD   LYS  39          1HD       LYS  39   1.812   0.797   7.981
  291   1HE   LYS  39          2HE       LYS  39   4.021   0.353   7.659
  292   2HE   LYS  39          1HE       LYS  39   4.537   1.755   8.597
  293   1HZ   LYS  39          1HZ       LYS  39   4.083   0.555  10.622
  294   2HZ   LYS  39          2HZ       LYS  39   5.147  -0.348   9.654
  295   3HZ   LYS  39          3HZ       LYS  39   3.507  -0.781   9.750
  296    H    GLU  40           H        GLU  40  -0.878   3.387   4.999
  297    HA   GLU  40           HA       GLU  40  -2.925   1.515   5.799
  298   1HB   GLU  40          2HB       GLU  40  -2.908   3.962   4.040
  299   2HB   GLU  40          1HB       GLU  40  -4.334   2.939   4.198
  300   1HG   GLU  40          2HG       GLU  40  -4.290   3.250   6.648
  301   2HG   GLU  40          1HG       GLU  40  -2.873   4.288   6.488
  302    H    LEU  41           H        LEU  41  -0.573   1.287   3.446
  303    HA   LEU  41           HA       LEU  41  -1.894   0.449   1.131
  304   1HB   LEU  41          2HB       LEU  41   0.579   0.845   1.443
  305   2HB   LEU  41          1HB       LEU  41   0.667  -0.723   2.211
  306    HG   LEU  41           HG       LEU  41   1.323  -0.503  -0.279
  307   1HD1  LEU  41          1HD1      LEU  41  -0.705  -2.655  -0.028
  308   2HD1  LEU  41          2HD1      LEU  41   0.519  -2.597   1.240
  309   3HD1  LEU  41          3HD1      LEU  41   1.004  -2.760  -0.448
  310   1HD2  LEU  41          1HD2      LEU  41  -0.754   0.768  -0.899
  311   2HD2  LEU  41          2HD2      LEU  41  -1.692  -0.687  -0.568
  312   3HD2  LEU  41          3HD2      LEU  41  -0.508  -0.681  -1.873
  313    H    GLY  42           H        GLY  42  -1.025  -1.386   4.055
  314   1HA   GLY  42          2HA       GLY  42  -1.797  -3.946   3.104
  315   2HA   GLY  42          1HA       GLY  42  -1.644  -3.481   4.792
  316    H    LYS  43           H        LYS  43  -3.669  -1.223   4.153
  317    HA   LYS  43           HA       LYS  43  -6.017  -2.763   4.871
  318   1HB   LYS  43          2HB       LYS  43  -5.326  -0.506   5.874
  319   2HB   LYS  43          1HB       LYS  43  -5.915   0.208   4.374
  320   1HG   LYS  43          2HG       LYS  43  -7.789   0.292   5.793
  321   2HG   LYS  43          1HG       LYS  43  -8.080  -1.149   4.823
  322   1HD   LYS  43          2HD       LYS  43  -6.726  -2.322   6.794
  323   2HD   LYS  43          1HD       LYS  43  -7.304  -0.926   7.705
  324   1HE   LYS  43          2HE       LYS  43  -9.631  -1.477   6.768
  325   2HE   LYS  43          1HE       LYS  43  -8.944  -3.024   6.275
  326   1HZ   LYS  43          1HZ       LYS  43  -9.987  -3.152   8.457
  327   2HZ   LYS  43          2HZ       LYS  43  -8.944  -1.946   9.045
  328   3HZ   LYS  43          3HZ       LYS  43  -8.321  -3.451   8.561
  329    H    VAL  44           H        VAL  44  -4.929  -0.768   2.128
  330    HA   VAL  44           HA       VAL  44  -7.397  -0.861   0.715
  331    HB   VAL  44           HB       VAL  44  -6.019  -0.225  -1.289
  332   1HG1  VAL  44          1HG1      VAL  44  -6.936   1.546   0.020
  333   2HG1  VAL  44          2HG1      VAL  44  -5.243   1.967  -0.242
  334   3HG1  VAL  44          3HG1      VAL  44  -5.755   1.299   1.308
  335   1HG2  VAL  44          1HG2      VAL  44  -3.942  -1.431  -0.517
  336   2HG2  VAL  44          2HG2      VAL  44  -3.734  -0.172   0.702
  337   3HG2  VAL  44          3HG2      VAL  44  -3.661   0.237  -1.012
  338    H    MET  45           H        MET  45  -4.610  -3.011   0.860
  339    HA   MET  45           HA       MET  45  -5.200  -4.615  -1.391
  340   1HB   MET  45          2HB       MET  45  -3.922  -5.578   1.180
  341   2HB   MET  45          1HB       MET  45  -3.758  -6.288  -0.425
  342   1HG   MET  45          2HG       MET  45  -2.995  -3.427  -0.184
  343   2HG   MET  45          1HG       MET  45  -1.935  -4.584   0.617
  344   1HE   MET  45          1HE       MET  45  -3.847  -3.526  -2.262
  345   2HE   MET  45          2HE       MET  45  -4.005  -5.141  -2.951
  346   3HE   MET  45          3HE       MET  45  -2.948  -3.961  -3.725
  347    H    ARG  46           H        ARG  46  -6.339  -4.649   1.937
  348    HA   ARG  46           HA       ARG  46  -7.710  -7.137   1.861
  349   1HB   ARG  46          2HB       ARG  46  -7.992  -4.671   3.572
  350   2HB   ARG  46          1HB       ARG  46  -9.101  -6.032   3.740
  351   1HG   ARG  46          2HG       ARG  46  -7.143  -7.541   4.075
  352   2HG   ARG  46          1HG       ARG  46  -6.084  -6.131   4.021
  353   1HD   ARG  46          2HD       ARG  46  -7.067  -5.203   5.996
  354   2HD   ARG  46          1HD       ARG  46  -8.390  -6.364   5.962
  355    HE   ARG  46           HE       ARG  46  -5.809  -7.628   6.190
  356   1HH1  ARG  46          2HH1      ARG  46  -8.365  -6.016   7.944
  357   2HH1  ARG  46          1HH1      ARG  46  -8.003  -6.804   9.441
  358   1HH2  ARG  46          1HH2      ARG  46  -5.356  -8.650   8.163
  359   2HH2  ARG  46          2HH2      ARG  46  -6.305  -8.290   9.567
  360    H    MET  47           H        MET  47  -8.643  -3.834   1.015
  361    HA   MET  47           HA       MET  47 -11.412  -4.406   0.561
  362   1HB   MET  47          2HB       MET  47  -9.622  -2.125  -0.291
  363   2HB   MET  47          1HB       MET  47 -11.332  -2.206  -0.714
  364   1HG   MET  47          2HG       MET  47 -10.476  -2.553   2.150
  365   2HG   MET  47          1HG       MET  47 -10.620  -0.935   1.462
  366   1HE   MET  47          1HE       MET  47 -13.945  -0.397   2.894
  367   2HE   MET  47          2HE       MET  47 -12.492   0.289   2.172
  368   3HE   MET  47          3HE       MET  47 -12.358  -0.745   3.592
  369    H    LEU  48           H        LEU  48  -8.511  -4.377  -1.469
  370    HA   LEU  48           HA       LEU  48  -9.915  -4.707  -3.952
  371   1HB   LEU  48          2HB       LEU  48  -7.069  -4.863  -3.074
  372   2HB   LEU  48          1HB       LEU  48  -7.505  -5.595  -4.603
  373    HG   LEU  48           HG       LEU  48  -8.218  -2.732  -3.991
  374   1HD1  LEU  48          1HD1      LEU  48  -5.826  -2.856  -3.641
  375   2HD1  LEU  48          2HD1      LEU  48  -6.106  -2.147  -5.231
  376   3HD1  LEU  48          3HD1      LEU  48  -5.620  -3.837  -5.093
  377   1HD2  LEU  48          1HD2      LEU  48  -8.162  -2.579  -6.459
  378   2HD2  LEU  48          2HD2      LEU  48  -9.286  -3.831  -5.929
  379   3HD2  LEU  48          3HD2      LEU  48  -7.698  -4.278  -6.552
  380    H    GLY  49           H        GLY  49  -7.831  -6.958  -2.099
  381   1HA   GLY  49          2HA       GLY  49  -9.346  -9.159  -1.830
  382   2HA   GLY  49          1HA       GLY  49  -8.926  -9.246  -3.538
  383    H    GLN  50           H        GLN  50  -7.170  -8.382  -0.548
  384    HA   GLN  50           HA       GLN  50  -5.336 -10.621  -0.864
  385   1HB   GLN  50          2HB       GLN  50  -4.598  -7.831  -1.578
  386   2HB   GLN  50          1HB       GLN  50  -3.437  -8.726  -0.598
  387   1HG   GLN  50          2HG       GLN  50  -3.687 -10.630  -2.285
  388   2HG   GLN  50          1HG       GLN  50  -4.532  -9.473  -3.315
  389   1HE2  GLN  50          1HE2      GLN  50  -1.422 -10.613  -2.416
  390   2HE2  GLN  50          2HE2      GLN  50  -0.512  -9.380  -3.145
  391    H    ASN  51           H        ASN  51  -4.036 -10.978   0.998
  392    HA   ASN  51           HA       ASN  51  -4.544  -9.230   3.312
  393   1HB   ASN  51          2HB       ASN  51  -6.151 -11.305   3.128
  394   2HB   ASN  51          1HB       ASN  51  -4.745 -12.196   3.710
  395   1HD2  ASN  51          1HD2      ASN  51  -7.231  -9.883   4.616
  396   2HD2  ASN  51          2HD2      ASN  51  -6.792  -9.770   6.252
  397    HA   PRO  52           HA       PRO  52  -0.161 -10.729   3.132
  398   1HB   PRO  52          2HB       PRO  52   0.996  -8.266   2.867
  399   2HB   PRO  52          1HB       PRO  52   0.461  -9.244   1.495
  400   1HG   PRO  52          2HG       PRO  52  -0.738  -6.806   2.648
  401   2HG   PRO  52          1HG       PRO  52  -0.868  -7.455   1.008
  402   1HD   PRO  52          2HD       PRO  52  -2.818  -7.650   3.078
  403   2HD   PRO  52          1HD       PRO  52  -2.851  -8.473   1.501
  404    H    THR  53           H        THR  53   1.785  -9.371   4.373
  405    HA   THR  53           HA       THR  53   0.752  -8.890   7.107
  406    HB   THR  53           HB       THR  53   2.726  -9.792   7.989
  407    HG1  THR  53           HG1      THR  53   4.597  -9.482   7.093
  408   1HG2  THR  53          1HG2      THR  53   3.192 -11.889   6.742
  409   2HG2  THR  53          2HG2      THR  53   2.269 -11.253   5.380
  410   3HG2  THR  53          3HG2      THR  53   1.466 -11.575   6.918
  411    HA   PRO  54           HA       PRO  54   2.305  -4.768   7.036
  412   1HB   PRO  54          2HB       PRO  54   3.663  -4.528   9.406
  413   2HB   PRO  54          1HB       PRO  54   1.896  -4.542   9.270
  414   1HG   PRO  54          2HG       PRO  54   3.748  -6.713  10.141
  415   2HG   PRO  54          1HG       PRO  54   2.109  -6.336  10.700
  416   1HD   PRO  54          2HD       PRO  54   2.715  -8.384   8.938
  417   2HD   PRO  54          1HD       PRO  54   1.120  -7.602   9.044
  418    H    GLU  55           H        GLU  55   4.681  -7.266   7.668
  419    HA   GLU  55           HA       GLU  55   6.961  -5.578   7.014
  420   1HB   GLU  55          2HB       GLU  55   7.029  -8.588   7.184
  421   2HB   GLU  55          1HB       GLU  55   8.323  -7.438   7.507
  422   1HG   GLU  55          2HG       GLU  55   5.816  -7.785   9.186
  423   2HG   GLU  55          1HG       GLU  55   7.421  -8.375   9.610
  424    H    GLU  56           H        GLU  56   4.906  -7.991   5.483
  425    HA   GLU  56           HA       GLU  56   6.467  -8.401   3.135
  426   1HB   GLU  56          2HB       GLU  56   4.540  -9.855   4.001
  427   2HB   GLU  56          1HB       GLU  56   3.462  -8.656   3.288
  428   1HG   GLU  56          2HG       GLU  56   4.370  -9.035   1.087
  429   2HG   GLU  56          1HG       GLU  56   5.662 -10.045   1.737
  430    H    LEU  57           H        LEU  57   3.469  -6.490   3.658
  431    HA   LEU  57           HA       LEU  57   3.464  -5.231   1.140
  432   1HB   LEU  57          2HB       LEU  57   1.877  -3.696   2.058
  433   2HB   LEU  57          1HB       LEU  57   1.537  -5.293   2.679
  434    HG   LEU  57           HG       LEU  57   3.059  -4.372   4.701
  435   1HD1  LEU  57          1HD1      LEU  57   1.964  -1.933   4.938
  436   2HD1  LEU  57          2HD1      LEU  57   2.082  -1.998   3.179
  437   3HD1  LEU  57          3HD1      LEU  57   3.532  -2.180   4.166
  438   1HD2  LEU  57          1HD2      LEU  57   0.745  -3.494   5.613
  439   2HD2  LEU  57          2HD2      LEU  57   0.948  -5.205   5.245
  440   3HD2  LEU  57          3HD2      LEU  57   0.125  -4.150   4.099
  441    H    GLN  58           H        GLN  58   5.280  -4.535   4.052
  442    HA   GLN  58           HA       GLN  58   5.927  -1.849   3.708
  443   1HB   GLN  58          2HB       GLN  58   6.776  -3.904   5.399
  444   2HB   GLN  58          1HB       GLN  58   8.241  -3.388   4.566
  445   1HG   GLN  58          2HG       GLN  58   6.301  -1.547   6.003
  446   2HG   GLN  58          1HG       GLN  58   7.864  -2.070   6.629
  447   1HE2  GLN  58          1HE2      GLN  58   6.286   0.079   4.327
  448   2HE2  GLN  58          2HE2      GLN  58   7.696   0.886   3.833
  449    H    GLU  59           H        GLU  59   7.426  -4.723   2.256
  450    HA   GLU  59           HA       GLU  59   9.535  -3.349   0.932
  451   1HB   GLU  59          2HB       GLU  59   8.241  -6.036   0.472
  452   2HB   GLU  59          1HB       GLU  59   9.558  -5.442  -0.539
  453   1HG   GLU  59          2HG       GLU  59   9.794  -5.482   2.472
  454   2HG   GLU  59          1HG       GLU  59  10.186  -6.902   1.503
  455    H    MET  60           H        MET  60   6.247  -4.260  -0.060
  456    HA   MET  60           HA       MET  60   6.427  -3.596  -2.785
  457   1HB   MET  60          2HB       MET  60   4.082  -3.498  -0.876
  458   2HB   MET  60          1HB       MET  60   3.930  -3.196  -2.607
  459   1HG   MET  60          2HG       MET  60   5.328  -5.684  -1.668
  460   2HG   MET  60          1HG       MET  60   3.565  -5.630  -1.666
  461   1HE   MET  60          1HE       MET  60   6.736  -6.227  -3.913
  462   2HE   MET  60          2HE       MET  60   5.711  -7.330  -4.829
  463   3HE   MET  60          3HE       MET  60   5.703  -7.389  -3.068
  464    H    ILE  61           H        ILE  61   5.644  -1.607   0.049
  465    HA   ILE  61           HA       ILE  61   4.932   0.770  -1.231
  466    HB   ILE  61           HB       ILE  61   6.287   0.249   1.416
  467   1HG1  ILE  61          2HG1      ILE  61   3.508   1.264   1.118
  468   2HG1  ILE  61          1HG1      ILE  61   3.799  -0.405   0.631
  469   1HG2  ILE  61          1HG2      ILE  61   5.223   2.824   0.236
  470   2HG2  ILE  61          2HG2      ILE  61   6.849   2.508   0.845
  471   3HG2  ILE  61          3HG2      ILE  61   5.490   2.590   1.965
  472   1HD1  ILE  61          1HD1      ILE  61   3.157  -0.219   3.027
  473   2HD1  ILE  61          2HD1      ILE  61   4.593   0.767   3.310
  474   3HD1  ILE  61          3HD1      ILE  61   4.760  -0.914   2.804
  475    H    ASP  62           H        ASP  62   8.085   0.228   0.355
  476    HA   ASP  62           HA       ASP  62   9.456   2.364  -0.750
  477   1HB   ASP  62          2HB       ASP  62  10.185   0.584   1.036
  478   2HB   ASP  62          1HB       ASP  62  10.899  -0.233  -0.354
  479    H    GLU  63           H        GLU  63   8.813  -0.793  -2.189
  480    HA   GLU  63           HA       GLU  63  10.653  -0.592  -4.347
  481   1HB   GLU  63          2HB       GLU  63   8.229  -2.268  -3.795
  482   2HB   GLU  63          1HB       GLU  63   8.925  -2.259  -5.415
  483   1HG   GLU  63          2HG       GLU  63  11.118  -2.894  -4.489
  484   2HG   GLU  63          1HG       GLU  63  10.441  -2.883  -2.861
  485    H    VAL  64           H        VAL  64   7.139   0.080  -4.169
  486    HA   VAL  64           HA       VAL  64   7.083   1.087  -6.879
  487    HB   VAL  64           HB       VAL  64   4.739   1.499  -6.532
  488   1HG1  VAL  64          1HG1      VAL  64   4.295  -0.704  -6.647
  489   2HG1  VAL  64          2HG1      VAL  64   4.743  -0.944  -4.959
  490   3HG1  VAL  64          3HG1      VAL  64   5.979  -0.995  -6.215
  491   1HG2  VAL  64          1HG2      VAL  64   3.721   1.142  -4.277
  492   2HG2  VAL  64          2HG2      VAL  64   4.822   2.519  -4.319
  493   3HG2  VAL  64          3HG2      VAL  64   5.343   0.994  -3.601
  494    H    ASP  65           H        ASP  65   7.455   2.513  -3.699
  495    HA   ASP  65           HA       ASP  65   6.598   5.134  -4.307
  496   1HB   ASP  65          2HB       ASP  65   7.494   3.889  -2.038
  497   2HB   ASP  65          1HB       ASP  65   8.856   4.933  -2.429
  498    H    GLU  66           H        GLU  66   7.338   5.874  -6.235
  499    HA   GLU  66           HA       GLU  66  10.054   5.688  -7.106
  500   1HB   GLU  66          2HB       GLU  66   7.725   7.373  -8.035
  501   2HB   GLU  66          1HB       GLU  66   9.311   7.424  -8.806
  502   1HG   GLU  66          2HG       GLU  66   7.955   4.775  -8.359
  503   2HG   GLU  66          1HG       GLU  66   7.486   5.777  -9.732
  504    H    ASP  67           H        ASP  67   8.146   8.293  -5.611
  505    HA   ASP  67           HA       ASP  67  10.418  10.108  -5.627
  506   1HB   ASP  67          2HB       ASP  67   8.810  11.526  -4.159
  507   2HB   ASP  67          1HB       ASP  67   8.429  11.307  -5.863
  508    H    GLY  68           H        GLY  68   8.704   8.097  -3.272
  509   1HA   GLY  68          2HA       GLY  68   9.425   7.258  -1.241
  510   2HA   GLY  68          1HA       GLY  68  10.998   7.990  -1.544
  511    H    SER  69           H        SER  69   7.719   9.353  -1.254
  512    HA   SER  69           HA       SER  69   8.756  11.431   0.527
  513   1HB   SER  69          2HB       SER  69   6.493  12.447   0.216
  514   2HB   SER  69          1HB       SER  69   7.374  12.217  -1.290
  515    HG   SER  69           HG       SER  69   5.846  10.922  -1.913
  516    H    GLY  70           H        GLY  70   6.051   9.104   0.451
  517   1HA   GLY  70          2HA       GLY  70   6.128   7.905   2.833
  518   2HA   GLY  70          1HA       GLY  70   5.551   9.500   3.305
  519    H    THR  71           H        THR  71   4.120   9.797   0.682
  520    HA   THR  71           HA       THR  71   1.753   8.171   1.373
  521    HB   THR  71           HB       THR  71   0.443   9.862   0.183
  522    HG1  THR  71           HG1      THR  71   1.720  10.635  -1.376
  523   1HG2  THR  71          1HG2      THR  71   2.439  11.019   2.145
  524   2HG2  THR  71          2HG2      THR  71   0.885  10.284   2.539
  525   3HG2  THR  71          3HG2      THR  71   0.941  11.812   1.661
  526    H    VAL  72           H        VAL  72   0.546   7.158  -0.312
  527    HA   VAL  72           HA       VAL  72   2.207   6.488  -2.659
  528    HB   VAL  72           HB       VAL  72  -0.254   5.043  -1.661
  529   1HG1  VAL  72          1HG1      VAL  72   0.438   3.292  -3.156
  530   2HG1  VAL  72          2HG1      VAL  72   1.977   4.092  -3.477
  531   3HG1  VAL  72          3HG1      VAL  72   0.475   4.793  -4.082
  532   1HG2  VAL  72          1HG2      VAL  72   2.693   4.578  -1.114
  533   2HG2  VAL  72          2HG2      VAL  72   1.448   3.362  -0.826
  534   3HG2  VAL  72          3HG2      VAL  72   1.423   4.880   0.070
  535    H    ASP  73           H        ASP  73   1.739   7.458  -4.496
  536    HA   ASP  73           HA       ASP  73  -0.850   8.749  -4.897
  537   1HB   ASP  73          2HB       ASP  73   1.525   8.598  -6.774
  538   2HB   ASP  73          1HB       ASP  73   0.134   9.672  -6.921
  539    H    PHE  74           H        PHE  74  -1.778   8.459  -7.225
  540    HA   PHE  74           HA       PHE  74  -2.649   5.780  -7.475
  541   1HB   PHE  74          2HB       PHE  74  -3.795   7.933  -8.325
  542   2HB   PHE  74          1HB       PHE  74  -2.764   7.759  -9.745
  543    HD1  PHE  74           HD1      PHE  74  -4.302   7.136 -11.428
  544    HD2  PHE  74           HD2      PHE  74  -4.281   5.039  -7.680
  545    HE1  PHE  74           HE1      PHE  74  -5.863   5.450 -12.360
  546    HE2  PHE  74           HE2      PHE  74  -5.836   3.353  -8.614
  547    HZ   PHE  74           HZ       PHE  74  -6.630   3.557 -10.954
  548    H    ASP  75           H        ASP  75  -0.024   7.551  -9.022
  549    HA   ASP  75           HA       ASP  75   0.529   5.659 -11.082
  550   1HB   ASP  75          2HB       ASP  75   1.947   7.978  -9.868
  551   2HB   ASP  75          1HB       ASP  75   2.932   6.798 -10.731
  552    H    GLU  76           H        GLU  76   1.646   6.057  -7.751
  553    HA   GLU  76           HA       GLU  76   3.522   3.847  -7.902
  554   1HB   GLU  76          2HB       GLU  76   2.520   5.067  -5.337
  555   2HB   GLU  76          1HB       GLU  76   4.095   4.355  -5.680
  556   1HG   GLU  76          2HG       GLU  76   4.578   6.243  -7.233
  557   2HG   GLU  76          1HG       GLU  76   3.027   6.965  -6.801
  558    H    PHE  77           H        PHE  77   0.184   4.312  -7.209
  559    HA   PHE  77           HA       PHE  77  -0.224   1.964  -5.593
  560   1HB   PHE  77          2HB       PHE  77  -1.708   3.935  -5.451
  561   2HB   PHE  77          1HB       PHE  77  -2.207   3.677  -7.120
  562    HD1  PHE  77           HD1      PHE  77  -3.928   2.148  -7.657
  563    HD2  PHE  77           HD2      PHE  77  -2.157   2.084  -3.741
  564    HE1  PHE  77           HE1      PHE  77  -5.675   0.563  -6.887
  565    HE2  PHE  77           HE2      PHE  77  -3.903   0.499  -2.976
  566    HZ   PHE  77           HZ       PHE  77  -5.663  -0.261  -4.549
  567    H    LEU  78           H        LEU  78  -0.480   2.780  -9.030
  568    HA   LEU  78           HA       LEU  78  -1.734   0.290  -9.766
  569   1HB   LEU  78          2HB       LEU  78  -0.393   2.425 -11.408
  570   2HB   LEU  78          1HB       LEU  78  -1.239   1.048 -12.082
  571    HG   LEU  78           HG       LEU  78  -2.761   2.744 -10.170
  572   1HD1  LEU  78          1HD1      LEU  78  -1.480   4.370 -11.568
  573   2HD1  LEU  78          2HD1      LEU  78  -3.218   4.440 -11.858
  574   3HD1  LEU  78          3HD1      LEU  78  -2.165   3.623 -13.012
  575   1HD2  LEU  78          1HD2      LEU  78  -3.748   1.987 -12.870
  576   2HD2  LEU  78          2HD2      LEU  78  -4.555   1.884 -11.306
  577   3HD2  LEU  78          3HD2      LEU  78  -3.386   0.651 -11.777
  578    H    VAL  79           H        VAL  79   1.592   1.563  -9.863
  579    HA   VAL  79           HA       VAL  79   2.743  -0.525 -11.362
  580    HB   VAL  79           HB       VAL  79   4.884   0.059 -10.093
  581   1HG1  VAL  79          1HG1      VAL  79   3.265   2.058 -11.673
  582   2HG1  VAL  79          2HG1      VAL  79   4.528   0.971 -12.261
  583   3HG1  VAL  79          3HG1      VAL  79   4.949   2.344 -11.232
  584   1HG2  VAL  79          1HG2      VAL  79   3.161   2.342  -9.094
  585   2HG2  VAL  79          2HG2      VAL  79   4.870   2.074  -8.759
  586   3HG2  VAL  79          3HG2      VAL  79   3.658   0.981  -8.092
  587    H    MET  80           H        MET  80   1.709  -0.424  -8.054
  588    HA   MET  80           HA       MET  80   3.184  -2.326  -6.751
  589   1HB   MET  80          2HB       MET  80   0.344  -1.489  -6.644
  590   2HB   MET  80          1HB       MET  80   0.715  -3.049  -5.909
  591   1HG   MET  80          2HG       MET  80   2.057  -2.117  -4.277
  592   2HG   MET  80          1HG       MET  80   2.536  -0.762  -5.297
  593   1HE   MET  80          1HE       MET  80   2.411   0.085  -2.943
  594   2HE   MET  80          2HE       MET  80   1.022   0.968  -2.313
  595   3HE   MET  80          3HE       MET  80   1.831   1.537  -3.770
  596    H    MET  81           H        MET  81   0.750  -2.879  -9.266
  597    HA   MET  81           HA       MET  81   0.672  -5.733  -8.997
  598   1HB   MET  81          2HB       MET  81  -0.227  -3.801 -11.124
  599   2HB   MET  81          1HB       MET  81  -0.278  -5.542 -11.401
  600   1HG   MET  81          2HG       MET  81  -1.559  -5.727  -9.206
  601   2HG   MET  81          1HG       MET  81  -1.707  -3.971  -9.249
  602   1HE   MET  81          1HE       MET  81  -4.366  -6.855 -10.337
  603   2HE   MET  81          2HE       MET  81  -4.989  -5.331  -9.707
  604   3HE   MET  81          3HE       MET  81  -3.596  -6.090  -8.940
  605    H    VAL  82           H        VAL  82   2.124  -3.627 -11.510
  606    HA   VAL  82           HA       VAL  82   3.517  -5.685 -12.849
  607    HB   VAL  82           HB       VAL  82   4.933  -3.827 -13.790
  608   1HG1  VAL  82          1HG1      VAL  82   2.214  -2.750 -14.067
  609   2HG1  VAL  82          2HG1      VAL  82   2.311  -4.497 -14.289
  610   3HG1  VAL  82          3HG1      VAL  82   3.291  -3.426 -15.291
  611   1HG2  VAL  82          1HG2      VAL  82   4.256  -1.509 -13.247
  612   2HG2  VAL  82          2HG2      VAL  82   4.899  -2.332 -11.828
  613   3HG2  VAL  82          3HG2      VAL  82   3.159  -2.124 -12.014
  614    H    ARG  83           H        ARG  83   4.435  -3.656 -10.105
  615    HA   ARG  83           HA       ARG  83   7.191  -4.301 -10.021
  616   1HB   ARG  83          2HB       ARG  83   5.273  -3.471  -7.832
  617   2HB   ARG  83          1HB       ARG  83   7.015  -3.630  -7.600
  618   1HG   ARG  83          2HG       ARG  83   5.989  -1.957  -9.874
  619   2HG   ARG  83          1HG       ARG  83   5.984  -1.288  -8.243
  620   1HD   ARG  83          2HD       ARG  83   8.491  -2.431  -8.415
  621   2HD   ARG  83          1HD       ARG  83   8.243  -1.818 -10.043
  622    HE   ARG  83           HE       ARG  83   8.707  -0.257  -7.682
  623   1HH1  ARG  83          2HH1      ARG  83   7.072  -0.272 -10.766
  624   2HH1  ARG  83          1HH1      ARG  83   7.096   1.449 -10.927
  625   1HH2  ARG  83          1HH2      ARG  83   8.727   1.998  -7.918
  626   2HH2  ARG  83          2HH2      ARG  83   8.026   2.729  -9.322
  627    H    CYS  84           H        CYS  84   4.357  -6.088  -9.081
  628    HA   CYS  84           HA       CYS  84   5.620  -7.869  -7.232
  629   1HB   CYS  84          2HB       CYS  84   3.060  -7.337  -7.675
  630   2HB   CYS  84          1HB       CYS  84   3.206  -8.707  -8.777
  631    HG   CYS  84           HG       CYS  84   3.906  -8.925  -5.730
  632    H    MET  85           H        MET  85   5.676  -7.651 -10.671
  633    HA   MET  85           HA       MET  85   5.842 -10.347 -11.430
  634   1HB   MET  85          2HB       MET  85   6.827  -7.774 -12.591
  635   2HB   MET  85          1HB       MET  85   7.442  -9.285 -13.262
  636   1HG   MET  85          2HG       MET  85   4.486  -8.964 -12.833
  637   2HG   MET  85          1HG       MET  85   5.242  -8.221 -14.242
  638   1HE   MET  85          1HE       MET  85   4.151 -11.609 -12.521
  639   2HE   MET  85          2HE       MET  85   3.552 -12.180 -14.077
  640   3HE   MET  85          3HE       MET  85   3.103 -10.576 -13.504
  641    H    LYS  86           H        LYS  86   8.687  -8.194 -11.345
  642    HA   LYS  86           HA       LYS  86  10.869  -8.536 -10.763
  643   1HB   LYS  86          2HB       LYS  86   9.343 -10.060  -8.721
  644   2HB   LYS  86          1HB       LYS  86  11.068 -10.406  -8.841
  645   1HG   LYS  86          2HG       LYS  86  11.685  -8.260  -8.222
  646   2HG   LYS  86          1HG       LYS  86  10.194  -7.542  -8.833
  647   1HD   LYS  86          2HD       LYS  86   9.636  -7.456  -6.620
  648   2HD   LYS  86          1HD       LYS  86   9.192  -9.144  -6.876
  649   1HE   LYS  86          2HE       LYS  86  11.005  -9.939  -5.724
  650   2HE   LYS  86          1HE       LYS  86  12.055  -8.632  -6.269
  651   1HZ   LYS  86          1HZ       LYS  86  10.990  -7.141  -4.727
  652   2HZ   LYS  86          2HZ       LYS  86  11.557  -8.505  -3.889
  653   3HZ   LYS  86          3HZ       LYS  86   9.902  -8.347  -4.241
  654    H    ASP  87           H        ASP  87   9.860 -11.885 -10.118
  655    HA   ASP  87           HA       ASP  87  10.448 -13.884 -11.068
  656   1HB   ASP  87          2HB       ASP  87  11.130 -12.312 -13.565
  657   2HB   ASP  87          1HB       ASP  87  10.746 -14.028 -13.452
  658    H    ASP  88           H        ASP  88  12.196 -14.052  -9.611
  659    HA   ASP  88           HA       ASP  88  14.842 -13.180 -10.500
  660   1HB   ASP  88          2HB       ASP  88  13.880 -14.556  -7.980
  661   2HB   ASP  88          1HB       ASP  88  15.577 -14.206  -8.309
  662    H    SER  89           HN       SER  89  14.765 -14.562 -12.417
  663    HA   SER  89           HA       SER  89  15.469 -17.372 -11.795
  664   1HB   SER  89          2HB       SER  89  14.651 -17.919 -14.088
  665   2HB   SER  89          1HB       SER  89  13.382 -17.323 -13.022
  666    HG   SER  89           HG       SER  89  13.973 -16.391 -15.352
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  14.842  -1.136 -20.254
    2   2H    MET   1          2H        MET   1  16.322  -0.304 -20.217
    3   3H    MET   1          3H        MET   1  14.860   0.553 -20.100
    4    HA   MET   1           HA       MET   1  15.924  -1.367 -18.098
    5   1HB   MET   1          2HB       MET   1  16.974   0.991 -18.354
    6   2HB   MET   1          1HB       MET   1  15.440   1.589 -17.722
    7   1HG   MET   1          2HG       MET   1  15.710   0.412 -15.667
    8   2HG   MET   1          1HG       MET   1  17.025  -0.568 -16.317
    9   1HE   MET   1          1HE       MET   1  19.616   0.135 -15.583
   10   2HE   MET   1          2HE       MET   1  20.013   1.528 -16.587
   11   3HE   MET   1          3HE       MET   1  19.017   0.233 -17.245
   12    H    ASN   2           H        ASN   2  14.327  -2.369 -17.070
   13    HA   ASN   2           HA       ASN   2  12.283  -2.870 -16.161
   14   1HB   ASN   2          2HB       ASN   2  12.725  -0.028 -15.565
   15   2HB   ASN   2          1HB       ASN   2  11.024  -0.497 -15.561
   16   1HD2  ASN   2          1HD2      ASN   2  14.089  -2.103 -14.487
   17   2HD2  ASN   2          2HD2      ASN   2  13.484  -2.537 -12.963
   18    H    ASP   3           H        ASP   3  11.660  -3.635 -18.285
   19    HA   ASP   3           HA       ASP   3   9.788  -1.876 -19.735
   20   1HB   ASP   3          2HB       ASP   3   9.978  -3.481 -21.579
   21   2HB   ASP   3          1HB       ASP   3  11.565  -2.892 -21.089
   22    H    ILE   4           H        ILE   4   9.502  -3.878 -17.228
   23    HA   ILE   4           HA       ILE   4   7.492  -5.727 -18.047
   24    HB   ILE   4           HB       ILE   4   7.136  -6.210 -15.752
   25   1HG1  ILE   4          2HG1      ILE   4   6.901  -3.742 -15.106
   26   2HG1  ILE   4          1HG1      ILE   4   7.675  -4.786 -13.917
   27   1HG2  ILE   4          1HG2      ILE   4   9.409  -6.747 -16.759
   28   2HG2  ILE   4          2HG2      ILE   4   9.333  -6.728 -14.998
   29   3HG2  ILE   4          3HG2      ILE   4  10.035  -5.363 -15.865
   30   1HD1  ILE   4          1HD1      ILE   4   8.935  -2.736 -15.740
   31   2HD1  ILE   4          2HD1      ILE   4   9.902  -4.031 -15.032
   32   3HD1  ILE   4          3HD1      ILE   4   9.068  -2.882 -13.988
   33    H    TYR   5           H        TYR   5   7.439  -2.366 -17.139
   34    HA   TYR   5           HA       TYR   5   4.677  -2.148 -16.476
   35   1HB   TYR   5          2HB       TYR   5   6.494  -0.010 -17.620
   36   2HB   TYR   5          1HB       TYR   5   4.987   0.247 -16.741
   37    HD1  TYR   5           HD1      TYR   5   8.497   0.073 -16.431
   38    HD2  TYR   5           HD2      TYR   5   4.870  -0.940 -14.372
   39    HE1  TYR   5           HE1      TYR   5   9.738   0.002 -14.289
   40    HE2  TYR   5           HE2      TYR   5   6.111  -1.003 -12.223
   41    HH   TYR   5           HH       TYR   5   8.479   0.252 -11.427
   42    H    LYS   6           H        LYS   6   6.527  -1.933 -19.461
   43    HA   LYS   6           HA       LYS   6   4.326  -1.046 -21.099
   44   1HB   LYS   6          2HB       LYS   6   6.794  -2.472 -22.104
   45   2HB   LYS   6          1HB       LYS   6   5.782  -1.312 -22.960
   46   1HG   LYS   6          2HG       LYS   6   7.729  -0.789 -20.709
   47   2HG   LYS   6          1HG       LYS   6   7.711  -0.079 -22.322
   48   1HD   LYS   6          2HD       LYS   6   5.756   1.220 -21.824
   49   2HD   LYS   6          1HD       LYS   6   5.475   0.337 -20.322
   50   1HE   LYS   6          2HE       LYS   6   7.297   1.357 -19.236
   51   2HE   LYS   6          1HE       LYS   6   8.050   1.844 -20.754
   52   1HZ   LYS   6          1HZ       LYS   6   6.282   3.425 -21.112
   53   2HZ   LYS   6          2HZ       LYS   6   6.999   3.706 -19.598
   54   3HZ   LYS   6          3HZ       LYS   6   5.493   2.926 -19.695
   55    H    ALA   7           H        ALA   7   5.872  -4.132 -20.363
   56    HA   ALA   7           HA       ALA   7   4.306  -5.716 -22.149
   57   1HB   ALA   7          1HB       ALA   7   6.528  -6.263 -20.786
   58   2HB   ALA   7          2HB       ALA   7   5.404  -7.537 -21.258
   59   3HB   ALA   7          3HB       ALA   7   5.367  -6.892 -19.617
   60    H    ALA   8           H        ALA   8   3.937  -4.658 -18.802
   61    HA   ALA   8           HA       ALA   8   1.684  -6.297 -18.173
   62   1HB   ALA   8          1HB       ALA   8   1.354  -4.576 -16.323
   63   2HB   ALA   8          2HB       ALA   8   2.799  -3.773 -16.941
   64   3HB   ALA   8          3HB       ALA   8   2.901  -5.423 -16.325
   65    H    VAL   9           H        VAL   9   2.090  -3.086 -19.586
   66    HA   VAL   9           HA       VAL   9  -0.513  -2.100 -19.342
   67    HB   VAL   9           HB       VAL   9   1.723  -1.641 -21.285
   68   1HG1  VAL   9          1HG1      VAL   9   0.289   0.165 -22.329
   69   2HG1  VAL   9          2HG1      VAL   9  -1.105  -0.586 -21.552
   70   3HG1  VAL   9          3HG1      VAL   9  -0.176  -1.482 -22.755
   71   1HG2  VAL   9          1HG2      VAL   9   2.030   0.273 -20.077
   72   2HG2  VAL   9          2HG2      VAL   9   1.131  -0.609 -18.843
   73   3HG2  VAL   9          3HG2      VAL   9   0.300   0.549 -19.880
   74    H    GLU  10           H        GLU  10   0.874  -4.140 -21.915
   75    HA   GLU  10           HA       GLU  10  -1.611  -4.270 -23.373
   76   1HB   GLU  10          2HB       GLU  10   1.045  -5.661 -23.639
   77   2HB   GLU  10          1HB       GLU  10  -0.346  -6.146 -24.611
   78   1HG   GLU  10          2HG       GLU  10  -0.506  -3.519 -25.039
   79   2HG   GLU  10          1HG       GLU  10   1.218  -3.598 -24.676
   80    H    GLN  11           H        GLN  11  -0.629  -5.771 -20.522
   81    HA   GLN  11           HA       GLN  11  -2.205  -8.202 -21.080
   82   1HB   GLN  11          2HB       GLN  11  -0.294  -7.681 -18.796
   83   2HB   GLN  11          1HB       GLN  11  -1.076  -9.209 -19.190
   84   1HG   GLN  11          2HG       GLN  11   0.587  -7.808 -21.257
   85   2HG   GLN  11          1HG       GLN  11   1.374  -8.778 -20.012
   86   1HE2  GLN  11          1HE2      GLN  11  -0.674  -8.924 -22.881
   87   2HE2  GLN  11          2HE2      GLN  11  -0.678 -10.616 -23.013
   88    H    LEU  12           H        LEU  12  -2.126  -5.302 -19.126
   89    HA   LEU  12           HA       LEU  12  -3.901  -6.235 -17.089
   90   1HB   LEU  12          2HB       LEU  12  -4.266  -3.756 -16.678
   91   2HB   LEU  12          1HB       LEU  12  -2.649  -4.376 -16.455
   92    HG   LEU  12           HG       LEU  12  -1.995  -3.423 -18.635
   93   1HD1  LEU  12          1HD1      LEU  12  -3.704  -1.732 -19.591
   94   2HD1  LEU  12          2HD1      LEU  12  -4.906  -2.646 -18.679
   95   3HD1  LEU  12          3HD1      LEU  12  -3.955  -3.443 -19.934
   96   1HD2  LEU  12          1HD2      LEU  12  -3.364  -1.523 -16.711
   97   2HD2  LEU  12          2HD2      LEU  12  -2.233  -1.019 -17.967
   98   3HD2  LEU  12          3HD2      LEU  12  -1.683  -2.056 -16.651
   99    H    THR  13           H        THR  13  -6.058  -5.301 -16.698
  100    HA   THR  13           HA       THR  13  -7.599  -5.087 -19.219
  101    HB   THR  13           HB       THR  13  -9.494  -5.886 -17.504
  102    HG1  THR  13           HG1      THR  13  -8.471  -6.325 -15.701
  103   1HG2  THR  13          1HG2      THR  13  -7.486  -7.583 -18.993
  104   2HG2  THR  13          2HG2      THR  13  -9.073  -7.048 -19.546
  105   3HG2  THR  13          3HG2      THR  13  -8.947  -8.247 -18.260
  106    H    ASP  14           H        ASP  14  -9.723  -3.957 -18.928
  107    HA   ASP  14           HA       ASP  14  -9.312  -1.338 -17.885
  108   1HB   ASP  14          2HB       ASP  14 -10.881  -2.030 -19.788
  109   2HB   ASP  14          1HB       ASP  14 -12.001  -2.551 -18.528
  110    H    GLU  15           H        GLU  15 -10.799  -4.258 -16.628
  111    HA   GLU  15           HA       GLU  15 -12.224  -3.102 -14.461
  112   1HB   GLU  15          2HB       GLU  15 -11.140  -5.886 -14.908
  113   2HB   GLU  15          1HB       GLU  15 -12.119  -5.438 -13.513
  114   1HG   GLU  15          2HG       GLU  15 -14.038  -5.324 -14.729
  115   2HG   GLU  15          1HG       GLU  15 -13.231  -4.594 -16.117
  116    H    GLN  16           H        GLN  16  -8.895  -4.337 -14.770
  117    HA   GLN  16           HA       GLN  16  -8.245  -4.285 -12.029
  118   1HB   GLN  16          2HB       GLN  16  -6.010  -4.585 -12.643
  119   2HB   GLN  16          1HB       GLN  16  -6.889  -5.287 -13.995
  120   1HG   GLN  16          2HG       GLN  16  -5.693  -3.933 -15.341
  121   2HG   GLN  16          1HG       GLN  16  -6.610  -2.585 -14.681
  122   1HE2  GLN  16          1HE2      GLN  16  -5.515  -1.144 -13.234
  123   2HE2  GLN  16          2HE2      GLN  16  -3.885  -1.328 -12.807
  124    H    LYS  17           H        LYS  17  -8.364  -1.721 -14.429
  125    HA   LYS  17           HA       LYS  17  -7.090   0.212 -12.664
  126   1HB   LYS  17          2HB       LYS  17  -8.054   0.196 -15.467
  127   2HB   LYS  17          1HB       LYS  17  -8.170   1.738 -14.619
  128   1HG   LYS  17          2HG       LYS  17  -5.987   2.001 -15.183
  129   2HG   LYS  17          1HG       LYS  17  -5.667   0.866 -13.869
  130   1HD   LYS  17          2HD       LYS  17  -4.617  -0.312 -15.527
  131   2HD   LYS  17          1HD       LYS  17  -6.252  -0.886 -15.849
  132   1HE   LYS  17          2HE       LYS  17  -5.574  -0.167 -17.967
  133   2HE   LYS  17          1HE       LYS  17  -6.419   1.255 -17.358
  134   1HZ   LYS  17          1HZ       LYS  17  -4.282   1.846 -18.310
  135   2HZ   LYS  17          2HZ       LYS  17  -3.485   0.796 -17.238
  136   3HZ   LYS  17          3HZ       LYS  17  -4.295   2.166 -16.644
  137    H    ASN  18           H        ASN  18 -10.313  -0.825 -13.566
  138    HA   ASN  18           HA       ASN  18 -11.758   1.415 -12.571
  139   1HB   ASN  18          2HB       ASN  18 -12.384  -1.306 -13.499
  140   2HB   ASN  18          1HB       ASN  18 -13.465  -0.720 -12.234
  141   1HD2  ASN  18          1HD2      ASN  18 -12.062   0.285 -15.397
  142   2HD2  ASN  18          2HD2      ASN  18 -13.390   1.244 -15.843
  143    H    GLU  19           H        GLU  19 -10.708  -1.659 -11.132
  144    HA   GLU  19           HA       GLU  19 -11.915  -1.178  -8.566
  145   1HB   GLU  19          2HB       GLU  19  -9.628  -3.039  -9.280
  146   2HB   GLU  19          1HB       GLU  19 -10.584  -3.083  -7.798
  147   1HG   GLU  19          2HG       GLU  19 -12.597  -3.223  -9.556
  148   2HG   GLU  19          1HG       GLU  19 -11.329  -3.925 -10.559
  149    H    PHE  20           H        PHE  20  -8.707  -0.736  -9.984
  150    HA   PHE  20           HA       PHE  20  -7.352   0.064  -7.628
  151   1HB   PHE  20          2HB       PHE  20  -6.836   0.346 -10.564
  152   2HB   PHE  20          1HB       PHE  20  -5.872   1.299  -9.441
  153    HD1  PHE  20           HD1      PHE  20  -3.877   0.010 -10.239
  154    HD2  PHE  20           HD2      PHE  20  -7.162  -1.886  -8.219
  155    HE1  PHE  20           HE1      PHE  20  -2.455  -1.964  -9.772
  156    HE2  PHE  20           HE2      PHE  20  -5.742  -3.857  -7.756
  157    HZ   PHE  20           HZ       PHE  20  -3.387  -3.899  -8.529
  158    H    LYS  21           H        LYS  21  -9.000   1.926 -10.177
  159    HA   LYS  21           HA       LYS  21  -8.394   4.493  -9.139
  160   1HB   LYS  21          2HB       LYS  21  -9.228   4.075 -11.460
  161   2HB   LYS  21          1HB       LYS  21 -10.815   3.705 -10.785
  162   1HG   LYS  21          2HG       LYS  21 -10.732   6.046 -11.528
  163   2HG   LYS  21          1HG       LYS  21 -10.900   5.968  -9.774
  164   1HD   LYS  21          2HD       LYS  21  -8.575   6.456  -9.440
  165   2HD   LYS  21          1HD       LYS  21  -8.218   6.238 -11.154
  166   1HE   LYS  21          2HE       LYS  21  -8.318   8.599 -10.814
  167   2HE   LYS  21          1HE       LYS  21  -9.837   8.164 -11.598
  168   1HZ   LYS  21          1HZ       LYS  21 -10.975   8.255  -9.545
  169   2HZ   LYS  21          2HZ       LYS  21 -10.035   9.668  -9.626
  170   3HZ   LYS  21          3HZ       LYS  21  -9.537   8.367  -8.654
  171    H    ALA  22           H        ALA  22 -11.339   2.478  -8.858
  172    HA   ALA  22           HA       ALA  22 -12.772   4.172  -7.127
  173   1HB   ALA  22          1HB       ALA  22 -12.858   1.154  -7.311
  174   2HB   ALA  22          2HB       ALA  22 -13.837   2.280  -8.252
  175   3HB   ALA  22          3HB       ALA  22 -14.061   2.162  -6.507
  176    H    ALA  23           H        ALA  23 -10.575   1.465  -6.404
  177    HA   ALA  23           HA       ALA  23 -10.792   1.576  -3.585
  178   1HB   ALA  23          1HB       ALA  23  -9.814  -0.370  -4.631
  179   2HB   ALA  23          2HB       ALA  23  -8.593   0.376  -3.601
  180   3HB   ALA  23          3HB       ALA  23  -8.532   0.606  -5.348
  181    H    PHE  24           H        PHE  24  -9.196   3.642  -5.841
  182    HA   PHE  24           HA       PHE  24  -7.320   4.726  -3.900
  183   1HB   PHE  24          2HB       PHE  24  -6.971   4.461  -6.482
  184   2HB   PHE  24          1HB       PHE  24  -7.882   5.965  -6.577
  185    HD1  PHE  24           HD1      PHE  24  -4.780   4.371  -5.382
  186    HD2  PHE  24           HD2      PHE  24  -6.973   8.056  -5.691
  187    HE1  PHE  24           HE1      PHE  24  -2.735   5.640  -4.781
  188    HE2  PHE  24           HE2      PHE  24  -4.926   9.321  -5.092
  189    HZ   PHE  24           HZ       PHE  24  -2.809   8.113  -4.638
  190    H    ASP  25           H        ASP  25 -10.018   6.048  -5.894
  191    HA   ASP  25           HA       ASP  25 -10.076   8.543  -4.618
  192   1HB   ASP  25          2HB       ASP  25 -12.422   8.731  -5.520
  193   2HB   ASP  25          1HB       ASP  25 -11.176   8.388  -6.705
  194    H    ILE  26           H        ILE  26 -11.561   5.499  -3.627
  195    HA   ILE  26           HA       ILE  26 -13.483   6.526  -1.842
  196    HB   ILE  26           HB       ILE  26 -13.230   4.368  -0.605
  197   1HG1  ILE  26          2HG1      ILE  26 -11.071   3.849  -2.676
  198   2HG1  ILE  26          1HG1      ILE  26 -10.777   4.128  -0.962
  199   1HG2  ILE  26          1HG2      ILE  26 -13.759   4.683  -3.499
  200   2HG2  ILE  26          2HG2      ILE  26 -14.776   3.991  -2.235
  201   3HG2  ILE  26          3HG2      ILE  26 -13.496   3.023  -2.965
  202   1HD1  ILE  26          1HD1      ILE  26 -10.780   1.754  -1.268
  203   2HD1  ILE  26          2HD1      ILE  26 -12.258   1.816  -2.226
  204   3HD1  ILE  26          3HD1      ILE  26 -12.313   2.157  -0.496
  205    H    PHE  27           H        PHE  27 -10.012   6.039  -1.493
  206    HA   PHE  27           HA       PHE  27 -10.025   6.876   1.302
  207   1HB   PHE  27          2HB       PHE  27  -7.895   5.942  -0.611
  208   2HB   PHE  27          1HB       PHE  27  -7.463   6.729   0.906
  209    HD1  PHE  27           HD1      PHE  27  -8.543   3.668  -0.652
  210    HD2  PHE  27           HD2      PHE  27  -8.420   5.776   3.087
  211    HE1  PHE  27           HE1      PHE  27  -8.934   1.540   0.558
  212    HE2  PHE  27           HE2      PHE  27  -8.810   3.648   4.298
  213    HZ   PHE  27           HZ       PHE  27  -9.068   1.530   3.034
  214    H    ILE  28           H        ILE  28  -9.319   8.161  -1.895
  215    HA   ILE  28           HA       ILE  28  -8.234  10.650  -0.788
  216    HB   ILE  28           HB       ILE  28  -8.696  10.020  -3.704
  217   1HG1  ILE  28          2HG1      ILE  28  -7.289   8.238  -3.144
  218   2HG1  ILE  28          1HG1      ILE  28  -6.137   9.492  -3.570
  219   1HG2  ILE  28          1HG2      ILE  28  -6.570  11.542  -3.757
  220   2HG2  ILE  28          2HG2      ILE  28  -7.096  12.023  -2.142
  221   3HG2  ILE  28          3HG2      ILE  28  -8.154  12.281  -3.529
  222   1HD1  ILE  28          1HD1      ILE  28  -6.163  10.099  -1.052
  223   2HD1  ILE  28          2HD1      ILE  28  -5.299   8.640  -1.538
  224   3HD1  ILE  28          3HD1      ILE  28  -6.905   8.514  -0.826
  225    H    GLN  29           H        GLN  29 -11.027  10.000  -0.267
  226    HA   GLN  29           HA       GLN  29 -12.715  11.498  -2.026
  227   1HB   GLN  29          2HB       GLN  29 -14.391  11.353  -0.184
  228   2HB   GLN  29          1HB       GLN  29 -13.715   9.788  -0.629
  229   1HG   GLN  29          2HG       GLN  29 -12.459   9.620   1.330
  230   2HG   GLN  29          1HG       GLN  29 -12.427  11.365   1.581
  231   1HE2  GLN  29          1HE2      GLN  29 -14.579  12.388   2.210
  232   2HE2  GLN  29          2HE2      GLN  29 -15.671  11.457   3.116
  233    H    ASP  30           H        ASP  30 -10.758  12.275   0.768
  234    HA   ASP  30           HA       ASP  30 -11.086  15.108   0.258
  235   1HB   ASP  30          2HB       ASP  30 -12.907  14.129   1.987
  236   2HB   ASP  30          1HB       ASP  30 -11.573  14.410   3.106
  237    H    ALA  31           H        ALA  31  -8.871  13.468  -0.050
  238    HA   ALA  31           HA       ALA  31  -7.155  13.463   2.239
  239   1HB   ALA  31          1HB       ALA  31  -6.811  11.905   0.371
  240   2HB   ALA  31          2HB       ALA  31  -5.376  12.900   0.626
  241   3HB   ALA  31          3HB       ALA  31  -6.475  13.261  -0.705
  242    H    GLU  32           H        GLU  32  -5.141  14.669   2.411
  243    HA   GLU  32           HA       GLU  32  -5.556  17.488   2.137
  244   1HB   GLU  32          2HB       GLU  32  -3.083  15.919   2.903
  245   2HB   GLU  32          1HB       GLU  32  -3.225  17.674   3.006
  246   1HG   GLU  32          2HG       GLU  32  -4.451  17.572   4.907
  247   2HG   GLU  32          1HG       GLU  32  -5.461  16.268   4.283
  248    H    ASP  33           H        ASP  33  -3.276  15.213   0.626
  249    HA   ASP  33           HA       ASP  33  -2.602  17.246  -1.401
  250   1HB   ASP  33          2HB       ASP  33  -1.284  14.592  -0.768
  251   2HB   ASP  33          1HB       ASP  33  -0.733  15.740  -1.989
  252    H    GLY  34           H        GLY  34  -4.008  14.044  -1.001
  253   1HA   GLY  34          2HA       GLY  34  -5.785  13.420  -2.584
  254   2HA   GLY  34          1HA       GLY  34  -4.762  14.056  -3.868
  255    H    CYS  35           H        CYS  35  -3.631  12.107  -1.149
  256    HA   CYS  35           HA       CYS  35  -3.355   9.724  -2.834
  257   1HB   CYS  35          2HB       CYS  35  -0.989  10.886  -1.348
  258   2HB   CYS  35          1HB       CYS  35  -0.998   9.491  -2.418
  259    HG   CYS  35           HG       CYS  35  -1.211  12.451  -3.356
  260    H    ILE  36           H        ILE  36  -2.258   7.931  -1.410
  261    HA   ILE  36           HA       ILE  36  -3.608   8.010   1.218
  262    HB   ILE  36           HB       ILE  36  -3.458   5.545   1.175
  263   1HG1  ILE  36          2HG1      ILE  36  -2.911   4.975  -1.513
  264   2HG1  ILE  36          1HG1      ILE  36  -1.657   6.123  -1.045
  265   1HG2  ILE  36          1HG2      ILE  36  -4.616   6.450  -1.459
  266   2HG2  ILE  36          2HG2      ILE  36  -5.347   6.925   0.074
  267   3HG2  ILE  36          3HG2      ILE  36  -5.227   5.219  -0.354
  268   1HD1  ILE  36          1HD1      ILE  36  -0.620   4.600   0.257
  269   2HD1  ILE  36          2HD1      ILE  36  -1.658   3.391  -0.501
  270   3HD1  ILE  36          3HD1      ILE  36  -2.131   4.127   1.033
  271    H    SER  37           H        SER  37  -2.384   6.375   2.797
  272    HA   SER  37           HA       SER  37   0.295   7.512   3.089
  273   1HB   SER  37          2HB       SER  37  -1.531   7.218   4.969
  274   2HB   SER  37          1HB       SER  37  -0.884   5.583   5.052
  275    HG   SER  37           HG       SER  37   0.349   8.047   5.586
  276    H    THR  38           H        THR  38   2.136   6.413   2.814
  277    HA   THR  38           HA       THR  38   2.242   4.009   1.367
  278    HB   THR  38           HB       THR  38   4.656   3.928   2.060
  279    HG1  THR  38           HG1      THR  38   4.127   6.372   3.370
  280   1HG2  THR  38          1HG2      THR  38   3.322   6.308   0.845
  281   2HG2  THR  38          2HG2      THR  38   4.438   5.151   0.119
  282   3HG2  THR  38          3HG2      THR  38   5.049   6.414   1.188
  283    H    LYS  39           H        LYS  39   2.320   4.629   4.836
  284    HA   LYS  39           HA       LYS  39   2.894   1.900   5.568
  285   1HB   LYS  39          2HB       LYS  39   1.815   4.191   7.231
  286   2HB   LYS  39          1HB       LYS  39   2.392   2.650   7.864
  287   1HG   LYS  39          2HG       LYS  39   4.423   3.641   7.996
  288   2HG   LYS  39          1HG       LYS  39   4.485   3.469   6.242
  289   1HD   LYS  39          2HD       LYS  39   3.608   5.687   5.915
  290   2HD   LYS  39          1HD       LYS  39   3.241   5.856   7.632
  291   1HE   LYS  39          2HE       LYS  39   5.812   5.410   7.940
  292   2HE   LYS  39          1HE       LYS  39   5.911   5.913   6.252
  293   1HZ   LYS  39          1HZ       LYS  39   4.714   7.477   8.477
  294   2HZ   LYS  39          2HZ       LYS  39   4.744   7.958   6.847
  295   3HZ   LYS  39          3HZ       LYS  39   6.195   7.796   7.714
  296    H    GLU  40           H        GLU  40   0.027   3.718   4.791
  297    HA   GLU  40           HA       GLU  40  -1.747   1.750   6.035
  298   1HB   GLU  40          2HB       GLU  40  -2.222   4.389   4.656
  299   2HB   GLU  40          1HB       GLU  40  -3.538   3.299   5.082
  300   1HG   GLU  40          2HG       GLU  40  -2.221   3.323   7.437
  301   2HG   GLU  40          1HG       GLU  40  -1.784   4.926   6.848
  302    H    LEU  41           H        LEU  41   0.005   1.508   3.377
  303    HA   LEU  41           HA       LEU  41  -1.789   1.136   1.240
  304   1HB   LEU  41          2HB       LEU  41   0.988   0.427   1.826
  305   2HB   LEU  41          1HB       LEU  41   0.183  -0.705   0.760
  306    HG   LEU  41           HG       LEU  41   0.435   2.274   0.315
  307   1HD1  LEU  41          1HD1      LEU  41   2.564   1.180  -0.033
  308   2HD1  LEU  41          2HD1      LEU  41   1.863   1.499  -1.619
  309   3HD1  LEU  41          3HD1      LEU  41   1.800  -0.126  -0.938
  310   1HD2  LEU  41          1HD2      LEU  41  -0.643   0.121  -1.531
  311   2HD2  LEU  41          2HD2      LEU  41  -0.624   1.859  -1.830
  312   3HD2  LEU  41          3HD2      LEU  41  -1.667   1.191  -0.572
  313    H    GLY  42           H        GLY  42  -1.063  -0.863   3.998
  314   1HA   GLY  42          2HA       GLY  42  -1.935  -3.367   2.987
  315   2HA   GLY  42          1HA       GLY  42  -1.868  -2.912   4.686
  316    H    LYS  43           H        LYS  43  -3.684  -0.509   3.796
  317    HA   LYS  43           HA       LYS  43  -6.170  -1.811   4.474
  318   1HB   LYS  43          2HB       LYS  43  -5.330   0.553   5.188
  319   2HB   LYS  43          1HB       LYS  43  -5.945   1.057   3.614
  320   1HG   LYS  43          2HG       LYS  43  -7.937   1.262   4.663
  321   2HG   LYS  43          1HG       LYS  43  -8.009  -0.497   4.568
  322   1HD   LYS  43          2HD       LYS  43  -6.767  -0.560   6.780
  323   2HD   LYS  43          1HD       LYS  43  -7.020   1.182   6.886
  324   1HE   LYS  43          2HE       LYS  43  -9.276  -0.803   6.503
  325   2HE   LYS  43          1HE       LYS  43  -8.764  -0.212   8.083
  326   1HZ   LYS  43          1HZ       LYS  43  -9.102   2.086   7.129
  327   2HZ   LYS  43          2HZ       LYS  43 -10.509   1.179   7.414
  328   3HZ   LYS  43          3HZ       LYS  43  -9.906   1.341   5.834
  329    H    VAL  44           H        VAL  44  -4.830  -0.110   1.634
  330    HA   VAL  44           HA       VAL  44  -7.195  -0.314   0.059
  331    HB   VAL  44           HB       VAL  44  -5.650   0.126  -1.881
  332   1HG1  VAL  44          1HG1      VAL  44  -5.440   1.912   0.559
  333   2HG1  VAL  44          2HG1      VAL  44  -6.699   1.967  -0.676
  334   3HG1  VAL  44          3HG1      VAL  44  -5.042   2.409  -1.086
  335   1HG2  VAL  44          1HG2      VAL  44  -3.663  -1.017  -0.813
  336   2HG2  VAL  44          2HG2      VAL  44  -3.541   0.358   0.285
  337   3HG2  VAL  44          3HG2      VAL  44  -3.318   0.590  -1.450
  338    H    MET  45           H        MET  45  -4.419  -2.440   0.553
  339    HA   MET  45           HA       MET  45  -4.923  -4.237  -1.579
  340   1HB   MET  45          2HB       MET  45  -3.683  -4.958   1.086
  341   2HB   MET  45          1HB       MET  45  -3.467  -5.785  -0.456
  342   1HG   MET  45          2HG       MET  45  -2.772  -2.894  -0.414
  343   2HG   MET  45          1HG       MET  45  -1.703  -3.968   0.487
  344   1HE   MET  45          1HE       MET  45  -3.692  -4.834  -3.071
  345   2HE   MET  45          2HE       MET  45  -2.654  -3.678  -3.904
  346   3HE   MET  45          3HE       MET  45  -3.583  -3.163  -2.496
  347    H    ARG  46           H        ARG  46  -6.143  -4.002   1.710
  348    HA   ARG  46           HA       ARG  46  -7.495  -6.514   1.775
  349   1HB   ARG  46          2HB       ARG  46  -7.723  -3.969   3.364
  350   2HB   ARG  46          1HB       ARG  46  -8.900  -5.265   3.578
  351   1HG   ARG  46          2HG       ARG  46  -7.289  -6.774   4.372
  352   2HG   ARG  46          1HG       ARG  46  -5.953  -5.874   3.654
  353   1HD   ARG  46          2HD       ARG  46  -5.798  -4.446   5.417
  354   2HD   ARG  46          1HD       ARG  46  -7.544  -4.353   5.621
  355    HE   ARG  46           HE       ARG  46  -6.654  -6.912   6.441
  356   1HH1  ARG  46          2HH1      ARG  46  -6.500  -3.551   7.380
  357   2HH1  ARG  46          1HH1      ARG  46  -6.357  -3.900   9.068
  358   1HH2  ARG  46          1HH2      ARG  46  -6.466  -7.344   8.661
  359   2HH2  ARG  46          2HH2      ARG  46  -6.338  -6.041   9.793
  360    H    MET  47           H        MET  47  -8.387  -3.261   0.727
  361    HA   MET  47           HA       MET  47 -11.165  -3.772   0.331
  362   1HB   MET  47          2HB       MET  47  -9.323  -1.691  -0.872
  363   2HB   MET  47          1HB       MET  47 -11.071  -1.714  -1.102
  364   1HG   MET  47          2HG       MET  47  -9.768  -1.672   1.632
  365   2HG   MET  47          1HG       MET  47 -10.253  -0.210   0.776
  366   1HE   MET  47          1HE       MET  47 -11.356  -1.612   3.739
  367   2HE   MET  47          2HE       MET  47 -11.028  -3.099   2.853
  368   3HE   MET  47          3HE       MET  47 -12.656  -2.775   3.441
  369    H    LEU  48           H        LEU  48  -8.292  -4.028  -1.721
  370    HA   LEU  48           HA       LEU  48  -9.712  -4.594  -4.146
  371   1HB   LEU  48          2HB       LEU  48  -6.924  -4.482  -3.265
  372   2HB   LEU  48          1HB       LEU  48  -7.221  -5.753  -4.431
  373    HG   LEU  48           HG       LEU  48  -6.467  -3.712  -5.538
  374   1HD1  LEU  48          1HD1      LEU  48  -8.224  -3.546  -7.198
  375   2HD1  LEU  48          2HD1      LEU  48  -9.427  -4.131  -6.048
  376   3HD1  LEU  48          3HD1      LEU  48  -8.165  -5.215  -6.633
  377   1HD2  LEU  48          1HD2      LEU  48  -9.003  -2.400  -4.526
  378   2HD2  LEU  48          2HD2      LEU  48  -7.671  -1.641  -5.398
  379   3HD2  LEU  48          3HD2      LEU  48  -7.439  -2.190  -3.738
  380    H    GLY  49           H        GLY  49  -7.882  -6.646  -1.867
  381   1HA   GLY  49          2HA       GLY  49  -9.336  -8.746  -1.333
  382   2HA   GLY  49          1HA       GLY  49  -9.101  -9.053  -3.052
  383    H    GLN  50           H        GLN  50  -7.083  -8.036  -0.286
  384    HA   GLN  50           HA       GLN  50  -5.309 -10.323  -0.681
  385   1HB   GLN  50          2HB       GLN  50  -4.602  -7.548  -1.438
  386   2HB   GLN  50          1HB       GLN  50  -3.405  -8.399  -0.461
  387   1HG   GLN  50          2HG       GLN  50  -3.688 -10.354  -2.102
  388   2HG   GLN  50          1HG       GLN  50  -4.534  -9.209  -3.144
  389   1HE2  GLN  50          1HE2      GLN  50  -3.271  -7.234  -3.825
  390   2HE2  GLN  50          2HE2      GLN  50  -1.579  -7.336  -3.916
  391    H    ASN  51           H        ASN  51  -4.127 -10.853   1.144
  392    HA   ASN  51           HA       ASN  51  -4.336  -9.082   3.484
  393   1HB   ASN  51          2HB       ASN  51  -6.227 -10.817   3.433
  394   2HB   ASN  51          1HB       ASN  51  -4.972 -12.021   3.723
  395   1HD2  ASN  51          1HD2      ASN  51  -5.165 -12.543   5.923
  396   2HD2  ASN  51          2HD2      ASN  51  -5.221 -11.400   7.177
  397    HA   PRO  52           HA       PRO  52  -0.172 -11.074   3.162
  398   1HB   PRO  52          2HB       PRO  52   1.257  -8.745   3.020
  399   2HB   PRO  52          1HB       PRO  52   0.590  -9.570   1.606
  400   1HG   PRO  52          2HG       PRO  52  -0.303  -7.084   2.923
  401   2HG   PRO  52          1HG       PRO  52  -0.535  -7.618   1.253
  402   1HD   PRO  52          2HD       PRO  52  -2.456  -7.714   3.358
  403   2HD   PRO  52          1HD       PRO  52  -2.613  -8.428   1.736
  404    H    THR  53           H        THR  53   1.950  -9.968   4.449
  405    HA   THR  53           HA       THR  53   1.006  -9.690   7.238
  406    HB   THR  53           HB       THR  53   2.961 -10.738   7.962
  407    HG1  THR  53           HG1      THR  53   4.840 -10.369   7.089
  408   1HG2  THR  53          1HG2      THR  53   2.677 -11.891   5.180
  409   2HG2  THR  53          2HG2      THR  53   1.606 -12.277   6.528
  410   3HG2  THR  53          3HG2      THR  53   3.316 -12.708   6.606
  411    HA   PRO  54           HA       PRO  54   2.731  -5.643   7.525
  412   1HB   PRO  54          2HB       PRO  54   4.253  -5.666   9.804
  413   2HB   PRO  54          1HB       PRO  54   2.482  -5.657   9.796
  414   1HG   PRO  54          2HG       PRO  54   4.356  -7.893  10.356
  415   2HG   PRO  54          1HG       PRO  54   2.730  -7.598  10.988
  416   1HD   PRO  54          2HD       PRO  54   3.371  -9.422   8.963
  417   2HD   PRO  54          1HD       PRO  54   1.742  -8.793   9.297
  418    H    GLU  55           H        GLU  55   5.100  -8.223   7.749
  419    HA   GLU  55           HA       GLU  55   7.365  -6.520   7.088
  420   1HB   GLU  55          2HB       GLU  55   7.313  -9.540   7.025
  421   2HB   GLU  55          1HB       GLU  55   8.701  -8.480   7.251
  422   1HG   GLU  55          2HG       GLU  55   7.612  -7.675   9.394
  423   2HG   GLU  55          1HG       GLU  55   6.426  -8.965   9.189
  424    H    GLU  56           H        GLU  56   5.248  -8.873   5.513
  425    HA   GLU  56           HA       GLU  56   6.638  -9.022   3.038
  426   1HB   GLU  56          2HB       GLU  56   4.711 -10.521   4.040
  427   2HB   GLU  56          1HB       GLU  56   3.669  -9.383   3.187
  428   1HG   GLU  56          2HG       GLU  56   5.121  -9.806   1.127
  429   2HG   GLU  56          1HG       GLU  56   5.822 -11.157   2.018
  430    H    LEU  57           H        LEU  57   3.710  -7.200   3.998
  431    HA   LEU  57           HA       LEU  57   3.394  -5.826   1.554
  432   1HB   LEU  57          2HB       LEU  57   1.499  -5.331   2.598
  433   2HB   LEU  57          1HB       LEU  57   2.152  -5.854   4.128
  434    HG   LEU  57           HG       LEU  57   2.815  -3.107   3.141
  435   1HD1  LEU  57          1HD1      LEU  57   0.256  -3.802   4.600
  436   2HD1  LEU  57          2HD1      LEU  57   0.331  -3.478   2.868
  437   3HD1  LEU  57          3HD1      LEU  57   0.758  -2.213   4.020
  438   1HD2  LEU  57          1HD2      LEU  57   3.388  -4.569   5.424
  439   2HD2  LEU  57          2HD2      LEU  57   2.026  -3.570   5.932
  440   3HD2  LEU  57          3HD2      LEU  57   3.483  -2.813   5.290
  441    H    GLN  58           H        GLN  58   5.411  -5.171   4.362
  442    HA   GLN  58           HA       GLN  58   6.012  -2.473   3.960
  443   1HB   GLN  58          2HB       GLN  58   6.754  -4.056   5.876
  444   2HB   GLN  58          1HB       GLN  58   8.124  -4.431   4.833
  445   1HG   GLN  58          2HG       GLN  58   8.775  -2.611   6.293
  446   2HG   GLN  58          1HG       GLN  58   8.578  -1.957   4.666
  447   1HE2  GLN  58          1HE2      GLN  58   6.801  -0.486   4.278
  448   2HE2  GLN  58          2HE2      GLN  58   5.839   0.116   5.542
  449    H    GLU  59           H        GLU  59   7.524  -5.360   2.532
  450    HA   GLU  59           HA       GLU  59   9.576  -4.032   1.111
  451   1HB   GLU  59          2HB       GLU  59   8.189  -6.680   0.751
  452   2HB   GLU  59          1HB       GLU  59   9.373  -6.115  -0.429
  453   1HG   GLU  59          2HG       GLU  59  11.107  -6.010   1.216
  454   2HG   GLU  59          1HG       GLU  59   9.957  -6.220   2.538
  455    H    MET  60           H        MET  60   6.220  -4.798   0.266
  456    HA   MET  60           HA       MET  60   6.343  -4.010  -2.459
  457   1HB   MET  60          2HB       MET  60   3.976  -4.044  -0.565
  458   2HB   MET  60          1HB       MET  60   3.874  -3.881  -2.318
  459   1HG   MET  60          2HG       MET  60   5.240  -6.223  -0.970
  460   2HG   MET  60          1HG       MET  60   3.535  -6.240  -1.417
  461   1HE   MET  60          1HE       MET  60   6.216  -8.224  -3.861
  462   2HE   MET  60          2HE       MET  60   5.446  -8.341  -2.281
  463   3HE   MET  60          3HE       MET  60   6.893  -7.356  -2.477
  464    H    ILE  61           H        ILE  61   5.398  -2.260   0.500
  465    HA   ILE  61           HA       ILE  61   4.567   0.147  -0.631
  466    HB   ILE  61           HB       ILE  61   5.949  -0.428   1.994
  467   1HG1  ILE  61          2HG1      ILE  61   3.104   0.394   1.748
  468   2HG1  ILE  61          1HG1      ILE  61   3.509  -1.218   1.165
  469   1HG2  ILE  61          1HG2      ILE  61   6.336   1.891   1.591
  470   2HG2  ILE  61          2HG2      ILE  61   4.930   1.815   2.654
  471   3HG2  ILE  61          3HG2      ILE  61   4.717   2.122   0.930
  472   1HD1  ILE  61          1HD1      ILE  61   4.431  -1.843   3.287
  473   2HD1  ILE  61          2HD1      ILE  61   2.855  -1.116   3.606
  474   3HD1  ILE  61          3HD1      ILE  61   4.328  -0.188   3.889
  475    H    ASP  62           H        ASP  62   7.744  -0.268   0.945
  476    HA   ASP  62           HA       ASP  62   8.973   2.008  -0.038
  477   1HB   ASP  62          2HB       ASP  62   9.826   0.218   1.662
  478   2HB   ASP  62          1HB       ASP  62  10.561  -0.524   0.241
  479    H    GLU  63           H        GLU  63   8.618  -1.139  -1.629
  480    HA   GLU  63           HA       GLU  63  10.416  -0.683  -3.771
  481   1HB   GLU  63          2HB       GLU  63   8.195  -2.589  -3.237
  482   2HB   GLU  63          1HB       GLU  63   8.691  -2.380  -4.916
  483   1HG   GLU  63          2HG       GLU  63  10.781  -2.789  -2.795
  484   2HG   GLU  63          1HG       GLU  63   9.901  -4.178  -3.430
  485    H    VAL  64           H        VAL  64   6.867  -0.273  -3.577
  486    HA   VAL  64           HA       VAL  64   6.659   0.789  -6.231
  487    HB   VAL  64           HB       VAL  64   4.348   1.271  -5.705
  488   1HG1  VAL  64          1HG1      VAL  64   4.006  -1.107  -4.359
  489   2HG1  VAL  64          2HG1      VAL  64   5.609  -1.307  -5.069
  490   3HG1  VAL  64          3HG1      VAL  64   4.224  -0.951  -6.101
  491   1HG2  VAL  64          1HG2      VAL  64   4.923   0.485  -2.839
  492   2HG2  VAL  64          2HG2      VAL  64   3.441   1.181  -3.492
  493   3HG2  VAL  64          3HG2      VAL  64   4.900   2.165  -3.372
  494    H    ASP  65           H        ASP  65   7.473   2.194  -3.165
  495    HA   ASP  65           HA       ASP  65   6.625   4.860  -3.682
  496   1HB   ASP  65          2HB       ASP  65   7.662   3.586  -1.492
  497   2HB   ASP  65          1HB       ASP  65   9.043   4.540  -2.021
  498    H    GLU  66           H        GLU  66   7.220   5.316  -5.797
  499    HA   GLU  66           HA       GLU  66   9.901   5.114  -6.771
  500   1HB   GLU  66          2HB       GLU  66   7.487   6.631  -7.780
  501   2HB   GLU  66          1HB       GLU  66   9.025   6.560  -8.641
  502   1HG   GLU  66          2HG       GLU  66   8.858   4.044  -8.577
  503   2HG   GLU  66          1HG       GLU  66   7.233   4.225  -7.916
  504    H    ASP  67           H        ASP  67   8.001   7.719  -5.309
  505    HA   ASP  67           HA       ASP  67  10.199   9.613  -5.687
  506   1HB   ASP  67          2HB       ASP  67   8.569  11.145  -4.342
  507   2HB   ASP  67          1HB       ASP  67   8.199  10.752  -6.016
  508    H    GLY  68           H        GLY  68   8.557   7.890  -3.061
  509   1HA   GLY  68          2HA       GLY  68   9.332   7.326  -0.950
  510   2HA   GLY  68          1HA       GLY  68  10.888   8.033  -1.379
  511    H    SER  69           H        SER  69   7.662   9.514  -1.392
  512    HA   SER  69           HA       SER  69   8.682  11.757   0.174
  513   1HB   SER  69          2HB       SER  69   6.428  12.752  -0.333
  514   2HB   SER  69          1HB       SER  69   7.389  12.364  -1.755
  515    HG   SER  69           HG       SER  69   5.520  11.420  -2.235
  516    H    GLY  70           H        GLY  70   5.969   9.450   0.312
  517   1HA   GLY  70          2HA       GLY  70   5.955   8.600   2.842
  518   2HA   GLY  70          1HA       GLY  70   5.340  10.237   3.054
  519    H    THR  71           H        THR  71   4.004  10.198   0.403
  520    HA   THR  71           HA       THR  71   1.676   8.536   1.147
  521    HB   THR  71           HB       THR  71   0.290  10.107  -0.055
  522    HG1  THR  71           HG1      THR  71   2.677  11.513  -0.672
  523   1HG2  THR  71          1HG2      THR  71   0.736  12.176   1.241
  524   2HG2  THR  71          2HG2      THR  71   2.319  11.536   1.684
  525   3HG2  THR  71          3HG2      THR  71   0.854  10.728   2.242
  526    H    VAL  72           H        VAL  72   0.556   7.402  -0.488
  527    HA   VAL  72           HA       VAL  72   2.270   6.661  -2.770
  528    HB   VAL  72           HB       VAL  72  -0.209   5.250  -1.766
  529   1HG1  VAL  72          1HG1      VAL  72   0.603   3.401  -3.118
  530   2HG1  VAL  72          2HG1      VAL  72   2.070   4.294  -3.521
  531   3HG1  VAL  72          3HG1      VAL  72   0.509   4.840  -4.133
  532   1HG2  VAL  72          1HG2      VAL  72   1.458   3.638  -0.780
  533   2HG2  VAL  72          2HG2      VAL  72   1.441   5.216   0.006
  534   3HG2  VAL  72          3HG2      VAL  72   2.724   4.812  -1.136
  535    H    ASP  73           H        ASP  73   1.845   7.542  -4.659
  536    HA   ASP  73           HA       ASP  73  -0.708   8.843  -5.180
  537   1HB   ASP  73          2HB       ASP  73   1.778   8.544  -6.890
  538   2HB   ASP  73          1HB       ASP  73   0.360   9.484  -7.339
  539    H    PHE  74           H        PHE  74  -1.514   8.461  -7.574
  540    HA   PHE  74           HA       PHE  74  -2.511   5.804  -7.685
  541   1HB   PHE  74          2HB       PHE  74  -3.548   7.939  -8.695
  542   2HB   PHE  74          1HB       PHE  74  -2.466   7.662 -10.058
  543    HD1  PHE  74           HD1      PHE  74  -3.963   7.006 -11.773
  544    HD2  PHE  74           HD2      PHE  74  -4.148   5.094  -7.932
  545    HE1  PHE  74           HE1      PHE  74  -5.540   5.322 -12.683
  546    HE2  PHE  74           HE2      PHE  74  -5.719   3.410  -8.843
  547    HZ   PHE  74           HZ       PHE  74  -6.419   3.523 -11.219
  548    H    ASP  75           H        ASP  75   0.223   7.409  -9.227
  549    HA   ASP  75           HA       ASP  75   0.808   5.393 -11.151
  550   1HB   ASP  75          2HB       ASP  75   2.340   7.655  -9.912
  551   2HB   ASP  75          1HB       ASP  75   3.200   6.445 -10.861
  552    H    GLU  76           H        GLU  76   1.834   5.989  -7.819
  553    HA   GLU  76           HA       GLU  76   3.619   3.719  -7.705
  554   1HB   GLU  76          2HB       GLU  76   2.453   5.099  -5.293
  555   2HB   GLU  76          1HB       GLU  76   4.027   4.324  -5.465
  556   1HG   GLU  76          2HG       GLU  76   4.662   6.112  -7.107
  557   2HG   GLU  76          1HG       GLU  76   3.127   6.915  -6.759
  558    H    PHE  77           H        PHE  77   0.252   4.304  -7.246
  559    HA   PHE  77           HA       PHE  77  -0.311   2.023  -5.582
  560   1HB   PHE  77          2HB       PHE  77  -1.733   4.043  -5.580
  561   2HB   PHE  77          1HB       PHE  77  -2.154   3.744  -7.263
  562    HD1  PHE  77           HD1      PHE  77  -2.396   2.362  -3.811
  563    HD2  PHE  77           HD2      PHE  77  -3.820   2.159  -7.863
  564    HE1  PHE  77           HE1      PHE  77  -4.226   0.851  -3.096
  565    HE2  PHE  77           HE2      PHE  77  -5.648   0.647  -7.141
  566    HZ   PHE  77           HZ       PHE  77  -5.852  -0.007  -4.759
  567    H    LEU  78           H        LEU  78  -0.373   2.743  -9.052
  568    HA   LEU  78           HA       LEU  78  -1.621   0.246  -9.791
  569   1HB   LEU  78          2HB       LEU  78  -0.168   2.323 -11.416
  570   2HB   LEU  78          1HB       LEU  78  -0.998   0.940 -12.098
  571    HG   LEU  78           HG       LEU  78  -2.602   2.710 -10.324
  572   1HD1  LEU  78          1HD1      LEU  78  -1.775   3.508 -13.132
  573   2HD1  LEU  78          2HD1      LEU  78  -1.229   4.298 -11.653
  574   3HD1  LEU  78          3HD1      LEU  78  -2.931   4.357 -12.107
  575   1HD2  LEU  78          1HD2      LEU  78  -3.132   0.599 -11.986
  576   2HD2  LEU  78          2HD2      LEU  78  -3.477   1.962 -13.050
  577   3HD2  LEU  78          3HD2      LEU  78  -4.326   1.807 -11.511
  578    H    VAL  79           H        VAL  79   1.704   1.506  -9.746
  579    HA   VAL  79           HA       VAL  79   2.966  -0.584 -11.134
  580    HB   VAL  79           HB       VAL  79   5.022   0.034  -9.845
  581   1HG1  VAL  79          1HG1      VAL  79   3.314   2.034 -11.287
  582   2HG1  VAL  79          2HG1      VAL  79   4.819   1.272 -11.803
  583   3HG1  VAL  79          3HG1      VAL  79   4.850   2.556 -10.594
  584   1HG2  VAL  79          1HG2      VAL  79   4.885   1.988  -8.332
  585   2HG2  VAL  79          2HG2      VAL  79   3.938   0.633  -7.717
  586   3HG2  VAL  79          3HG2      VAL  79   3.131   1.988  -8.504
  587    H    MET  80           H        MET  80   1.804  -0.394  -7.846
  588    HA   MET  80           HA       MET  80   3.101  -2.295  -6.421
  589   1HB   MET  80          2HB       MET  80   0.224  -1.531  -6.603
  590   2HB   MET  80          1HB       MET  80   0.646  -2.958  -5.659
  591   1HG   MET  80          2HG       MET  80   1.900  -1.739  -4.119
  592   2HG   MET  80          1HG       MET  80   2.215  -0.433  -5.261
  593   1HE   MET  80          1HE       MET  80  -0.090  -2.010  -2.668
  594   2HE   MET  80          2HE       MET  80  -0.994  -2.366  -4.138
  595   3HE   MET  80          3HE       MET  80  -1.666  -1.257  -2.946
  596    H    MET  81           H        MET  81   0.796  -2.927  -9.043
  597    HA   MET  81           HA       MET  81   0.585  -5.732  -8.681
  598   1HB   MET  81          2HB       MET  81   0.061  -3.852 -10.956
  599   2HB   MET  81          1HB       MET  81   0.065  -5.590 -11.260
  600   1HG   MET  81          2HG       MET  81  -1.476  -5.650  -9.111
  601   2HG   MET  81          1HG       MET  81  -1.781  -3.969  -9.545
  602   1HE   MET  81          1HE       MET  81  -3.724  -7.293 -10.096
  603   2HE   MET  81          2HE       MET  81  -1.971  -7.448 -10.014
  604   3HE   MET  81          3HE       MET  81  -2.814  -7.845 -11.509
  605    H    VAL  82           H        VAL  82   2.394  -4.001 -11.237
  606    HA   VAL  82           HA       VAL  82   3.901  -6.262 -12.044
  607    HB   VAL  82           HB       VAL  82   5.341  -4.614 -13.242
  608   1HG1  VAL  82          1HG1      VAL  82   3.034  -5.500 -14.016
  609   2HG1  VAL  82          2HG1      VAL  82   3.691  -4.086 -14.841
  610   3HG1  VAL  82          3HG1      VAL  82   2.438  -3.889 -13.614
  611   1HG2  VAL  82          1HG2      VAL  82   5.328  -2.750 -11.724
  612   2HG2  VAL  82          2HG2      VAL  82   3.568  -2.663 -11.750
  613   3HG2  VAL  82          3HG2      VAL  82   4.491  -2.223 -13.182
  614    H    ARG  83           H        ARG  83   4.452  -3.885  -9.523
  615    HA   ARG  83           HA       ARG  83   7.223  -4.133  -9.169
  616   1HB   ARG  83          2HB       ARG  83   5.021  -3.609  -7.162
  617   2HB   ARG  83          1HB       ARG  83   6.738  -3.506  -6.774
  618   1HG   ARG  83          2HG       ARG  83   5.848  -2.042  -9.203
  619   2HG   ARG  83          1HG       ARG  83   5.313  -1.387  -7.657
  620   1HD   ARG  83          2HD       ARG  83   7.353  -0.327  -7.848
  621   2HD   ARG  83          1HD       ARG  83   7.844  -1.784  -6.991
  622    HE   ARG  83           HE       ARG  83   7.973  -2.135  -9.835
  623   1HH1  ARG  83          2HH1      ARG  83   9.615  -0.732  -7.090
  624   2HH1  ARG  83          1HH1      ARG  83  11.182  -0.829  -7.820
  625   1HH2  ARG  83          1HH2      ARG  83  10.034  -2.254 -10.771
  626   2HH2  ARG  83          2HH2      ARG  83  11.419  -1.689  -9.899
  627    H    CYS  84           H        CYS  84   4.706  -6.417  -8.567
  628    HA   CYS  84           HA       CYS  84   6.008  -7.962  -6.535
  629   1HB   CYS  84          2HB       CYS  84   3.772  -8.598  -8.463
  630   2HB   CYS  84          1HB       CYS  84   4.355  -9.737  -7.250
  631    HG   CYS  84           HG       CYS  84   3.315  -8.370  -5.424
  632    H    MET  85           H        MET  85   6.563  -7.582  -9.883
  633    HA   MET  85           HA       MET  85   7.279 -10.040 -10.870
  634   1HB   MET  85          2HB       MET  85   8.768  -8.889 -12.382
  635   2HB   MET  85          1HB       MET  85   7.355  -7.869 -12.110
  636   1HG   MET  85          2HG       MET  85   8.642  -6.620 -10.368
  637   2HG   MET  85          1HG       MET  85  10.063  -7.582 -10.773
  638   1HE   MET  85          1HE       MET  85  11.779  -5.322 -12.847
  639   2HE   MET  85          2HE       MET  85  11.631  -6.381 -11.447
  640   3HE   MET  85          3HE       MET  85  11.110  -4.702 -11.330
  641    H    LYS  86           H        LYS  86   9.092  -8.055  -8.577
  642    HA   LYS  86           HA       LYS  86  11.528  -9.523  -8.699
  643   1HB   LYS  86          2HB       LYS  86  12.061  -8.416  -6.544
  644   2HB   LYS  86          1HB       LYS  86  11.490  -7.275  -7.759
  645   1HG   LYS  86          2HG       LYS  86  10.036  -6.580  -6.161
  646   2HG   LYS  86          1HG       LYS  86   9.137  -8.048  -6.539
  647   1HD   LYS  86          2HD       LYS  86  11.013  -9.040  -4.829
  648   2HD   LYS  86          1HD       LYS  86  10.807  -7.413  -4.180
  649   1HE   LYS  86          2HE       LYS  86   8.548  -7.748  -3.691
  650   2HE   LYS  86          1HE       LYS  86   8.381  -9.047  -4.872
  651   1HZ   LYS  86          1HZ       LYS  86   9.875  -9.186  -2.308
  652   2HZ   LYS  86          2HZ       LYS  86   9.804 -10.431  -3.463
  653   3HZ   LYS  86          3HZ       LYS  86   8.395  -9.941  -2.650
  654    H    ASP  87           H        ASP  87  12.345 -11.125  -7.385
  655    HA   ASP  87           HA       ASP  87  10.718 -12.309  -5.289
  656   1HB   ASP  87          2HB       ASP  87  10.891 -14.614  -6.364
  657   2HB   ASP  87          1HB       ASP  87   9.709 -13.518  -7.071
  658    H    ASP  88           H        ASP  88  12.318 -12.061  -3.816
  659    HA   ASP  88           HA       ASP  88  15.011 -13.045  -4.453
  660   1HB   ASP  88          2HB       ASP  88  14.449 -10.797  -3.224
  661   2HB   ASP  88          1HB       ASP  88  14.269 -11.836  -1.809
  662    H    SER  89           HN       SER  89  14.554 -15.268  -4.488
  663    HA   SER  89           HA       SER  89  14.014 -16.461  -1.829
  664   1HB   SER  89          2HB       SER  89  13.207 -18.473  -3.168
  665   2HB   SER  89          1HB       SER  89  12.166 -17.053  -3.207
  666    HG   SER  89           HG       SER  89  12.613 -16.782  -5.261
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  16.686   3.203 -16.212
    2   2H    MET   1          2H        MET   1  15.124   3.854 -16.365
    3   3H    MET   1          3H        MET   1  15.611   2.565 -17.358
    4    HA   MET   1           HA       MET   1  15.788   1.111 -15.430
    5   1HB   MET   1          2HB       MET   1  15.257   3.705 -14.078
    6   2HB   MET   1          1HB       MET   1  14.451   2.293 -13.394
    7   1HG   MET   1          2HG       MET   1  16.755   1.144 -13.498
    8   2HG   MET   1          1HG       MET   1  17.413   2.759 -13.758
    9   1HE   MET   1          1HE       MET   1  17.094   0.202 -11.496
   10   2HE   MET   1          2HE       MET   1  15.361   0.435 -11.280
   11   3HE   MET   1          3HE       MET   1  16.458   0.753  -9.939
   12    H    ASN   2           H        ASN   2  13.844   0.085 -14.438
   13    HA   ASN   2           HA       ASN   2  11.680  -0.669 -14.489
   14   1HB   ASN   2          2HB       ASN   2  11.018   1.996 -15.768
   15   2HB   ASN   2          1HB       ASN   2   9.856   0.830 -15.137
   16   1HD2  ASN   2          1HD2      ASN   2  11.114   0.040 -12.734
   17   2HD2  ASN   2          2HD2      ASN   2  11.244   1.380 -11.707
   18    H    ASP   3           H        ASP   3  10.298  -1.782 -15.903
   19    HA   ASP   3           HA       ASP   3  10.267  -1.436 -18.725
   20   1HB   ASP   3          2HB       ASP   3  12.601  -2.238 -18.523
   21   2HB   ASP   3          1HB       ASP   3  12.015  -3.707 -17.745
   22    H    ILE   4           H        ILE   4   9.968  -3.727 -16.044
   23    HA   ILE   4           HA       ILE   4   8.244  -5.567 -17.336
   24    HB   ILE   4           HB       ILE   4   7.770  -6.490 -15.183
   25   1HG1  ILE   4          2HG1      ILE   4   7.290  -4.224 -14.124
   26   2HG1  ILE   4          1HG1      ILE   4   8.136  -5.379 -13.100
   27   1HG2  ILE   4          1HG2      ILE   4   9.945  -7.102 -15.797
   28   2HG2  ILE   4          2HG2      ILE   4  10.152  -6.481 -14.160
   29   3HG2  ILE   4          3HG2      ILE   4  10.581  -5.477 -15.544
   30   1HD1  ILE   4          1HD1      ILE   4   9.418  -3.467 -12.763
   31   2HD1  ILE   4          2HD1      ILE   4   9.167  -2.884 -14.411
   32   3HD1  ILE   4          3HD1      ILE   4  10.291  -4.209 -14.102
   33    H    TYR   5           H        TYR   5   7.642  -2.439 -15.922
   34    HA   TYR   5           HA       TYR   5   4.858  -2.747 -15.405
   35   1HB   TYR   5          2HB       TYR   5   6.154  -0.147 -16.233
   36   2HB   TYR   5          1HB       TYR   5   4.744  -0.381 -15.212
   37    HD1  TYR   5           HD1      TYR   5   7.224   1.263 -14.540
   38    HD2  TYR   5           HD2      TYR   5   6.160  -2.812 -13.703
   39    HE1  TYR   5           HE1      TYR   5   8.680   1.292 -12.542
   40    HE2  TYR   5           HE2      TYR   5   7.627  -2.785 -11.717
   41    HH   TYR   5           HH       TYR   5   8.720  -0.068 -10.272
   42    H    LYS   6           H        LYS   6   6.765  -1.928 -18.225
   43    HA   LYS   6           HA       LYS   6   4.491  -1.179 -19.864
   44   1HB   LYS   6          2HB       LYS   6   7.228  -1.928 -20.893
   45   2HB   LYS   6          1HB       LYS   6   6.041  -0.854 -21.628
   46   1HG   LYS   6          2HG       LYS   6   7.744  -0.352 -19.180
   47   2HG   LYS   6          1HG       LYS   6   7.683   0.584 -20.673
   48   1HD   LYS   6          2HD       LYS   6   5.446   1.361 -20.170
   49   2HD   LYS   6          1HD       LYS   6   5.340   0.287 -18.773
   50   1HE   LYS   6          2HE       LYS   6   6.758   1.593 -17.487
   51   2HE   LYS   6          1HE       LYS   6   7.610   2.237 -18.890
   52   1HZ   LYS   6          1HZ       LYS   6   6.204   3.909 -17.866
   53   2HZ   LYS   6          2HZ       LYS   6   4.834   2.927 -18.084
   54   3HZ   LYS   6          3HZ       LYS   6   5.661   3.551 -19.432
   55    H    ALA   7           H        ALA   7   6.542  -4.007 -19.420
   56    HA   ALA   7           HA       ALA   7   5.392  -5.530 -21.565
   57   1HB   ALA   7          1HB       ALA   7   7.162  -6.182 -19.227
   58   2HB   ALA   7          2HB       ALA   7   7.514  -6.292 -20.952
   59   3HB   ALA   7          3HB       ALA   7   6.450  -7.476 -20.193
   60    H    ALA   8           H        ALA   8   4.634  -5.044 -18.173
   61    HA   ALA   8           HA       ALA   8   2.727  -7.238 -18.101
   62   1HB   ALA   8          1HB       ALA   8   3.540  -5.156 -16.073
   63   2HB   ALA   8          2HB       ALA   8   3.928  -6.876 -16.073
   64   3HB   ALA   8          3HB       ALA   8   2.271  -6.348 -15.782
   65    H    VAL   9           H        VAL   9   2.668  -3.792 -18.735
   66    HA   VAL   9           HA       VAL   9   0.034  -3.178 -18.001
   67    HB   VAL   9           HB       VAL   9   1.887  -1.602 -18.868
   68   1HG1  VAL   9          1HG1      VAL   9   0.519  -1.857 -21.520
   69   2HG1  VAL   9          2HG1      VAL   9   1.822  -2.979 -21.136
   70   3HG1  VAL   9          3HG1      VAL   9   2.130  -1.244 -21.143
   71   1HG2  VAL   9          1HG2      VAL   9   0.255   0.063 -19.381
   72   2HG2  VAL   9          2HG2      VAL   9  -0.528  -1.044 -18.254
   73   3HG2  VAL   9          3HG2      VAL   9  -0.889  -1.139 -19.978
   74    H    GLU  10           H        GLU  10   1.246  -4.847 -20.859
   75    HA   GLU  10           HA       GLU  10  -1.229  -4.787 -22.312
   76   1HB   GLU  10          2HB       GLU  10   1.357  -6.282 -22.585
   77   2HB   GLU  10          1HB       GLU  10  -0.050  -6.797 -23.516
   78   1HG   GLU  10          2HG       GLU  10   0.819  -3.907 -23.481
   79   2HG   GLU  10          1HG       GLU  10   1.543  -5.063 -24.599
   80    H    GLN  11           H        GLN  11   0.036  -6.755 -19.743
   81    HA   GLN  11           HA       GLN  11  -1.688  -9.024 -20.241
   82   1HB   GLN  11          2HB       GLN  11  -0.132  -8.329 -17.738
   83   2HB   GLN  11          1HB       GLN  11  -0.844  -9.895 -18.130
   84   1HG   GLN  11          2HG       GLN  11   1.258  -8.534 -19.841
   85   2HG   GLN  11          1HG       GLN  11   1.631  -9.736 -18.607
   86   1HE2  GLN  11          1HE2      GLN  11   0.321  -9.279 -21.836
   87   2HE2  GLN  11          2HE2      GLN  11   0.106 -10.927 -22.183
   88    H    LEU  12           H        LEU  12  -1.650  -6.246 -18.044
   89    HA   LEU  12           HA       LEU  12  -4.014  -7.026 -16.617
   90   1HB   LEU  12          2HB       LEU  12  -2.917  -4.235 -16.830
   91   2HB   LEU  12          1HB       LEU  12  -3.889  -4.915 -15.547
   92    HG   LEU  12           HG       LEU  12  -1.402  -6.384 -15.863
   93   1HD1  LEU  12          1HD1      LEU  12   0.003  -4.474 -14.951
   94   2HD1  LEU  12          2HD1      LEU  12  -1.295  -3.389 -15.448
   95   3HD1  LEU  12          3HD1      LEU  12  -0.432  -4.343 -16.654
   96   1HD2  LEU  12          1HD2      LEU  12  -2.229  -6.697 -13.762
   97   2HD2  LEU  12          2HD2      LEU  12  -3.096  -5.163 -13.771
   98   3HD2  LEU  12          3HD2      LEU  12  -1.375  -5.199 -13.392
   99    H    THR  13           H        THR  13  -5.959  -5.575 -16.540
  100    HA   THR  13           HA       THR  13  -6.701  -4.660 -19.263
  101    HB   THR  13           HB       THR  13  -9.107  -5.273 -18.263
  102    HG1  THR  13           HG1      THR  13  -8.521  -6.115 -16.344
  103   1HG2  THR  13          1HG2      THR  13  -8.696  -7.612 -19.305
  104   2HG2  THR  13          2HG2      THR  13  -7.078  -7.001 -19.655
  105   3HG2  THR  13          3HG2      THR  13  -8.493  -6.190 -20.328
  106    H    ASP  14           H        ASP  14  -8.766  -3.265 -19.136
  107    HA   ASP  14           HA       ASP  14  -8.179  -0.916 -17.651
  108   1HB   ASP  14          2HB       ASP  14  -9.570  -1.161 -19.822
  109   2HB   ASP  14          1HB       ASP  14 -10.909  -1.563 -18.745
  110    H    GLU  15           H        GLU  15 -10.157  -3.736 -17.039
  111    HA   GLU  15           HA       GLU  15 -11.822  -2.784 -14.989
  112   1HB   GLU  15          2HB       GLU  15 -10.726  -5.502 -15.657
  113   2HB   GLU  15          1HB       GLU  15 -11.697  -5.254 -14.207
  114   1HG   GLU  15          2HG       GLU  15 -13.286  -3.986 -15.948
  115   2HG   GLU  15          1HG       GLU  15 -12.500  -5.088 -17.079
  116    H    GLN  16           H        GLN  16  -8.499  -4.090 -14.852
  117    HA   GLN  16           HA       GLN  16  -8.294  -4.181 -12.032
  118   1HB   GLN  16          2HB       GLN  16  -5.960  -4.461 -12.304
  119   2HB   GLN  16          1HB       GLN  16  -6.672  -5.211 -13.729
  120   1HG   GLN  16          2HG       GLN  16  -5.407  -3.877 -15.017
  121   2HG   GLN  16          1HG       GLN  16  -6.271  -2.483 -14.386
  122   1HE2  GLN  16          1HE2      GLN  16  -5.308  -2.591 -11.644
  123   2HE2  GLN  16          2HE2      GLN  16  -3.646  -2.262 -11.675
  124    H    LYS  17           H        LYS  17  -7.938  -1.548 -14.331
  125    HA   LYS  17           HA       LYS  17  -6.867   0.300 -12.366
  126   1HB   LYS  17          2HB       LYS  17  -7.701   0.495 -15.240
  127   2HB   LYS  17          1HB       LYS  17  -7.546   1.968 -14.281
  128   1HG   LYS  17          2HG       LYS  17  -5.348   1.869 -14.844
  129   2HG   LYS  17          1HG       LYS  17  -5.250   0.621 -13.601
  130   1HD   LYS  17          2HD       LYS  17  -5.107  -1.082 -15.128
  131   2HD   LYS  17          1HD       LYS  17  -6.160  -0.273 -16.288
  132   1HE   LYS  17          2HE       LYS  17  -3.518   1.002 -15.765
  133   2HE   LYS  17          1HE       LYS  17  -3.504  -0.510 -16.672
  134   1HZ   LYS  17          1HZ       LYS  17  -5.089   1.912 -17.339
  135   2HZ   LYS  17          2HZ       LYS  17  -5.137   0.444 -18.194
  136   3HZ   LYS  17          3HZ       LYS  17  -3.709   1.363 -18.157
  137    H    ASN  18           H        ASN  18  -9.989  -0.629 -13.667
  138    HA   ASN  18           HA       ASN  18 -11.527   1.587 -12.817
  139   1HB   ASN  18          2HB       ASN  18 -12.051  -1.173 -13.720
  140   2HB   ASN  18          1HB       ASN  18 -13.266  -0.523 -12.617
  141   1HD2  ASN  18          1HD2      ASN  18 -12.665  -0.793 -15.846
  142   2HD2  ASN  18          2HD2      ASN  18 -13.432   0.615 -16.403
  143    H    GLU  19           H        GLU  19 -10.692  -1.492 -11.243
  144    HA   GLU  19           HA       GLU  19 -12.116  -0.924  -8.812
  145   1HB   GLU  19          2HB       GLU  19  -9.840  -2.883  -9.236
  146   2HB   GLU  19          1HB       GLU  19 -10.989  -2.877  -7.899
  147   1HG   GLU  19          2HG       GLU  19 -11.804  -3.178 -10.802
  148   2HG   GLU  19          1HG       GLU  19 -11.527  -4.543  -9.720
  149    H    PHE  20           H        PHE  20  -8.763  -0.636  -9.909
  150    HA   PHE  20           HA       PHE  20  -7.586   0.132  -7.465
  151   1HB   PHE  20          2HB       PHE  20  -6.857   0.459 -10.350
  152   2HB   PHE  20          1HB       PHE  20  -5.960   1.371  -9.141
  153    HD1  PHE  20           HD1      PHE  20  -7.413  -1.854  -8.181
  154    HD2  PHE  20           HD2      PHE  20  -3.911   0.102  -9.717
  155    HE1  PHE  20           HE1      PHE  20  -6.063  -3.859  -7.656
  156    HE2  PHE  20           HE2      PHE  20  -2.562  -1.905  -9.192
  157    HZ   PHE  20           HZ       PHE  20  -3.637  -3.887  -8.158
  158    H    LYS  21           H        LYS  21  -9.175   2.027 -10.009
  159    HA   LYS  21           HA       LYS  21  -8.522   4.591  -8.973
  160   1HB   LYS  21          2HB       LYS  21  -9.368   4.115 -11.308
  161   2HB   LYS  21          1HB       LYS  21 -10.972   3.895 -10.607
  162   1HG   LYS  21          2HG       LYS  21 -10.653   6.205 -11.453
  163   2HG   LYS  21          1HG       LYS  21 -10.918   6.181  -9.710
  164   1HD   LYS  21          2HD       LYS  21  -8.667   6.644  -9.229
  165   2HD   LYS  21          1HD       LYS  21  -8.117   6.098 -10.814
  166   1HE   LYS  21          2HE       LYS  21  -9.785   8.125 -11.541
  167   2HE   LYS  21          1HE       LYS  21  -9.193   8.733  -9.995
  168   1HZ   LYS  21          1HZ       LYS  21  -6.923   8.336 -10.774
  169   2HZ   LYS  21          2HZ       LYS  21  -7.749   9.426 -11.781
  170   3HZ   LYS  21          3HZ       LYS  21  -7.521   7.817 -12.274
  171    H    ALA  22           H        ALA  22 -11.377   2.494  -8.580
  172    HA   ALA  22           HA       ALA  22 -12.833   4.282  -6.912
  173   1HB   ALA  22          1HB       ALA  22 -14.081   2.523  -7.909
  174   2HB   ALA  22          2HB       ALA  22 -14.027   2.138  -6.188
  175   3HB   ALA  22          3HB       ALA  22 -12.966   1.292  -7.315
  176    H    ALA  23           H        ALA  23 -10.607   1.599  -6.238
  177    HA   ALA  23           HA       ALA  23 -10.807   1.633  -3.414
  178   1HB   ALA  23          1HB       ALA  23  -8.495   0.556  -3.536
  179   2HB   ALA  23          2HB       ALA  23  -8.631   0.701  -5.289
  180   3HB   ALA  23          3HB       ALA  23  -9.790  -0.280  -4.392
  181    H    PHE  24           H        PHE  24  -9.050   3.622  -5.690
  182    HA   PHE  24           HA       PHE  24  -7.281   4.775  -3.708
  183   1HB   PHE  24          2HB       PHE  24  -6.945   4.529  -6.315
  184   2HB   PHE  24          1HB       PHE  24  -7.837   6.046  -6.371
  185    HD1  PHE  24           HD1      PHE  24  -4.738   4.393  -5.238
  186    HD2  PHE  24           HD2      PHE  24  -6.899   8.102  -5.453
  187    HE1  PHE  24           HE1      PHE  24  -2.676   5.632  -4.638
  188    HE2  PHE  24           HE2      PHE  24  -4.838   9.340  -4.849
  189    HZ   PHE  24           HZ       PHE  24  -2.724   8.104  -4.445
  190    H    ASP  25           H        ASP  25  -9.977   5.982  -5.713
  191    HA   ASP  25           HA       ASP  25 -10.261   8.523  -4.680
  192   1HB   ASP  25          2HB       ASP  25 -11.526   7.417  -6.615
  193   2HB   ASP  25          1HB       ASP  25 -12.649   6.828  -5.389
  194    H    ILE  26           H        ILE  26 -11.749   5.524  -3.393
  195    HA   ILE  26           HA       ILE  26 -13.340   6.725  -1.415
  196    HB   ILE  26           HB       ILE  26 -13.208   4.545  -0.219
  197   1HG1  ILE  26          2HG1      ILE  26 -11.251   3.850  -2.436
  198   2HG1  ILE  26          1HG1      ILE  26 -10.836   4.047  -0.735
  199   1HG2  ILE  26          1HG2      ILE  26 -14.902   4.536  -1.814
  200   2HG2  ILE  26          2HG2      ILE  26 -13.915   3.188  -2.374
  201   3HG2  ILE  26          3HG2      ILE  26 -13.781   4.761  -3.156
  202   1HD1  ILE  26          1HD1      ILE  26 -11.098   1.714  -0.994
  203   2HD1  ILE  26          2HD1      ILE  26 -12.524   1.903  -2.014
  204   3HD1  ILE  26          3HD1      ILE  26 -12.625   2.241  -0.286
  205    H    PHE  27           H        PHE  27  -9.905   5.909  -1.394
  206    HA   PHE  27           HA       PHE  27  -9.585   6.599   1.410
  207   1HB   PHE  27          2HB       PHE  27  -7.824   5.556  -0.753
  208   2HB   PHE  27          1HB       PHE  27  -7.054   6.461   0.550
  209    HD1  PHE  27           HD1      PHE  27  -6.924   5.585   2.788
  210    HD2  PHE  27           HD2      PHE  27  -9.145   3.501  -0.240
  211    HE1  PHE  27           HE1      PHE  27  -7.090   3.604   4.271
  212    HE2  PHE  27           HE2      PHE  27  -9.311   1.521   1.243
  213    HZ   PHE  27           HZ       PHE  27  -8.284   1.573   3.498
  214    H    ILE  28           H        ILE  28  -9.249   8.171  -1.711
  215    HA   ILE  28           HA       ILE  28  -7.823  10.452  -0.561
  216    HB   ILE  28           HB       ILE  28  -8.846  10.189  -3.391
  217   1HG1  ILE  28          2HG1      ILE  28  -7.461   8.313  -3.281
  218   2HG1  ILE  28          1HG1      ILE  28  -6.335   9.565  -3.771
  219   1HG2  ILE  28          1HG2      ILE  28  -6.540  11.576  -3.534
  220   2HG2  ILE  28          2HG2      ILE  28  -7.051  12.033  -1.906
  221   3HG2  ILE  28          3HG2      ILE  28  -8.106  12.352  -3.284
  222   1HD1  ILE  28          1HD1      ILE  28  -5.196   8.490  -2.021
  223   2HD1  ILE  28          2HD1      ILE  28  -6.663   8.290  -1.064
  224   3HD1  ILE  28          3HD1      ILE  28  -5.923   9.883  -1.221
  225    H    GLN  29           H        GLN  29 -10.640   9.780   0.235
  226    HA   GLN  29           HA       GLN  29 -12.395  11.714  -0.920
  227   1HB   GLN  29          2HB       GLN  29 -13.805  11.312   1.113
  228   2HB   GLN  29          1HB       GLN  29 -13.372   9.840   0.249
  229   1HG   GLN  29          2HG       GLN  29 -11.639   9.327   1.859
  230   2HG   GLN  29          1HG       GLN  29 -11.850  10.885   2.652
  231   1HE2  GLN  29          1HE2      GLN  29 -14.194  11.259   3.529
  232   2HE2  GLN  29          2HE2      GLN  29 -14.967   9.908   4.209
  233    H    ASP  30           H        ASP  30 -10.118  11.744   1.765
  234    HA   ASP  30           HA       ASP  30 -10.269  14.662   1.848
  235   1HB   ASP  30          2HB       ASP  30 -10.205  14.498   4.430
  236   2HB   ASP  30          1HB       ASP  30 -11.758  14.316   3.625
  237    H    ALA  31           H        ALA  31  -8.320  12.997   0.750
  238    HA   ALA  31           HA       ALA  31  -6.154  12.442   2.502
  239   1HB   ALA  31          1HB       ALA  31  -6.346  11.387   0.296
  240   2HB   ALA  31          2HB       ALA  31  -4.815  12.248   0.444
  241   3HB   ALA  31          3HB       ALA  31  -6.139  12.956  -0.480
  242    H    GLU  32           H        GLU  32  -4.060  13.494   2.487
  243    HA   GLU  32           HA       GLU  32  -4.303  16.359   2.823
  244   1HB   GLU  32          2HB       GLU  32  -1.865  14.579   3.060
  245   2HB   GLU  32          1HB       GLU  32  -1.974  16.261   3.582
  246   1HG   GLU  32          2HG       GLU  32  -4.053  15.387   4.954
  247   2HG   GLU  32          1HG       GLU  32  -3.261  13.822   4.770
  248    H    ASP  33           H        ASP  33  -2.434  14.180   0.715
  249    HA   ASP  33           HA       ASP  33  -1.967  16.468  -1.111
  250   1HB   ASP  33          2HB       ASP  33  -0.022  15.019   0.132
  251   2HB   ASP  33          1HB       ASP  33  -0.203  14.112  -1.369
  252    H    GLY  34           H        GLY  34  -4.267  14.556  -1.022
  253   1HA   GLY  34          2HA       GLY  34  -5.603  13.454  -2.537
  254   2HA   GLY  34          1HA       GLY  34  -4.547  14.081  -3.797
  255    H    CYS  35           H        CYS  35  -3.448  12.039  -1.140
  256    HA   CYS  35           HA       CYS  35  -3.275   9.689  -2.902
  257   1HB   CYS  35          2HB       CYS  35  -0.900  10.804  -1.390
  258   2HB   CYS  35          1HB       CYS  35  -0.921   9.338  -2.361
  259    HG   CYS  35           HG       CYS  35  -0.977  12.230  -3.487
  260    H    ILE  36           H        ILE  36  -2.180   7.833  -1.509
  261    HA   ILE  36           HA       ILE  36  -3.626   7.810   1.069
  262    HB   ILE  36           HB       ILE  36  -3.512   5.351   0.928
  263   1HG1  ILE  36          2HG1      ILE  36  -2.874   4.876  -1.755
  264   2HG1  ILE  36          1HG1      ILE  36  -1.622   5.987  -1.199
  265   1HG2  ILE  36          1HG2      ILE  36  -5.326   6.826  -0.204
  266   2HG2  ILE  36          2HG2      ILE  36  -5.239   5.123  -0.654
  267   3HG2  ILE  36          3HG2      ILE  36  -4.553   6.352  -1.717
  268   1HD1  ILE  36          1HD1      ILE  36  -2.087   4.066   0.866
  269   2HD1  ILE  36          2HD1      ILE  36  -0.622   4.321  -0.081
  270   3HD1  ILE  36          3HD1      ILE  36  -1.856   3.199  -0.654
  271    H    SER  37           H        SER  37  -2.516   6.211   2.698
  272    HA   SER  37           HA       SER  37   0.222   7.194   3.043
  273   1HB   SER  37          2HB       SER  37  -1.630   7.226   4.873
  274   2HB   SER  37          1HB       SER  37  -1.246   5.518   5.058
  275    HG   SER  37           HG       SER  37   0.252   7.781   5.656
  276    H    THR  38           H        THR  38   1.914   5.787   3.716
  277    HA   THR  38           HA       THR  38   2.238   3.489   2.103
  278    HB   THR  38           HB       THR  38   4.276   3.063   3.460
  279    HG1  THR  38           HG1      THR  38   4.411   3.864   5.381
  280   1HG2  THR  38          1HG2      THR  38   5.364   4.733   2.383
  281   2HG2  THR  38          2HG2      THR  38   4.435   5.983   3.204
  282   3HG2  THR  38          3HG2      THR  38   3.771   5.187   1.778
  283    H    LYS  39           H        LYS  39   1.496   3.861   5.562
  284    HA   LYS  39           HA       LYS  39   1.345   1.057   6.105
  285   1HB   LYS  39          2HB       LYS  39   0.454   1.717   8.266
  286   2HB   LYS  39          1HB       LYS  39   1.804   2.769   7.844
  287   1HG   LYS  39          2HG       LYS  39  -0.469   4.015   6.747
  288   2HG   LYS  39          1HG       LYS  39  -0.965   3.474   8.349
  289   1HD   LYS  39          2HD       LYS  39   1.655   4.912   7.936
  290   2HD   LYS  39          1HD       LYS  39   0.150   5.805   8.155
  291   1HE   LYS  39          2HE       LYS  39  -0.231   4.467  10.268
  292   2HE   LYS  39          1HE       LYS  39   1.402   3.829  10.080
  293   1HZ   LYS  39          1HZ       LYS  39   1.412   5.735  11.533
  294   2HZ   LYS  39          2HZ       LYS  39   0.657   6.693  10.350
  295   3HZ   LYS  39          3HZ       LYS  39   2.236   6.115  10.099
  296    H    GLU  40           H        GLU  40  -0.850   3.315   4.668
  297    HA   GLU  40           HA       GLU  40  -3.267   1.891   5.361
  298   1HB   GLU  40          2HB       GLU  40  -2.582   4.357   3.947
  299   2HB   GLU  40          1HB       GLU  40  -3.889   3.464   3.173
  300   1HG   GLU  40          2HG       GLU  40  -5.211   4.498   4.708
  301   2HG   GLU  40          1HG       GLU  40  -4.603   3.261   5.809
  302    H    LEU  41           H        LEU  41  -0.773   1.153   3.240
  303    HA   LEU  41           HA       LEU  41  -2.135   0.316   0.915
  304   1HB   LEU  41          2HB       LEU  41   0.269   0.494   0.920
  305   2HB   LEU  41          1HB       LEU  41   0.402  -0.712   2.181
  306    HG   LEU  41           HG       LEU  41  -0.224  -2.468   0.678
  307   1HD1  LEU  41          1HD1      LEU  41  -0.766  -0.316  -1.391
  308   2HD1  LEU  41          2HD1      LEU  41  -2.013  -1.195  -0.505
  309   3HD1  LEU  41          3HD1      LEU  41  -0.950  -2.054  -1.621
  310   1HD2  LEU  41          1HD2      LEU  41   2.114  -1.448   0.500
  311   2HD2  LEU  41          2HD2      LEU  41   1.542  -0.630  -0.954
  312   3HD2  LEU  41          3HD2      LEU  41   1.581  -2.392  -0.891
  313    H    GLY  42           H        GLY  42  -1.315  -1.439   3.911
  314   1HA   GLY  42          2HA       GLY  42  -2.330  -3.962   3.177
  315   2HA   GLY  42          1HA       GLY  42  -2.161  -3.376   4.826
  316    H    LYS  43           H        LYS  43  -3.971  -1.021   4.004
  317    HA   LYS  43           HA       LYS  43  -6.463  -2.309   4.748
  318   1HB   LYS  43          2HB       LYS  43  -5.526  -0.047   5.617
  319   2HB   LYS  43          1HB       LYS  43  -6.155   0.611   4.108
  320   1HG   LYS  43          2HG       LYS  43  -8.001   0.878   5.473
  321   2HG   LYS  43          1HG       LYS  43  -8.334  -0.723   4.815
  322   1HD   LYS  43          2HD       LYS  43  -7.368  -1.778   6.796
  323   2HD   LYS  43          1HD       LYS  43  -6.908  -0.202   7.443
  324   1HE   LYS  43          2HE       LYS  43  -9.170   0.438   7.789
  325   2HE   LYS  43          1HE       LYS  43  -9.777  -0.866   6.769
  326   1HZ   LYS  43          1HZ       LYS  43 -10.069  -1.409   9.086
  327   2HZ   LYS  43          2HZ       LYS  43  -8.413  -1.181   9.389
  328   3HZ   LYS  43          3HZ       LYS  43  -8.930  -2.460   8.397
  329    H    VAL  44           H        VAL  44  -5.143  -0.537   1.944
  330    HA   VAL  44           HA       VAL  44  -7.609  -0.495   0.502
  331    HB   VAL  44           HB       VAL  44  -6.176   0.051  -1.483
  332   1HG1  VAL  44          1HG1      VAL  44  -6.946   1.934  -0.322
  333   2HG1  VAL  44          2HG1      VAL  44  -5.200   2.175  -0.329
  334   3HG1  VAL  44          3HG1      VAL  44  -5.998   1.554   1.116
  335   1HG2  VAL  44          1HG2      VAL  44  -3.923  -0.052   0.542
  336   2HG2  VAL  44          2HG2      VAL  44  -3.791   0.412  -1.153
  337   3HG2  VAL  44          3HG2      VAL  44  -4.174  -1.254  -0.723
  338    H    MET  45           H        MET  45  -4.874  -2.754   0.599
  339    HA   MET  45           HA       MET  45  -5.667  -4.327  -1.633
  340   1HB   MET  45          2HB       MET  45  -4.035  -5.089   0.800
  341   2HB   MET  45          1HB       MET  45  -4.194  -6.070  -0.658
  342   1HG   MET  45          2HG       MET  45  -3.284  -4.170  -1.990
  343   2HG   MET  45          1HG       MET  45  -3.037  -3.276  -0.493
  344   1HE   MET  45          1HE       MET  45  -1.923  -3.822   1.287
  345   2HE   MET  45          2HE       MET  45  -0.253  -4.378   1.224
  346   3HE   MET  45          3HE       MET  45  -1.532  -5.503   1.670
  347    H    ARG  46           H        ARG  46  -6.529  -4.356   1.770
  348    HA   ARG  46           HA       ARG  46  -7.792  -6.867   1.925
  349   1HB   ARG  46          2HB       ARG  46  -7.915  -4.336   3.475
  350   2HB   ARG  46          1HB       ARG  46  -9.285  -5.433   3.652
  351   1HG   ARG  46          2HG       ARG  46  -7.437  -7.268   3.941
  352   2HG   ARG  46          1HG       ARG  46  -6.394  -5.899   4.325
  353   1HD   ARG  46          2HD       ARG  46  -7.444  -5.482   6.306
  354   2HD   ARG  46          1HD       ARG  46  -9.031  -5.901   5.671
  355    HE   ARG  46           HE       ARG  46  -7.684  -8.300   5.821
  356   1HH1  ARG  46          2HH1      ARG  46  -8.495  -5.731   8.043
  357   2HH1  ARG  46          1HH1      ARG  46  -8.551  -6.773   9.423
  358   1HH2  ARG  46          1HH2      ARG  46  -7.761  -9.647   7.642
  359   2HH2  ARG  46          2HH2      ARG  46  -8.138  -8.986   9.198
  360    H    MET  47           H        MET  47  -9.021  -3.690   0.932
  361    HA   MET  47           HA       MET  47 -11.730  -4.529   0.567
  362   1HB   MET  47          2HB       MET  47 -10.131  -2.118  -0.209
  363   2HB   MET  47          1HB       MET  47 -11.700  -2.387  -0.970
  364   1HG   MET  47          2HG       MET  47 -12.511  -2.801   1.496
  365   2HG   MET  47          1HG       MET  47 -11.062  -1.890   1.924
  366   1HE   MET  47          1HE       MET  47 -13.336  -0.273   3.040
  367   2HE   MET  47          2HE       MET  47 -14.224  -1.565   2.236
  368   3HE   MET  47          3HE       MET  47 -14.646   0.116   1.918
  369    H    LEU  48           H        LEU  48  -8.882  -4.380  -1.529
  370    HA   LEU  48           HA       LEU  48 -10.261  -4.896  -3.978
  371   1HB   LEU  48          2HB       LEU  48  -7.419  -4.985  -3.083
  372   2HB   LEU  48          1HB       LEU  48  -7.843  -5.804  -4.571
  373    HG   LEU  48           HG       LEU  48  -8.624  -2.931  -4.151
  374   1HD1  LEU  48          1HD1      LEU  48  -5.927  -4.035  -4.967
  375   2HD1  LEU  48          2HD1      LEU  48  -6.276  -2.873  -3.689
  376   3HD1  LEU  48          3HD1      LEU  48  -6.451  -2.402  -5.380
  377   1HD2  LEU  48          1HD2      LEU  48  -7.908  -4.595  -6.589
  378   2HD2  LEU  48          2HD2      LEU  48  -8.455  -2.919  -6.615
  379   3HD2  LEU  48          3HD2      LEU  48  -9.546  -4.194  -6.072
  380    H    GLY  49           H        GLY  49  -8.164  -7.032  -2.015
  381   1HA   GLY  49          2HA       GLY  49  -9.648  -9.224  -1.608
  382   2HA   GLY  49          1HA       GLY  49  -9.271  -9.400  -3.318
  383    H    GLN  50           H        GLN  50  -7.296  -8.209  -0.589
  384    HA   GLN  50           HA       GLN  50  -5.582 -10.553  -0.643
  385   1HB   GLN  50          2HB       GLN  50  -4.837  -8.044  -2.013
  386   2HB   GLN  50          1HB       GLN  50  -3.618  -8.676  -0.905
  387   1HG   GLN  50          2HG       GLN  50  -4.332 -10.972  -2.144
  388   2HG   GLN  50          1HG       GLN  50  -4.642  -9.824  -3.447
  389   1HE2  GLN  50          1HE2      GLN  50  -2.149 -11.506  -1.722
  390   2HE2  GLN  50          2HE2      GLN  50  -0.829 -10.751  -2.475
  391    H    ASN  51           H        ASN  51  -4.169 -10.667   1.153
  392    HA   ASN  51           HA       ASN  51  -4.198  -8.455   3.067
  393   1HB   ASN  51          2HB       ASN  51  -6.226  -9.864   3.563
  394   2HB   ASN  51          1HB       ASN  51  -5.134 -11.202   3.921
  395   1HD2  ASN  51          1HD2      ASN  51  -5.237  -7.677   4.771
  396   2HD2  ASN  51          2HD2      ASN  51  -4.931  -7.929   6.421
  397    HA   PRO  52           HA       PRO  52  -0.195 -10.716   3.128
  398   1HB   PRO  52          2HB       PRO  52   1.348  -8.503   2.673
  399   2HB   PRO  52          1HB       PRO  52   0.637  -9.473   1.379
  400   1HG   PRO  52          2HG       PRO  52  -0.117  -6.793   2.344
  401   2HG   PRO  52          1HG       PRO  52  -0.396  -7.539   0.765
  402   1HD   PRO  52          2HD       PRO  52  -2.293  -7.244   2.879
  403   2HD   PRO  52          1HD       PRO  52  -2.513  -8.151   1.363
  404    H    THR  53           H        THR  53   1.974  -9.589   4.259
  405    HA   THR  53           HA       THR  53   1.106  -9.020   7.007
  406    HB   THR  53           HB       THR  53   3.353  -9.566   7.671
  407    HG1  THR  53           HG1      THR  53   5.007  -9.499   6.337
  408   1HG2  THR  53          1HG2      THR  53   2.102 -11.545   7.226
  409   2HG2  THR  53          2HG2      THR  53   3.692 -11.794   6.502
  410   3HG2  THR  53          3HG2      THR  53   2.317 -11.363   5.484
  411    HA   PRO  54           HA       PRO  54   2.242  -4.767   6.867
  412   1HB   PRO  54          2HB       PRO  54   3.727  -4.409   9.146
  413   2HB   PRO  54          1HB       PRO  54   1.964  -4.578   9.126
  414   1HG   PRO  54          2HG       PRO  54   4.049  -6.577   9.865
  415   2HG   PRO  54          1HG       PRO  54   2.422  -6.349  10.525
  416   1HD   PRO  54          2HD       PRO  54   3.098  -8.331   8.714
  417   2HD   PRO  54          1HD       PRO  54   1.450  -7.698   8.926
  418    H    GLU  55           H        GLU  55   4.838  -7.064   7.299
  419    HA   GLU  55           HA       GLU  55   6.958  -5.230   6.552
  420   1HB   GLU  55          2HB       GLU  55   7.136  -8.246   6.572
  421   2HB   GLU  55          1HB       GLU  55   8.437  -7.074   6.783
  422   1HG   GLU  55          2HG       GLU  55   7.282  -6.303   8.896
  423   2HG   GLU  55          1HG       GLU  55   6.179  -7.667   8.712
  424    H    GLU  56           H        GLU  56   4.963  -7.724   5.035
  425    HA   GLU  56           HA       GLU  56   6.366  -7.919   2.577
  426   1HB   GLU  56          2HB       GLU  56   3.647  -8.662   3.539
  427   2HB   GLU  56          1HB       GLU  56   3.882  -8.540   1.796
  428   1HG   GLU  56          2HG       GLU  56   5.771 -10.097   1.913
  429   2HG   GLU  56          1HG       GLU  56   5.608 -10.188   3.668
  430    H    LEU  57           H        LEU  57   3.297  -6.192   3.296
  431    HA   LEU  57           HA       LEU  57   3.135  -4.819   0.857
  432   1HB   LEU  57          2HB       LEU  57   1.535  -3.390   1.890
  433   2HB   LEU  57          1HB       LEU  57   1.297  -5.009   2.506
  434    HG   LEU  57           HG       LEU  57   2.905  -4.029   4.444
  435   1HD1  LEU  57          1HD1      LEU  57   1.607  -1.665   4.748
  436   2HD1  LEU  57          2HD1      LEU  57   1.743  -1.712   2.992
  437   3HD1  LEU  57          3HD1      LEU  57   3.194  -1.800   3.991
  438   1HD2  LEU  57          1HD2      LEU  57   0.873  -3.741   5.747
  439   2HD2  LEU  57          2HD2      LEU  57   0.631  -5.082   4.628
  440   3HD2  LEU  57          3HD2      LEU  57  -0.079  -3.504   4.282
  441    H    GLN  58           H        GLN  58   5.010  -4.101   3.744
  442    HA   GLN  58           HA       GLN  58   5.567  -1.384   3.291
  443   1HB   GLN  58          2HB       GLN  58   6.165  -2.826   5.345
  444   2HB   GLN  58          1HB       GLN  58   7.602  -3.289   4.435
  445   1HG   GLN  58          2HG       GLN  58   8.127  -1.370   5.854
  446   2HG   GLN  58          1HG       GLN  58   8.168  -0.876   4.162
  447   1HE2  GLN  58          1HE2      GLN  58   6.494   0.580   3.398
  448   2HE2  GLN  58          2HE2      GLN  58   5.414   1.341   4.466
  449    H    GLU  59           H        GLU  59   7.204  -4.317   2.112
  450    HA   GLU  59           HA       GLU  59   9.365  -3.065   0.809
  451   1HB   GLU  59          2HB       GLU  59   7.931  -5.677   0.387
  452   2HB   GLU  59          1HB       GLU  59   9.176  -5.153  -0.747
  453   1HG   GLU  59          2HG       GLU  59   9.756  -5.057   2.197
  454   2HG   GLU  59          1HG       GLU  59   9.836  -6.605   1.357
  455    H    MET  60           H        MET  60   6.071  -3.809  -0.287
  456    HA   MET  60           HA       MET  60   6.353  -3.005  -2.976
  457   1HB   MET  60          2HB       MET  60   3.922  -2.968  -1.170
  458   2HB   MET  60          1HB       MET  60   3.870  -2.671  -2.908
  459   1HG   MET  60          2HG       MET  60   5.072  -4.922  -3.171
  460   2HG   MET  60          1HG       MET  60   4.672  -5.208  -1.477
  461   1HE   MET  60          1HE       MET  60   3.711  -7.273  -2.215
  462   2HE   MET  60          2HE       MET  60   1.983  -7.447  -2.508
  463   3HE   MET  60          3HE       MET  60   2.544  -6.710  -1.010
  464    H    ILE  61           H        ILE  61   5.471  -1.178  -0.054
  465    HA   ILE  61           HA       ILE  61   4.745   1.259  -1.143
  466    HB   ILE  61           HB       ILE  61   6.288   0.644   1.386
  467   1HG1  ILE  61          2HG1      ILE  61   4.125  -0.312   1.539
  468   2HG1  ILE  61          1HG1      ILE  61   3.980   1.234   2.367
  469   1HG2  ILE  61          1HG2      ILE  61   6.721   2.951   0.776
  470   2HG2  ILE  61          2HG2      ILE  61   5.589   2.910   2.127
  471   3HG2  ILE  61          3HG2      ILE  61   5.002   3.236   0.496
  472   1HD1  ILE  61          1HD1      ILE  61   3.168   2.202   0.152
  473   2HD1  ILE  61          2HD1      ILE  61   2.071   1.061   0.931
  474   3HD1  ILE  61          3HD1      ILE  61   3.066   0.539  -0.429
  475    H    ASP  62           H        ASP  62   7.989   0.700   0.233
  476    HA   ASP  62           HA       ASP  62   9.229   2.899  -0.959
  477   1HB   ASP  62          2HB       ASP  62  10.058   1.098   0.839
  478   2HB   ASP  62          1HB       ASP  62  10.879   0.451  -0.581
  479    H    GLU  63           H        GLU  63   8.742  -0.364  -2.248
  480    HA   GLU  63           HA       GLU  63  10.498  -0.153  -4.465
  481   1HB   GLU  63          2HB       GLU  63   8.160  -1.910  -3.800
  482   2HB   GLU  63          1HB       GLU  63   8.843  -1.945  -5.425
  483   1HG   GLU  63          2HG       GLU  63  10.761  -2.081  -3.142
  484   2HG   GLU  63          1HG       GLU  63   9.780  -3.512  -3.457
  485    H    VAL  64           H        VAL  64   7.043   0.647  -4.101
  486    HA   VAL  64           HA       VAL  64   6.846   1.416  -6.907
  487    HB   VAL  64           HB       VAL  64   4.514   1.806  -6.507
  488   1HG1  VAL  64          1HG1      VAL  64   4.266  -0.455  -4.887
  489   2HG1  VAL  64          2HG1      VAL  64   5.831  -0.656  -5.674
  490   3HG1  VAL  64          3HG1      VAL  64   4.377  -0.439  -6.647
  491   1HG2  VAL  64          1HG2      VAL  64   3.528   1.750  -4.269
  492   2HG2  VAL  64          2HG2      VAL  64   4.788   2.983  -4.325
  493   3HG2  VAL  64          3HG2      VAL  64   5.107   1.430  -3.555
  494    H    ASP  65           H        ASP  65   7.149   2.995  -3.771
  495    HA   ASP  65           HA       ASP  65   6.429   5.604  -4.655
  496   1HB   ASP  65          2HB       ASP  65   6.907   4.497  -2.199
  497   2HB   ASP  65          1HB       ASP  65   8.368   5.450  -2.441
  498    H    GLU  66           H        GLU  66   7.501   6.004  -6.565
  499    HA   GLU  66           HA       GLU  66  10.255   5.667  -7.041
  500   1HB   GLU  66          2HB       GLU  66   8.144   7.398  -8.288
  501   2HB   GLU  66          1HB       GLU  66   9.832   7.567  -8.774
  502   1HG   GLU  66          2HG       GLU  66   9.864   5.056  -9.148
  503   2HG   GLU  66          1HG       GLU  66   8.114   5.079  -8.928
  504    H    ASP  67           H        ASP  67   8.473   8.544  -5.915
  505    HA   ASP  67           HA       ASP  67  10.909  10.093  -5.667
  506   1HB   ASP  67          2HB       ASP  67   9.366  11.784  -4.562
  507   2HB   ASP  67          1HB       ASP  67   8.983  11.372  -6.233
  508    H    GLY  68           H        GLY  68   8.755   8.314  -3.494
  509   1HA   GLY  68          2HA       GLY  68   9.140   7.497  -1.366
  510   2HA   GLY  68          1HA       GLY  68  10.798   8.075  -1.497
  511    H    SER  69           H        SER  69   7.591   9.641  -1.516
  512    HA   SER  69           HA       SER  69   8.612  11.781   0.180
  513   1HB   SER  69          2HB       SER  69   6.313  12.754  -0.201
  514   2HB   SER  69          1HB       SER  69   7.266  12.506  -1.661
  515    HG   SER  69           HG       SER  69   5.830  11.118  -2.314
  516    H    GLY  70           H        GLY  70   5.875   9.494   0.226
  517   1HA   GLY  70          2HA       GLY  70   5.967   8.471   2.715
  518   2HA   GLY  70          1HA       GLY  70   5.294  10.072   3.015
  519    H    THR  71           H        THR  71   3.905  10.184   0.436
  520    HA   THR  71           HA       THR  71   1.640   8.418   1.104
  521    HB   THR  71           HB       THR  71   0.253   9.978  -0.158
  522    HG1  THR  71           HG1      THR  71   1.150  11.245  -1.553
  523   1HG2  THR  71          1HG2      THR  71   2.139  11.308   1.803
  524   2HG2  THR  71          2HG2      THR  71   0.602  10.526   2.176
  525   3HG2  THR  71          3HG2      THR  71   0.626  12.024   1.245
  526    H    VAL  72           H        VAL  72   0.567   7.258  -0.542
  527    HA   VAL  72           HA       VAL  72   2.317   6.579  -2.808
  528    HB   VAL  72           HB       VAL  72  -0.171   5.125  -1.900
  529   1HG1  VAL  72          1HG1      VAL  72   0.695   4.787  -4.254
  530   2HG1  VAL  72          2HG1      VAL  72   0.665   3.325  -3.268
  531   3HG1  VAL  72          3HG1      VAL  72   2.187   4.171  -3.543
  532   1HG2  VAL  72          1HG2      VAL  72   1.389   5.062  -0.059
  533   2HG2  VAL  72          2HG2      VAL  72   2.740   4.742  -1.146
  534   3HG2  VAL  72          3HG2      VAL  72   1.503   3.511  -0.892
  535    H    ASP  73           H        ASP  73   1.914   7.394  -4.731
  536    HA   ASP  73           HA       ASP  73  -0.592   8.775  -5.275
  537   1HB   ASP  73          2HB       ASP  73   1.730   8.313  -7.164
  538   2HB   ASP  73          1HB       ASP  73   0.458   9.523  -7.313
  539    H    PHE  74           H        PHE  74  -1.583   8.382  -7.520
  540    HA   PHE  74           HA       PHE  74  -2.579   5.737  -7.628
  541   1HB   PHE  74          2HB       PHE  74  -3.656   7.874  -8.573
  542   2HB   PHE  74          1HB       PHE  74  -2.620   7.632  -9.978
  543    HD1  PHE  74           HD1      PHE  74  -4.146   6.993 -11.665
  544    HD2  PHE  74           HD2      PHE  74  -4.250   5.027  -7.846
  545    HE1  PHE  74           HE1      PHE  74  -5.744   5.326 -12.564
  546    HE2  PHE  74           HE2      PHE  74  -5.844   3.359  -8.749
  547    HZ   PHE  74           HZ       PHE  74  -6.595   3.508 -11.108
  548    H    ASP  75           H        ASP  75   0.087   7.336  -9.305
  549    HA   ASP  75           HA       ASP  75   0.564   5.304 -11.243
  550   1HB   ASP  75          2HB       ASP  75   2.116   7.614 -10.145
  551   2HB   ASP  75          1HB       ASP  75   2.984   6.372 -11.045
  552    H    GLU  76           H        GLU  76   1.760   5.914  -7.966
  553    HA   GLU  76           HA       GLU  76   3.572   3.664  -7.959
  554   1HB   GLU  76          2HB       GLU  76   2.527   5.012  -5.476
  555   2HB   GLU  76          1HB       GLU  76   4.102   4.270  -5.751
  556   1HG   GLU  76          2HG       GLU  76   4.602   6.073  -7.424
  557   2HG   GLU  76          1HG       GLU  76   3.077   6.841  -6.991
  558    H    PHE  77           H        PHE  77   0.220   4.177  -7.352
  559    HA   PHE  77           HA       PHE  77  -0.225   1.868  -5.682
  560   1HB   PHE  77          2HB       PHE  77  -1.701   3.856  -5.608
  561   2HB   PHE  77          1HB       PHE  77  -2.188   3.545  -7.272
  562    HD1  PHE  77           HD1      PHE  77  -4.023   2.167  -7.710
  563    HD2  PHE  77           HD2      PHE  77  -2.035   1.892  -3.910
  564    HE1  PHE  77           HE1      PHE  77  -5.776   0.605  -6.902
  565    HE2  PHE  77           HE2      PHE  77  -3.785   0.330  -3.107
  566    HZ   PHE  77           HZ       PHE  77  -5.656  -0.312  -4.601
  567    H    LEU  78           H        LEU  78  -0.540   2.644  -9.134
  568    HA   LEU  78           HA       LEU  78  -1.746   0.131  -9.836
  569   1HB   LEU  78          2HB       LEU  78  -0.429   2.252 -11.512
  570   2HB   LEU  78          1HB       LEU  78  -1.283   0.865 -12.159
  571    HG   LEU  78           HG       LEU  78  -2.759   2.617 -10.248
  572   1HD1  LEU  78          1HD1      LEU  78  -1.989   3.369 -13.077
  573   2HD1  LEU  78          2HD1      LEU  78  -1.728   4.301 -11.603
  574   3HD1  LEU  78          3HD1      LEU  78  -3.361   4.083 -12.231
  575   1HD2  LEU  78          1HD2      LEU  78  -3.701   1.573 -12.905
  576   2HD2  LEU  78          2HD2      LEU  78  -4.620   1.840 -11.425
  577   3HD2  LEU  78          3HD2      LEU  78  -3.527   0.462 -11.546
  578    H    VAL  79           H        VAL  79   1.576   1.403  -9.880
  579    HA   VAL  79           HA       VAL  79   2.761  -0.624 -11.431
  580    HB   VAL  79           HB       VAL  79   4.881  -0.082 -10.156
  581   1HG1  VAL  79          1HG1      VAL  79   3.490   1.325 -12.110
  582   2HG1  VAL  79          2HG1      VAL  79   5.183   1.554 -11.675
  583   3HG1  VAL  79          3HG1      VAL  79   3.941   2.567 -10.942
  584   1HG2  VAL  79          1HG2      VAL  79   3.652   0.604  -8.054
  585   2HG2  VAL  79          2HG2      VAL  79   3.154   2.066  -8.902
  586   3HG2  VAL  79          3HG2      VAL  79   4.864   1.762  -8.604
  587    H    MET  80           H        MET  80   1.747  -0.611  -8.087
  588    HA   MET  80           HA       MET  80   3.193  -2.648  -6.933
  589   1HB   MET  80          2HB       MET  80   0.404  -1.661  -6.633
  590   2HB   MET  80          1HB       MET  80   0.794  -3.216  -5.896
  591   1HG   MET  80          2HG       MET  80   2.746  -2.142  -4.763
  592   2HG   MET  80          1HG       MET  80   2.234  -0.590  -5.426
  593   1HE   MET  80          1HE       MET  80   0.875   0.731  -2.555
  594   2HE   MET  80          2HE       MET  80  -0.057   0.883  -4.042
  595   3HE   MET  80          3HE       MET  80   1.700   0.801  -4.119
  596    H    MET  81           H        MET  81   0.568  -2.941  -9.293
  597    HA   MET  81           HA       MET  81   0.265  -5.779  -9.063
  598   1HB   MET  81          2HB       MET  81  -0.669  -3.685 -10.983
  599   2HB   MET  81          1HB       MET  81  -0.748  -5.377 -11.475
  600   1HG   MET  81          2HG       MET  81  -1.829  -4.473  -8.807
  601   2HG   MET  81          1HG       MET  81  -2.811  -4.390 -10.271
  602   1HE   MET  81          1HE       MET  81  -4.599  -7.504  -9.617
  603   2HE   MET  81          2HE       MET  81  -4.451  -6.090 -10.658
  604   3HE   MET  81          3HE       MET  81  -4.504  -5.886  -8.908
  605    H    VAL  82           H        VAL  82   1.758  -3.754 -11.617
  606    HA   VAL  82           HA       VAL  82   2.847  -5.889 -13.101
  607    HB   VAL  82           HB       VAL  82   4.398  -4.165 -14.063
  608   1HG1  VAL  82          1HG1      VAL  82   1.900  -4.600 -14.688
  609   2HG1  VAL  82          2HG1      VAL  82   2.694  -3.155 -15.312
  610   3HG1  VAL  82          3HG1      VAL  82   1.613  -3.039 -13.923
  611   1HG2  VAL  82          1HG2      VAL  82   4.146  -1.844 -13.370
  612   2HG2  VAL  82          2HG2      VAL  82   4.590  -2.810 -11.962
  613   3HG2  VAL  82          3HG2      VAL  82   2.919  -2.295 -12.188
  614    H    ARG  83           H        ARG  83   4.119  -4.111 -10.324
  615    HA   ARG  83           HA       ARG  83   6.793  -4.992 -10.414
  616   1HB   ARG  83          2HB       ARG  83   5.035  -4.271  -8.058
  617   2HB   ARG  83          1HB       ARG  83   6.774  -4.543  -7.947
  618   1HG   ARG  83          2HG       ARG  83   6.167  -2.727 -10.124
  619   2HG   ARG  83          1HG       ARG  83   5.481  -2.134  -8.612
  620   1HD   ARG  83          2HD       ARG  83   7.755  -1.302  -8.857
  621   2HD   ARG  83          1HD       ARG  83   7.677  -2.436  -7.515
  622    HE   ARG  83           HE       ARG  83   8.418  -3.806  -9.897
  623   1HH1  ARG  83          2HH1      ARG  83   9.641  -1.528  -7.554
  624   2HH1  ARG  83          1HH1      ARG  83  11.286  -2.027  -7.740
  625   1HH2  ARG  83          1HH2      ARG  83  10.585  -4.448 -10.127
  626   2HH2  ARG  83          2HH2      ARG  83  11.822  -3.676  -9.192
  627    H    CYS  84           H        CYS  84   3.854  -6.499  -9.195
  628    HA   CYS  84           HA       CYS  84   5.193  -8.680  -7.869
  629   1HB   CYS  84          2HB       CYS  84   2.337  -8.077  -8.583
  630   2HB   CYS  84          1HB       CYS  84   2.794  -9.685  -8.021
  631    HG   CYS  84           HG       CYS  84   3.812  -7.439  -6.201
  632    H    MET  85           H        MET  85   4.149  -8.011 -11.119
  633    HA   MET  85           HA       MET  85   4.425 -10.830 -11.912
  634   1HB   MET  85          2HB       MET  85   3.410  -8.387 -13.385
  635   2HB   MET  85          1HB       MET  85   3.587  -9.979 -14.129
  636   1HG   MET  85          2HG       MET  85   2.136  -9.929 -11.545
  637   2HG   MET  85          1HG       MET  85   1.311  -9.147 -12.894
  638   1HE   MET  85          1HE       MET  85  -0.481 -11.771 -14.435
  639   2HE   MET  85          2HE       MET  85   0.586 -10.651 -15.279
  640   3HE   MET  85          3HE       MET  85  -0.278 -10.117 -13.840
  641    H    LYS  86           H        LYS  86   6.795  -9.659 -11.074
  642    HA   LYS  86           HA       LYS  86   8.259  -8.811 -13.465
  643   1HB   LYS  86          2HB       LYS  86  10.169  -8.505 -11.922
  644   2HB   LYS  86          1HB       LYS  86   8.745  -7.613 -11.393
  645   1HG   LYS  86          2HG       LYS  86   8.367  -9.015  -9.583
  646   2HG   LYS  86          1HG       LYS  86   9.138 -10.398 -10.357
  647   1HD   LYS  86          2HD       LYS  86  10.698  -9.765  -8.711
  648   2HD   LYS  86          1HD       LYS  86  11.323  -9.007 -10.176
  649   1HE   LYS  86          2HE       LYS  86  10.446  -6.868  -9.557
  650   2HE   LYS  86          1HE       LYS  86   9.475  -7.566  -8.262
  651   1HZ   LYS  86          1HZ       LYS  86  12.443  -7.577  -8.356
  652   2HZ   LYS  86          2HZ       LYS  86  11.475  -8.161  -7.088
  653   3HZ   LYS  86          3HZ       LYS  86  11.505  -6.500  -7.444
  654    H    ASP  87           H        ASP  87  10.014  -9.927 -14.338
  655    HA   ASP  87           HA       ASP  87  10.646 -12.596 -13.327
  656   1HB   ASP  87          2HB       ASP  87   8.663 -12.468 -15.163
  657   2HB   ASP  87          1HB       ASP  87  10.062 -12.550 -16.234
  658    H    ASP  88           H        ASP  88  12.178 -10.180 -13.477
  659    HA   ASP  88           HA       ASP  88  14.235  -9.400 -14.128
  660   1HB   ASP  88          2HB       ASP  88  14.679 -11.882 -13.428
  661   2HB   ASP  88          1HB       ASP  88  14.912 -12.143 -15.156
  662    H    SER  89           HN       SER  89  12.886  -8.296 -15.846
  663    HA   SER  89           HA       SER  89  14.210  -8.606 -18.396
  664   1HB   SER  89          2HB       SER  89  12.343 -10.312 -18.480
  665   2HB   SER  89          1HB       SER  89  11.207  -8.971 -18.363
  666    HG   SER  89           HG       SER  89  12.812  -9.789 -20.460
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1  17.340  -3.196 -17.870
    2   2H    MET   1          2H        MET   1  17.795  -1.837 -18.781
    3   3H    MET   1          3H        MET   1  17.047  -3.159 -19.540
    4    HA   MET   1           HA       MET   1  15.796  -1.355 -17.537
    5   1HB   MET   1          2HB       MET   1  16.237  -0.693 -20.081
    6   2HB   MET   1          1HB       MET   1  14.820  -1.709 -20.345
    7   1HG   MET   1          2HG       MET   1  13.779   0.323 -19.965
    8   2HG   MET   1          1HG       MET   1  13.855  -0.287 -18.311
    9   1HE   MET   1          1HE       MET   1  13.601   2.371 -19.899
   10   2HE   MET   1          2HE       MET   1  14.821   3.597 -19.565
   11   3HE   MET   1          3HE       MET   1  13.731   3.079 -18.284
   12    H    ASN   2           H        ASN   2  13.862  -2.020 -16.726
   13    HA   ASN   2           HA       ASN   2  13.187  -4.801 -16.872
   14   1HB   ASN   2          2HB       ASN   2  12.016  -2.401 -15.509
   15   2HB   ASN   2          1HB       ASN   2  11.062  -3.879 -15.622
   16   1HD2  ASN   2          1HD2      ASN   2  12.496  -5.958 -15.000
   17   2HD2  ASN   2          2HD2      ASN   2  13.448  -5.768 -13.608
   18    H    ASP   3           H        ASP   3  11.404  -5.796 -17.804
   19    HA   ASP   3           HA       ASP   3   9.912  -4.172 -19.782
   20   1HB   ASP   3          2HB       ASP   3  11.243  -6.842 -20.071
   21   2HB   ASP   3          1HB       ASP   3   9.823  -6.461 -21.047
   22    H    ILE   4           H        ILE   4   9.459  -5.677 -16.926
   23    HA   ILE   4           HA       ILE   4   7.171  -7.319 -17.508
   24    HB   ILE   4           HB       ILE   4   6.853  -7.561 -15.173
   25   1HG1  ILE   4          2HG1      ILE   4   7.031  -5.027 -14.748
   26   2HG1  ILE   4          1HG1      ILE   4   7.637  -6.093 -13.484
   27   1HG2  ILE   4          1HG2      ILE   4   9.098  -8.149 -14.353
   28   2HG2  ILE   4          2HG2      ILE   4   9.825  -7.214 -15.658
   29   3HG2  ILE   4          3HG2      ILE   4   8.879  -8.655 -16.027
   30   1HD1  ILE   4          1HD1      ILE   4   9.185  -4.414 -15.445
   31   2HD1  ILE   4          2HD1      ILE   4   9.933  -5.828 -14.707
   32   3HD1  ILE   4          3HD1      ILE   4   9.355  -4.508 -13.693
   33    H    TYR   5           H        TYR   5   7.705  -3.930 -16.883
   34    HA   TYR   5           HA       TYR   5   5.004  -3.229 -16.245
   35   1HB   TYR   5          2HB       TYR   5   7.188  -1.483 -17.420
   36   2HB   TYR   5          1HB       TYR   5   5.715  -0.928 -16.625
   37    HD1  TYR   5           HD1      TYR   5   5.309  -1.832 -14.193
   38    HD2  TYR   5           HD2      TYR   5   9.132  -1.776 -16.151
   39    HE1  TYR   5           HE1      TYR   5   6.439  -1.984 -11.994
   40    HE2  TYR   5           HE2      TYR   5  10.262  -1.930 -13.952
   41    HH   TYR   5           HH       TYR   5   9.106  -2.977 -11.360
   42    H    LYS   6           H        LYS   6   6.923  -3.465 -19.191
   43    HA   LYS   6           HA       LYS   6   5.018  -2.273 -20.959
   44   1HB   LYS   6          2HB       LYS   6   7.053  -4.359 -21.760
   45   2HB   LYS   6          1HB       LYS   6   6.385  -3.059 -22.742
   46   1HG   LYS   6          2HG       LYS   6   8.381  -2.859 -20.481
   47   2HG   LYS   6          1HG       LYS   6   8.558  -2.309 -22.146
   48   1HD   LYS   6          2HD       LYS   6   7.058  -0.490 -21.817
   49   2HD   LYS   6          1HD       LYS   6   6.457  -1.163 -20.302
   50   1HE   LYS   6          2HE       LYS   6   8.343  -0.527 -19.106
   51   2HE   LYS   6          1HE       LYS   6   9.378  -0.533 -20.533
   52   1HZ   LYS   6          1HZ       LYS   6   7.234   1.448 -19.973
   53   2HZ   LYS   6          2HZ       LYS   6   8.266   1.449 -21.324
   54   3HZ   LYS   6          3HZ       LYS   6   8.896   1.718 -19.770
   55    H    ALA   7           H        ALA   7   5.736  -5.580 -19.950
   56    HA   ALA   7           HA       ALA   7   3.859  -6.879 -21.655
   57   1HB   ALA   7          1HB       ALA   7   4.038  -8.695 -19.782
   58   2HB   ALA   7          2HB       ALA   7   5.319  -7.662 -19.149
   59   3HB   ALA   7          3HB       ALA   7   5.454  -8.338 -20.772
   60    H    ALA   8           H        ALA   8   3.654  -5.419 -18.451
   61    HA   ALA   8           HA       ALA   8   1.019  -6.414 -17.868
   62   1HB   ALA   8          1HB       ALA   8   1.124  -4.591 -16.069
   63   2HB   ALA   8          2HB       ALA   8   2.776  -4.308 -16.616
   64   3HB   ALA   8          3HB       ALA   8   2.319  -5.883 -15.967
   65    H    VAL   9           H        VAL   9   2.347  -3.552 -19.422
   66    HA   VAL   9           HA       VAL   9   0.218  -1.773 -19.258
   67    HB   VAL   9           HB       VAL   9   2.322  -2.257 -21.350
   68   1HG1  VAL   9          1HG1      VAL   9   1.522  -0.101 -22.414
   69   2HG1  VAL   9          2HG1      VAL   9   0.037  -0.271 -21.477
   70   3HG1  VAL   9          3HG1      VAL   9   0.468  -1.491 -22.677
   71   1HG2  VAL   9          1HG2      VAL   9   2.221  -0.866 -18.936
   72   2HG2  VAL   9          2HG2      VAL   9   2.033   0.395 -20.154
   73   3HG2  VAL   9          3HG2      VAL   9   3.440  -0.668 -20.195
   74    H    GLU  10           H        GLU  10   0.762  -4.299 -21.721
   75    HA   GLU  10           HA       GLU  10  -1.605  -3.798 -23.199
   76   1HB   GLU  10          2HB       GLU  10   0.343  -6.060 -23.030
   77   2HB   GLU  10          1HB       GLU  10  -1.203  -6.338 -23.833
   78   1HG   GLU  10          2HG       GLU  10   0.284  -3.844 -24.540
   79   2HG   GLU  10          1HG       GLU  10   0.915  -5.371 -25.156
   80    H    GLN  11           H        GLN  11  -1.064  -5.436 -20.186
   81    HA   GLN  11           HA       GLN  11  -3.529  -6.972 -20.316
   82   1HB   GLN  11          2HB       GLN  11  -1.704  -6.528 -17.943
   83   2HB   GLN  11          1HB       GLN  11  -2.954  -7.761 -18.098
   84   1HG   GLN  11          2HG       GLN  11  -1.694  -8.635 -20.121
   85   2HG   GLN  11          1HG       GLN  11  -0.383  -7.543 -19.679
   86   1HE2  GLN  11          1HE2      GLN  11  -0.080  -7.764 -16.990
   87   2HE2  GLN  11          2HE2      GLN  11   0.170  -9.374 -16.516
   88    H    LEU  12           H        LEU  12  -2.396  -3.926 -19.018
   89    HA   LEU  12           HA       LEU  12  -4.402  -3.430 -17.110
   90   1HB   LEU  12          2HB       LEU  12  -3.094  -1.343 -18.845
   91   2HB   LEU  12          1HB       LEU  12  -3.816  -1.113 -17.271
   92    HG   LEU  12           HG       LEU  12  -1.173  -2.348 -17.980
   93   1HD1  LEU  12          1HD1      LEU  12  -0.448  -0.845 -16.122
   94   2HD1  LEU  12          2HD1      LEU  12  -2.116  -0.296 -15.958
   95   3HD1  LEU  12          3HD1      LEU  12  -1.223   0.028 -17.444
   96   1HD2  LEU  12          1HD2      LEU  12  -1.145  -2.933 -15.430
   97   2HD2  LEU  12          2HD2      LEU  12  -1.947  -4.043 -16.543
   98   3HD2  LEU  12          3HD2      LEU  12  -2.903  -2.918 -15.577
   99    H    THR  13           H        THR  13  -6.497  -3.568 -17.498
  100    HA   THR  13           HA       THR  13  -7.585  -2.437 -20.009
  101    HB   THR  13           HB       THR  13  -9.654  -3.872 -18.970
  102    HG1  THR  13           HG1      THR  13  -8.766  -5.820 -18.227
  103   1HG2  THR  13          1HG2      THR  13  -9.343  -5.252 -20.801
  104   2HG2  THR  13          2HG2      THR  13  -7.596  -5.334 -20.575
  105   3HG2  THR  13          3HG2      THR  13  -8.331  -3.883 -21.257
  106    H    ASP  14           H        ASP  14 -10.003  -1.775 -19.645
  107    HA   ASP  14           HA       ASP  14 -10.010   0.483 -17.919
  108   1HB   ASP  14          2HB       ASP  14 -12.270  -0.952 -19.336
  109   2HB   ASP  14          1HB       ASP  14 -12.476   0.552 -18.439
  110    H    GLU  15           H        GLU  15 -11.067  -2.833 -17.595
  111    HA   GLU  15           HA       GLU  15 -12.638  -2.532 -15.243
  112   1HB   GLU  15          2HB       GLU  15 -12.577  -4.930 -15.108
  113   2HB   GLU  15          1HB       GLU  15 -12.704  -4.494 -16.809
  114   1HG   GLU  15          2HG       GLU  15 -10.123  -4.650 -16.840
  115   2HG   GLU  15          1HG       GLU  15 -10.293  -5.517 -15.314
  116    H    GLN  16           H        GLN  16  -9.227  -3.314 -15.826
  117    HA   GLN  16           HA       GLN  16  -8.515  -3.797 -13.111
  118   1HB   GLN  16          2HB       GLN  16  -6.831  -2.913 -15.472
  119   2HB   GLN  16          1HB       GLN  16  -6.174  -3.384 -13.905
  120   1HG   GLN  16          2HG       GLN  16  -8.080  -5.259 -15.252
  121   2HG   GLN  16          1HG       GLN  16  -6.433  -5.159 -15.872
  122   1HE2  GLN  16          1HE2      GLN  16  -4.967  -6.522 -14.842
  123   2HE2  GLN  16          2HE2      GLN  16  -5.150  -7.136 -13.270
  124    H    LYS  17           H        LYS  17  -8.156  -0.925 -15.203
  125    HA   LYS  17           HA       LYS  17  -7.070   0.801 -13.268
  126   1HB   LYS  17          2HB       LYS  17  -8.433   1.128 -15.872
  127   2HB   LYS  17          1HB       LYS  17  -8.536   2.515 -14.788
  128   1HG   LYS  17          2HG       LYS  17  -6.518   2.989 -15.805
  129   2HG   LYS  17          1HG       LYS  17  -5.938   1.998 -14.466
  130   1HD   LYS  17          2HD       LYS  17  -4.938   0.756 -16.086
  131   2HD   LYS  17          1HD       LYS  17  -6.548   0.086 -16.343
  132   1HE   LYS  17          2HE       LYS  17  -5.541   2.567 -17.757
  133   2HE   LYS  17          1HE       LYS  17  -5.407   0.947 -18.438
  134   1HZ   LYS  17          1HZ       LYS  17  -7.385   1.814 -19.294
  135   2HZ   LYS  17          2HZ       LYS  17  -7.863   2.470 -17.802
  136   3HZ   LYS  17          3HZ       LYS  17  -7.889   0.789 -18.042
  137    H    ASN  18           H        ASN  18 -10.399  -0.135 -13.969
  138    HA   ASN  18           HA       ASN  18 -11.694   1.792 -12.330
  139   1HB   ASN  18          2HB       ASN  18 -12.449  -0.615 -13.809
  140   2HB   ASN  18          1HB       ASN  18 -13.333  -0.449 -12.291
  141   1HD2  ASN  18          1HD2      ASN  18 -12.693   1.132 -15.413
  142   2HD2  ASN  18          2HD2      ASN  18 -13.977   2.236 -15.304
  143    H    GLU  19           H        GLU  19 -10.405  -1.456 -11.712
  144    HA   GLU  19           HA       GLU  19 -11.408  -1.785  -9.079
  145   1HB   GLU  19          2HB       GLU  19  -8.889  -2.915 -10.340
  146   2HB   GLU  19          1HB       GLU  19  -9.587  -3.453  -8.812
  147   1HG   GLU  19          2HG       GLU  19 -11.760  -3.581 -10.487
  148   2HG   GLU  19          1HG       GLU  19 -10.443  -4.025 -11.572
  149    H    PHE  20           H        PHE  20  -8.189  -0.760 -10.235
  150    HA   PHE  20           HA       PHE  20  -7.166  -0.082  -7.678
  151   1HB   PHE  20          2HB       PHE  20  -6.351   0.938 -10.410
  152   2HB   PHE  20          1HB       PHE  20  -5.428   1.174  -8.927
  153    HD1  PHE  20           HD1      PHE  20  -5.968  -0.959 -11.713
  154    HD2  PHE  20           HD2      PHE  20  -4.857  -1.005  -7.565
  155    HE1  PHE  20           HE1      PHE  20  -4.936  -3.188 -12.016
  156    HE2  PHE  20           HE2      PHE  20  -3.813  -3.236  -7.869
  157    HZ   PHE  20           HZ       PHE  20  -3.858  -4.327 -10.097
  158    H    LYS  21           H        LYS  21  -8.882   1.803 -10.139
  159    HA   LYS  21           HA       LYS  21  -8.525   4.361  -9.005
  160   1HB   LYS  21          2HB       LYS  21  -9.419   3.929 -11.305
  161   2HB   LYS  21          1HB       LYS  21 -10.935   3.403 -10.571
  162   1HG   LYS  21          2HG       LYS  21 -11.059   5.772 -11.257
  163   2HG   LYS  21          1HG       LYS  21 -11.188   5.615  -9.505
  164   1HD   LYS  21          2HD       LYS  21  -9.169   6.622  -9.127
  165   2HD   LYS  21          1HD       LYS  21  -8.435   5.921 -10.568
  166   1HE   LYS  21          2HE       LYS  21  -8.603   8.266 -11.005
  167   2HE   LYS  21          1HE       LYS  21  -9.895   7.508 -11.935
  168   1HZ   LYS  21          1HZ       LYS  21 -11.431   8.037 -10.123
  169   2HZ   LYS  21          2HZ       LYS  21 -10.717   9.435 -10.770
  170   3HZ   LYS  21          3HZ       LYS  21 -10.181   8.816  -9.281
  171    H    ALA  22           H        ALA  22 -11.112   1.947  -8.562
  172    HA   ALA  22           HA       ALA  22 -12.665   3.500  -6.755
  173   1HB   ALA  22          1HB       ALA  22 -12.487   0.495  -7.088
  174   2HB   ALA  22          2HB       ALA  22 -13.635   1.570  -7.885
  175   3HB   ALA  22          3HB       ALA  22 -13.713   1.333  -6.139
  176    H    ALA  23           H        ALA  23 -10.118   1.070  -6.292
  177    HA   ALA  23           HA       ALA  23 -10.192   1.011  -3.453
  178   1HB   ALA  23          1HB       ALA  23  -7.934   0.005  -3.631
  179   2HB   ALA  23          2HB       ALA  23  -7.907   0.401  -5.351
  180   3HB   ALA  23          3HB       ALA  23  -9.083  -0.758  -4.729
  181    H    PHE  24           H        PHE  24  -8.831   3.244  -5.748
  182    HA   PHE  24           HA       PHE  24  -7.042   4.492  -3.823
  183   1HB   PHE  24          2HB       PHE  24  -6.771   4.269  -6.439
  184   2HB   PHE  24          1HB       PHE  24  -7.774   5.717  -6.464
  185    HD1  PHE  24           HD1      PHE  24  -6.918   7.844  -5.749
  186    HD2  PHE  24           HD2      PHE  24  -4.573   4.280  -5.253
  187    HE1  PHE  24           HE1      PHE  24  -4.936   9.228  -5.202
  188    HE2  PHE  24           HE2      PHE  24  -2.588   5.662  -4.704
  189    HZ   PHE  24           HZ       PHE  24  -2.768   8.136  -4.681
  190    H    ASP  25           H        ASP  25  -9.901   5.471  -5.726
  191    HA   ASP  25           HA       ASP  25 -10.333   7.990  -4.661
  192   1HB   ASP  25          2HB       ASP  25 -12.117   5.942  -5.900
  193   2HB   ASP  25          1HB       ASP  25 -12.858   7.342  -5.126
  194    H    ILE  26           H        ILE  26 -11.511   4.867  -3.366
  195    HA   ILE  26           HA       ILE  26 -13.198   5.870  -1.375
  196    HB   ILE  26           HB       ILE  26 -12.726   3.756  -0.132
  197   1HG1  ILE  26          2HG1      ILE  26 -10.762   3.299  -2.404
  198   2HG1  ILE  26          1HG1      ILE  26 -10.331   3.565  -0.718
  199   1HG2  ILE  26          1HG2      ILE  26 -13.495   3.913  -3.007
  200   2HG2  ILE  26          2HG2      ILE  26 -14.443   3.389  -1.616
  201   3HG2  ILE  26          3HG2      ILE  26 -13.250   2.304  -2.328
  202   1HD1  ILE  26          1HD1      ILE  26 -11.754   1.202  -1.932
  203   2HD1  ILE  26          2HD1      ILE  26 -11.846   1.539  -0.204
  204   3HD1  ILE  26          3HD1      ILE  26 -10.284   1.214  -0.958
  205    H    PHE  27           H        PHE  27  -9.687   5.561  -1.411
  206    HA   PHE  27           HA       PHE  27  -9.443   6.414   1.368
  207   1HB   PHE  27          2HB       PHE  27  -7.529   5.516  -0.751
  208   2HB   PHE  27          1HB       PHE  27  -6.922   6.463   0.607
  209    HD1  PHE  27           HD1      PHE  27  -6.911   5.577   2.867
  210    HD2  PHE  27           HD2      PHE  27  -8.571   3.307  -0.380
  211    HE1  PHE  27           HE1      PHE  27  -6.961   3.554   4.303
  212    HE2  PHE  27           HE2      PHE  27  -8.621   1.287   1.056
  213    HZ   PHE  27           HZ       PHE  27  -7.816   1.410   3.398
  214    H    ILE  28           H        ILE  28  -9.223   7.796  -1.859
  215    HA   ILE  28           HA       ILE  28  -8.099  10.299  -0.831
  216    HB   ILE  28           HB       ILE  28  -8.952   9.779  -3.680
  217   1HG1  ILE  28          2HG1      ILE  28  -7.447   8.003  -3.391
  218   2HG1  ILE  28          1HG1      ILE  28  -6.408   9.302  -3.949
  219   1HG2  ILE  28          1HG2      ILE  28  -8.374  11.998  -3.636
  220   2HG2  ILE  28          2HG2      ILE  28  -6.754  11.320  -3.814
  221   3HG2  ILE  28          3HG2      ILE  28  -7.337  11.807  -2.221
  222   1HD1  ILE  28          1HD1      ILE  28  -5.213   8.488  -2.113
  223   2HD1  ILE  28          2HD1      ILE  28  -6.673   8.166  -1.181
  224   3HD1  ILE  28          3HD1      ILE  28  -6.116   9.825  -1.401
  225    H    GLN  29           H        GLN  29 -10.728   9.549   0.098
  226    HA   GLN  29           HA       GLN  29 -12.723  11.027  -1.338
  227   1HB   GLN  29          2HB       GLN  29 -14.037  10.828   0.834
  228   2HB   GLN  29          1HB       GLN  29 -13.567   9.309   0.079
  229   1HG   GLN  29          2HG       GLN  29 -11.773   8.987   1.643
  230   2HG   GLN  29          1HG       GLN  29 -11.937  10.628   2.265
  231   1HE2  GLN  29          1HE2      GLN  29 -12.645   7.502   3.095
  232   2HE2  GLN  29          2HE2      GLN  29 -14.027   7.764   4.045
  233    H    ASP  30           H        ASP  30 -10.446  11.739   1.235
  234    HA   ASP  30           HA       ASP  30 -10.849  14.588   0.838
  235   1HB   ASP  30          2HB       ASP  30 -10.954  14.879   3.420
  236   2HB   ASP  30          1HB       ASP  30 -12.434  14.483   2.555
  237    H    ALA  31           H        ALA  31  -8.719  13.047   0.117
  238    HA   ALA  31           HA       ALA  31  -6.651  12.933   2.092
  239   1HB   ALA  31          1HB       ALA  31  -5.194  12.319   0.281
  240   2HB   ALA  31          2HB       ALA  31  -6.319  12.966  -0.913
  241   3HB   ALA  31          3HB       ALA  31  -6.744  11.523   0.006
  242    H    GLU  32           H        GLU  32  -4.622  14.134   1.968
  243    HA   GLU  32           HA       GLU  32  -5.112  16.984   1.717
  244   1HB   GLU  32          2HB       GLU  32  -2.685  15.410   2.600
  245   2HB   GLU  32          1HB       GLU  32  -2.736  17.171   2.536
  246   1HG   GLU  32          2HG       GLU  32  -4.866  16.973   3.992
  247   2HG   GLU  32          1HG       GLU  32  -4.343  15.316   4.292
  248    H    ASP  33           H        ASP  33  -2.949  14.588   0.220
  249    HA   ASP  33           HA       ASP  33  -2.359  16.554  -1.918
  250   1HB   ASP  33          2HB       ASP  33  -0.732  14.152  -1.043
  251   2HB   ASP  33          1HB       ASP  33  -0.302  15.271  -2.335
  252    H    GLY  34           H        GLY  34  -4.642  14.501  -1.607
  253   1HA   GLY  34          2HA       GLY  34  -5.879  13.181  -3.027
  254   2HA   GLY  34          1HA       GLY  34  -4.859  13.776  -4.332
  255    H    CYS  35           H        CYS  35  -3.679  12.031  -1.497
  256    HA   CYS  35           HA       CYS  35  -3.284   9.583  -3.082
  257   1HB   CYS  35          2HB       CYS  35  -1.048  10.911  -1.533
  258   2HB   CYS  35          1HB       CYS  35  -0.943   9.430  -2.477
  259    HG   CYS  35           HG       CYS  35  -1.433  10.904  -4.640
  260    H    ILE  36           H        ILE  36  -2.159   7.885  -1.541
  261    HA   ILE  36           HA       ILE  36  -3.674   7.952   0.997
  262    HB   ILE  36           HB       ILE  36  -3.469   5.499   1.005
  263   1HG1  ILE  36          2HG1      ILE  36  -2.711   4.857  -1.598
  264   2HG1  ILE  36          1HG1      ILE  36  -1.539   6.081  -1.110
  265   1HG2  ILE  36          1HG2      ILE  36  -4.437   6.261  -1.740
  266   2HG2  ILE  36          2HG2      ILE  36  -5.279   6.845  -0.306
  267   3HG2  ILE  36          3HG2      ILE  36  -5.136   5.113  -0.599
  268   1HD1  ILE  36          1HD1      ILE  36  -1.963   4.302   1.093
  269   2HD1  ILE  36          2HD1      ILE  36  -0.481   4.583   0.180
  270   3HD1  ILE  36          3HD1      ILE  36  -1.618   3.341  -0.347
  271    H    SER  37           H        SER  37  -2.547   6.548   2.759
  272    HA   SER  37           HA       SER  37   0.149   7.647   3.076
  273   1HB   SER  37          2HB       SER  37  -1.632   7.869   4.877
  274   2HB   SER  37          1HB       SER  37  -1.462   6.136   5.140
  275    HG   SER  37           HG       SER  37   0.429   8.205   5.499
  276    H    THR  38           H        THR  38   1.915   6.395   3.713
  277    HA   THR  38           HA       THR  38   2.322   3.979   2.351
  278    HB   THR  38           HB       THR  38   4.332   3.727   3.878
  279    HG1  THR  38           HG1      THR  38   4.466   4.960   5.565
  280   1HG2  THR  38          1HG2      THR  38   5.072   4.875   2.066
  281   2HG2  THR  38          2HG2      THR  38   5.048   6.269   3.144
  282   3HG2  THR  38          3HG2      THR  38   3.682   5.961   2.072
  283    H    LYS  39           H        LYS  39   1.522   4.574   5.768
  284    HA   LYS  39           HA       LYS  39   1.557   1.853   6.581
  285   1HB   LYS  39          2HB       LYS  39   0.388   2.632   8.583
  286   2HB   LYS  39          1HB       LYS  39   1.696   3.738   8.169
  287   1HG   LYS  39          2HG       LYS  39   0.105   5.262   7.090
  288   2HG   LYS  39          1HG       LYS  39  -1.218   4.147   7.432
  289   1HD   LYS  39          2HD       LYS  39   0.489   5.077   9.711
  290   2HD   LYS  39          1HD       LYS  39  -0.718   6.183   9.054
  291   1HE   LYS  39          2HE       LYS  39  -2.247   3.984   9.229
  292   2HE   LYS  39          1HE       LYS  39  -1.098   3.610  10.514
  293   1HZ   LYS  39          1HZ       LYS  39  -1.561   5.788  11.487
  294   2HZ   LYS  39          2HZ       LYS  39  -2.964   4.838  11.385
  295   3HZ   LYS  39          3HZ       LYS  39  -2.706   6.096  10.273
  296    H    GLU  40           H        GLU  40  -0.863   3.833   4.998
  297    HA   GLU  40           HA       GLU  40  -3.064   2.032   5.544
  298   1HB   GLU  40          2HB       GLU  40  -2.759   4.439   3.746
  299   2HB   GLU  40          1HB       GLU  40  -4.240   3.489   3.831
  300   1HG   GLU  40          2HG       GLU  40  -4.318   3.889   6.293
  301   2HG   GLU  40          1HG       GLU  40  -2.899   4.926   6.140
  302    H    LEU  41           H        LEU  41  -0.426   1.696   3.558
  303    HA   LEU  41           HA       LEU  41  -1.537   0.875   1.094
  304   1HB   LEU  41          2HB       LEU  41   0.927   1.350   1.786
  305   2HB   LEU  41          1HB       LEU  41   0.950  -0.339   2.236
  306    HG   LEU  41           HG       LEU  41   1.858   0.200  -0.053
  307   1HD1  LEU  41          1HD1      LEU  41   0.645  -2.009   0.821
  308   2HD1  LEU  41          2HD1      LEU  41   1.179  -1.855  -0.853
  309   3HD1  LEU  41          3HD1      LEU  41  -0.512  -1.576  -0.437
  310   1HD2  LEU  41          1HD2      LEU  41   0.327   0.743  -1.834
  311   2HD2  LEU  41          2HD2      LEU  41   0.049   1.912  -0.543
  312   3HD2  LEU  41          3HD2      LEU  41  -1.065   0.563  -0.766
  313    H    GLY  42           H        GLY  42  -0.783  -0.897   4.077
  314   1HA   GLY  42          2HA       GLY  42  -1.341  -3.501   3.128
  315   2HA   GLY  42          1HA       GLY  42  -1.393  -2.993   4.811
  316    H    LYS  43           H        LYS  43  -3.439  -0.861   3.992
  317    HA   LYS  43           HA       LYS  43  -5.780  -2.540   4.406
  318   1HB   LYS  43          2HB       LYS  43  -5.567   0.474   4.194
  319   2HB   LYS  43          1HB       LYS  43  -6.983  -0.433   4.728
  320   1HG   LYS  43          2HG       LYS  43  -5.680  -1.357   6.614
  321   2HG   LYS  43          1HG       LYS  43  -4.270  -0.439   6.084
  322   1HD   LYS  43          2HD       LYS  43  -5.281   1.638   6.597
  323   2HD   LYS  43          1HD       LYS  43  -6.895   0.930   6.673
  324   1HE   LYS  43          2HE       LYS  43  -5.827  -0.516   8.614
  325   2HE   LYS  43          1HE       LYS  43  -4.681   0.822   8.694
  326   1HZ   LYS  43          1HZ       LYS  43  -6.537   1.205  10.169
  327   2HZ   LYS  43          2HZ       LYS  43  -7.639   1.037   8.889
  328   3HZ   LYS  43          3HZ       LYS  43  -6.557   2.347   8.917
  329    H    VAL  44           H        VAL  44  -4.481  -0.408   1.872
  330    HA   VAL  44           HA       VAL  44  -6.817  -0.456   0.246
  331    HB   VAL  44           HB       VAL  44  -5.320   0.346  -1.576
  332   1HG1  VAL  44          1HG1      VAL  44  -5.443   1.605   1.136
  333   2HG1  VAL  44          2HG1      VAL  44  -6.184   2.127  -0.377
  334   3HG1  VAL  44          3HG1      VAL  44  -4.460   2.376  -0.108
  335   1HG2  VAL  44          1HG2      VAL  44  -2.976   0.759  -1.127
  336   2HG2  VAL  44          2HG2      VAL  44  -3.298  -0.943  -0.795
  337   3HG2  VAL  44          3HG2      VAL  44  -3.154   0.204   0.537
  338    H    MET  45           H        MET  45  -3.971  -2.566   0.425
  339    HA   MET  45           HA       MET  45  -4.481  -4.015  -1.973
  340   1HB   MET  45          2HB       MET  45  -3.021  -4.863   0.538
  341   2HB   MET  45          1HB       MET  45  -3.007  -5.751  -0.987
  342   1HG   MET  45          2HG       MET  45  -2.108  -3.702  -2.110
  343   2HG   MET  45          1HG       MET  45  -2.002  -2.932  -0.529
  344   1HE   MET  45          1HE       MET  45   0.484  -4.016   1.368
  345   2HE   MET  45          2HE       MET  45  -0.386  -5.544   1.464
  346   3HE   MET  45          3HE       MET  45  -1.285  -4.032   1.352
  347    H    ARG  46           H        ARG  46  -5.655  -4.286   1.318
  348    HA   ARG  46           HA       ARG  46  -6.794  -6.871   1.177
  349   1HB   ARG  46          2HB       ARG  46  -7.017  -4.535   2.959
  350   2HB   ARG  46          1HB       ARG  46  -8.476  -5.522   2.877
  351   1HG   ARG  46          2HG       ARG  46  -7.501  -7.270   3.954
  352   2HG   ARG  46          1HG       ARG  46  -5.987  -7.087   3.070
  353   1HD   ARG  46          2HD       ARG  46  -6.067  -4.819   4.666
  354   2HD   ARG  46          1HD       ARG  46  -6.737  -6.067   5.710
  355    HE   ARG  46           HE       ARG  46  -4.001  -5.869   4.783
  356   1HH1  ARG  46          2HH1      ARG  46  -6.502  -8.002   5.971
  357   2HH1  ARG  46          1HH1      ARG  46  -5.386  -9.181   6.566
  358   1HH2  ARG  46          1HH2      ARG  46  -2.559  -7.435   5.570
  359   2HH2  ARG  46          2HH2      ARG  46  -3.163  -8.865   6.339
  360    H    MET  47           H        MET  47  -8.038  -3.661   0.328
  361    HA   MET  47           HA       MET  47 -10.701  -4.422  -0.266
  362   1HB   MET  47          2HB       MET  47  -8.994  -2.142  -1.290
  363   2HB   MET  47          1HB       MET  47 -10.696  -2.338  -1.706
  364   1HG   MET  47          2HG       MET  47  -9.901  -2.415   1.185
  365   2HG   MET  47          1HG       MET  47  -9.995  -0.856   0.368
  366   1HE   MET  47          1HE       MET  47 -13.273  -0.728   2.288
  367   2HE   MET  47          2HE       MET  47 -12.019   0.264   1.551
  368   3HE   MET  47          3HE       MET  47 -11.571  -1.014   2.678
  369    H    LEU  48           H        LEU  48  -7.718  -4.421  -2.168
  370    HA   LEU  48           HA       LEU  48  -8.944  -5.008  -4.689
  371   1HB   LEU  48          2HB       LEU  48  -6.180  -5.006  -3.601
  372   2HB   LEU  48          1HB       LEU  48  -6.470  -5.990  -5.018
  373    HG   LEU  48           HG       LEU  48  -7.249  -3.078  -4.942
  374   1HD1  LEU  48          1HD1      LEU  48  -5.098  -2.509  -5.874
  375   2HD1  LEU  48          2HD1      LEU  48  -4.619  -4.206  -5.938
  376   3HD1  LEU  48          3HD1      LEU  48  -4.806  -3.399  -4.380
  377   1HD2  LEU  48          1HD2      LEU  48  -6.465  -4.916  -7.224
  378   2HD2  LEU  48          2HD2      LEU  48  -7.153  -3.298  -7.356
  379   3HD2  LEU  48          3HD2      LEU  48  -8.132  -4.623  -6.729
  380    H    GLY  49           H        GLY  49  -7.240  -7.024  -2.281
  381   1HA   GLY  49          2HA       GLY  49  -8.639  -9.198  -1.938
  382   2HA   GLY  49          1HA       GLY  49  -8.214  -9.458  -3.627
  383    H    GLN  50           H        GLN  50  -6.555  -8.454  -0.618
  384    HA   GLN  50           HA       GLN  50  -4.620 -10.630  -0.948
  385   1HB   GLN  50          2HB       GLN  50  -3.986  -7.741  -1.293
  386   2HB   GLN  50          1HB       GLN  50  -2.846  -8.706  -0.354
  387   1HG   GLN  50          2HG       GLN  50  -2.717 -10.342  -2.212
  388   2HG   GLN  50          1HG       GLN  50  -3.816  -9.339  -3.158
  389   1HE2  GLN  50          1HE2      GLN  50  -0.704 -10.053  -3.233
  390   2HE2  GLN  50          2HE2      GLN  50  -0.010  -8.540  -3.563
  391    H    ASN  51           H        ASN  51  -3.414 -11.085   0.958
  392    HA   ASN  51           HA       ASN  51  -4.187  -9.645   3.401
  393   1HB   ASN  51          2HB       ASN  51  -5.691 -11.727   2.881
  394   2HB   ASN  51          1HB       ASN  51  -4.288 -12.648   3.421
  395   1HD2  ASN  51          1HD2      ASN  51  -7.122 -11.708   4.632
  396   2HD2  ASN  51          2HD2      ASN  51  -6.690 -11.322   6.228
  397    HA   PRO  52           HA       PRO  52   0.256 -11.005   3.363
  398   1HB   PRO  52          2HB       PRO  52   1.372  -8.513   3.236
  399   2HB   PRO  52          1HB       PRO  52   0.919  -9.451   1.808
  400   1HG   PRO  52          2HG       PRO  52  -0.373  -7.073   2.976
  401   2HG   PRO  52          1HG       PRO  52  -0.431  -7.683   1.316
  402   1HD   PRO  52          2HD       PRO  52  -2.442  -7.973   3.327
  403   2HD   PRO  52          1HD       PRO  52  -2.424  -8.718   1.712
  404    H    THR  53           H        THR  53   2.112  -9.644   4.736
  405    HA   THR  53           HA       THR  53   0.974  -9.357   7.449
  406    HB   THR  53           HB       THR  53   3.035 -10.079   8.327
  407    HG1  THR  53           HG1      THR  53   4.320  -9.872   5.835
  408   1HG2  THR  53          1HG2      THR  53   1.896 -11.918   7.180
  409   2HG2  THR  53          2HG2      THR  53   3.646 -12.110   7.068
  410   3HG2  THR  53          3HG2      THR  53   2.734 -11.514   5.681
  411    HA   PRO  54           HA       PRO  54   2.187  -5.125   7.680
  412   1HB   PRO  54          2HB       PRO  54   3.604  -4.911  10.017
  413   2HB   PRO  54          1HB       PRO  54   1.846  -5.093   9.934
  414   1HG   PRO  54          2HG       PRO  54   3.928  -7.104  10.624
  415   2HG   PRO  54          1HG       PRO  54   2.264  -6.954  11.212
  416   1HD   PRO  54          2HD       PRO  54   3.108  -8.780   9.290
  417   2HD   PRO  54          1HD       PRO  54   1.423  -8.254   9.513
  418    H    GLU  55           H        GLU  55   4.843  -7.393   8.036
  419    HA   GLU  55           HA       GLU  55   6.886  -5.405   7.449
  420   1HB   GLU  55          2HB       GLU  55   8.428  -7.371   7.406
  421   2HB   GLU  55          1HB       GLU  55   7.533  -7.219   8.912
  422   1HG   GLU  55          2HG       GLU  55   6.090  -9.012   8.374
  423   2HG   GLU  55          1HG       GLU  55   6.513  -8.953   6.664
  424    H    GLU  56           H        GLU  56   5.019  -7.837   5.740
  425    HA   GLU  56           HA       GLU  56   6.587  -7.868   3.350
  426   1HB   GLU  56          2HB       GLU  56   3.861  -8.836   4.111
  427   2HB   GLU  56          1HB       GLU  56   4.259  -8.697   2.399
  428   1HG   GLU  56          2HG       GLU  56   6.080 -10.117   4.351
  429   2HG   GLU  56          1HG       GLU  56   4.767 -10.954   3.522
  430    H    LEU  57           H        LEU  57   3.420  -6.338   4.103
  431    HA   LEU  57           HA       LEU  57   3.156  -4.915   1.703
  432   1HB   LEU  57          2HB       LEU  57   1.546  -3.551   2.812
  433   2HB   LEU  57          1HB       LEU  57   1.368  -5.188   3.400
  434    HG   LEU  57           HG       LEU  57   3.007  -4.194   5.312
  435   1HD1  LEU  57          1HD1      LEU  57   3.202  -1.946   4.809
  436   2HD1  LEU  57          2HD1      LEU  57   1.713  -1.890   5.752
  437   3HD1  LEU  57          3HD1      LEU  57   1.641  -1.887   3.991
  438   1HD2  LEU  57          1HD2      LEU  57   0.730  -3.607   6.483
  439   2HD2  LEU  57          2HD2      LEU  57   1.046  -5.271   5.994
  440   3HD2  LEU  57          3HD2      LEU  57   0.017  -4.242   5.001
  441    H    GLN  58           H        GLN  58   5.010  -4.194   4.602
  442    HA   GLN  58           HA       GLN  58   5.530  -1.472   4.181
  443   1HB   GLN  58          2HB       GLN  58   6.118  -2.881   6.235
  444   2HB   GLN  58          1HB       GLN  58   7.549  -3.389   5.339
  445   1HG   GLN  58          2HG       GLN  58   8.109  -1.465   6.742
  446   2HG   GLN  58          1HG       GLN  58   8.176  -0.993   5.045
  447   1HE2  GLN  58          1HE2      GLN  58   6.455   0.418   4.221
  448   2HE2  GLN  58          2HE2      GLN  58   5.418   1.244   5.282
  449    H    GLU  59           H        GLU  59   7.343  -4.344   3.086
  450    HA   GLU  59           HA       GLU  59   9.395  -2.939   1.735
  451   1HB   GLU  59          2HB       GLU  59   8.289  -5.727   1.469
  452   2HB   GLU  59          1HB       GLU  59   9.545  -5.136   0.380
  453   1HG   GLU  59          2HG       GLU  59  11.086  -4.807   2.153
  454   2HG   GLU  59          1HG       GLU  59   9.824  -4.917   3.379
  455    H    MET  60           H        MET  60   6.172  -3.970   0.742
  456    HA   MET  60           HA       MET  60   6.471  -3.478  -2.041
  457   1HB   MET  60          2HB       MET  60   3.942  -3.350  -0.376
  458   2HB   MET  60          1HB       MET  60   4.028  -3.512  -2.129
  459   1HG   MET  60          2HG       MET  60   5.534  -5.514  -0.508
  460   2HG   MET  60          1HG       MET  60   3.776  -5.644  -0.515
  461   1HE   MET  60          1HE       MET  60   4.292  -8.372  -3.001
  462   2HE   MET  60          2HE       MET  60   3.733  -7.819  -1.424
  463   3HE   MET  60          3HE       MET  60   5.454  -8.077  -1.701
  464    H    ILE  61           H        ILE  61   5.378  -1.439   0.665
  465    HA   ILE  61           HA       ILE  61   4.474   0.774  -0.774
  466    HB   ILE  61           HB       ILE  61   5.780   0.587   1.945
  467   1HG1  ILE  61          2HG1      ILE  61   2.929   1.272   1.534
  468   2HG1  ILE  61          1HG1      ILE  61   3.386  -0.373   1.112
  469   1HG2  ILE  61          1HG2      ILE  61   4.597   2.852   2.250
  470   2HG2  ILE  61          2HG2      ILE  61   4.542   2.926   0.488
  471   3HG2  ILE  61          3HG2      ILE  61   6.097   2.851   1.321
  472   1HD1  ILE  61          1HD1      ILE  61   4.257  -0.777   3.310
  473   2HD1  ILE  61          2HD1      ILE  61   2.657  -0.067   3.512
  474   3HD1  ILE  61          3HD1      ILE  61   4.097   0.922   3.751
  475    H    ASP  62           H        ASP  62   7.625   0.718   0.930
  476    HA   ASP  62           HA       ASP  62   8.747   2.907  -0.350
  477   1HB   ASP  62          2HB       ASP  62  10.909   2.118   0.365
  478   2HB   ASP  62          1HB       ASP  62   9.737   1.746   1.623
  479    H    GLU  63           H        GLU  63   8.596  -0.442  -1.465
  480    HA   GLU  63           HA       GLU  63  10.435  -0.288  -3.594
  481   1HB   GLU  63          2HB       GLU  63   8.139  -2.052  -2.908
  482   2HB   GLU  63          1HB       GLU  63   8.693  -2.070  -4.581
  483   1HG   GLU  63          2HG       GLU  63  11.022  -2.459  -3.753
  484   2HG   GLU  63          1HG       GLU  63  10.381  -2.587  -2.117
  485    H    VAL  64           H        VAL  64   6.884   0.162  -3.633
  486    HA   VAL  64           HA       VAL  64   6.845   0.974  -6.391
  487    HB   VAL  64           HB       VAL  64   4.498   1.487  -6.053
  488   1HG1  VAL  64          1HG1      VAL  64   5.512  -1.027  -4.719
  489   2HG1  VAL  64          2HG1      VAL  64   4.857  -0.837  -6.346
  490   3HG1  VAL  64          3HG1      VAL  64   3.789  -0.724  -4.949
  491   1HG2  VAL  64          1HG2      VAL  64   4.867   2.564  -3.786
  492   2HG2  VAL  64          2HG2      VAL  64   4.926   0.938  -3.105
  493   3HG2  VAL  64          3HG2      VAL  64   3.454   1.514  -3.887
  494    H    ASP  65           H        ASP  65   7.303   2.645  -3.359
  495    HA   ASP  65           HA       ASP  65   6.548   5.246  -4.267
  496   1HB   ASP  65          2HB       ASP  65   7.138   4.189  -1.811
  497   2HB   ASP  65          1HB       ASP  65   8.594   5.120  -2.150
  498    H    GLU  66           H        GLU  66   7.555   5.419  -6.289
  499    HA   GLU  66           HA       GLU  66  10.337   5.165  -6.757
  500   1HB   GLU  66          2HB       GLU  66   8.117   6.589  -8.205
  501   2HB   GLU  66          1HB       GLU  66   9.789   6.737  -8.743
  502   1HG   GLU  66          2HG       GLU  66   8.786   3.985  -8.177
  503   2HG   GLU  66          1HG       GLU  66   8.181   4.780  -9.630
  504    H    ASP  67           H        ASP  67   8.338   7.957  -5.856
  505    HA   ASP  67           HA       ASP  67  10.576   9.794  -5.966
  506   1HB   ASP  67          2HB       ASP  67   8.919  11.398  -4.892
  507   2HB   ASP  67          1HB       ASP  67   8.463  10.774  -6.475
  508    H    GLY  68           H        GLY  68   8.673   8.213  -3.404
  509   1HA   GLY  68          2HA       GLY  68   9.316   7.651  -1.246
  510   2HA   GLY  68          1HA       GLY  68  10.910   8.318  -1.586
  511    H    SER  69           H        SER  69   7.616   9.695  -1.588
  512    HA   SER  69           HA       SER  69   8.613  12.036  -0.131
  513   1HB   SER  69          2HB       SER  69   6.398  13.016  -0.656
  514   2HB   SER  69          1HB       SER  69   7.245  12.479  -2.100
  515    HG   SER  69           HG       SER  69   4.850  11.816  -1.408
  516    H    GLY  70           H        GLY  70   5.890   9.743   0.083
  517   1HA   GLY  70          2HA       GLY  70   5.972   8.934   2.652
  518   2HA   GLY  70          1HA       GLY  70   5.289  10.549   2.811
  519    H    THR  71           H        THR  71   3.897  10.441   0.235
  520    HA   THR  71           HA       THR  71   1.665   8.683   1.033
  521    HB   THR  71           HB       THR  71   0.211  10.146  -0.235
  522    HG1  THR  71           HG1      THR  71   2.498  11.701  -0.851
  523   1HG2  THR  71          1HG2      THR  71   0.562  12.273   1.005
  524   2HG2  THR  71          2HG2      THR  71   2.161  11.703   1.486
  525   3HG2  THR  71          3HG2      THR  71   0.718  10.857   2.046
  526    H    VAL  72           H        VAL  72   0.587   7.423  -0.530
  527    HA   VAL  72           HA       VAL  72   2.309   6.678  -2.807
  528    HB   VAL  72           HB       VAL  72  -0.100   5.184  -1.751
  529   1HG1  VAL  72          1HG1      VAL  72   0.673   4.705  -4.087
  530   2HG1  VAL  72          2HG1      VAL  72   0.836   3.322  -3.005
  531   3HG1  VAL  72          3HG1      VAL  72   2.254   4.278  -3.433
  532   1HG2  VAL  72          1HG2      VAL  72   1.651   3.699  -0.688
  533   2HG2  VAL  72          2HG2      VAL  72   1.508   5.294   0.051
  534   3HG2  VAL  72          3HG2      VAL  72   2.841   4.949  -1.052
  535    H    ASP  73           H        ASP  73   1.830   7.440  -4.732
  536    HA   ASP  73           HA       ASP  73  -0.760   8.650  -5.282
  537   1HB   ASP  73          2HB       ASP  73   1.800   8.409  -6.874
  538   2HB   ASP  73          1HB       ASP  73   0.330   9.106  -7.544
  539    H    PHE  74           H        PHE  74  -1.433   8.174  -7.760
  540    HA   PHE  74           HA       PHE  74  -2.457   5.514  -7.742
  541   1HB   PHE  74          2HB       PHE  74  -3.449   7.631  -8.872
  542   2HB   PHE  74          1HB       PHE  74  -2.382   7.227 -10.214
  543    HD1  PHE  74           HD1      PHE  74  -3.824   6.421 -11.891
  544    HD2  PHE  74           HD2      PHE  74  -4.203   4.931  -7.880
  545    HE1  PHE  74           HE1      PHE  74  -5.448   4.721 -12.675
  546    HE2  PHE  74           HE2      PHE  74  -5.821   3.230  -8.666
  547    HZ   PHE  74           HZ       PHE  74  -6.449   3.124 -11.063
  548    H    ASP  75           H        ASP  75   0.265   7.066  -9.390
  549    HA   ASP  75           HA       ASP  75   0.862   4.948 -11.186
  550   1HB   ASP  75          2HB       ASP  75   2.305   7.333 -10.140
  551   2HB   ASP  75          1HB       ASP  75   3.287   6.040 -10.824
  552    H    GLU  76           H        GLU  76   1.811   5.651  -7.863
  553    HA   GLU  76           HA       GLU  76   3.610   3.383  -7.656
  554   1HB   GLU  76          2HB       GLU  76   2.477   4.923  -5.324
  555   2HB   GLU  76          1HB       GLU  76   4.031   4.101  -5.448
  556   1HG   GLU  76          2HG       GLU  76   4.907   5.770  -6.920
  557   2HG   GLU  76          1HG       GLU  76   3.308   6.465  -7.192
  558    H    PHE  77           H        PHE  77   0.257   4.022  -7.256
  559    HA   PHE  77           HA       PHE  77  -0.346   1.864  -5.445
  560   1HB   PHE  77          2HB       PHE  77  -1.738   3.914  -5.620
  561   2HB   PHE  77          1HB       PHE  77  -2.176   3.458  -7.264
  562    HD1  PHE  77           HD1      PHE  77  -3.945   1.956  -7.676
  563    HD2  PHE  77           HD2      PHE  77  -2.307   2.298  -3.714
  564    HE1  PHE  77           HE1      PHE  77  -5.782   0.546  -6.788
  565    HE2  PHE  77           HE2      PHE  77  -4.141   0.885  -2.836
  566    HZ   PHE  77           HZ       PHE  77  -5.880   0.009  -4.371
  567    H    LEU  78           H        LEU  78  -0.535   2.382  -8.959
  568    HA   LEU  78           HA       LEU  78  -1.761  -0.157  -9.506
  569   1HB   LEU  78          2HB       LEU  78  -0.347   1.809 -11.289
  570   2HB   LEU  78          1HB       LEU  78  -1.194   0.389 -11.864
  571    HG   LEU  78           HG       LEU  78  -2.759   2.245 -10.152
  572   1HD1  LEU  78          1HD1      LEU  78  -1.418   3.041 -12.679
  573   2HD1  LEU  78          2HD1      LEU  78  -1.995   4.037 -11.346
  574   3HD1  LEU  78          3HD1      LEU  78  -3.132   3.439 -12.554
  575   1HD2  LEU  78          1HD2      LEU  78  -3.408   0.065 -11.546
  576   2HD2  LEU  78          2HD2      LEU  78  -3.566   1.239 -12.854
  577   3HD2  LEU  78          3HD2      LEU  78  -4.531   1.416 -11.388
  578    H    VAL  79           H        VAL  79   1.586   1.022  -9.482
  579    HA   VAL  79           HA       VAL  79   2.780  -1.121 -10.858
  580    HB   VAL  79           HB       VAL  79   4.855  -0.554  -9.505
  581   1HG1  VAL  79          1HG1      VAL  79   3.342   1.519 -11.100
  582   2HG1  VAL  79          2HG1      VAL  79   4.593   0.413 -11.670
  583   3HG1  VAL  79          3HG1      VAL  79   5.016   1.745 -10.593
  584   1HG2  VAL  79          1HG2      VAL  79   4.822   1.409  -8.118
  585   2HG2  VAL  79          2HG2      VAL  79   3.532   0.353  -7.547
  586   3HG2  VAL  79          3HG2      VAL  79   3.148   1.752  -8.547
  587    H    MET  80           H        MET  80   1.573  -0.896  -7.602
  588    HA   MET  80           HA       MET  80   2.867  -2.798  -6.152
  589   1HB   MET  80          2HB       MET  80   0.018  -1.961  -6.337
  590   2HB   MET  80          1HB       MET  80   0.358  -3.454  -5.462
  591   1HG   MET  80          2HG       MET  80   2.221  -2.062  -4.281
  592   2HG   MET  80          1HG       MET  80   1.318  -0.664  -4.865
  593   1HE   MET  80          1HE       MET  80  -1.811  -1.095  -4.482
  594   2HE   MET  80          2HE       MET  80  -0.595   0.160  -4.258
  595   3HE   MET  80          3HE       MET  80  -1.658  -0.274  -2.922
  596    H    MET  81           H        MET  81   0.531  -3.405  -8.760
  597    HA   MET  81           HA       MET  81   0.428  -6.240  -8.382
  598   1HB   MET  81          2HB       MET  81  -0.512  -4.335 -10.477
  599   2HB   MET  81          1HB       MET  81  -0.391  -6.044 -10.900
  600   1HG   MET  81          2HG       MET  81  -1.589  -6.128  -8.409
  601   2HG   MET  81          1HG       MET  81  -2.306  -4.688  -9.131
  602   1HE   MET  81          1HE       MET  81  -2.184  -8.955 -10.547
  603   2HE   MET  81          2HE       MET  81  -3.046  -8.660  -9.039
  604   3HE   MET  81          3HE       MET  81  -1.372  -8.136  -9.205
  605    H    VAL  82           H        VAL  82   2.042  -4.253 -10.904
  606    HA   VAL  82           HA       VAL  82   3.383  -6.419 -12.132
  607    HB   VAL  82           HB       VAL  82   4.945  -4.647 -13.044
  608   1HG1  VAL  82          1HG1      VAL  82   3.379  -4.008 -14.631
  609   2HG1  VAL  82          2HG1      VAL  82   2.115  -3.744 -13.430
  610   3HG1  VAL  82          3HG1      VAL  82   2.558  -5.385 -13.898
  611   1HG2  VAL  82          1HG2      VAL  82   4.735  -3.094 -11.100
  612   2HG2  VAL  82          2HG2      VAL  82   3.061  -2.790 -11.560
  613   3HG2  VAL  82          3HG2      VAL  82   4.371  -2.309 -12.635
  614    H    ARG  83           H        ARG  83   4.237  -4.424  -9.358
  615    HA   ARG  83           HA       ARG  83   6.978  -5.176  -9.185
  616   1HB   ARG  83          2HB       ARG  83   5.015  -4.151  -7.127
  617   2HB   ARG  83          1HB       ARG  83   6.707  -4.485  -6.754
  618   1HG   ARG  83          2HG       ARG  83   7.075  -2.994  -8.954
  619   2HG   ARG  83          1HG       ARG  83   5.529  -2.324  -8.438
  620   1HD   ARG  83          2HD       ARG  83   6.910  -0.980  -7.191
  621   2HD   ARG  83          1HD       ARG  83   6.761  -2.323  -6.065
  622    HE   ARG  83           HE       ARG  83   8.989  -2.863  -6.471
  623   1HH1  ARG  83          2HH1      ARG  83   7.841  -0.567  -8.844
  624   2HH1  ARG  83          1HH1      ARG  83   9.415  -0.272  -9.498
  625   1HH2  ARG  83          1HH2      ARG  83  11.039  -2.455  -7.347
  626   2HH2  ARG  83          2HH2      ARG  83  11.219  -1.335  -8.655
  627    H    CYS  84           H        CYS  84   4.002  -6.749  -8.279
  628    HA   CYS  84           HA       CYS  84   5.056  -8.574  -6.361
  629   1HB   CYS  84          2HB       CYS  84   2.560  -7.952  -6.993
  630   2HB   CYS  84          1HB       CYS  84   2.730  -9.330  -8.078
  631    HG   CYS  84           HG       CYS  84   2.046 -10.480  -5.925
  632    H    MET  85           H        MET  85   5.088  -8.485  -9.849
  633    HA   MET  85           HA       MET  85   5.353 -11.178 -10.522
  634   1HB   MET  85          2HB       MET  85   6.438  -8.643 -11.718
  635   2HB   MET  85          1HB       MET  85   6.906 -10.208 -12.385
  636   1HG   MET  85          2HG       MET  85   4.338 -10.699 -12.374
  637   2HG   MET  85          1HG       MET  85   4.176  -8.946 -12.264
  638   1HE   MET  85          1HE       MET  85   5.559 -11.968 -14.455
  639   2HE   MET  85          2HE       MET  85   4.662 -11.419 -15.867
  640   3HE   MET  85          3HE       MET  85   3.828 -11.628 -14.330
  641    H    LYS  86           H        LYS  86   7.774  -8.896  -9.308
  642    HA   LYS  86           HA       LYS  86   9.830  -9.183  -8.360
  643   1HB   LYS  86          2HB       LYS  86   8.573 -11.838  -8.005
  644   2HB   LYS  86          1HB       LYS  86  10.331 -11.804  -7.895
  645   1HG   LYS  86          2HG       LYS  86   8.888  -9.640  -6.457
  646   2HG   LYS  86          1HG       LYS  86   8.713 -11.265  -5.794
  647   1HD   LYS  86          2HD       LYS  86  11.458 -10.932  -6.471
  648   2HD   LYS  86          1HD       LYS  86  10.961  -9.489  -5.586
  649   1HE   LYS  86          2HE       LYS  86   9.768 -11.419  -4.082
  650   2HE   LYS  86          1HE       LYS  86  11.189 -12.292  -4.653
  651   1HZ   LYS  86          1HZ       LYS  86  11.222  -9.641  -3.311
  652   2HZ   LYS  86          2HZ       LYS  86  12.586 -10.508  -3.839
  653   3HZ   LYS  86          3HZ       LYS  86  11.622 -11.118  -2.580
  654    H    ASP  87           H        ASP  87   9.803 -12.335 -10.004
  655    HA   ASP  87           HA       ASP  87  11.038 -13.182 -11.739
  656   1HB   ASP  87          2HB       ASP  87  10.131 -10.987 -12.845
  657   2HB   ASP  87          1HB       ASP  87  11.792 -10.426 -12.656
  658    H    ASP  88           H        ASP  88  12.815 -14.162 -11.040
  659    HA   ASP  88           HA       ASP  88  14.943 -12.724  -9.699
  660   1HB   ASP  88          2HB       ASP  88  14.596 -15.621 -10.498
  661   2HB   ASP  88          1HB       ASP  88  16.064 -15.010  -9.734
  662    H    SER  89           HN       SER  89  15.663 -11.277 -11.298
  663    HA   SER  89           HA       SER  89  17.298 -12.533 -13.423
  664   1HB   SER  89          2HB       SER  89  15.181 -11.381 -14.258
  665   2HB   SER  89          1HB       SER  89  15.906  -9.868 -13.724
  666    HG   SER  89           HG       SER  89  16.515 -11.484 -15.871
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  16.523   2.823 -13.341
    2   2H    MET   1          2H        MET   1  15.508   2.930 -11.982
    3   3H    MET   1          3H        MET   1  16.135   4.341 -12.689
    4    HA   MET   1           HA       MET   1  13.793   3.994 -13.264
    5   1HB   MET   1          2HB       MET   1  15.765   4.892 -14.861
    6   2HB   MET   1          1HB       MET   1  15.257   3.498 -15.815
    7   1HG   MET   1          2HG       MET   1  13.042   4.316 -16.038
    8   2HG   MET   1          1HG       MET   1  13.256   5.486 -14.734
    9   1HE   MET   1          1HE       MET   1  14.805   8.476 -16.100
   10   2HE   MET   1          2HE       MET   1  15.648   7.290 -15.108
   11   3HE   MET   1          3HE       MET   1  13.936   7.602 -14.831
   12    H    ASN   2           H        ASN   2  12.242   2.521 -13.546
   13    HA   ASN   2           HA       ASN   2  13.019  -0.232 -14.259
   14   1HB   ASN   2          2HB       ASN   2  11.410   0.717 -12.223
   15   2HB   ASN   2          1HB       ASN   2  10.244   0.192 -13.437
   16   1HD2  ASN   2          1HD2      ASN   2  13.274  -0.999 -11.862
   17   2HD2  ASN   2          2HD2      ASN   2  12.784  -2.623 -11.833
   18    H    ASP   3           H        ASP   3  11.923  -1.397 -15.850
   19    HA   ASP   3           HA       ASP   3  10.217   0.190 -17.676
   20   1HB   ASP   3          2HB       ASP   3  11.296  -0.953 -19.581
   21   2HB   ASP   3          1HB       ASP   3  12.436   0.028 -18.663
   22    H    ILE   4           H        ILE   4   9.960  -2.193 -15.574
   23    HA   ILE   4           HA       ILE   4   8.742  -4.223 -17.274
   24    HB   ILE   4           HB       ILE   4   8.471  -5.552 -15.333
   25   1HG1  ILE   4          2HG1      ILE   4   9.061  -4.380 -13.033
   26   2HG1  ILE   4          1HG1      ILE   4   8.569  -2.917 -13.887
   27   1HG2  ILE   4          1HG2      ILE   4  10.683  -5.640 -14.424
   28   2HG2  ILE   4          2HG2      ILE   4  10.950  -3.924 -14.731
   29   3HG2  ILE   4          3HG2      ILE   4  10.852  -5.056 -16.080
   30   1HD1  ILE   4          1HD1      ILE   4   6.797  -4.388 -12.565
   31   2HD1  ILE   4          2HD1      ILE   4   6.797  -5.322 -14.061
   32   3HD1  ILE   4          3HD1      ILE   4   6.370  -3.610 -14.089
   33    H    TYR   5           H        TYR   5   7.771  -1.474 -15.382
   34    HA   TYR   5           HA       TYR   5   5.022  -2.126 -15.032
   35   1HB   TYR   5          2HB       TYR   5   6.166   0.664 -15.273
   36   2HB   TYR   5          1HB       TYR   5   4.707   0.166 -14.421
   37    HD1  TYR   5           HD1      TYR   5   5.447  -2.128 -12.866
   38    HD2  TYR   5           HD2      TYR   5   7.771   1.374 -13.742
   39    HE1  TYR   5           HE1      TYR   5   6.769  -2.490 -10.805
   40    HE2  TYR   5           HE2      TYR   5   9.099   1.004 -11.685
   41    HH   TYR   5           HH       TYR   5   9.583  -1.399 -10.211
   42    H    LYS   6           H        LYS   6   6.879  -0.670 -17.619
   43    HA   LYS   6           HA       LYS   6   4.567   0.214 -19.128
   44   1HB   LYS   6          2HB       LYS   6   7.347  -0.172 -20.243
   45   2HB   LYS   6          1HB       LYS   6   6.098   0.946 -20.786
   46   1HG   LYS   6          2HG       LYS   6   7.759   1.098 -18.260
   47   2HG   LYS   6          1HG       LYS   6   7.668   2.275 -19.570
   48   1HD   LYS   6          2HD       LYS   6   5.403   2.862 -18.982
   49   2HD   LYS   6          1HD       LYS   6   5.308   1.536 -17.822
   50   1HE   LYS   6          2HE       LYS   6   6.689   2.605 -16.279
   51   2HE   LYS   6          1HE       LYS   6   7.465   3.600 -17.510
   52   1HZ   LYS   6          1HZ       LYS   6   5.933   4.877 -16.124
   53   2HZ   LYS   6          2HZ       LYS   6   4.646   3.881 -16.612
   54   3HZ   LYS   6          3HZ       LYS   6   5.440   4.867 -17.746
   55    H    ALA   7           H        ALA   7   6.806  -2.506 -19.153
   56    HA   ALA   7           HA       ALA   7   5.761  -3.721 -21.534
   57   1HB   ALA   7          1HB       ALA   7   8.024  -4.127 -20.185
   58   2HB   ALA   7          2HB       ALA   7   7.296  -5.393 -21.175
   59   3HB   ALA   7          3HB       ALA   7   7.054  -5.390 -19.428
   60    H    ALA   8           H        ALA   8   4.976  -3.878 -18.111
   61    HA   ALA   8           HA       ALA   8   3.147  -6.118 -18.447
   62   1HB   ALA   8          1HB       ALA   8   2.707  -5.788 -16.031
   63   2HB   ALA   8          2HB       ALA   8   3.764  -4.376 -16.052
   64   3HB   ALA   8          3HB       ALA   8   4.425  -5.979 -16.381
   65    H    VAL   9           H        VAL   9   2.990  -2.643 -18.545
   66    HA   VAL   9           HA       VAL   9   0.390  -2.154 -17.664
   67    HB   VAL   9           HB       VAL   9   2.264  -0.508 -18.526
   68   1HG1  VAL   9          1HG1      VAL   9   0.447  -0.602 -20.946
   69   2HG1  VAL   9          2HG1      VAL   9   2.022  -1.392 -20.905
   70   3HG1  VAL   9          3HG1      VAL   9   1.911   0.359 -20.731
   71   1HG2  VAL   9          1HG2      VAL   9  -0.690   0.039 -18.948
   72   2HG2  VAL   9          2HG2      VAL   9   0.562   1.246 -18.650
   73   3HG2  VAL   9          3HG2      VAL   9   0.132   0.090 -17.389
   74    H    GLU  10           H        GLU  10   1.500  -3.406 -20.770
   75    HA   GLU  10           HA       GLU  10  -1.036  -3.212 -22.091
   76   1HB   GLU  10          2HB       GLU  10   1.474  -4.785 -22.677
   77   2HB   GLU  10          1HB       GLU  10   0.034  -4.881 -23.693
   78   1HG   GLU  10          2HG       GLU  10   0.147  -2.291 -23.743
   79   2HG   GLU  10          1HG       GLU  10   1.798  -2.494 -23.161
   80    H    GLN  11           H        GLN  11   0.319  -5.462 -19.832
   81    HA   GLN  11           HA       GLN  11  -1.357  -7.692 -20.565
   82   1HB   GLN  11          2HB       GLN  11   0.225  -7.235 -18.026
   83   2HB   GLN  11          1HB       GLN  11  -0.473  -8.765 -18.556
   84   1HG   GLN  11          2HG       GLN  11   1.490  -7.236 -20.273
   85   2HG   GLN  11          1HG       GLN  11   2.027  -8.391 -19.056
   86   1HE2  GLN  11          1HE2      GLN  11   0.711  -8.082 -22.260
   87   2HE2  GLN  11          2HE2      GLN  11   0.535  -9.742 -22.568
   88    H    LEU  12           H        LEU  12  -1.430  -5.137 -18.110
   89    HA   LEU  12           HA       LEU  12  -3.628  -6.151 -16.626
   90   1HB   LEU  12          2HB       LEU  12  -2.851  -3.259 -16.955
   91   2HB   LEU  12          1HB       LEU  12  -3.801  -3.953 -15.662
   92    HG   LEU  12           HG       LEU  12  -1.272  -5.296 -15.749
   93   1HD1  LEU  12          1HD1      LEU  12   0.220  -3.683 -16.209
   94   2HD1  LEU  12          2HD1      LEU  12  -0.500  -2.632 -14.991
   95   3HD1  LEU  12          3HD1      LEU  12  -1.107  -2.608 -16.646
   96   1HD2  LEU  12          1HD2      LEU  12  -1.236  -3.767 -13.496
   97   2HD2  LEU  12          2HD2      LEU  12  -2.149  -5.268 -13.635
   98   3HD2  LEU  12          3HD2      LEU  12  -2.956  -3.720 -13.881
   99    H    THR  13           H        THR  13  -5.786  -5.336 -16.539
  100    HA   THR  13           HA       THR  13  -6.793  -4.410 -19.168
  101    HB   THR  13           HB       THR  13  -9.004  -5.455 -18.049
  102    HG1  THR  13           HG1      THR  13  -8.256  -6.343 -16.254
  103   1HG2  THR  13          1HG2      THR  13  -8.305  -7.626 -19.260
  104   2HG2  THR  13          2HG2      THR  13  -6.815  -6.765 -19.649
  105   3HG2  THR  13          3HG2      THR  13  -8.366  -6.139 -20.207
  106    H    ASP  14           H        ASP  14  -8.885  -3.237 -19.053
  107    HA   ASP  14           HA       ASP  14  -8.684  -0.927 -17.436
  108   1HB   ASP  14          2HB       ASP  14 -10.934  -2.076 -19.087
  109   2HB   ASP  14          1HB       ASP  14 -11.110  -0.568 -18.187
  110    H    GLU  15           H        GLU  15 -10.387  -3.978 -17.020
  111    HA   GLU  15           HA       GLU  15 -12.167  -3.272 -14.963
  112   1HB   GLU  15          2HB       GLU  15 -10.819  -5.851 -15.724
  113   2HB   GLU  15          1HB       GLU  15 -11.827  -5.757 -14.280
  114   1HG   GLU  15          2HG       GLU  15 -12.798  -4.804 -16.981
  115   2HG   GLU  15          1HG       GLU  15 -13.006  -6.471 -16.443
  116    H    GLN  16           H        GLN  16  -8.784  -4.373 -14.814
  117    HA   GLN  16           HA       GLN  16  -8.559  -4.499 -11.995
  118   1HB   GLN  16          2HB       GLN  16  -6.591  -4.200 -14.242
  119   2HB   GLN  16          1HB       GLN  16  -6.048  -3.998 -12.577
  120   1HG   GLN  16          2HG       GLN  16  -6.552  -6.209 -12.004
  121   2HG   GLN  16          1HG       GLN  16  -7.707  -6.392 -13.324
  122   1HE2  GLN  16          1HE2      GLN  16  -4.176  -5.921 -12.755
  123   2HE2  GLN  16          2HE2      GLN  16  -3.695  -6.778 -14.139
  124    H    LYS  17           H        LYS  17  -7.858  -1.884 -14.305
  125    HA   LYS  17           HA       LYS  17  -7.004  -0.006 -12.334
  126   1HB   LYS  17          2HB       LYS  17  -7.766   0.146 -15.221
  127   2HB   LYS  17          1HB       LYS  17  -7.697   1.641 -14.288
  128   1HG   LYS  17          2HG       LYS  17  -5.497   1.467 -15.056
  129   2HG   LYS  17          1HG       LYS  17  -5.381   0.702 -13.470
  130   1HD   LYS  17          2HD       LYS  17  -5.362  -1.475 -14.387
  131   2HD   LYS  17          1HD       LYS  17  -5.999  -0.924 -15.937
  132   1HE   LYS  17          2HE       LYS  17  -3.410   0.262 -15.070
  133   2HE   LYS  17          1HE       LYS  17  -3.380  -1.436 -15.547
  134   1HZ   LYS  17          1HZ       LYS  17  -4.510   0.775 -17.179
  135   2HZ   LYS  17          2HZ       LYS  17  -4.400  -0.857 -17.639
  136   3HZ   LYS  17          3HZ       LYS  17  -2.990   0.063 -17.421
  137    H    ASN  18           H        ASN  18 -10.132  -0.957 -13.590
  138    HA   ASN  18           HA       ASN  18 -11.640   1.303 -12.763
  139   1HB   ASN  18          2HB       ASN  18 -12.205  -1.415 -13.723
  140   2HB   ASN  18          1HB       ASN  18 -13.393  -0.819 -12.563
  141   1HD2  ASN  18          1HD2      ASN  18 -11.735   0.109 -15.619
  142   2HD2  ASN  18          2HD2      ASN  18 -12.999   1.094 -16.176
  143    H    GLU  19           H        GLU  19 -11.000  -1.845 -11.212
  144    HA   GLU  19           HA       GLU  19 -12.392  -1.271  -8.790
  145   1HB   GLU  19          2HB       GLU  19 -10.082  -3.195  -9.209
  146   2HB   GLU  19          1HB       GLU  19 -11.217  -3.200  -7.860
  147   1HG   GLU  19          2HG       GLU  19 -13.046  -3.391  -9.722
  148   2HG   GLU  19          1HG       GLU  19 -11.708  -3.930 -10.736
  149    H    PHE  20           H        PHE  20  -9.035  -0.955  -9.841
  150    HA   PHE  20           HA       PHE  20  -7.881  -0.174  -7.394
  151   1HB   PHE  20          2HB       PHE  20  -7.146   0.132 -10.277
  152   2HB   PHE  20          1HB       PHE  20  -6.265   1.081  -9.083
  153    HD1  PHE  20           HD1      PHE  20  -4.196  -0.172  -9.625
  154    HD2  PHE  20           HD2      PHE  20  -7.681  -2.139  -8.066
  155    HE1  PHE  20           HE1      PHE  20  -2.822  -2.143  -9.035
  156    HE2  PHE  20           HE2      PHE  20  -6.314  -4.109  -7.478
  157    HZ   PHE  20           HZ       PHE  20  -3.878  -4.117  -7.961
  158    H    LYS  21           H        LYS  21  -9.406   1.729  -9.974
  159    HA   LYS  21           HA       LYS  21  -8.786   4.291  -8.948
  160   1HB   LYS  21          2HB       LYS  21  -9.611   3.878 -11.263
  161   2HB   LYS  21          1HB       LYS  21 -11.202   3.505 -10.599
  162   1HG   LYS  21          2HG       LYS  21 -11.048   5.861 -11.382
  163   2HG   LYS  21          1HG       LYS  21 -11.365   5.761  -9.652
  164   1HD   LYS  21          2HD       LYS  21  -9.163   6.370  -9.083
  165   2HD   LYS  21          1HD       LYS  21  -8.539   5.961 -10.681
  166   1HE   LYS  21          2HE       LYS  21 -10.614   8.114 -10.446
  167   2HE   LYS  21          1HE       LYS  21  -8.945   8.490 -10.021
  168   1HZ   LYS  21          1HZ       LYS  21  -9.861   7.340 -12.603
  169   2HZ   LYS  21          2HZ       LYS  21  -8.248   7.689 -12.193
  170   3HZ   LYS  21          3HZ       LYS  21  -9.380   8.946 -12.349
  171    H    ALA  22           H        ALA  22 -11.571   2.140  -8.449
  172    HA   ALA  22           HA       ALA  22 -13.036   3.963  -6.808
  173   1HB   ALA  22          1HB       ALA  22 -14.497   2.146  -6.345
  174   2HB   ALA  22          2HB       ALA  22 -13.253   0.954  -6.715
  175   3HB   ALA  22          3HB       ALA  22 -13.966   1.916  -8.010
  176    H    ALA  23           H        ALA  23 -10.829   1.258  -6.116
  177    HA   ALA  23           HA       ALA  23 -11.050   1.363  -3.285
  178   1HB   ALA  23          1HB       ALA  23 -10.128  -0.623  -4.196
  179   2HB   ALA  23          2HB       ALA  23  -8.788   0.176  -3.374
  180   3HB   ALA  23          3HB       ALA  23  -8.927   0.271  -5.130
  181    H    PHE  24           H        PHE  24  -9.325   3.315  -5.573
  182    HA   PHE  24           HA       PHE  24  -7.480   4.404  -3.596
  183   1HB   PHE  24          2HB       PHE  24  -7.040   4.039  -6.144
  184   2HB   PHE  24          1HB       PHE  24  -7.943   5.536  -6.347
  185    HD1  PHE  24           HD1      PHE  24  -4.898   4.006  -4.921
  186    HD2  PHE  24           HD2      PHE  24  -7.032   7.672  -5.615
  187    HE1  PHE  24           HE1      PHE  24  -2.860   5.300  -4.364
  188    HE2  PHE  24           HE2      PHE  24  -4.993   8.963  -5.050
  189    HZ   PHE  24           HZ       PHE  24  -2.908   7.778  -4.425
  190    H    ASP  25           H        ASP  25 -10.095   5.635  -5.698
  191    HA   ASP  25           HA       ASP  25 -10.236   8.231  -4.703
  192   1HB   ASP  25          2HB       ASP  25 -11.461   7.130  -6.720
  193   2HB   ASP  25          1HB       ASP  25 -12.727   6.777  -5.544
  194    H    ILE  26           H        ILE  26 -11.812   5.291  -3.426
  195    HA   ILE  26           HA       ILE  26 -13.603   6.494  -1.649
  196    HB   ILE  26           HB       ILE  26 -13.354   4.426  -0.253
  197   1HG1  ILE  26          2HG1      ILE  26 -11.284   3.716  -2.359
  198   2HG1  ILE  26          1HG1      ILE  26 -10.939   4.064  -0.668
  199   1HG2  ILE  26          1HG2      ILE  26 -14.039   4.580  -3.113
  200   2HG2  ILE  26          2HG2      ILE  26 -14.970   3.928  -1.766
  201   3HG2  ILE  26          3HG2      ILE  26 -13.729   2.943  -2.536
  202   1HD1  ILE  26          1HD1      ILE  26 -12.557   2.168  -0.095
  203   2HD1  ILE  26          2HD1      ILE  26 -11.022   1.689  -0.820
  204   3HD1  ILE  26          3HD1      ILE  26 -12.486   1.732  -1.802
  205    H    PHE  27           H        PHE  27 -10.140   5.893  -1.307
  206    HA   PHE  27           HA       PHE  27 -10.073   6.932   1.413
  207   1HB   PHE  27          2HB       PHE  27  -8.055   5.779  -0.478
  208   2HB   PHE  27          1HB       PHE  27  -7.495   6.772   0.867
  209    HD1  PHE  27           HD1      PHE  27  -7.738   6.041   3.170
  210    HD2  PHE  27           HD2      PHE  27  -9.267   3.669  -0.068
  211    HE1  PHE  27           HE1      PHE  27  -8.049   4.128   4.717
  212    HE2  PHE  27           HE2      PHE  27  -9.579   1.757   1.479
  213    HZ   PHE  27           HZ       PHE  27  -8.970   1.987   3.873
  214    H    ILE  28           H        ILE  28  -9.440   8.036  -1.865
  215    HA   ILE  28           HA       ILE  28  -8.344  10.589  -0.917
  216    HB   ILE  28           HB       ILE  28  -8.820   9.811  -3.795
  217   1HG1  ILE  28          2HG1      ILE  28  -7.462   8.024  -3.130
  218   2HG1  ILE  28          1HG1      ILE  28  -6.289   9.219  -3.660
  219   1HG2  ILE  28          1HG2      ILE  28  -8.238  12.079  -3.684
  220   2HG2  ILE  28          2HG2      ILE  28  -6.682  11.290  -3.945
  221   3HG2  ILE  28          3HG2      ILE  28  -7.137  11.829  -2.328
  222   1HD1  ILE  28          1HD1      ILE  28  -6.967   8.347  -0.871
  223   2HD1  ILE  28          2HD1      ILE  28  -6.352   9.979  -1.137
  224   3HD1  ILE  28          3HD1      ILE  28  -5.382   8.583  -1.609
  225    H    GLN  29           H        GLN  29 -11.037  10.118  -0.217
  226    HA   GLN  29           HA       GLN  29 -12.816  11.369  -2.091
  227   1HB   GLN  29          2HB       GLN  29 -14.393  11.485  -0.128
  228   2HB   GLN  29          1HB       GLN  29 -13.803   9.867  -0.499
  229   1HG   GLN  29          2HG       GLN  29 -12.511   9.747   1.409
  230   2HG   GLN  29          1HG       GLN  29 -12.236  11.488   1.463
  231   1HE2  GLN  29          1HE2      GLN  29 -14.099  12.855   2.232
  232   2HE2  GLN  29          2HE2      GLN  29 -15.254  12.168   3.267
  233    H    ASP  30           H        ASP  30 -10.727  12.496   0.482
  234    HA   ASP  30           HA       ASP  30 -11.144  15.245  -0.351
  235   1HB   ASP  30          2HB       ASP  30 -12.673  14.286   1.798
  236   2HB   ASP  30          1HB       ASP  30 -11.356  15.187   2.542
  237    H    ALA  31           H        ALA  31  -8.908  13.526  -0.518
  238    HA   ALA  31           HA       ALA  31  -7.070  13.933   1.632
  239   1HB   ALA  31          1HB       ALA  31  -6.451  13.309  -1.264
  240   2HB   ALA  31          2HB       ALA  31  -6.866  12.100  -0.049
  241   3HB   ALA  31          3HB       ALA  31  -5.390  13.051   0.122
  242    H    GLU  32           H        GLU  32  -5.182  15.250   1.627
  243    HA   GLU  32           HA       GLU  32  -5.654  17.932   0.740
  244   1HB   GLU  32          2HB       GLU  32  -3.281  16.593   2.039
  245   2HB   GLU  32          1HB       GLU  32  -3.273  18.296   1.581
  246   1HG   GLU  32          2HG       GLU  32  -5.555  18.356   2.902
  247   2HG   GLU  32          1HG       GLU  32  -4.913  16.907   3.676
  248    H    ASP  33           H        ASP  33  -3.289  15.435  -0.175
  249    HA   ASP  33           HA       ASP  33  -2.484  17.039  -2.505
  250   1HB   ASP  33          2HB       ASP  33  -0.775  15.927  -0.980
  251   2HB   ASP  33          1HB       ASP  33  -1.327  14.386  -1.636
  252    H    GLY  34           H        GLY  34  -3.890  13.891  -1.667
  253   1HA   GLY  34          2HA       GLY  34  -5.693  13.054  -3.120
  254   2HA   GLY  34          1HA       GLY  34  -4.726  13.576  -4.495
  255    H    CYS  35           H        CYS  35  -3.822  11.799  -1.545
  256    HA   CYS  35           HA       CYS  35  -3.407   9.316  -2.990
  257   1HB   CYS  35          2HB       CYS  35  -0.935   9.454  -1.844
  258   2HB   CYS  35          1HB       CYS  35  -1.260   9.819  -3.537
  259    HG   CYS  35           HG       CYS  35  -0.844  11.954  -1.304
  260    H    ILE  36           H        ILE  36  -2.323   7.669  -1.420
  261    HA   ILE  36           HA       ILE  36  -3.602   8.039   1.220
  262    HB   ILE  36           HB       ILE  36  -3.511   5.562   1.395
  263   1HG1  ILE  36          2HG1      ILE  36  -3.144   4.849  -1.323
  264   2HG1  ILE  36          1HG1      ILE  36  -1.784   5.885  -0.897
  265   1HG2  ILE  36          1HG2      ILE  36  -5.333   5.147  -0.121
  266   2HG2  ILE  36          2HG2      ILE  36  -4.813   6.447  -1.192
  267   3HG2  ILE  36          3HG2      ILE  36  -5.467   6.826   0.402
  268   1HD1  ILE  36          1HD1      ILE  36  -2.386   3.997   1.235
  269   2HD1  ILE  36          2HD1      ILE  36  -0.863   4.290   0.399
  270   3HD1  ILE  36          3HD1      ILE  36  -2.042   3.172  -0.288
  271    H    SER  37           H        SER  37  -2.384   6.379   2.851
  272    HA   SER  37           HA       SER  37   0.327   7.470   3.044
  273   1HB   SER  37          2HB       SER  37  -1.429   7.422   4.968
  274   2HB   SER  37          1HB       SER  37  -0.961   5.732   5.127
  275    HG   SER  37           HG       SER  37   0.268   7.783   6.130
  276    H    THR  38           H        THR  38   2.149   6.266   3.007
  277    HA   THR  38           HA       THR  38   2.195   3.784   1.663
  278    HB   THR  38           HB       THR  38   4.587   3.663   2.534
  279    HG1  THR  38           HG1      THR  38   5.132   5.002   4.036
  280   1HG2  THR  38          1HG2      THR  38   4.344   4.599   0.396
  281   2HG2  THR  38          2HG2      THR  38   5.194   5.862   1.288
  282   3HG2  THR  38          3HG2      THR  38   3.457   5.995   1.007
  283    H    LYS  39           H        LYS  39   2.326   4.615   5.103
  284    HA   LYS  39           HA       LYS  39   2.713   1.926   6.019
  285   1HB   LYS  39          2HB       LYS  39   2.332   2.816   8.235
  286   2HB   LYS  39          1HB       LYS  39   3.335   3.956   7.339
  287   1HG   LYS  39          2HG       LYS  39   0.790   4.825   6.728
  288   2HG   LYS  39          1HG       LYS  39   0.611   4.293   8.400
  289   1HD   LYS  39          2HD       LYS  39   3.049   5.880   7.800
  290   2HD   LYS  39          1HD       LYS  39   1.519   6.756   7.721
  291   1HE   LYS  39          2HE       LYS  39   0.989   5.678  10.002
  292   2HE   LYS  39          1HE       LYS  39   2.704   5.274  10.071
  293   1HZ   LYS  39          1HZ       LYS  39   2.262   7.385  11.148
  294   2HZ   LYS  39          2HZ       LYS  39   1.574   8.001   9.722
  295   3HZ   LYS  39          3HZ       LYS  39   3.229   7.616   9.774
  296    H    GLU  40           H        GLU  40  -0.044   3.718   4.938
  297    HA   GLU  40           HA       GLU  40  -1.894   1.819   6.228
  298   1HB   GLU  40          2HB       GLU  40  -2.064   4.531   6.093
  299   2HB   GLU  40          1HB       GLU  40  -3.008   4.070   4.676
  300   1HG   GLU  40          2HG       GLU  40  -4.615   2.973   5.929
  301   2HG   GLU  40          1HG       GLU  40  -3.490   2.589   7.232
  302    H    LEU  41           H        LEU  41  -0.149   1.541   3.636
  303    HA   LEU  41           HA       LEU  41  -1.969   1.361   1.455
  304   1HB   LEU  41          2HB       LEU  41   0.761   1.117   1.751
  305   2HB   LEU  41          1HB       LEU  41   0.268  -0.521   1.380
  306    HG   LEU  41           HG       LEU  41  -0.346   1.919  -0.293
  307   1HD1  LEU  41          1HD1      LEU  41   1.565  -0.387  -0.779
  308   2HD1  LEU  41          2HD1      LEU  41   2.048   1.241  -0.301
  309   3HD1  LEU  41          3HD1      LEU  41   1.280   0.974  -1.865
  310   1HD2  LEU  41          1HD2      LEU  41  -0.711  -0.995  -1.022
  311   2HD2  LEU  41          2HD2      LEU  41  -1.334   0.422  -1.868
  312   3HD2  LEU  41          3HD2      LEU  41  -2.007  -0.037  -0.303
  313    H    GLY  42           H        GLY  42  -0.834  -0.936   3.886
  314   1HA   GLY  42          2HA       GLY  42  -1.956  -3.293   2.841
  315   2HA   GLY  42          1HA       GLY  42  -1.606  -3.004   4.540
  316    H    LYS  43           H        LYS  43  -3.508  -0.542   4.262
  317    HA   LYS  43           HA       LYS  43  -5.899  -1.989   5.072
  318   1HB   LYS  43          2HB       LYS  43  -5.421   0.997   4.910
  319   2HB   LYS  43          1HB       LYS  43  -6.760   0.193   5.728
  320   1HG   LYS  43          2HG       LYS  43  -3.845  -0.250   6.438
  321   2HG   LYS  43          1HG       LYS  43  -4.889   0.905   7.267
  322   1HD   LYS  43          2HD       LYS  43  -6.435  -0.924   7.874
  323   2HD   LYS  43          1HD       LYS  43  -5.387  -2.081   7.051
  324   1HE   LYS  43          2HE       LYS  43  -3.532  -1.033   8.625
  325   2HE   LYS  43          1HE       LYS  43  -4.925  -0.595   9.613
  326   1HZ   LYS  43          1HZ       LYS  43  -4.287  -3.332   8.649
  327   2HZ   LYS  43          2HZ       LYS  43  -5.615  -2.904   9.619
  328   3HZ   LYS  43          3HZ       LYS  43  -4.036  -2.760  10.225
  329    H    VAL  44           H        VAL  44  -4.885   0.218   2.468
  330    HA   VAL  44           HA       VAL  44  -7.476   0.373   1.264
  331    HB   VAL  44           HB       VAL  44  -6.294   1.378  -0.667
  332   1HG1  VAL  44          1HG1      VAL  44  -6.621   2.402   1.877
  333   2HG1  VAL  44          2HG1      VAL  44  -6.181   3.343   0.452
  334   3HG1  VAL  44          3HG1      VAL  44  -4.926   2.749   1.539
  335   1HG2  VAL  44          1HG2      VAL  44  -3.780   0.895   0.959
  336   2HG2  VAL  44          2HG2      VAL  44  -3.882   1.686  -0.613
  337   3HG2  VAL  44          3HG2      VAL  44  -4.226  -0.037  -0.470
  338    H    MET  45           H        MET  45  -4.638  -1.700   0.751
  339    HA   MET  45           HA       MET  45  -5.647  -2.967  -1.610
  340   1HB   MET  45          2HB       MET  45  -3.924  -4.683  -1.190
  341   2HB   MET  45          1HB       MET  45  -3.263  -3.055  -1.110
  342   1HG   MET  45          2HG       MET  45  -3.384  -3.117   1.347
  343   2HG   MET  45          1HG       MET  45  -4.078  -4.736   1.279
  344   1HE   MET  45          1HE       MET  45  -1.580  -2.418   0.176
  345   2HE   MET  45          2HE       MET  45  -0.238  -3.336  -0.501
  346   3HE   MET  45          3HE       MET  45  -0.252  -2.951   1.219
  347    H    ARG  46           H        ARG  46  -5.879  -3.605   1.822
  348    HA   ARG  46           HA       ARG  46  -6.921  -6.197   1.826
  349   1HB   ARG  46          2HB       ARG  46  -6.814  -3.966   3.704
  350   2HB   ARG  46          1HB       ARG  46  -8.296  -4.907   3.874
  351   1HG   ARG  46          2HG       ARG  46  -6.816  -6.988   3.860
  352   2HG   ARG  46          1HG       ARG  46  -5.443  -5.897   4.047
  353   1HD   ARG  46          2HD       ARG  46  -6.357  -5.024   6.122
  354   2HD   ARG  46          1HD       ARG  46  -7.834  -5.956   5.906
  355    HE   ARG  46           HE       ARG  46  -6.700  -7.863   6.634
  356   1HH1  ARG  46          2HH1      ARG  46  -4.461  -5.237   6.072
  357   2HH1  ARG  46          1HH1      ARG  46  -3.130  -6.048   6.823
  358   1HH2  ARG  46          1HH2      ARG  46  -4.938  -8.903   7.611
  359   2HH2  ARG  46          2HH2      ARG  46  -3.398  -8.117   7.690
  360    H    MET  47           H        MET  47  -8.578  -3.070   1.483
  361    HA   MET  47           HA       MET  47 -11.230  -4.059   1.400
  362   1HB   MET  47          2HB       MET  47  -9.871  -1.529   0.770
  363   2HB   MET  47          1HB       MET  47 -11.295  -1.838  -0.222
  364   1HG   MET  47          2HG       MET  47 -12.136  -0.719   1.692
  365   2HG   MET  47          1HG       MET  47 -12.491  -2.422   1.982
  366   1HE   MET  47          1HE       MET  47 -12.618  -3.008   3.931
  367   2HE   MET  47          2HE       MET  47 -12.565  -1.567   4.942
  368   3HE   MET  47          3HE       MET  47 -11.481  -2.914   5.282
  369    H    LEU  48           H        LEU  48  -8.747  -3.626  -1.077
  370    HA   LEU  48           HA       LEU  48 -10.354  -4.147  -3.354
  371   1HB   LEU  48          2HB       LEU  48  -7.533  -3.845  -2.743
  372   2HB   LEU  48          1HB       LEU  48  -7.794  -5.119  -3.912
  373    HG   LEU  48           HG       LEU  48  -8.942  -2.351  -4.257
  374   1HD1  LEU  48          1HD1      LEU  48  -6.324  -3.451  -5.317
  375   2HD1  LEU  48          2HD1      LEU  48  -6.472  -2.233  -4.049
  376   3HD1  LEU  48          3HD1      LEU  48  -7.011  -1.869  -5.688
  377   1HD2  LEU  48          1HD2      LEU  48  -9.868  -4.308  -5.551
  378   2HD2  LEU  48          2HD2      LEU  48  -8.266  -4.521  -6.259
  379   3HD2  LEU  48          3HD2      LEU  48  -9.174  -3.039  -6.561
  380    H    GLY  49           H        GLY  49  -8.339  -6.251  -1.308
  381   1HA   GLY  49          2HA       GLY  49  -9.594  -8.484  -0.931
  382   2HA   GLY  49          1HA       GLY  49  -9.420  -8.632  -2.678
  383    H    GLN  50           H        GLN  50  -7.329  -7.689   0.064
  384    HA   GLN  50           HA       GLN  50  -5.415  -9.792  -0.673
  385   1HB   GLN  50          2HB       GLN  50  -4.940  -6.867  -0.916
  386   2HB   GLN  50          1HB       GLN  50  -3.648  -7.818  -0.181
  387   1HG   GLN  50          2HG       GLN  50  -3.684  -9.352  -2.128
  388   2HG   GLN  50          1HG       GLN  50  -4.941  -8.362  -2.871
  389   1HE2  GLN  50          1HE2      GLN  50  -4.326  -6.265  -3.733
  390   2HE2  GLN  50          2HE2      GLN  50  -2.699  -5.814  -3.904
  391    H    ASN  51           H        ASN  51  -3.994 -10.378   1.007
  392    HA   ASN  51           HA       ASN  51  -4.280  -9.066   3.604
  393   1HB   ASN  51          2HB       ASN  51  -6.056 -10.990   3.216
  394   2HB   ASN  51          1HB       ASN  51  -4.683 -12.033   3.586
  395   1HD2  ASN  51          1HD2      ASN  51  -3.782 -11.941   5.758
  396   2HD2  ASN  51          2HD2      ASN  51  -4.590 -11.145   7.021
  397    HA   PRO  52           HA       PRO  52  -0.074 -10.822   2.759
  398   1HB   PRO  52          2HB       PRO  52   1.267  -8.440   2.794
  399   2HB   PRO  52          1HB       PRO  52   0.525  -9.125   1.341
  400   1HG   PRO  52          2HG       PRO  52  -0.353  -6.847   3.003
  401   2HG   PRO  52          1HG       PRO  52  -0.673  -7.186   1.296
  402   1HD   PRO  52          2HD       PRO  52  -2.457  -7.603   3.477
  403   2HD   PRO  52          1HD       PRO  52  -2.684  -8.142   1.797
  404    H    THR  53           H        THR  53   2.093  -9.826   3.996
  405    HA   THR  53           HA       THR  53   1.386  -9.859   6.870
  406    HB   THR  53           HB       THR  53   3.425 -10.947   7.303
  407    HG1  THR  53           HG1      THR  53   5.190 -10.577   6.198
  408   1HG2  THR  53          1HG2      THR  53   3.607 -12.789   5.694
  409   2HG2  THR  53          2HG2      THR  53   2.668 -11.865   4.520
  410   3HG2  THR  53          3HG2      THR  53   1.915 -12.411   6.019
  411    HA   PRO  54           HA       PRO  54   3.186  -5.865   7.421
  412   1HB   PRO  54          2HB       PRO  54   4.921  -6.137   9.526
  413   2HB   PRO  54          1HB       PRO  54   3.158  -6.109   9.692
  414   1HG   PRO  54          2HG       PRO  54   5.034  -8.408   9.835
  415   2HG   PRO  54          1HG       PRO  54   3.482  -8.166  10.649
  416   1HD   PRO  54          2HD       PRO  54   3.889  -9.779   8.400
  417   2HD   PRO  54          1HD       PRO  54   2.311  -9.167   8.946
  418    H    GLU  55           H        GLU  55   5.497  -8.471   7.105
  419    HA   GLU  55           HA       GLU  55   7.737  -6.737   6.450
  420   1HB   GLU  55          2HB       GLU  55   7.594  -9.723   6.006
  421   2HB   GLU  55          1HB       GLU  55   9.027  -8.724   6.231
  422   1HG   GLU  55          2HG       GLU  55   6.909  -9.287   8.331
  423   2HG   GLU  55          1HG       GLU  55   8.528  -9.981   8.286
  424    H    GLU  56           H        GLU  56   5.530  -8.966   4.771
  425    HA   GLU  56           HA       GLU  56   6.660  -8.734   2.187
  426   1HB   GLU  56          2HB       GLU  56   3.937  -9.536   3.190
  427   2HB   GLU  56          1HB       GLU  56   4.270  -9.412   1.461
  428   1HG   GLU  56          2HG       GLU  56   6.344 -10.888   1.973
  429   2HG   GLU  56          1HG       GLU  56   5.524 -11.259   3.488
  430    H    LEU  57           H        LEU  57   3.870  -7.041   3.672
  431    HA   LEU  57           HA       LEU  57   3.264  -5.429   1.448
  432   1HB   LEU  57          2HB       LEU  57   1.554  -5.000   2.797
  433   2HB   LEU  57          1HB       LEU  57   2.408  -5.658   4.169
  434    HG   LEU  57           HG       LEU  57   3.015  -2.857   3.314
  435   1HD1  LEU  57          1HD1      LEU  57   0.650  -3.602   5.051
  436   2HD1  LEU  57          2HD1      LEU  57   0.504  -3.145   3.354
  437   3HD1  LEU  57          3HD1      LEU  57   1.124  -1.985   4.528
  438   1HD2  LEU  57          1HD2      LEU  57   4.091  -2.863   5.296
  439   2HD2  LEU  57          2HD2      LEU  57   3.692  -4.572   5.462
  440   3HD2  LEU  57          3HD2      LEU  57   2.617  -3.346   6.134
  441    H    GLN  58           H        GLN  58   5.546  -4.969   4.111
  442    HA   GLN  58           HA       GLN  58   6.223  -2.280   3.650
  443   1HB   GLN  58          2HB       GLN  58   6.941  -3.835   5.597
  444   2HB   GLN  58          1HB       GLN  58   8.262  -4.314   4.532
  445   1HG   GLN  58          2HG       GLN  58   9.054  -2.488   5.907
  446   2HG   GLN  58          1HG       GLN  58   8.833  -1.869   4.270
  447   1HE2  GLN  58          1HE2      GLN  58   7.045  -0.383   3.885
  448   2HE2  GLN  58          2HE2      GLN  58   6.191   0.326   5.168
  449    H    GLU  59           H        GLU  59   7.644  -5.271   2.335
  450    HA   GLU  59           HA       GLU  59   9.665  -4.065   0.776
  451   1HB   GLU  59          2HB       GLU  59   8.186  -6.683   0.498
  452   2HB   GLU  59          1HB       GLU  59   9.469  -6.202  -0.612
  453   1HG   GLU  59          2HG       GLU  59  11.114  -6.246   1.063
  454   2HG   GLU  59          1HG       GLU  59   9.928  -6.118   2.363
  455    H    MET  60           H        MET  60   6.245  -4.678   0.132
  456    HA   MET  60           HA       MET  60   6.338  -4.052  -2.656
  457   1HB   MET  60          2HB       MET  60   4.098  -4.196  -0.638
  458   2HB   MET  60          1HB       MET  60   3.817  -3.684  -2.302
  459   1HG   MET  60          2HG       MET  60   4.759  -5.790  -3.134
  460   2HG   MET  60          1HG       MET  60   5.111  -6.301  -1.484
  461   1HE   MET  60          1HE       MET  60   3.674  -7.384  -3.929
  462   2HE   MET  60          2HE       MET  60   2.185  -6.507  -4.273
  463   3HE   MET  60          3HE       MET  60   2.108  -8.091  -3.504
  464    H    ILE  61           H        ILE  61   5.381  -2.187   0.239
  465    HA   ILE  61           HA       ILE  61   4.616   0.202  -0.924
  466    HB   ILE  61           HB       ILE  61   6.071  -0.351   1.665
  467   1HG1  ILE  61          2HG1      ILE  61   3.266   0.615   1.493
  468   2HG1  ILE  61          1HG1      ILE  61   3.568  -1.033   0.945
  469   1HG2  ILE  61          1HG2      ILE  61   4.910   2.236   0.605
  470   2HG2  ILE  61          2HG2      ILE  61   6.559   1.940   1.158
  471   3HG2  ILE  61          3HG2      ILE  61   5.228   1.949   2.316
  472   1HD1  ILE  61          1HD1      ILE  61   4.471   0.064   3.621
  473   2HD1  ILE  61          2HD1      ILE  61   4.600  -1.604   3.061
  474   3HD1  ILE  61          3HD1      ILE  61   3.014  -0.902   3.380
  475    H    ASP  62           H        ASP  62   7.843  -0.285   0.513
  476    HA   ASP  62           HA       ASP  62   9.089   1.958  -0.516
  477   1HB   ASP  62          2HB       ASP  62  10.268  -0.759   0.095
  478   2HB   ASP  62          1HB       ASP  62  11.230   0.676  -0.249
  479    H    GLU  63           H        GLU  63   8.707  -1.224  -2.064
  480    HA   GLU  63           HA       GLU  63  10.386  -0.678  -4.298
  481   1HB   GLU  63          2HB       GLU  63   8.286  -2.725  -3.697
  482   2HB   GLU  63          1HB       GLU  63   8.870  -2.551  -5.351
  483   1HG   GLU  63          2HG       GLU  63  10.986  -2.600  -3.283
  484   2HG   GLU  63          1HG       GLU  63  10.089  -4.107  -3.467
  485    H    VAL  64           H        VAL  64   6.824  -0.529  -3.931
  486    HA   VAL  64           HA       VAL  64   6.377   0.392  -6.597
  487    HB   VAL  64           HB       VAL  64   4.093   0.802  -5.943
  488   1HG1  VAL  64          1HG1      VAL  64   4.119  -1.502  -4.304
  489   2HG1  VAL  64          2HG1      VAL  64   5.488  -1.667  -5.402
  490   3HG1  VAL  64          3HG1      VAL  64   3.865  -1.432  -6.047
  491   1HG2  VAL  64          1HG2      VAL  64   4.674   1.931  -3.765
  492   2HG2  VAL  64          2HG2      VAL  64   4.953   0.333  -3.075
  493   3HG2  VAL  64          3HG2      VAL  64   3.345   0.778  -3.642
  494    H    ASP  65           H        ASP  65   7.123   2.040  -3.587
  495    HA   ASP  65           HA       ASP  65   6.262   4.638  -4.439
  496   1HB   ASP  65          2HB       ASP  65   7.020   3.614  -2.020
  497   2HB   ASP  65          1HB       ASP  65   8.457   4.528  -2.467
  498    H    GLU  66           H        GLU  66   7.142   4.719  -6.551
  499    HA   GLU  66           HA       GLU  66   9.812   4.454  -7.286
  500   1HB   GLU  66          2HB       GLU  66   9.263   5.793  -9.242
  501   2HB   GLU  66          1HB       GLU  66   7.934   4.697  -8.874
  502   1HG   GLU  66          2HG       GLU  66   7.160   6.846  -7.420
  503   2HG   GLU  66          1HG       GLU  66   8.038   7.662  -8.711
  504    H    ASP  67           H        ASP  67   8.163   7.261  -5.895
  505    HA   ASP  67           HA       ASP  67  10.572   8.899  -6.118
  506   1HB   ASP  67          2HB       ASP  67   9.118  10.633  -4.951
  507   2HB   ASP  67          1HB       ASP  67   8.589  10.129  -6.552
  508    H    GLY  68           H        GLY  68   8.567   7.443  -3.568
  509   1HA   GLY  68          2HA       GLY  68   9.156   6.755  -1.439
  510   2HA   GLY  68          1HA       GLY  68  10.822   7.219  -1.788
  511    H    SER  69           H        SER  69   7.720   8.982  -1.668
  512    HA   SER  69           HA       SER  69   9.023  11.158  -0.204
  513   1HB   SER  69          2HB       SER  69   6.885  12.371  -0.593
  514   2HB   SER  69          1HB       SER  69   7.637  11.824  -2.088
  515    HG   SER  69           HG       SER  69   6.035  10.469  -2.396
  516    H    GLY  70           H        GLY  70   6.067   9.179   0.078
  517   1HA   GLY  70          2HA       GLY  70   6.192   8.311   2.637
  518   2HA   GLY  70          1HA       GLY  70   5.650   9.974   2.837
  519    H    THR  71           H        THR  71   4.182   9.907   0.239
  520    HA   THR  71           HA       THR  71   1.828   8.386   1.169
  521    HB   THR  71           HB       THR  71   0.487   9.940  -0.179
  522    HG1  THR  71           HG1      THR  71   1.544  11.682  -1.181
  523   1HG2  THR  71          1HG2      THR  71   0.988  12.016   1.125
  524   2HG2  THR  71          2HG2      THR  71   2.485  11.263   1.678
  525   3HG2  THR  71          3HG2      THR  71   0.927  10.567   2.129
  526    H    VAL  72           H        VAL  72   0.572   7.221  -0.344
  527    HA   VAL  72           HA       VAL  72   2.120   6.311  -2.688
  528    HB   VAL  72           HB       VAL  72  -0.246   4.969  -1.359
  529   1HG1  VAL  72          1HG1      VAL  72   0.301   4.523  -3.834
  530   2HG1  VAL  72          2HG1      VAL  72   0.221   3.116  -2.774
  531   3HG1  VAL  72          3HG1      VAL  72   1.787   3.773  -3.249
  532   1HG2  VAL  72          1HG2      VAL  72   2.737   4.474  -1.104
  533   2HG2  VAL  72          2HG2      VAL  72   1.492   3.380  -0.501
  534   3HG2  VAL  72          3HG2      VAL  72   1.645   5.000   0.177
  535    H    ASP  73           H        ASP  73   1.568   7.285  -4.505
  536    HA   ASP  73           HA       ASP  73  -1.105   8.375  -4.893
  537   1HB   ASP  73          2HB       ASP  73   1.395   8.404  -6.596
  538   2HB   ASP  73          1HB       ASP  73  -0.142   9.084  -7.128
  539    H    PHE  74           H        PHE  74  -1.831   7.997  -7.377
  540    HA   PHE  74           HA       PHE  74  -2.736   5.316  -7.459
  541   1HB   PHE  74          2HB       PHE  74  -3.698   7.500  -8.586
  542   2HB   PHE  74          1HB       PHE  74  -2.705   6.975  -9.948
  543    HD1  PHE  74           HD1      PHE  74  -4.038   5.914 -11.541
  544    HD2  PHE  74           HD2      PHE  74  -4.696   5.109  -7.379
  545    HE1  PHE  74           HE1      PHE  74  -5.741   4.214 -12.140
  546    HE2  PHE  74           HE2      PHE  74  -6.415   3.424  -7.973
  547    HZ   PHE  74           HZ       PHE  74  -6.940   2.977 -10.355
  548    H    ASP  75           H        ASP  75  -0.065   6.962  -9.160
  549    HA   ASP  75           HA       ASP  75   0.531   4.877 -10.976
  550   1HB   ASP  75          2HB       ASP  75   1.925   7.275  -9.960
  551   2HB   ASP  75          1HB       ASP  75   2.994   5.968 -10.468
  552    H    GLU  76           H        GLU  76   1.439   5.440  -7.622
  553    HA   GLU  76           HA       GLU  76   3.247   3.179  -7.495
  554   1HB   GLU  76          2HB       GLU  76   2.039   4.608  -5.128
  555   2HB   GLU  76          1HB       GLU  76   3.585   3.768  -5.230
  556   1HG   GLU  76          2HG       GLU  76   4.499   5.473  -6.675
  557   2HG   GLU  76          1HG       GLU  76   2.922   6.249  -6.844
  558    H    PHE  77           H        PHE  77  -0.124   3.849  -6.981
  559    HA   PHE  77           HA       PHE  77  -0.733   1.488  -5.445
  560   1HB   PHE  77          2HB       PHE  77  -2.062   3.600  -5.349
  561   2HB   PHE  77          1HB       PHE  77  -2.563   3.330  -7.014
  562    HD1  PHE  77           HD1      PHE  77  -2.768   2.019  -3.545
  563    HD2  PHE  77           HD2      PHE  77  -4.250   1.726  -7.577
  564    HE1  PHE  77           HE1      PHE  77  -4.634   0.588  -2.757
  565    HE2  PHE  77           HE2      PHE  77  -6.116   0.292  -6.778
  566    HZ   PHE  77           HZ       PHE  77  -6.306  -0.272  -4.371
  567    H    LEU  78           H        LEU  78  -0.531   2.310  -8.844
  568    HA   LEU  78           HA       LEU  78  -1.981  -0.063  -9.717
  569   1HB   LEU  78          2HB       LEU  78  -0.521   2.107 -11.208
  570   2HB   LEU  78          1HB       LEU  78  -1.238   0.725 -12.001
  571    HG   LEU  78           HG       LEU  78  -3.287   1.674 -11.983
  572   1HD1  LEU  78          1HD1      LEU  78  -4.457   2.172 -10.089
  573   2HD1  LEU  78          2HD1      LEU  78  -3.128   3.073  -9.369
  574   3HD1  LEU  78          3HD1      LEU  78  -3.124   1.312  -9.330
  575   1HD2  LEU  78          1HD2      LEU  78  -2.411   4.255 -10.878
  576   2HD2  LEU  78          2HD2      LEU  78  -3.101   3.879 -12.455
  577   3HD2  LEU  78          3HD2      LEU  78  -1.381   3.628 -12.162
  578    H    VAL  79           H        VAL  79   1.374   1.100  -9.606
  579    HA   VAL  79           HA       VAL  79   2.577  -0.928 -11.116
  580    HB   VAL  79           HB       VAL  79   4.640  -0.486  -9.721
  581   1HG1  VAL  79          1HG1      VAL  79   4.709   0.813 -11.601
  582   2HG1  VAL  79          2HG1      VAL  79   4.487   2.109 -10.427
  583   3HG1  VAL  79          3HG1      VAL  79   3.102   1.486 -11.326
  584   1HG2  VAL  79          1HG2      VAL  79   4.539   1.472  -8.210
  585   2HG2  VAL  79          2HG2      VAL  79   3.518   0.153  -7.634
  586   3HG2  VAL  79          3HG2      VAL  79   2.791   1.543  -8.436
  587    H    MET  80           H        MET  80   1.379  -0.975  -7.831
  588    HA   MET  80           HA       MET  80   2.716  -3.045  -6.631
  589   1HB   MET  80          2HB       MET  80  -0.018  -1.965  -6.465
  590   2HB   MET  80          1HB       MET  80   0.151  -3.624  -5.892
  591   1HG   MET  80          2HG       MET  80   2.281  -2.636  -4.663
  592   2HG   MET  80          1HG       MET  80   1.407  -1.115  -4.840
  593   1HE   MET  80          1HE       MET  80  -1.900  -1.635  -3.030
  594   2HE   MET  80          2HE       MET  80  -1.597  -1.917  -4.742
  595   3HE   MET  80          3HE       MET  80  -0.823  -0.559  -3.931
  596    H    MET  81           H        MET  81   0.310  -3.326  -9.209
  597    HA   MET  81           HA       MET  81   0.123  -6.207  -8.996
  598   1HB   MET  81          2HB       MET  81  -0.913  -4.197 -10.991
  599   2HB   MET  81          1HB       MET  81  -1.093  -5.934 -11.233
  600   1HG   MET  81          2HG       MET  81  -1.915  -4.730  -8.609
  601   2HG   MET  81          1HG       MET  81  -2.988  -4.582 -10.000
  602   1HE   MET  81          1HE       MET  81  -2.803  -7.898  -7.147
  603   2HE   MET  81          2HE       MET  81  -3.100  -6.164  -7.043
  604   3HE   MET  81          3HE       MET  81  -1.460  -6.756  -7.294
  605    H    VAL  82           H        VAL  82   1.662  -3.913 -11.247
  606    HA   VAL  82           HA       VAL  82   2.754  -5.999 -12.903
  607    HB   VAL  82           HB       VAL  82   4.056  -4.100 -13.953
  608   1HG1  VAL  82          1HG1      VAL  82   1.121  -3.449 -13.786
  609   2HG1  VAL  82          2HG1      VAL  82   1.661  -4.958 -14.521
  610   3HG1  VAL  82          3HG1      VAL  82   2.185  -3.414 -15.192
  611   1HG2  VAL  82          1HG2      VAL  82   3.630  -1.863 -13.294
  612   2HG2  VAL  82          2HG2      VAL  82   3.912  -2.716 -11.776
  613   3HG2  VAL  82          3HG2      VAL  82   2.265  -2.333 -12.279
  614    H    ARG  83           H        ARG  83   4.012  -4.103 -10.186
  615    HA   ARG  83           HA       ARG  83   6.755  -4.566 -10.544
  616   1HB   ARG  83          2HB       ARG  83   6.948  -4.325  -8.050
  617   2HB   ARG  83          1HB       ARG  83   6.082  -3.016  -8.845
  618   1HG   ARG  83          2HG       ARG  83   4.575  -3.419  -7.165
  619   2HG   ARG  83          1HG       ARG  83   3.992  -4.624  -8.308
  620   1HD   ARG  83          2HD       ARG  83   4.297  -5.526  -6.003
  621   2HD   ARG  83          1HD       ARG  83   5.261  -6.367  -7.208
  622    HE   ARG  83           HE       ARG  83   6.634  -4.205  -5.820
  623   1HH1  ARG  83          2HH1      ARG  83   5.870  -7.615  -5.920
  624   2HH1  ARG  83          1HH1      ARG  83   7.229  -8.073  -4.952
  625   1HH2  ARG  83          1HH2      ARG  83   8.402  -4.836  -4.553
  626   2HH2  ARG  83          2HH2      ARG  83   8.658  -6.505  -4.180
  627    H    CYS  84           H        CYS  84   4.255  -6.778  -9.613
  628    HA   CYS  84           HA       CYS  84   5.855  -8.702  -8.257
  629   1HB   CYS  84          2HB       CYS  84   3.211  -8.900  -9.699
  630   2HB   CYS  84          1HB       CYS  84   3.963 -10.277  -8.894
  631    HG   CYS  84           HG       CYS  84   3.157  -9.384  -6.736
  632    H    MET  85           H        MET  85   5.632  -7.851 -11.598
  633    HA   MET  85           HA       MET  85   6.174 -10.349 -12.809
  634   1HB   MET  85          2HB       MET  85   5.694  -7.801 -13.736
  635   2HB   MET  85          1HB       MET  85   7.399  -8.026 -14.127
  636   1HG   MET  85          2HG       MET  85   6.401 -10.438 -14.883
  637   2HG   MET  85          1HG       MET  85   5.012  -9.403 -15.213
  638   1HE   MET  85          1HE       MET  85   6.430 -10.971 -17.541
  639   2HE   MET  85          2HE       MET  85   6.351  -9.695 -18.753
  640   3HE   MET  85          3HE       MET  85   5.019  -9.907 -17.620
  641    H    LYS  86           H        LYS  86   8.410  -7.642 -12.112
  642    HA   LYS  86           HA       LYS  86  10.555  -9.620 -11.666
  643   1HB   LYS  86          2HB       LYS  86  10.559  -7.292 -13.554
  644   2HB   LYS  86          1HB       LYS  86  12.060  -7.756 -12.752
  645   1HG   LYS  86          2HG       LYS  86  10.333  -9.775 -14.197
  646   2HG   LYS  86          1HG       LYS  86  11.582  -8.851 -15.031
  647   1HD   LYS  86          2HD       LYS  86  13.222  -9.670 -13.283
  648   2HD   LYS  86          1HD       LYS  86  11.956 -10.750 -12.699
  649   1HE   LYS  86          2HE       LYS  86  12.616 -10.753 -15.625
  650   2HE   LYS  86          1HE       LYS  86  13.698 -11.587 -14.510
  651   1HZ   LYS  86          1HZ       LYS  86  11.983 -13.065 -15.353
  652   2HZ   LYS  86          2HZ       LYS  86  10.771 -12.042 -14.745
  653   3HZ   LYS  86          3HZ       LYS  86  11.816 -12.851 -13.679
  654    H    ASP  87           H        ASP  87  12.051  -9.081 -10.111
  655    HA   ASP  87           HA       ASP  87  11.496  -6.601  -8.587
  656   1HB   ASP  87          2HB       ASP  87  12.040  -9.405  -7.660
  657   2HB   ASP  87          1HB       ASP  87  12.493  -8.039  -6.640
  658    H    ASP  88           H        ASP  88  13.083  -5.217  -8.986
  659    HA   ASP  88           HA       ASP  88  15.853  -6.227  -9.219
  660   1HB   ASP  88          2HB       ASP  88  14.604  -3.633 -10.165
  661   2HB   ASP  88          1HB       ASP  88  16.324  -4.003 -10.273
  662    H    SER  89           HN       SER  89  15.117  -6.270  -6.687
  663    HA   SER  89           HA       SER  89  16.094  -3.747  -5.490
  664   1HB   SER  89          2HB       SER  89  13.730  -4.942  -4.940
  665   2HB   SER  89          1HB       SER  89  14.756  -5.752  -3.760
  666    HG   SER  89           HG       SER  89  14.555  -3.977  -2.656
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1  15.942   2.190 -15.262
    2   2H    MET   1          2H        MET   1  14.679   3.103 -15.944
    3   3H    MET   1          3H        MET   1  16.287   3.375 -16.428
    4    HA   MET   1           HA       MET   1  15.051   2.111 -18.096
    5   1HB   MET   1          2HB       MET   1  17.579   1.767 -17.432
    6   2HB   MET   1          1HB       MET   1  17.008   0.204 -16.848
    7   1HG   MET   1          2HG       MET   1  16.097  -0.334 -19.044
    8   2HG   MET   1          1HG       MET   1  16.524   1.268 -19.645
    9   1HE   MET   1          1HE       MET   1  18.946  -0.550 -21.697
   10   2HE   MET   1          2HE       MET   1  17.259  -0.099 -21.464
   11   3HE   MET   1          3HE       MET   1  17.795  -1.724 -21.044
   12    H    ASN   2           H        ASN   2  13.144   1.103 -18.138
   13    HA   ASN   2           HA       ASN   2  12.804  -1.459 -16.832
   14   1HB   ASN   2          2HB       ASN   2  11.996   0.778 -15.384
   15   2HB   ASN   2          1HB       ASN   2  10.512   0.203 -16.140
   16   1HD2  ASN   2          1HD2      ASN   2  13.401  -1.401 -14.645
   17   2HD2  ASN   2          2HD2      ASN   2  12.484  -2.465 -13.695
   18    H    ASP   3           H        ASP   3  11.665  -2.732 -18.133
   19    HA   ASP   3           HA       ASP   3   9.824  -1.484 -20.096
   20   1HB   ASP   3          2HB       ASP   3  10.410  -3.380 -21.615
   21   2HB   ASP   3          1HB       ASP   3  11.758  -2.295 -21.285
   22    H    ILE   4           H        ILE   4   9.534  -2.924 -17.338
   23    HA   ILE   4           HA       ILE   4   7.900  -5.224 -18.040
   24    HB   ILE   4           HB       ILE   4   7.554  -5.518 -15.663
   25   1HG1  ILE   4          2HG1      ILE   4   8.846  -3.739 -14.184
   26   2HG1  ILE   4          1HG1      ILE   4   8.529  -2.683 -15.563
   27   1HG2  ILE   4          1HG2      ILE   4  10.357  -4.777 -16.500
   28   2HG2  ILE   4          2HG2      ILE   4   9.652  -6.384 -16.331
   29   3HG2  ILE   4          3HG2      ILE   4  10.012  -5.425 -14.896
   30   1HD1  ILE   4          1HD1      ILE   4   6.769  -3.113 -13.504
   31   2HD1  ILE   4          2HD1      ILE   4   6.210  -4.282 -14.699
   32   3HD1  ILE   4          3HD1      ILE   4   6.305  -2.574 -15.118
   33    H    TYR   5           H        TYR   5   7.450  -1.836 -17.352
   34    HA   TYR   5           HA       TYR   5   4.711  -1.887 -16.611
   35   1HB   TYR   5          2HB       TYR   5   6.209   0.330 -18.037
   36   2HB   TYR   5          1HB       TYR   5   4.702   0.492 -17.136
   37    HD1  TYR   5           HD1      TYR   5   8.135   0.985 -16.916
   38    HD2  TYR   5           HD2      TYR   5   4.866  -0.657 -14.672
   39    HE1  TYR   5           HE1      TYR   5   9.422   1.289 -14.821
   40    HE2  TYR   5           HE2      TYR   5   6.152  -0.348 -12.570
   41    HH   TYR   5           HH       TYR   5   8.377   1.529 -12.039
   42    H    LYS   6           H        LYS   6   6.386  -1.844 -19.689
   43    HA   LYS   6           HA       LYS   6   3.982  -1.411 -21.258
   44   1HB   LYS   6          2HB       LYS   6   6.608  -2.477 -22.303
   45   2HB   LYS   6          1HB       LYS   6   5.368  -1.584 -23.181
   46   1HG   LYS   6          2HG       LYS   6   7.279  -0.544 -21.081
   47   2HG   LYS   6          1HG       LYS   6   7.093   0.002 -22.747
   48   1HD   LYS   6          2HD       LYS   6   4.928   0.958 -22.272
   49   2HD   LYS   6          1HD       LYS   6   4.901   0.226 -20.667
   50   1HE   LYS   6          2HE       LYS   6   6.525   1.694 -19.827
   51   2HE   LYS   6          1HE       LYS   6   7.129   2.100 -21.433
   52   1HZ   LYS   6          1HZ       LYS   6   5.814   3.900 -20.509
   53   2HZ   LYS   6          2HZ       LYS   6   4.476   2.867 -20.333
   54   3HZ   LYS   6          3HZ       LYS   6   5.055   3.257 -21.883
   55    H    ALA   7           H        ALA   7   6.033  -4.108 -20.317
   56    HA   ALA   7           HA       ALA   7   4.635  -6.077 -21.887
   57   1HB   ALA   7          1HB       ALA   7   5.870  -7.666 -20.259
   58   2HB   ALA   7          2HB       ALA   7   6.659  -6.203 -19.666
   59   3HB   ALA   7          3HB       ALA   7   6.841  -6.680 -21.354
   60    H    ALA   8           H        ALA   8   4.213  -4.676 -18.706
   61    HA   ALA   8           HA       ALA   8   2.422  -6.781 -17.796
   62   1HB   ALA   8          1HB       ALA   8   3.333  -4.174 -16.567
   63   2HB   ALA   8          2HB       ALA   8   3.787  -5.812 -16.094
   64   3HB   ALA   8          3HB       ALA   8   2.146  -5.236 -15.810
   65    H    VAL   9           H        VAL   9   2.194  -3.420 -18.955
   66    HA   VAL   9           HA       VAL   9  -0.493  -2.939 -18.342
   67    HB   VAL   9           HB       VAL   9   1.271  -1.322 -19.307
   68   1HG1  VAL   9          1HG1      VAL   9   0.004  -2.024 -21.945
   69   2HG1  VAL   9          2HG1      VAL   9   1.465  -2.854 -21.413
   70   3HG1  VAL   9          3HG1      VAL   9   1.477  -1.105 -21.631
   71   1HG2  VAL   9          1HG2      VAL   9  -0.897  -0.489 -18.786
   72   2HG2  VAL   9          2HG2      VAL   9  -1.642  -1.380 -20.113
   73   3HG2  VAL   9          3HG2      VAL   9  -0.603   0.005 -20.453
   74    H    GLU  10           H        GLU  10   0.916  -4.776 -20.997
   75    HA   GLU  10           HA       GLU  10  -1.541  -5.029 -22.479
   76   1HB   GLU  10          2HB       GLU  10   1.095  -6.504 -22.623
   77   2HB   GLU  10          1HB       GLU  10  -0.266  -6.846 -23.692
   78   1HG   GLU  10          2HG       GLU  10  -0.221  -4.632 -24.607
   79   2HG   GLU  10          1HG       GLU  10   0.902  -4.072 -23.368
   80    H    GLN  11           H        GLN  11  -0.154  -6.641 -19.742
   81    HA   GLN  11           HA       GLN  11  -1.712  -9.076 -20.086
   82   1HB   GLN  11          2HB       GLN  11  -0.052  -8.165 -17.724
   83   2HB   GLN  11          1HB       GLN  11  -0.715  -9.780 -17.970
   84   1HG   GLN  11          2HG       GLN  11   1.089  -8.532 -20.039
   85   2HG   GLN  11          1HG       GLN  11   1.766  -9.351 -18.633
   86   1HE2  GLN  11          1HE2      GLN  11   0.130  -9.839 -21.697
   87   2HE2  GLN  11          2HE2      GLN  11   0.134 -11.535 -21.644
   88    H    LEU  12           H        LEU  12  -1.692  -6.222 -17.985
   89    HA   LEU  12           HA       LEU  12  -3.937  -7.043 -16.406
   90   1HB   LEU  12          2HB       LEU  12  -2.806  -4.279 -16.822
   91   2HB   LEU  12          1HB       LEU  12  -3.926  -4.753 -15.565
   92    HG   LEU  12           HG       LEU  12  -1.589  -6.434 -15.448
   93   1HD1  LEU  12          1HD1      LEU  12  -0.896  -3.559 -14.941
   94   2HD1  LEU  12          2HD1      LEU  12  -0.760  -4.194 -16.582
   95   3HD1  LEU  12          3HD1      LEU  12   0.169  -4.926 -15.275
   96   1HD2  LEU  12          1HD2      LEU  12  -1.607  -5.741 -13.156
   97   2HD2  LEU  12          2HD2      LEU  12  -3.297  -5.800 -13.653
   98   3HD2  LEU  12          3HD2      LEU  12  -2.464  -4.249 -13.541
   99    H    THR  13           H        THR  13  -5.997  -5.946 -16.330
  100    HA   THR  13           HA       THR  13  -6.919  -5.080 -19.011
  101    HB   THR  13           HB       THR  13  -9.226  -5.777 -17.829
  102    HG1  THR  13           HG1      THR  13  -8.525  -6.567 -15.947
  103   1HG2  THR  13          1HG2      THR  13  -7.264  -7.678 -19.134
  104   2HG2  THR  13          2HG2      THR  13  -8.409  -6.627 -19.967
  105   3HG2  THR  13          3HG2      THR  13  -8.998  -7.960 -18.973
  106    H    ASP  14           H        ASP  14  -8.904  -3.687 -18.925
  107    HA   ASP  14           HA       ASP  14  -8.393  -1.306 -17.484
  108   1HB   ASP  14          2HB       ASP  14  -9.744  -1.579 -19.648
  109   2HB   ASP  14          1HB       ASP  14 -11.085  -2.071 -18.612
  110    H    GLU  15           H        GLU  15 -10.355  -4.132 -16.808
  111    HA   GLU  15           HA       GLU  15 -12.040  -3.138 -14.797
  112   1HB   GLU  15          2HB       GLU  15 -10.864  -5.872 -15.288
  113   2HB   GLU  15          1HB       GLU  15 -11.946  -5.555 -13.935
  114   1HG   GLU  15          2HG       GLU  15 -13.487  -6.191 -15.547
  115   2HG   GLU  15          1HG       GLU  15 -13.451  -4.449 -15.819
  116    H    GLN  16           H        GLN  16  -8.767  -4.540 -14.563
  117    HA   GLN  16           HA       GLN  16  -8.527  -4.416 -11.749
  118   1HB   GLN  16          2HB       GLN  16  -6.558  -4.549 -14.012
  119   2HB   GLN  16          1HB       GLN  16  -5.982  -4.251 -12.370
  120   1HG   GLN  16          2HG       GLN  16  -7.482  -6.295 -11.737
  121   2HG   GLN  16          1HG       GLN  16  -7.409  -6.668 -13.459
  122   1HE2  GLN  16          1HE2      GLN  16  -5.629  -7.904 -14.084
  123   2HE2  GLN  16          2HE2      GLN  16  -4.183  -8.036 -13.206
  124    H    LYS  17           H        LYS  17  -7.610  -2.099 -14.293
  125    HA   LYS  17           HA       LYS  17  -6.488  -0.159 -12.538
  126   1HB   LYS  17          2HB       LYS  17  -7.356  -0.209 -15.388
  127   2HB   LYS  17          1HB       LYS  17  -7.200   1.370 -14.615
  128   1HG   LYS  17          2HG       LYS  17  -5.020   1.101 -15.320
  129   2HG   LYS  17          1HG       LYS  17  -4.905   0.297 -13.754
  130   1HD   LYS  17          2HD       LYS  17  -4.934  -1.842 -14.698
  131   2HD   LYS  17          1HD       LYS  17  -5.711  -1.285 -16.181
  132   1HE   LYS  17          2HE       LYS  17  -3.512  -1.597 -16.900
  133   2HE   LYS  17          1HE       LYS  17  -3.504   0.114 -16.480
  134   1HZ   LYS  17          1HZ       LYS  17  -1.598  -1.046 -15.546
  135   2HZ   LYS  17          2HZ       LYS  17  -2.628  -2.103 -14.703
  136   3HZ   LYS  17          3HZ       LYS  17  -2.602  -0.448 -14.315
  137    H    ASN  18           H        ASN  18  -9.760  -0.785 -13.693
  138    HA   ASN  18           HA       ASN  18 -10.939   1.659 -12.855
  139   1HB   ASN  18          2HB       ASN  18 -12.530   0.674 -14.120
  140   2HB   ASN  18          1HB       ASN  18 -11.844  -0.924 -13.885
  141   1HD2  ASN  18          1HD2      ASN  18 -12.836  -2.294 -12.335
  142   2HD2  ASN  18          2HD2      ASN  18 -14.177  -1.832 -11.404
  143    H    GLU  19           H        GLU  19 -10.565  -1.514 -11.294
  144    HA   GLU  19           HA       GLU  19 -11.889  -0.889  -8.864
  145   1HB   GLU  19          2HB       GLU  19  -9.619  -2.842  -9.355
  146   2HB   GLU  19          1HB       GLU  19 -10.625  -2.791  -7.908
  147   1HG   GLU  19          2HG       GLU  19 -11.858  -3.067 -10.643
  148   2HG   GLU  19          1HG       GLU  19 -11.267  -4.478  -9.769
  149    H    PHE  20           H        PHE  20  -8.512  -0.699  -9.892
  150    HA   PHE  20           HA       PHE  20  -7.333   0.156  -7.497
  151   1HB   PHE  20          2HB       PHE  20  -6.639   0.468 -10.397
  152   2HB   PHE  20          1HB       PHE  20  -5.720   1.370  -9.195
  153    HD1  PHE  20           HD1      PHE  20  -3.694   0.082  -9.822
  154    HD2  PHE  20           HD2      PHE  20  -7.180  -1.842  -8.210
  155    HE1  PHE  20           HE1      PHE  20  -2.352  -1.933  -9.321
  156    HE2  PHE  20           HE2      PHE  20  -5.838  -3.856  -7.705
  157    HZ   PHE  20           HZ       PHE  20  -3.419  -3.906  -8.258
  158    H    LYS  21           H        LYS  21  -8.887   2.027 -10.090
  159    HA   LYS  21           HA       LYS  21  -8.259   4.604  -9.117
  160   1HB   LYS  21          2HB       LYS  21  -9.151   4.112 -11.407
  161   2HB   LYS  21          1HB       LYS  21 -10.729   3.807 -10.682
  162   1HG   LYS  21          2HG       LYS  21 -10.531   6.130 -11.550
  163   2HG   LYS  21          1HG       LYS  21 -10.808   6.094  -9.810
  164   1HD   LYS  21          2HD       LYS  21  -8.548   6.617  -9.322
  165   2HD   LYS  21          1HD       LYS  21  -8.016   6.213 -10.955
  166   1HE   LYS  21          2HE       LYS  21 -10.018   8.419 -10.547
  167   2HE   LYS  21          1HE       LYS  21  -8.304   8.735 -10.288
  168   1HZ   LYS  21          1HZ       LYS  21  -7.881   7.853 -12.531
  169   2HZ   LYS  21          2HZ       LYS  21  -8.875   9.230 -12.549
  170   3HZ   LYS  21          3HZ       LYS  21  -9.552   7.689 -12.771
  171    H    ALA  22           H        ALA  22 -11.132   2.545  -8.611
  172    HA   ALA  22           HA       ALA  22 -12.499   4.380  -6.915
  173   1HB   ALA  22          1HB       ALA  22 -13.695   2.555  -8.014
  174   2HB   ALA  22          2HB       ALA  22 -13.876   2.429  -6.264
  175   3HB   ALA  22          3HB       ALA  22 -12.750   1.369  -7.114
  176    H    ALA  23           H        ALA  23 -10.347   1.629  -6.277
  177    HA   ALA  23           HA       ALA  23 -10.514   1.672  -3.451
  178   1HB   ALA  23          1HB       ALA  23  -9.589  -0.246  -4.684
  179   2HB   ALA  23          2HB       ALA  23  -8.432   0.361  -3.498
  180   3HB   ALA  23          3HB       ALA  23  -8.227   0.745  -5.207
  181    H    PHE  24           H        PHE  24  -8.786   3.660  -5.730
  182    HA   PHE  24           HA       PHE  24  -6.916   4.706  -3.768
  183   1HB   PHE  24          2HB       PHE  24  -6.567   4.484  -6.347
  184   2HB   PHE  24          1HB       PHE  24  -7.498   5.977  -6.437
  185    HD1  PHE  24           HD1      PHE  24  -4.437   4.421  -5.005
  186    HD2  PHE  24           HD2      PHE  24  -6.544   8.080  -5.807
  187    HE1  PHE  24           HE1      PHE  24  -2.412   5.721  -4.411
  188    HE2  PHE  24           HE2      PHE  24  -4.521   9.380  -5.207
  189    HZ   PHE  24           HZ       PHE  24  -2.453   8.198  -4.511
  190    H    ASP  25           H        ASP  25  -9.623   6.008  -5.696
  191    HA   ASP  25           HA       ASP  25  -9.797   8.549  -4.610
  192   1HB   ASP  25          2HB       ASP  25 -11.121   7.460  -6.558
  193   2HB   ASP  25          1HB       ASP  25 -12.287   7.026  -5.307
  194    H    ILE  26           H        ILE  26 -11.207   5.537  -3.312
  195    HA   ILE  26           HA       ILE  26 -12.836   6.736  -1.341
  196    HB   ILE  26           HB       ILE  26 -12.715   4.542  -0.169
  197   1HG1  ILE  26          2HG1      ILE  26 -10.789   3.840  -2.410
  198   2HG1  ILE  26          1HG1      ILE  26 -10.337   4.051  -0.721
  199   1HG2  ILE  26          1HG2      ILE  26 -13.397   3.231  -2.384
  200   2HG2  ILE  26          2HG2      ILE  26 -13.314   4.848  -3.082
  201   3HG2  ILE  26          3HG2      ILE  26 -14.411   4.523  -1.740
  202   1HD1  ILE  26          1HD1      ILE  26 -10.614   1.707  -1.001
  203   2HD1  ILE  26          2HD1      ILE  26 -12.103   1.918  -1.921
  204   3HD1  ILE  26          3HD1      ILE  26 -12.082   2.250  -0.188
  205    H    PHE  27           H        PHE  27  -9.393   6.099  -1.403
  206    HA   PHE  27           HA       PHE  27  -9.113   6.786   1.438
  207   1HB   PHE  27          2HB       PHE  27  -7.295   5.607  -0.631
  208   2HB   PHE  27          1HB       PHE  27  -6.601   6.398   0.783
  209    HD1  PHE  27           HD1      PHE  27  -7.037   5.536   3.058
  210    HD2  PHE  27           HD2      PHE  27  -8.530   3.529  -0.433
  211    HE1  PHE  27           HE1      PHE  27  -7.496   3.512   4.416
  212    HE2  PHE  27           HE2      PHE  27  -8.990   1.506   0.924
  213    HZ   PHE  27           HZ       PHE  27  -8.472   1.497   3.349
  214    H    ILE  28           H        ILE  28  -8.864   8.280  -1.675
  215    HA   ILE  28           HA       ILE  28  -7.063  10.394  -0.780
  216    HB   ILE  28           HB       ILE  28  -8.602  10.202  -3.374
  217   1HG1  ILE  28          2HG1      ILE  28  -7.236   8.388  -3.679
  218   2HG1  ILE  28          1HG1      ILE  28  -6.068   9.637  -4.074
  219   1HG2  ILE  28          1HG2      ILE  28  -6.628  12.084  -2.237
  220   2HG2  ILE  28          2HG2      ILE  28  -7.838  12.339  -3.495
  221   3HG2  ILE  28          3HG2      ILE  28  -6.302  11.562  -3.893
  222   1HD1  ILE  28          1HD1      ILE  28  -6.345   8.074  -1.514
  223   2HD1  ILE  28          2HD1      ILE  28  -5.505   9.624  -1.541
  224   3HD1  ILE  28          3HD1      ILE  28  -4.916   8.285  -2.526
  225    H    GLN  29           H        GLN  29 -10.484   9.830  -1.094
  226    HA   GLN  29           HA       GLN  29 -11.475  12.438  -1.269
  227   1HB   GLN  29          2HB       GLN  29 -13.497  11.579  -0.068
  228   2HB   GLN  29          1HB       GLN  29 -13.008  10.584  -1.436
  229   1HG   GLN  29          2HG       GLN  29 -13.010   8.826  -0.023
  230   2HG   GLN  29          1HG       GLN  29 -11.579   9.529   0.729
  231   1HE2  GLN  29          1HE2      GLN  29 -15.171   9.968   0.846
  232   2HE2  GLN  29          2HE2      GLN  29 -15.222  10.210   2.524
  233    H    ASP  30           H        ASP  30 -10.169  10.696   1.496
  234    HA   ASP  30           HA       ASP  30 -10.839  12.881   3.327
  235   1HB   ASP  30          2HB       ASP  30  -9.676  11.413   5.034
  236   2HB   ASP  30          1HB       ASP  30 -11.118  10.715   4.305
  237    H    ALA  31           H        ALA  31  -8.159  11.709   1.431
  238    HA   ALA  31           HA       ALA  31  -6.058  12.977   2.896
  239   1HB   ALA  31          1HB       ALA  31  -6.172  12.131  -0.010
  240   2HB   ALA  31          2HB       ALA  31  -5.604  11.140   1.332
  241   3HB   ALA  31          3HB       ALA  31  -4.711  12.588   0.868
  242    H    GLU  32           H        GLU  32  -4.897  14.863   2.337
  243    HA   GLU  32           HA       GLU  32  -6.572  16.941   1.094
  244   1HB   GLU  32          2HB       GLU  32  -4.117  17.142   2.850
  245   2HB   GLU  32          1HB       GLU  32  -4.957  18.526   2.152
  246   1HG   GLU  32          2HG       GLU  32  -6.643  18.406   3.665
  247   2HG   GLU  32          1HG       GLU  32  -6.752  16.651   3.534
  248    H    ASP  33           H        ASP  33  -3.393  15.416   0.820
  249    HA   ASP  33           HA       ASP  33  -2.474  17.205  -1.253
  250   1HB   ASP  33          2HB       ASP  33  -1.413  14.693   0.003
  251   2HB   ASP  33          1HB       ASP  33  -0.704  15.295  -1.495
  252    H    GLY  34           H        GLY  34  -3.840  13.933  -1.120
  253   1HA   GLY  34          2HA       GLY  34  -5.328  13.289  -2.977
  254   2HA   GLY  34          1HA       GLY  34  -4.158  14.020  -4.069
  255    H    CYS  35           H        CYS  35  -3.531  11.920  -1.272
  256    HA   CYS  35           HA       CYS  35  -2.914   9.626  -2.936
  257   1HB   CYS  35          2HB       CYS  35  -0.546   9.697  -1.594
  258   2HB   CYS  35          1HB       CYS  35  -0.755  10.252  -3.251
  259    HG   CYS  35           HG       CYS  35  -0.721  12.674  -2.464
  260    H    ILE  36           H        ILE  36  -1.927   7.834  -1.495
  261    HA   ILE  36           HA       ILE  36  -3.406   7.864   1.063
  262    HB   ILE  36           HB       ILE  36  -3.266   5.398   0.958
  263   1HG1  ILE  36          2HG1      ILE  36  -2.591   4.954  -1.742
  264   2HG1  ILE  36          1HG1      ILE  36  -1.335   6.020  -1.115
  265   1HG2  ILE  36          1HG2      ILE  36  -4.993   5.153  -0.607
  266   2HG2  ILE  36          2HG2      ILE  36  -4.288   6.329  -1.715
  267   3HG2  ILE  36          3HG2      ILE  36  -5.067   6.874  -0.230
  268   1HD1  ILE  36          1HD1      ILE  36  -1.752   3.213  -0.590
  269   2HD1  ILE  36          2HD1      ILE  36  -1.812   4.131   0.917
  270   3HD1  ILE  36          3HD1      ILE  36  -0.395   4.240  -0.128
  271    H    SER  37           H        SER  37  -2.309   6.275   2.722
  272    HA   SER  37           HA       SER  37   0.418   7.279   3.101
  273   1HB   SER  37          2HB       SER  37  -1.447   7.324   4.908
  274   2HB   SER  37          1HB       SER  37  -1.095   5.608   5.094
  275    HG   SER  37           HG       SER  37   0.495   7.853   5.626
  276    H    THR  38           H        THR  38   2.079   5.824   3.900
  277    HA   THR  38           HA       THR  38   2.470   3.567   2.249
  278    HB   THR  38           HB       THR  38   4.392   3.057   3.764
  279    HG1  THR  38           HG1      THR  38   4.085   3.719   5.728
  280   1HG2  THR  38          1HG2      THR  38   4.919   5.855   3.561
  281   2HG2  THR  38          2HG2      THR  38   3.929   5.390   2.179
  282   3HG2  THR  38          3HG2      THR  38   5.458   4.567   2.485
  283    H    LYS  39           H        LYS  39   1.172   3.907   5.515
  284    HA   LYS  39           HA       LYS  39   1.052   1.037   5.961
  285   1HB   LYS  39          2HB       LYS  39  -0.152   3.283   7.593
  286   2HB   LYS  39          1HB       LYS  39   0.054   1.609   8.106
  287   1HG   LYS  39          2HG       LYS  39   2.229   3.637   7.515
  288   2HG   LYS  39          1HG       LYS  39   1.875   2.863   9.059
  289   1HD   LYS  39          2HD       LYS  39   2.486   0.667   8.093
  290   2HD   LYS  39          1HD       LYS  39   2.865   1.456   6.561
  291   1HE   LYS  39          2HE       LYS  39   4.846   2.275   7.327
  292   2HE   LYS  39          1HE       LYS  39   4.185   2.652   8.917
  293   1HZ   LYS  39          1HZ       LYS  39   4.317   0.327   9.505
  294   2HZ   LYS  39          2HZ       LYS  39   5.843   0.880   9.005
  295   3HZ   LYS  39          3HZ       LYS  39   4.897  -0.070   7.961
  296    H    GLU  40           H        GLU  40  -0.800   3.153   4.162
  297    HA   GLU  40           HA       GLU  40  -3.410   2.081   4.834
  298   1HB   GLU  40          2HB       GLU  40  -2.399   4.326   3.332
  299   2HB   GLU  40          1HB       GLU  40  -3.560   3.422   2.362
  300   1HG   GLU  40          2HG       GLU  40  -5.038   4.751   3.522
  301   2HG   GLU  40          1HG       GLU  40  -4.909   3.425   4.678
  302    H    LEU  41           H        LEU  41  -0.824   0.905   3.019
  303    HA   LEU  41           HA       LEU  41  -2.130  -0.143   0.738
  304   1HB   LEU  41          2HB       LEU  41   0.299  -0.039   0.897
  305   2HB   LEU  41          1HB       LEU  41   0.283  -1.180   2.224
  306    HG   LEU  41           HG       LEU  41  -0.343  -2.980   0.788
  307   1HD1  LEU  41          1HD1      LEU  41  -0.758  -0.885  -1.370
  308   2HD1  LEU  41          2HD1      LEU  41  -2.036  -1.776  -0.542
  309   3HD1  LEU  41          3HD1      LEU  41  -0.907  -2.628  -1.596
  310   1HD2  LEU  41          1HD2      LEU  41   1.580  -1.279  -0.825
  311   2HD2  LEU  41          2HD2      LEU  41   1.505  -3.040  -0.764
  312   3HD2  LEU  41          3HD2      LEU  41   2.040  -2.131   0.649
  313    H    GLY  42           H        GLY  42  -1.543  -1.514   3.975
  314   1HA   GLY  42          2HA       GLY  42  -2.670  -4.066   3.467
  315   2HA   GLY  42          1HA       GLY  42  -2.471  -3.329   5.053
  316    H    LYS  43           H        LYS  43  -4.142  -0.967   3.877
  317    HA   LYS  43           HA       LYS  43  -6.703  -1.996   4.789
  318   1HB   LYS  43          2HB       LYS  43  -5.973   0.784   3.844
  319   2HB   LYS  43          1HB       LYS  43  -7.441   0.321   4.703
  320   1HG   LYS  43          2HG       LYS  43  -5.838  -0.572   6.537
  321   2HG   LYS  43          1HG       LYS  43  -4.607   0.403   5.736
  322   1HD   LYS  43          2HD       LYS  43  -5.386   2.030   7.142
  323   2HD   LYS  43          1HD       LYS  43  -6.607   2.225   5.884
  324   1HE   LYS  43          2HE       LYS  43  -8.257   1.255   7.146
  325   2HE   LYS  43          1HE       LYS  43  -7.145   0.124   7.917
  326   1HZ   LYS  43          1HZ       LYS  43  -7.341   3.027   8.518
  327   2HZ   LYS  43          2HZ       LYS  43  -6.292   1.922   9.273
  328   3HZ   LYS  43          3HZ       LYS  43  -7.973   1.779   9.478
  329    H    VAL  44           H        VAL  44  -5.221  -0.917   1.759
  330    HA   VAL  44           HA       VAL  44  -7.712  -0.906   0.306
  331    HB   VAL  44           HB       VAL  44  -6.261  -0.670  -1.712
  332   1HG1  VAL  44          1HG1      VAL  44  -5.805   1.158   0.654
  333   2HG1  VAL  44          2HG1      VAL  44  -7.001   1.339  -0.631
  334   3HG1  VAL  44          3HG1      VAL  44  -5.286   1.556  -0.984
  335   1HG2  VAL  44          1HG2      VAL  44  -3.973  -0.548   0.266
  336   2HG2  VAL  44          2HG2      VAL  44  -3.877  -0.468  -1.493
  337   3HG2  VAL  44          3HG2      VAL  44  -4.329  -1.978  -0.703
  338    H    MET  45           H        MET  45  -5.135  -3.230   0.909
  339    HA   MET  45           HA       MET  45  -5.710  -5.101  -1.107
  340   1HB   MET  45          2HB       MET  45  -4.779  -5.757   1.699
  341   2HB   MET  45          1HB       MET  45  -4.571  -6.743   0.254
  342   1HG   MET  45          2HG       MET  45  -3.507  -3.976   0.095
  343   2HG   MET  45          1HG       MET  45  -2.655  -5.071   1.183
  344   1HE   MET  45          1HE       MET  45  -3.218  -5.092  -3.275
  345   2HE   MET  45          2HE       MET  45  -4.187  -4.348  -2.001
  346   3HE   MET  45          3HE       MET  45  -4.468  -6.032  -2.444
  347    H    ARG  46           H        ARG  46  -7.170  -4.548   2.050
  348    HA   ARG  46           HA       ARG  46  -8.753  -6.892   2.183
  349   1HB   ARG  46          2HB       ARG  46  -8.901  -4.186   3.467
  350   2HB   ARG  46          1HB       ARG  46 -10.260  -5.299   3.632
  351   1HG   ARG  46          2HG       ARG  46  -8.781  -7.018   4.554
  352   2HG   ARG  46          1HG       ARG  46  -7.383  -5.967   4.324
  353   1HD   ARG  46          2HD       ARG  46  -7.821  -4.797   6.206
  354   2HD   ARG  46          1HD       ARG  46  -9.532  -4.659   5.815
  355    HE   ARG  46           HE       ARG  46  -9.047  -7.303   6.642
  356   1HH1  ARG  46          2HH1      ARG  46  -8.982  -4.058   7.930
  357   2HH1  ARG  46          1HH1      ARG  46  -9.360  -4.557   9.542
  358   1HH2  ARG  46          1HH2      ARG  46  -9.543  -7.933   8.764
  359   2HH2  ARG  46          2HH2      ARG  46  -9.677  -6.742  10.015
  360    H    MET  47           H        MET  47  -9.307  -3.725   0.706
  361    HA   MET  47           HA       MET  47 -12.045  -4.280  -0.015
  362   1HB   MET  47          2HB       MET  47 -10.106  -2.097  -0.793
  363   2HB   MET  47          1HB       MET  47 -11.741  -2.197  -1.448
  364   1HG   MET  47          2HG       MET  47 -11.186  -2.203   1.526
  365   2HG   MET  47          1HG       MET  47 -11.452  -0.717   0.616
  366   1HE   MET  47          1HE       MET  47 -13.576   0.345   0.538
  367   2HE   MET  47          2HE       MET  47 -13.414  -0.147   2.223
  368   3HE   MET  47          3HE       MET  47 -14.969  -0.308   1.411
  369    H    LEU  48           H        LEU  48  -8.893  -4.512  -1.610
  370    HA   LEU  48           HA       LEU  48  -9.996  -5.030  -4.223
  371   1HB   LEU  48          2HB       LEU  48  -7.252  -5.170  -3.030
  372   2HB   LEU  48          1HB       LEU  48  -7.560  -5.877  -4.601
  373    HG   LEU  48           HG       LEU  48  -8.244  -3.000  -4.008
  374   1HD1  LEU  48          1HD1      LEU  48  -5.843  -3.389  -3.494
  375   2HD1  LEU  48          2HD1      LEU  48  -6.058  -2.382  -4.926
  376   3HD1  LEU  48          3HD1      LEU  48  -5.630  -4.084  -5.102
  377   1HD2  LEU  48          1HD2      LEU  48  -9.202  -4.049  -6.035
  378   2HD2  LEU  48          2HD2      LEU  48  -7.583  -4.520  -6.554
  379   3HD2  LEU  48          3HD2      LEU  48  -8.019  -2.813  -6.461
  380    H    GLY  49           H        GLY  49  -7.960  -7.129  -2.153
  381   1HA   GLY  49          2HA       GLY  49  -9.508  -9.317  -1.769
  382   2HA   GLY  49          1HA       GLY  49  -9.003  -9.515  -3.444
  383    H    GLN  50           H        GLN  50  -7.374  -8.399  -0.469
  384    HA   GLN  50           HA       GLN  50  -5.544 -10.656  -0.491
  385   1HB   GLN  50          2HB       GLN  50  -4.783  -7.992  -1.531
  386   2HB   GLN  50          1HB       GLN  50  -3.667  -8.687  -0.355
  387   1HG   GLN  50          2HG       GLN  50  -3.740 -10.828  -1.734
  388   2HG   GLN  50          1HG       GLN  50  -4.580  -9.896  -2.975
  389   1HE2  GLN  50          1HE2      GLN  50  -3.381  -7.979  -3.883
  390   2HE2  GLN  50          2HE2      GLN  50  -1.683  -7.987  -3.865
  391    H    ASN  51           H        ASN  51  -4.072 -10.606   1.390
  392    HA   ASN  51           HA       ASN  51  -4.637  -8.663   3.478
  393   1HB   ASN  51          2HB       ASN  51  -6.416 -10.610   3.500
  394   2HB   ASN  51          1HB       ASN  51  -5.111 -11.513   4.269
  395   1HD2  ASN  51          1HD2      ASN  51  -7.188  -8.631   4.624
  396   2HD2  ASN  51          2HD2      ASN  51  -6.894  -8.426   6.282
  397    HA   PRO  52           HA       PRO  52  -0.396 -10.498   3.670
  398   1HB   PRO  52          2HB       PRO  52   0.953  -8.154   3.262
  399   2HB   PRO  52          1HB       PRO  52   0.395  -9.201   1.952
  400   1HG   PRO  52          2HG       PRO  52  -0.660  -6.596   2.853
  401   2HG   PRO  52          1HG       PRO  52  -0.772  -7.367   1.264
  402   1HD   PRO  52          2HD       PRO  52  -2.814  -7.252   3.251
  403   2HD   PRO  52          1HD       PRO  52  -2.842  -8.200   1.745
  404    H    THR  53           H        THR  53   1.602  -9.175   4.887
  405    HA   THR  53           HA       THR  53   0.536  -8.561   7.572
  406    HB   THR  53           HB       THR  53   2.619  -9.259   8.459
  407    HG1  THR  53           HG1      THR  53   4.404  -9.645   6.986
  408   1HG2  THR  53          1HG2      THR  53   1.301 -11.136   7.555
  409   2HG2  THR  53          2HG2      THR  53   3.033 -11.455   7.456
  410   3HG2  THR  53          3HG2      THR  53   2.142 -10.972   6.013
  411    HA   PRO  54           HA       PRO  54   1.911  -4.377   7.392
  412   1HB   PRO  54          2HB       PRO  54   3.312  -4.003   9.720
  413   2HB   PRO  54          1HB       PRO  54   1.546  -4.109   9.628
  414   1HG   PRO  54          2HG       PRO  54   3.521  -6.155  10.521
  415   2HG   PRO  54          1HG       PRO  54   1.872  -5.852  11.095
  416   1HD   PRO  54          2HD       PRO  54   2.575  -7.909   9.370
  417   2HD   PRO  54          1HD       PRO  54   0.935  -7.231   9.503
  418    H    GLU  55           H        GLU  55   4.449  -6.721   8.074
  419    HA   GLU  55           HA       GLU  55   6.586  -4.921   7.249
  420   1HB   GLU  55          2HB       GLU  55   8.063  -6.870   7.577
  421   2HB   GLU  55          1HB       GLU  55   7.067  -6.564   8.995
  422   1HG   GLU  55          2HG       GLU  55   5.530  -8.347   8.355
  423   2HG   GLU  55          1HG       GLU  55   6.410  -8.605   6.850
  424    H    GLU  56           H        GLU  56   4.654  -7.532   5.909
  425    HA   GLU  56           HA       GLU  56   6.216  -7.992   3.569
  426   1HB   GLU  56          2HB       GLU  56   4.366  -9.482   4.590
  427   2HB   GLU  56          1HB       GLU  56   3.240  -8.437   3.726
  428   1HG   GLU  56          2HG       GLU  56   5.310  -9.102   1.899
  429   2HG   GLU  56          1HG       GLU  56   4.828 -10.599   2.690
  430    H    LEU  57           H        LEU  57   3.149  -6.181   4.060
  431    HA   LEU  57           HA       LEU  57   3.015  -5.136   1.441
  432   1HB   LEU  57          2HB       LEU  57   1.383  -3.597   2.281
  433   2HB   LEU  57          1HB       LEU  57   1.117  -5.163   3.007
  434    HG   LEU  57           HG       LEU  57   2.636  -4.052   4.935
  435   1HD1  LEU  57          1HD1      LEU  57   2.470  -1.912   3.311
  436   2HD1  LEU  57          2HD1      LEU  57   2.513  -1.758   5.067
  437   3HD1  LEU  57          3HD1      LEU  57   0.971  -1.685   4.214
  438   1HD2  LEU  57          1HD2      LEU  57  -0.312  -3.420   4.652
  439   2HD2  LEU  57          2HD2      LEU  57   0.588  -3.719   6.139
  440   3HD2  LEU  57          3HD2      LEU  57   0.287  -5.040   5.009
  441    H    GLN  58           H        GLN  58   4.743  -4.060   4.309
  442    HA   GLN  58           HA       GLN  58   5.309  -1.410   3.582
  443   1HB   GLN  58          2HB       GLN  58   6.157  -3.207   5.612
  444   2HB   GLN  58          1HB       GLN  58   7.609  -2.550   4.861
  445   1HG   GLN  58          2HG       GLN  58   5.283  -0.869   5.843
  446   2HG   GLN  58          1HG       GLN  58   6.769  -1.142   6.753
  447   1HE2  GLN  58          1HE2      GLN  58   5.358   0.633   4.070
  448   2HE2  GLN  58          2HE2      GLN  58   6.747   1.532   3.690
  449    H    GLU  59           H        GLU  59   6.898  -4.443   2.682
  450    HA   GLU  59           HA       GLU  59   9.173  -3.372   1.410
  451   1HB   GLU  59          2HB       GLU  59   7.720  -5.954   1.344
  452   2HB   GLU  59          1HB       GLU  59   8.714  -5.594  -0.065
  453   1HG   GLU  59          2HG       GLU  59   9.758  -5.315   2.759
  454   2HG   GLU  59          1HG       GLU  59   9.883  -6.822   1.851
  455    H    MET  60           H        MET  60   5.954  -4.193   0.127
  456    HA   MET  60           HA       MET  60   6.420  -3.532  -2.565
  457   1HB   MET  60          2HB       MET  60   4.015  -3.823  -0.843
  458   2HB   MET  60          1HB       MET  60   3.811  -2.915  -2.341
  459   1HG   MET  60          2HG       MET  60   3.435  -5.051  -3.140
  460   2HG   MET  60          1HG       MET  60   5.184  -4.968  -3.348
  461   1HE   MET  60          1HE       MET  60   3.365  -8.381  -1.929
  462   2HE   MET  60          2HE       MET  60   2.977  -7.125  -3.102
  463   3HE   MET  60          3HE       MET  60   2.286  -7.051  -1.483
  464    H    ILE  61           H        ILE  61   5.316  -1.525   0.158
  465    HA   ILE  61           HA       ILE  61   4.690   0.841  -1.128
  466    HB   ILE  61           HB       ILE  61   6.045   0.383   1.539
  467   1HG1  ILE  61          2HG1      ILE  61   3.870  -0.553   1.599
  468   2HG1  ILE  61          1HG1      ILE  61   3.682   1.043   2.314
  469   1HG2  ILE  61          1HG2      ILE  61   4.930   2.912   0.315
  470   2HG2  ILE  61          2HG2      ILE  61   6.561   2.630   0.927
  471   3HG2  ILE  61          3HG2      ILE  61   5.201   2.714   2.046
  472   1HD1  ILE  61          1HD1      ILE  61   3.077   1.844  -0.059
  473   2HD1  ILE  61          2HD1      ILE  61   1.881   0.857   0.780
  474   3HD1  ILE  61          3HD1      ILE  61   2.910   0.133  -0.457
  475    H    ASP  62           H        ASP  62   7.815   0.339   0.508
  476    HA   ASP  62           HA       ASP  62   9.173   2.463  -0.696
  477   1HB   ASP  62          2HB       ASP  62  10.248  -0.132   0.427
  478   2HB   ASP  62          1HB       ASP  62  11.252   1.245  -0.021
  479    H    GLU  63           H        GLU  63   8.723  -0.860  -1.818
  480    HA   GLU  63           HA       GLU  63  10.683  -0.874  -3.855
  481   1HB   GLU  63          2HB       GLU  63   8.217  -2.458  -3.281
  482   2HB   GLU  63          1HB       GLU  63   8.936  -2.585  -4.886
  483   1HG   GLU  63          2HG       GLU  63  11.110  -3.160  -3.873
  484   2HG   GLU  63          1HG       GLU  63  10.400  -3.030  -2.266
  485    H    VAL  64           H        VAL  64   7.289   0.172  -3.853
  486    HA   VAL  64           HA       VAL  64   7.581   1.032  -6.665
  487    HB   VAL  64           HB       VAL  64   5.170   1.129  -6.761
  488   1HG1  VAL  64          1HG1      VAL  64   6.551  -1.130  -6.735
  489   2HG1  VAL  64          2HG1      VAL  64   4.787  -1.157  -6.776
  490   3HG1  VAL  64          3HG1      VAL  64   5.637  -1.415  -5.252
  491   1HG2  VAL  64          1HG2      VAL  64   4.290   1.855  -4.763
  492   2HG2  VAL  64          2HG2      VAL  64   5.449   0.943  -3.798
  493   3HG2  VAL  64          3HG2      VAL  64   4.066   0.124  -4.520
  494    H    ASP  65           H        ASP  65   8.272   2.420  -3.850
  495    HA   ASP  65           HA       ASP  65   6.720   4.855  -4.058
  496   1HB   ASP  65          2HB       ASP  65   8.072   3.675  -1.983
  497   2HB   ASP  65          1HB       ASP  65   9.197   4.948  -2.459
  498    H    GLU  66           H        GLU  66   7.196   5.366  -6.243
  499    HA   GLU  66           HA       GLU  66   9.721   5.759  -7.369
  500   1HB   GLU  66          2HB       GLU  66   7.072   7.094  -7.927
  501   2HB   GLU  66          1HB       GLU  66   8.512   7.376  -8.905
  502   1HG   GLU  66          2HG       GLU  66   8.515   5.231  -9.774
  503   2HG   GLU  66          1HG       GLU  66   7.724   4.543  -8.356
  504    H    ASP  67           H        ASP  67   7.702   8.022  -5.508
  505    HA   ASP  67           HA       ASP  67   9.617  10.184  -5.809
  506   1HB   ASP  67          2HB       ASP  67   7.308  10.099  -3.864
  507   2HB   ASP  67          1HB       ASP  67   8.115  11.517  -4.528
  508    H    GLY  68           H        GLY  68   8.494   8.086  -3.152
  509   1HA   GLY  68          2HA       GLY  68   9.635   7.324  -1.279
  510   2HA   GLY  68          1HA       GLY  68  11.080   8.149  -1.864
  511    H    SER  69           H        SER  69   7.890   9.569  -1.342
  512    HA   SER  69           HA       SER  69   9.068  11.578   0.423
  513   1HB   SER  69          2HB       SER  69   6.772  12.646   0.131
  514   2HB   SER  69          1HB       SER  69   7.766  12.518  -1.317
  515    HG   SER  69           HG       SER  69   5.353  11.640  -1.047
  516    H    GLY  70           H        GLY  70   6.267   9.363   0.387
  517   1HA   GLY  70          2HA       GLY  70   6.318   8.250   2.827
  518   2HA   GLY  70          1HA       GLY  70   5.715   9.861   3.204
  519    H    THR  71           H        THR  71   4.319  10.100   0.608
  520    HA   THR  71           HA       THR  71   1.975   8.432   1.260
  521    HB   THR  71           HB       THR  71   0.651  10.075   0.045
  522    HG1  THR  71           HG1      THR  71   3.018  11.575  -0.326
  523   1HG2  THR  71          1HG2      THR  71   1.091  10.561   2.393
  524   2HG2  THR  71          2HG2      THR  71   1.099  12.068   1.476
  525   3HG2  THR  71          3HG2      THR  71   2.623  11.330   1.974
  526    H    VAL  72           H        VAL  72   0.833   7.365  -0.409
  527    HA   VAL  72           HA       VAL  72   2.512   6.727  -2.753
  528    HB   VAL  72           HB       VAL  72   0.152   5.155  -1.705
  529   1HG1  VAL  72          1HG1      VAL  72   1.000   3.397  -3.135
  530   2HG1  VAL  72          2HG1      VAL  72   2.435   4.345  -3.526
  531   3HG1  VAL  72          3HG1      VAL  72   0.851   4.861  -4.107
  532   1HG2  VAL  72          1HG2      VAL  72   1.956   3.602  -0.832
  533   2HG2  VAL  72          2HG2      VAL  72   1.828   5.134   0.032
  534   3HG2  VAL  72          3HG2      VAL  72   3.119   4.891  -1.144
  535    H    ASP  73           H        ASP  73   1.953   7.633  -4.603
  536    HA   ASP  73           HA       ASP  73  -0.682   8.826  -4.947
  537   1HB   ASP  73          2HB       ASP  73   1.709   8.730  -6.811
  538   2HB   ASP  73          1HB       ASP  73   0.232   9.657  -7.090
  539    H    PHE  74           H        PHE  74  -1.581   8.515  -7.318
  540    HA   PHE  74           HA       PHE  74  -2.493   5.841  -7.491
  541   1HB   PHE  74          2HB       PHE  74  -3.588   8.007  -8.406
  542   2HB   PHE  74          1HB       PHE  74  -2.577   7.742  -9.823
  543    HD1  PHE  74           HD1      PHE  74  -4.157   7.107 -11.462
  544    HD2  PHE  74           HD2      PHE  74  -4.149   5.149  -7.639
  545    HE1  PHE  74           HE1      PHE  74  -5.779   5.436 -12.313
  546    HE2  PHE  74           HE2      PHE  74  -5.766   3.478  -8.491
  547    HZ   PHE  74           HZ       PHE  74  -6.585   3.620 -10.828
  548    H    ASP  75           H        ASP  75   0.128   7.568  -9.100
  549    HA   ASP  75           HA       ASP  75   0.695   5.609 -11.090
  550   1HB   ASP  75          2HB       ASP  75   2.119   7.960  -9.934
  551   2HB   ASP  75          1HB       ASP  75   3.093   6.757 -10.778
  552    H    GLU  76           H        GLU  76   1.871   6.174  -7.798
  553    HA   GLU  76           HA       GLU  76   3.751   3.987  -7.819
  554   1HB   GLU  76          2HB       GLU  76   2.609   5.220  -5.321
  555   2HB   GLU  76          1HB       GLU  76   4.216   4.551  -5.583
  556   1HG   GLU  76          2HG       GLU  76   4.660   6.425  -7.202
  557   2HG   GLU  76          1HG       GLU  76   3.110   7.125  -6.737
  558    H    PHE  77           H        PHE  77   0.372   4.364  -7.227
  559    HA   PHE  77           HA       PHE  77   0.003   1.994  -5.629
  560   1HB   PHE  77          2HB       PHE  77  -1.534   3.924  -5.494
  561   2HB   PHE  77          1HB       PHE  77  -2.000   3.667  -7.172
  562    HD1  PHE  77           HD1      PHE  77  -1.846   1.903  -3.866
  563    HD2  PHE  77           HD2      PHE  77  -3.788   2.246  -7.686
  564    HE1  PHE  77           HE1      PHE  77  -3.565   0.271  -3.140
  565    HE2  PHE  77           HE2      PHE  77  -5.507   0.614  -6.955
  566    HZ   PHE  77           HZ       PHE  77  -5.395  -0.374  -4.684
  567    H    LEU  78           H        LEU  78  -0.517   2.872  -9.046
  568    HA   LEU  78           HA       LEU  78  -1.559   0.314  -9.795
  569   1HB   LEU  78          2HB       LEU  78  -0.439   2.585 -11.417
  570   2HB   LEU  78          1HB       LEU  78  -1.156   1.149 -12.119
  571    HG   LEU  78           HG       LEU  78  -2.804   2.637 -10.139
  572   1HD1  LEU  78          1HD1      LEU  78  -2.094   4.558 -11.268
  573   2HD1  LEU  78          2HD1      LEU  78  -3.523   4.089 -12.191
  574   3HD1  LEU  78          3HD1      LEU  78  -1.913   3.710 -12.805
  575   1HD2  LEU  78          1HD2      LEU  78  -4.574   1.798 -11.432
  576   2HD2  LEU  78          2HD2      LEU  78  -3.366   0.521 -11.574
  577   3HD2  LEU  78          3HD2      LEU  78  -3.584   1.680 -12.887
  578    H    VAL  79           H        VAL  79   1.687   1.737  -9.820
  579    HA   VAL  79           HA       VAL  79   2.938  -0.134 -11.506
  580    HB   VAL  79           HB       VAL  79   5.054   0.448 -10.255
  581   1HG1  VAL  79          1HG1      VAL  79   4.742   1.754 -12.149
  582   2HG1  VAL  79          2HG1      VAL  79   4.752   2.993 -10.893
  583   3HG1  VAL  79          3HG1      VAL  79   3.221   2.428 -11.562
  584   1HG2  VAL  79          1HG2      VAL  79   3.212   2.367  -8.805
  585   2HG2  VAL  79          2HG2      VAL  79   4.961   2.247  -8.620
  586   3HG2  VAL  79          3HG2      VAL  79   3.924   0.928  -8.077
  587    H    MET  80           H        MET  80   1.985  -0.370  -8.152
  588    HA   MET  80           HA       MET  80   3.565  -2.389  -7.152
  589   1HB   MET  80          2HB       MET  80   0.748  -1.556  -6.721
  590   2HB   MET  80          1HB       MET  80   1.204  -3.148  -6.117
  591   1HG   MET  80          2HG       MET  80   3.089  -2.148  -4.881
  592   2HG   MET  80          1HG       MET  80   2.647  -0.555  -5.495
  593   1HE   MET  80          1HE       MET  80   1.391   0.926  -4.594
  594   2HE   MET  80          2HE       MET  80   2.144   0.653  -3.025
  595   3HE   MET  80          3HE       MET  80   0.397   0.848  -3.132
  596    H    MET  81           H        MET  81   0.806  -2.724  -9.366
  597    HA   MET  81           HA       MET  81   0.784  -5.591  -9.329
  598   1HB   MET  81          2HB       MET  81  -0.525  -3.472 -10.985
  599   2HB   MET  81          1HB       MET  81  -0.499  -5.126 -11.594
  600   1HG   MET  81          2HG       MET  81  -1.379  -4.525  -8.774
  601   2HG   MET  81          1HG       MET  81  -2.509  -4.417 -10.123
  602   1HE   MET  81          1HE       MET  81  -1.772  -7.836  -7.643
  603   2HE   MET  81          2HE       MET  81  -1.590  -6.097  -7.425
  604   3HE   MET  81          3HE       MET  81  -0.221  -7.055  -7.986
  605    H    VAL  82           H        VAL  82   1.827  -3.251 -11.825
  606    HA   VAL  82           HA       VAL  82   2.935  -5.146 -13.590
  607    HB   VAL  82           HB       VAL  82   4.215  -3.210 -14.545
  608   1HG1  VAL  82          1HG1      VAL  82   1.675  -1.903 -14.393
  609   2HG1  VAL  82          2HG1      VAL  82   1.400  -3.645 -14.406
  610   3HG1  VAL  82          3HG1      VAL  82   2.323  -2.888 -15.706
  611   1HG2  VAL  82          1HG2      VAL  82   2.971  -1.831 -12.158
  612   2HG2  VAL  82          2HG2      VAL  82   3.537  -0.949 -13.573
  613   3HG2  VAL  82          3HG2      VAL  82   4.675  -1.887 -12.603
  614    H    ARG  83           H        ARG  83   4.380  -3.449 -10.834
  615    HA   ARG  83           HA       ARG  83   7.085  -3.995 -11.287
  616   1HB   ARG  83          2HB       ARG  83   5.504  -3.702  -8.735
  617   2HB   ARG  83          1HB       ARG  83   7.249  -3.951  -8.735
  618   1HG   ARG  83          2HG       ARG  83   6.132  -1.813 -10.506
  619   2HG   ARG  83          1HG       ARG  83   6.213  -1.498  -8.773
  620   1HD   ARG  83          2HD       ARG  83   8.546  -2.403 -10.481
  621   2HD   ARG  83          1HD       ARG  83   8.259  -0.744  -9.972
  622    HE   ARG  83           HE       ARG  83   8.295  -2.163  -7.623
  623   1HH1  ARG  83          2HH1      ARG  83  10.464  -1.790 -10.337
  624   2HH1  ARG  83          1HH1      ARG  83  11.887  -2.090  -9.400
  625   1HH2  ARG  83          1HH2      ARG  83  10.176  -2.555  -6.418
  626   2HH2  ARG  83          2HH2      ARG  83  11.726  -2.521  -7.189
  627    H    CYS  84           H        CYS  84   4.524  -6.095 -10.159
  628    HA   CYS  84           HA       CYS  84   6.130  -8.147  -9.027
  629   1HB   CYS  84          2HB       CYS  84   3.337  -8.140 -10.162
  630   2HB   CYS  84          1HB       CYS  84   4.075  -9.580  -9.460
  631    HG   CYS  84           HG       CYS  84   3.626  -6.948  -7.820
  632    H    MET  85           H        MET  85   5.670  -7.226 -12.311
  633    HA   MET  85           HA       MET  85   5.793  -9.712 -13.622
  634   1HB   MET  85          2HB       MET  85   5.566  -7.150 -14.482
  635   2HB   MET  85          1HB       MET  85   7.250  -7.469 -14.895
  636   1HG   MET  85          2HG       MET  85   5.573  -9.733 -15.592
  637   2HG   MET  85          1HG       MET  85   4.985  -8.255 -16.353
  638   1HE   MET  85          1HE       MET  85   7.350 -10.809 -18.432
  639   2HE   MET  85          2HE       MET  85   6.000  -9.800 -18.943
  640   3HE   MET  85          3HE       MET  85   5.858 -10.777 -17.483
  641    H    LYS  86           H        LYS  86   8.492  -7.395 -13.224
  642    HA   LYS  86           HA       LYS  86  10.777  -7.775 -13.490
  643   1HB   LYS  86          2HB       LYS  86  11.617  -9.168 -11.521
  644   2HB   LYS  86          1HB       LYS  86  10.640  -7.753 -11.134
  645   1HG   LYS  86          2HG       LYS  86   8.651  -9.180 -10.877
  646   2HG   LYS  86          1HG       LYS  86   9.602 -10.601 -11.304
  647   1HD   LYS  86          2HD       LYS  86  10.721  -8.956  -9.114
  648   2HD   LYS  86          1HD       LYS  86   9.196  -9.761  -8.741
  649   1HE   LYS  86          2HE       LYS  86  10.107 -11.920  -9.267
  650   2HE   LYS  86          1HE       LYS  86  11.561 -11.205  -9.964
  651   1HZ   LYS  86          1HZ       LYS  86  11.962 -12.032  -7.730
  652   2HZ   LYS  86          2HZ       LYS  86  10.742 -11.023  -7.113
  653   3HZ   LYS  86          3HZ       LYS  86  12.149 -10.348  -7.788
  654    H    ASP  87           H        ASP  87   9.807  -9.189 -15.507
  655    HA   ASP  87           HA       ASP  87  11.006 -11.884 -15.287
  656   1HB   ASP  87          2HB       ASP  87   8.531 -11.530 -16.024
  657   2HB   ASP  87          1HB       ASP  87   9.235 -11.023 -17.559
  658    H    ASP  88           H        ASP  88  13.133 -10.992 -15.532
  659    HA   ASP  88           HA       ASP  88  13.880  -9.534 -17.891
  660   1HB   ASP  88          2HB       ASP  88  15.463 -10.965 -15.756
  661   2HB   ASP  88          1HB       ASP  88  16.239 -10.216 -17.152
  662    H    SER  89           HN       SER  89  13.131 -10.707 -19.660
  663    HA   SER  89           HA       SER  89  14.179 -13.422 -20.070
  664   1HB   SER  89          2HB       SER  89  11.721 -12.683 -20.529
  665   2HB   SER  89          1HB       SER  89  12.383 -11.980 -22.002
  666    HG   SER  89           HG       SER  89  11.638 -14.238 -22.109
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  14.867  -2.628 -20.094
    2   2H    MET   1          2H        MET   1  16.361  -1.904 -20.460
    3   3H    MET   1          3H        MET   1  14.989  -0.938 -20.193
    4    HA   MET   1           HA       MET   1  16.411  -2.609 -18.189
    5   1HB   MET   1          2HB       MET   1  17.298  -0.281 -18.963
    6   2HB   MET   1          1HB       MET   1  15.920   0.366 -18.073
    7   1HG   MET   1          2HG       MET   1  16.716  -1.044 -16.093
    8   2HG   MET   1          1HG       MET   1  18.208  -1.294 -16.998
    9   1HE   MET   1          1HE       MET   1  18.949   1.146 -18.478
   10   2HE   MET   1          2HE       MET   1  20.007   0.292 -17.358
   11   3HE   MET   1          3HE       MET   1  19.885   2.048 -17.278
   12    H    ASN   2           H        ASN   2  13.971   0.011 -18.403
   13    HA   ASN   2           HA       ASN   2  12.435  -1.337 -16.266
   14   1HB   ASN   2          2HB       ASN   2  12.687   1.526 -17.135
   15   2HB   ASN   2          1HB       ASN   2  11.227   0.994 -16.302
   16   1HD2  ASN   2          1HD2      ASN   2  11.783  -0.418 -14.219
   17   2HD2  ASN   2          2HD2      ASN   2  13.043   0.185 -13.256
   18    H    ASP   3           H        ASP   3  12.151  -2.616 -18.574
   19    HA   ASP   3           HA       ASP   3   9.774  -1.579 -19.959
   20   1HB   ASP   3          2HB       ASP   3  10.178  -3.395 -21.572
   21   2HB   ASP   3          1HB       ASP   3  11.607  -2.381 -21.371
   22    H    ILE   4           H        ILE   4  10.173  -3.214 -17.197
   23    HA   ILE   4           HA       ILE   4   8.508  -5.512 -17.607
   24    HB   ILE   4           HB       ILE   4   8.578  -5.868 -15.269
   25   1HG1  ILE   4          2HG1      ILE   4   7.911  -3.453 -14.732
   26   2HG1  ILE   4          1HG1      ILE   4   9.021  -4.227 -13.607
   27   1HG2  ILE   4          1HG2      ILE   4  10.731  -6.231 -16.330
   28   2HG2  ILE   4          2HG2      ILE   4  10.984  -5.574 -14.714
   29   3HG2  ILE   4          3HG2      ILE   4  11.158  -4.532 -16.124
   30   1HD1  ILE   4          1HD1      ILE   4   9.981  -2.103 -13.960
   31   2HD1  ILE   4          2HD1      ILE   4   9.608  -2.118 -15.682
   32   3HD1  ILE   4          3HD1      ILE   4  10.896  -3.143 -15.048
   33    H    TYR   5           H        TYR   5   7.932  -2.145 -16.936
   34    HA   TYR   5           HA       TYR   5   5.273  -2.410 -15.917
   35   1HB   TYR   5          2HB       TYR   5   6.502  -0.024 -17.324
   36   2HB   TYR   5          1HB       TYR   5   5.091  -0.017 -16.267
   37    HD1  TYR   5           HD1      TYR   5   8.556   0.552 -16.386
   38    HD2  TYR   5           HD2      TYR   5   5.517  -1.156 -13.879
   39    HE1  TYR   5           HE1      TYR   5  10.034   0.813 -14.417
   40    HE2  TYR   5           HE2      TYR   5   6.991  -0.889 -11.906
   41    HH   TYR   5           HH       TYR   5   9.985  -0.653 -11.869
   42    H    LYS   6           H        LYS   6   6.705  -2.150 -19.108
   43    HA   LYS   6           HA       LYS   6   4.191  -1.738 -20.487
   44   1HB   LYS   6          2HB       LYS   6   6.760  -2.707 -21.749
   45   2HB   LYS   6          1HB       LYS   6   5.445  -1.808 -22.504
   46   1HG   LYS   6          2HG       LYS   6   7.479  -0.803 -20.505
   47   2HG   LYS   6          1HG       LYS   6   7.168  -0.204 -22.133
   48   1HD   LYS   6          2HD       LYS   6   5.024   0.686 -21.477
   49   2HD   LYS   6          1HD       LYS   6   5.121  -0.102 -19.902
   50   1HE   LYS   6          2HE       LYS   6   6.642   1.425 -19.074
   51   2HE   LYS   6          1HE       LYS   6   7.334   1.759 -20.663
   52   1HZ   LYS   6          1HZ       LYS   6   5.337   2.978 -21.246
   53   2HZ   LYS   6          2HZ       LYS   6   6.035   3.627 -19.840
   54   3HZ   LYS   6          3HZ       LYS   6   4.654   2.644 -19.730
   55    H    ALA   7           H        ALA   7   6.370  -4.423 -19.815
   56    HA   ALA   7           HA       ALA   7   4.874  -6.353 -21.347
   57   1HB   ALA   7          1HB       ALA   7   7.110  -6.972 -21.077
   58   2HB   ALA   7          2HB       ALA   7   6.292  -7.975 -19.879
   59   3HB   ALA   7          3HB       ALA   7   7.135  -6.509 -19.375
   60    H    ALA   8           H        ALA   8   4.770  -5.104 -18.081
   61    HA   ALA   8           HA       ALA   8   3.108  -7.258 -17.075
   62   1HB   ALA   8          1HB       ALA   8   2.964  -5.820 -15.030
   63   2HB   ALA   8          2HB       ALA   8   3.971  -4.629 -15.854
   64   3HB   ALA   8          3HB       ALA   8   4.613  -6.233 -15.499
   65    H    VAL   9           H        VAL   9   2.671  -3.992 -18.358
   66    HA   VAL   9           HA       VAL   9   0.050  -3.523 -17.454
   67    HB   VAL   9           HB       VAL   9   1.670  -1.918 -18.699
   68   1HG1  VAL   9          1HG1      VAL   9   0.079  -2.644 -21.127
   69   2HG1  VAL   9          2HG1      VAL   9   1.516  -3.591 -20.756
   70   3HG1  VAL   9          3HG1      VAL   9   1.651  -1.853 -21.014
   71   1HG2  VAL   9          1HG2      VAL   9  -1.252  -1.888 -19.495
   72   2HG2  VAL   9          2HG2      VAL   9  -0.185  -0.499 -19.285
   73   3HG2  VAL   9          3HG2      VAL   9  -0.681  -1.450 -17.885
   74    H    GLU  10           H        GLU  10   1.258  -5.487 -20.104
   75    HA   GLU  10           HA       GLU  10  -1.219  -5.869 -21.458
   76   1HB   GLU  10          2HB       GLU  10   1.285  -7.569 -21.366
   77   2HB   GLU  10          1HB       GLU  10  -0.087  -7.888 -22.428
   78   1HG   GLU  10          2HG       GLU  10   0.253  -5.338 -23.084
   79   2HG   GLU  10          1HG       GLU  10   1.893  -5.641 -22.510
   80    H    GLN  11           H        GLN  11   0.248  -7.311 -18.625
   81    HA   GLN  11           HA       GLN  11  -1.535  -9.588 -18.528
   82   1HB   GLN  11          2HB       GLN  11   0.188  -8.466 -16.305
   83   2HB   GLN  11          1HB       GLN  11  -0.511 -10.082 -16.392
   84   1HG   GLN  11          2HG       GLN  11   0.830 -10.492 -18.471
   85   2HG   GLN  11          1HG       GLN  11   1.608  -8.927 -18.229
   86   1HE2  GLN  11          1HE2      GLN  11   2.655  -8.674 -15.931
   87   2HE2  GLN  11          2HE2      GLN  11   3.427 -10.048 -15.305
   88    H    LEU  12           H        LEU  12  -1.386  -6.347 -17.172
   89    HA   LEU  12           HA       LEU  12  -3.515  -6.711 -15.282
   90   1HB   LEU  12          2HB       LEU  12  -2.724  -4.059 -16.441
   91   2HB   LEU  12          1HB       LEU  12  -3.361  -4.412 -14.852
   92    HG   LEU  12           HG       LEU  12  -0.555  -4.762 -15.878
   93   1HD1  LEU  12          1HD1      LEU  12  -1.957  -3.271 -13.679
   94   2HD1  LEU  12          2HD1      LEU  12  -0.786  -2.677 -14.858
   95   3HD1  LEU  12          3HD1      LEU  12  -0.248  -3.676 -13.508
   96   1HD2  LEU  12          1HD2      LEU  12  -1.927  -6.202 -13.609
   97   2HD2  LEU  12          2HD2      LEU  12  -0.205  -5.831 -13.523
   98   3HD2  LEU  12          3HD2      LEU  12  -0.823  -6.852 -14.821
   99    H    THR  13           H        THR  13  -5.636  -5.924 -15.414
  100    HA   THR  13           HA       THR  13  -6.649  -5.599 -18.179
  101    HB   THR  13           HB       THR  13  -8.883  -6.250 -16.867
  102    HG1  THR  13           HG1      THR  13  -8.316  -6.742 -14.901
  103   1HG2  THR  13          1HG2      THR  13  -6.801  -8.288 -17.692
  104   2HG2  THR  13          2HG2      THR  13  -7.858  -7.421 -18.807
  105   3HG2  THR  13          3HG2      THR  13  -8.547  -8.534 -17.627
  106    H    ASP  14           H        ASP  14  -8.686  -4.343 -18.343
  107    HA   ASP  14           HA       ASP  14  -8.362  -1.730 -17.265
  108   1HB   ASP  14          2HB       ASP  14 -10.625  -3.072 -18.747
  109   2HB   ASP  14          1HB       ASP  14 -10.727  -1.400 -18.194
  110    H    GLU  15           H        GLU  15 -10.276  -4.535 -16.340
  111    HA   GLU  15           HA       GLU  15 -12.027  -3.296 -14.499
  112   1HB   GLU  15          2HB       GLU  15 -10.952  -6.108 -14.723
  113   2HB   GLU  15          1HB       GLU  15 -12.076  -5.632 -13.450
  114   1HG   GLU  15          2HG       GLU  15 -13.423  -4.616 -15.515
  115   2HG   GLU  15          1HG       GLU  15 -12.533  -5.855 -16.397
  116    H    GLN  16           H        GLN  16  -8.762  -4.651 -14.146
  117    HA   GLN  16           HA       GLN  16  -8.531  -4.474 -11.343
  118   1HB   GLN  16          2HB       GLN  16  -6.492  -4.363 -13.565
  119   2HB   GLN  16          1HB       GLN  16  -6.023  -4.216 -11.872
  120   1HG   GLN  16          2HG       GLN  16  -7.779  -6.490 -12.784
  121   2HG   GLN  16          1HG       GLN  16  -6.025  -6.586 -12.948
  122   1HE2  GLN  16          1HE2      GLN  16  -4.731  -6.625 -10.961
  123   2HE2  GLN  16          2HE2      GLN  16  -5.448  -6.951  -9.457
  124    H    LYS  17           H        LYS  17  -7.731  -2.121 -13.897
  125    HA   LYS  17           HA       LYS  17  -6.822  -0.084 -12.117
  126   1HB   LYS  17          2HB       LYS  17  -7.541  -0.229 -15.007
  127   2HB   LYS  17          1HB       LYS  17  -7.539   1.364 -14.249
  128   1HG   LYS  17          2HG       LYS  17  -5.313   1.252 -14.840
  129   2HG   LYS  17          1HG       LYS  17  -5.217   0.470 -13.261
  130   1HD   LYS  17          2HD       LYS  17  -4.062  -1.022 -14.674
  131   2HD   LYS  17          1HD       LYS  17  -5.672  -1.732 -14.561
  132   1HE   LYS  17          2HE       LYS  17  -6.279  -1.021 -16.716
  133   2HE   LYS  17          1HE       LYS  17  -5.031   0.225 -16.758
  134   1HZ   LYS  17          1HZ       LYS  17  -4.532  -2.704 -16.782
  135   2HZ   LYS  17          2HZ       LYS  17  -3.348  -1.487 -16.870
  136   3HZ   LYS  17          3HZ       LYS  17  -4.461  -1.687 -18.138
  137    H    ASN  18           H        ASN  18  -9.963  -0.970 -13.452
  138    HA   ASN  18           HA       ASN  18 -11.415   1.353 -12.768
  139   1HB   ASN  18          2HB       ASN  18 -12.069  -1.449 -13.469
  140   2HB   ASN  18          1HB       ASN  18 -13.284  -0.609 -12.504
  141   1HD2  ASN  18          1HD2      ASN  18 -12.201  -1.077 -15.691
  142   2HD2  ASN  18          2HD2      ASN  18 -12.972   0.255 -16.407
  143    H    GLU  19           H        GLU  19 -10.809  -1.669 -10.980
  144    HA   GLU  19           HA       GLU  19 -12.270  -0.933  -8.638
  145   1HB   GLU  19          2HB       GLU  19  -9.976  -2.896  -8.910
  146   2HB   GLU  19          1HB       GLU  19 -11.093  -2.790  -7.549
  147   1HG   GLU  19          2HG       GLU  19 -12.916  -3.048  -9.465
  148   2HG   GLU  19          1HG       GLU  19 -11.572  -3.802 -10.322
  149    H    PHE  20           H        PHE  20  -8.872  -0.727  -9.601
  150    HA   PHE  20           HA       PHE  20  -7.756   0.190  -7.199
  151   1HB   PHE  20          2HB       PHE  20  -6.999   0.439 -10.086
  152   2HB   PHE  20          1HB       PHE  20  -6.127   1.397  -8.892
  153    HD1  PHE  20           HD1      PHE  20  -7.559  -1.874  -7.969
  154    HD2  PHE  20           HD2      PHE  20  -4.041   0.193  -9.306
  155    HE1  PHE  20           HE1      PHE  20  -6.176  -3.847  -7.391
  156    HE2  PHE  20           HE2      PHE  20  -2.661  -1.774  -8.724
  157    HZ   PHE  20           HZ       PHE  20  -3.727  -3.798  -7.764
  158    H    LYS  21           H        LYS  21  -9.325   1.978  -9.837
  159    HA   LYS  21           HA       LYS  21  -8.722   4.587  -8.917
  160   1HB   LYS  21          2HB       LYS  21  -9.567   4.095 -11.202
  161   2HB   LYS  21          1HB       LYS  21 -11.139   3.692 -10.514
  162   1HG   LYS  21          2HG       LYS  21 -11.063   6.030 -11.366
  163   2HG   LYS  21          1HG       LYS  21 -11.370   5.967  -9.631
  164   1HD   LYS  21          2HD       LYS  21  -9.073   6.510  -9.128
  165   2HD   LYS  21          1HD       LYS  21  -8.608   6.341 -10.822
  166   1HE   LYS  21          2HE       LYS  21  -8.827   8.664 -10.591
  167   2HE   LYS  21          1HE       LYS  21 -10.398   8.198 -11.243
  168   1HZ   LYS  21          1HZ       LYS  21  -9.806   8.528  -8.350
  169   2HZ   LYS  21          2HZ       LYS  21 -11.325   8.220  -9.048
  170   3HZ   LYS  21          3HZ       LYS  21 -10.548   9.706  -9.320
  171    H    ALA  22           H        ALA  22 -11.531   2.466  -8.362
  172    HA   ALA  22           HA       ALA  22 -12.961   4.313  -6.722
  173   1HB   ALA  22          1HB       ALA  22 -14.257   2.301  -6.004
  174   2HB   ALA  22          2HB       ALA  22 -13.129   1.295  -6.914
  175   3HB   ALA  22          3HB       ALA  22 -14.145   2.465  -7.756
  176    H    ALA  23           H        ALA  23 -10.785   1.590  -6.011
  177    HA   ALA  23           HA       ALA  23 -10.955   1.706  -3.192
  178   1HB   ALA  23          1HB       ALA  23  -8.868   0.634  -5.085
  179   2HB   ALA  23          2HB       ALA  23 -10.004  -0.261  -4.077
  180   3HB   ALA  23          3HB       ALA  23  -8.643   0.580  -3.336
  181    H    PHE  24           H        PHE  24  -9.225   3.648  -5.510
  182    HA   PHE  24           HA       PHE  24  -7.396   4.779  -3.554
  183   1HB   PHE  24          2HB       PHE  24  -7.005   4.449  -6.121
  184   2HB   PHE  24          1HB       PHE  24  -7.916   5.947  -6.278
  185    HD1  PHE  24           HD1      PHE  24  -4.854   4.399  -4.888
  186    HD2  PHE  24           HD2      PHE  24  -6.987   8.069  -5.564
  187    HE1  PHE  24           HE1      PHE  24  -2.813   5.691  -4.328
  188    HE2  PHE  24           HE2      PHE  24  -4.948   9.358  -4.998
  189    HZ   PHE  24           HZ       PHE  24  -2.861   8.169  -4.381
  190    H    ASP  25           H        ASP  25 -10.066   5.999  -5.595
  191    HA   ASP  25           HA       ASP  25 -10.232   8.581  -4.584
  192   1HB   ASP  25          2HB       ASP  25 -11.527   7.382  -6.541
  193   2HB   ASP  25          1HB       ASP  25 -12.759   7.149  -5.301
  194    H    ILE  26           H        ILE  26 -11.748   5.620  -3.270
  195    HA   ILE  26           HA       ILE  26 -13.456   6.841  -1.408
  196    HB   ILE  26           HB       ILE  26 -13.248   4.731  -0.084
  197   1HG1  ILE  26          2HG1      ILE  26 -11.252   4.000  -2.252
  198   2HG1  ILE  26          1HG1      ILE  26 -10.853   4.305  -0.564
  199   1HG2  ILE  26          1HG2      ILE  26 -14.913   4.347  -1.585
  200   2HG2  ILE  26          2HG2      ILE  26 -13.728   3.308  -2.375
  201   3HG2  ILE  26          3HG2      ILE  26 -13.964   4.961  -2.939
  202   1HD1  ILE  26          1HD1      ILE  26 -11.024   1.941  -0.739
  203   2HD1  ILE  26          2HD1      ILE  26 -12.493   2.044  -1.710
  204   3HD1  ILE  26          3HD1      ILE  26 -12.539   2.456   0.003
  205    H    PHE  27           H        PHE  27 -10.001   6.145  -1.230
  206    HA   PHE  27           HA       PHE  27  -9.791   7.054   1.527
  207   1HB   PHE  27          2HB       PHE  27  -7.900   5.953  -0.513
  208   2HB   PHE  27          1HB       PHE  27  -7.241   6.910   0.814
  209    HD1  PHE  27           HD1      PHE  27  -7.344   6.127   3.115
  210    HD2  PHE  27           HD2      PHE  27  -9.085   3.836  -0.076
  211    HE1  PHE  27           HE1      PHE  27  -7.556   4.175   4.629
  212    HE2  PHE  27           HE2      PHE  27  -9.296   1.886   1.439
  213    HZ   PHE  27           HZ       PHE  27  -8.531   2.055   3.792
  214    H    ILE  28           H        ILE  28  -9.324   8.314  -1.721
  215    HA   ILE  28           HA       ILE  28  -8.094  10.779  -0.727
  216    HB   ILE  28           HB       ILE  28  -8.841  10.152  -3.587
  217   1HG1  ILE  28          2HG1      ILE  28  -7.405   8.360  -3.170
  218   2HG1  ILE  28          1HG1      ILE  28  -6.281   9.607  -3.679
  219   1HG2  ILE  28          1HG2      ILE  28  -8.218  12.370  -3.589
  220   2HG2  ILE  28          2HG2      ILE  28  -6.626  11.625  -3.749
  221   3HG2  ILE  28          3HG2      ILE  28  -7.182  12.190  -2.172
  222   1HD1  ILE  28          1HD1      ILE  28  -6.109  10.188  -1.150
  223   2HD1  ILE  28          2HD1      ILE  28  -5.270   8.751  -1.738
  224   3HD1  ILE  28          3HD1      ILE  28  -6.810   8.588  -0.896
  225    H    GLN  29           H        GLN  29 -10.836  10.165   0.038
  226    HA   GLN  29           HA       GLN  29 -12.708  11.633  -1.506
  227   1HB   GLN  29          2HB       GLN  29 -14.007  11.734   0.714
  228   2HB   GLN  29          1HB       GLN  29 -13.678  10.140   0.045
  229   1HG   GLN  29          2HG       GLN  29 -11.728   9.912   1.551
  230   2HG   GLN  29          1HG       GLN  29 -12.065  11.506   2.224
  231   1HE2  GLN  29          1HE2      GLN  29 -13.324  11.458   4.094
  232   2HE2  GLN  29          2HE2      GLN  29 -14.401  10.212   4.506
  233    H    ASP  30           H        ASP  30 -10.476  12.528   1.070
  234    HA   ASP  30           HA       ASP  30 -10.737  15.328   0.343
  235   1HB   ASP  30          2HB       ASP  30 -10.930  15.820   2.944
  236   2HB   ASP  30          1HB       ASP  30 -12.366  15.589   1.952
  237    H    ALA  31           H        ALA  31  -8.620  13.688  -0.090
  238    HA   ALA  31           HA       ALA  31  -6.672  13.740   2.016
  239   1HB   ALA  31          1HB       ALA  31  -6.110  13.446  -0.935
  240   2HB   ALA  31          2HB       ALA  31  -6.721  12.121   0.054
  241   3HB   ALA  31          3HB       ALA  31  -5.151  12.841   0.417
  242    H    GLU  32           H        GLU  32  -4.564  14.844   1.796
  243    HA   GLU  32           HA       GLU  32  -4.970  17.666   1.219
  244   1HB   GLU  32          2HB       GLU  32  -2.752  16.095   2.517
  245   2HB   GLU  32          1HB       GLU  32  -2.537  17.789   2.076
  246   1HG   GLU  32          2HG       GLU  32  -4.924  16.899   3.694
  247   2HG   GLU  32          1HG       GLU  32  -3.383  17.260   4.471
  248    H    ASP  33           H        ASP  33  -2.805  15.059   0.130
  249    HA   ASP  33           HA       ASP  33  -1.992  16.769  -2.145
  250   1HB   ASP  33          2HB       ASP  33  -0.594  14.479  -0.763
  251   2HB   ASP  33          1HB       ASP  33  -0.071  15.109  -2.324
  252    H    GLY  34           H        GLY  34  -4.292  14.575  -1.622
  253   1HA   GLY  34          2HA       GLY  34  -5.537  13.255  -3.044
  254   2HA   GLY  34          1HA       GLY  34  -4.499  13.793  -4.359
  255    H    CYS  35           H        CYS  35  -3.777  11.983  -1.368
  256    HA   CYS  35           HA       CYS  35  -3.234   9.545  -2.848
  257   1HB   CYS  35          2HB       CYS  35  -0.860   9.634  -1.542
  258   2HB   CYS  35          1HB       CYS  35  -1.066  10.100  -3.227
  259    HG   CYS  35           HG       CYS  35  -0.609  12.463  -2.622
  260    H    ILE  36           H        ILE  36  -2.406   7.806  -1.361
  261    HA   ILE  36           HA       ILE  36  -3.830   8.024   1.212
  262    HB   ILE  36           HB       ILE  36  -3.671   5.545   1.267
  263   1HG1  ILE  36          2HG1      ILE  36  -3.027   4.954  -1.415
  264   2HG1  ILE  36          1HG1      ILE  36  -1.766   6.053  -0.862
  265   1HG2  ILE  36          1HG2      ILE  36  -5.492   6.942   0.022
  266   2HG2  ILE  36          2HG2      ILE  36  -5.414   5.203  -0.262
  267   3HG2  ILE  36          3HG2      ILE  36  -4.728   6.321  -1.442
  268   1HD1  ILE  36          1HD1      ILE  36  -2.430   4.042   1.152
  269   2HD1  ILE  36          2HD1      ILE  36  -0.860   4.489   0.488
  270   3HD1  ILE  36          3HD1      ILE  36  -1.872   3.321  -0.360
  271    H    SER  37           H        SER  37  -2.680   6.328   2.864
  272    HA   SER  37           HA       SER  37  -0.059   7.531   3.354
  273   1HB   SER  37          2HB       SER  37  -1.930   7.223   5.128
  274   2HB   SER  37          1HB       SER  37  -1.412   5.541   5.163
  275    HG   SER  37           HG       SER  37  -0.164   7.817   6.093
  276    H    THR  38           H        THR  38   1.831   6.482   3.229
  277    HA   THR  38           HA       THR  38   2.110   4.117   1.730
  278    HB   THR  38           HB       THR  38   4.475   4.102   2.677
  279    HG1  THR  38           HG1      THR  38   4.960   5.479   4.193
  280   1HG2  THR  38          1HG2      THR  38   3.195   6.412   1.252
  281   2HG2  THR  38          2HG2      THR  38   4.294   5.185   0.623
  282   3HG2  THR  38          3HG2      THR  38   4.912   6.478   1.651
  283    H    LYS  39           H        LYS  39   2.120   4.660   5.239
  284    HA   LYS  39           HA       LYS  39   2.698   1.966   5.959
  285   1HB   LYS  39          2HB       LYS  39   2.024   2.616   8.209
  286   2HB   LYS  39          1HB       LYS  39   3.022   3.880   7.496
  287   1HG   LYS  39          2HG       LYS  39   1.193   5.318   7.163
  288   2HG   LYS  39          1HG       LYS  39   0.019   4.008   7.267
  289   1HD   LYS  39          2HD       LYS  39  -0.247   4.937   9.369
  290   2HD   LYS  39          1HD       LYS  39   1.024   3.764   9.718
  291   1HE   LYS  39          2HE       LYS  39   2.011   5.642  10.623
  292   2HE   LYS  39          1HE       LYS  39   2.585   5.802   8.964
  293   1HZ   LYS  39          1HZ       LYS  39   0.751   7.272   8.483
  294   2HZ   LYS  39          2HZ       LYS  39   1.620   7.864   9.818
  295   3HZ   LYS  39          3HZ       LYS  39   0.132   7.078  10.052
  296    H    GLU  40           H        GLU  40  -0.207   3.569   4.918
  297    HA   GLU  40           HA       GLU  40  -1.881   1.344   5.881
  298   1HB   GLU  40          2HB       GLU  40  -2.384   3.977   6.052
  299   2HB   GLU  40          1HB       GLU  40  -3.101   3.656   4.473
  300   1HG   GLU  40          2HG       GLU  40  -4.649   2.119   5.345
  301   2HG   GLU  40          1HG       GLU  40  -3.702   1.850   6.808
  302    H    LEU  41           H        LEU  41   0.020   1.475   3.398
  303    HA   LEU  41           HA       LEU  41  -1.651   1.313   1.094
  304   1HB   LEU  41          2HB       LEU  41   1.076   1.311   1.554
  305   2HB   LEU  41          1HB       LEU  41   0.768  -0.312   0.975
  306    HG   LEU  41           HG       LEU  41   0.161   2.281  -0.439
  307   1HD1  LEU  41          1HD1      LEU  41   2.496   1.580  -0.570
  308   2HD1  LEU  41          2HD1      LEU  41   1.719   1.313  -2.130
  309   3HD1  LEU  41          3HD1      LEU  41   2.008  -0.046  -1.044
  310   1HD2  LEU  41          1HD2      LEU  41  -0.801   0.960  -2.227
  311   2HD2  LEU  41          2HD2      LEU  41  -1.633   0.532  -0.731
  312   3HD2  LEU  41          3HD2      LEU  41  -0.399  -0.541  -1.392
  313    H    GLY  42           H        GLY  42  -0.371  -1.073   3.365
  314   1HA   GLY  42          2HA       GLY  42  -1.274  -3.403   2.027
  315   2HA   GLY  42          1HA       GLY  42  -0.899  -3.287   3.741
  316    H    LYS  43           H        LYS  43  -2.973  -0.968   3.799
  317    HA   LYS  43           HA       LYS  43  -5.230  -2.651   4.504
  318   1HB   LYS  43          2HB       LYS  43  -4.333  -0.611   5.820
  319   2HB   LYS  43          1HB       LYS  43  -5.189   0.354   4.617
  320   1HG   LYS  43          2HG       LYS  43  -6.937   0.107   6.054
  321   2HG   LYS  43          1HG       LYS  43  -7.120  -1.447   5.243
  322   1HD   LYS  43          2HD       LYS  43  -7.020  -2.219   7.406
  323   2HD   LYS  43          1HD       LYS  43  -5.287  -2.154   7.081
  324   1HE   LYS  43          2HE       LYS  43  -5.127   0.044   8.117
  325   2HE   LYS  43          1HE       LYS  43  -6.876   0.111   8.326
  326   1HZ   LYS  43          1HZ       LYS  43  -5.072  -1.893   9.573
  327   2HZ   LYS  43          2HZ       LYS  43  -6.754  -1.795   9.792
  328   3HZ   LYS  43          3HZ       LYS  43  -5.746  -0.552  10.365
  329    H    VAL  44           H        VAL  44  -4.449  -0.151   2.090
  330    HA   VAL  44           HA       VAL  44  -7.098   0.087   1.074
  331    HB   VAL  44           HB       VAL  44  -6.022   1.183  -0.891
  332   1HG1  VAL  44          1HG1      VAL  44  -6.384   2.156   1.585
  333   2HG1  VAL  44          2HG1      VAL  44  -5.662   3.118   0.297
  334   3HG1  VAL  44          3HG1      VAL  44  -4.631   2.321   1.485
  335   1HG2  VAL  44          1HG2      VAL  44  -3.935  -0.262  -0.789
  336   2HG2  VAL  44          2HG2      VAL  44  -3.431   0.703   0.598
  337   3HG2  VAL  44          3HG2      VAL  44  -3.635   1.465  -0.978
  338    H    MET  45           H        MET  45  -4.435  -2.108   0.323
  339    HA   MET  45           HA       MET  45  -5.560  -3.113  -2.117
  340   1HB   MET  45          2HB       MET  45  -3.557  -4.402  -0.250
  341   2HB   MET  45          1HB       MET  45  -3.924  -4.932  -1.892
  342   1HG   MET  45          2HG       MET  45  -3.231  -2.684  -2.727
  343   2HG   MET  45          1HG       MET  45  -2.761  -2.254  -1.084
  344   1HE   MET  45          1HE       MET  45  -1.638  -3.653   0.324
  345   2HE   MET  45          2HE       MET  45   0.057  -3.403  -0.092
  346   3HE   MET  45          3HE       MET  45  -0.600  -5.037  -0.048
  347    H    ARG  46           H        ARG  46  -5.990  -3.842   1.267
  348    HA   ARG  46           HA       ARG  46  -7.086  -6.436   1.081
  349   1HB   ARG  46          2HB       ARG  46  -7.415  -4.210   3.084
  350   2HB   ARG  46          1HB       ARG  46  -8.326  -5.713   3.234
  351   1HG   ARG  46          2HG       ARG  46  -5.997  -6.860   2.912
  352   2HG   ARG  46          1HG       ARG  46  -5.353  -5.288   3.379
  353   1HD   ARG  46          2HD       ARG  46  -6.342  -5.377   5.512
  354   2HD   ARG  46          1HD       ARG  46  -7.495  -6.614   5.025
  355    HE   ARG  46           HE       ARG  46  -5.877  -8.235   5.437
  356   1HH1  ARG  46          2HH1      ARG  46  -4.430  -5.051   5.424
  357   2HH1  ARG  46          1HH1      ARG  46  -2.905  -5.608   6.021
  358   1HH2  ARG  46          1HH2      ARG  46  -3.866  -8.937   6.214
  359   2HH2  ARG  46          2HH2      ARG  46  -2.586  -7.799   6.468
  360    H    MET  47           H        MET  47  -8.591  -3.221   0.882
  361    HA   MET  47           HA       MET  47 -11.282  -4.065   0.731
  362   1HB   MET  47          2HB       MET  47 -10.029  -1.625   0.774
  363   2HB   MET  47          1HB       MET  47 -10.606  -1.703  -0.891
  364   1HG   MET  47          2HG       MET  47 -12.547  -2.598   1.157
  365   2HG   MET  47          1HG       MET  47 -12.143  -0.883   1.202
  366   1HE   MET  47          1HE       MET  47 -15.143  -2.841  -1.329
  367   2HE   MET  47          2HE       MET  47 -14.889  -2.669   0.406
  368   3HE   MET  47          3HE       MET  47 -13.870  -3.765  -0.522
  369    H    LEU  48           H        LEU  48  -8.753  -3.727  -1.711
  370    HA   LEU  48           HA       LEU  48 -10.383  -4.060  -4.012
  371   1HB   LEU  48          2HB       LEU  48  -7.721  -3.552  -3.554
  372   2HB   LEU  48          1HB       LEU  48  -7.678  -5.189  -4.166
  373    HG   LEU  48           HG       LEU  48  -7.360  -3.754  -6.031
  374   1HD1  LEU  48          1HD1      LEU  48  -9.055  -5.636  -6.271
  375   2HD1  LEU  48          2HD1      LEU  48  -9.197  -4.338  -7.456
  376   3HD1  LEU  48          3HD1      LEU  48 -10.313  -4.412  -6.093
  377   1HD2  LEU  48          1HD2      LEU  48  -9.137  -1.986  -6.550
  378   2HD2  LEU  48          2HD2      LEU  48  -8.070  -1.637  -5.190
  379   3HD2  LEU  48          3HD2      LEU  48  -9.709  -2.221  -4.899
  380    H    GLY  49           H        GLY  49  -8.560  -6.357  -2.000
  381   1HA   GLY  49          2HA       GLY  49  -9.876  -8.512  -1.651
  382   2HA   GLY  49          1HA       GLY  49  -9.876  -8.603  -3.410
  383    H    GLN  50           H        GLN  50  -7.504  -7.989  -0.807
  384    HA   GLN  50           HA       GLN  50  -5.793 -10.122  -1.902
  385   1HB   GLN  50          2HB       GLN  50  -5.162  -7.227  -1.821
  386   2HB   GLN  50          1HB       GLN  50  -3.894  -8.306  -1.240
  387   1HG   GLN  50          2HG       GLN  50  -3.583  -9.283  -3.299
  388   2HG   GLN  50          1HG       GLN  50  -5.268  -9.066  -3.775
  389   1HE2  GLN  50          1HE2      GLN  50  -2.169  -7.314  -3.405
  390   2HE2  GLN  50          2HE2      GLN  50  -2.584  -6.045  -4.454
  391    H    ASN  51           H        ASN  51  -4.319 -11.005  -0.407
  392    HA   ASN  51           HA       ASN  51  -4.545 -10.099   2.385
  393   1HB   ASN  51          2HB       ASN  51  -6.174 -12.040   1.775
  394   2HB   ASN  51          1HB       ASN  51  -4.719 -13.037   1.770
  395   1HD2  ASN  51          1HD2      ASN  51  -6.586 -10.783   3.859
  396   2HD2  ASN  51          2HD2      ASN  51  -6.042 -11.452   5.320
  397    HA   PRO  52           HA       PRO  52  -0.214 -11.263   1.219
  398   1HB   PRO  52          2HB       PRO  52   0.889  -8.797   1.638
  399   2HB   PRO  52          1HB       PRO  52   0.189  -9.306   0.097
  400   1HG   PRO  52          2HG       PRO  52  -0.865  -7.419   2.106
  401   2HG   PRO  52          1HG       PRO  52  -1.205  -7.524   0.374
  402   1HD   PRO  52          2HD       PRO  52  -2.860  -8.459   2.503
  403   2HD   PRO  52          1HD       PRO  52  -3.105  -8.727   0.761
  404    H    THR  53           H        THR  53   1.878 -10.251   2.604
  405    HA   THR  53           HA       THR  53   1.211 -10.817   5.431
  406    HB   THR  53           HB       THR  53   3.298 -11.828   5.699
  407    HG1  THR  53           HG1      THR  53   5.044 -11.089   4.785
  408   1HG2  THR  53          1HG2      THR  53   1.934 -13.129   4.100
  409   2HG2  THR  53          2HG2      THR  53   3.661 -13.331   3.806
  410   3HG2  THR  53          3HG2      THR  53   2.706 -12.274   2.765
  411    HA   PRO  54           HA       PRO  54   2.680  -6.846   6.656
  412   1HB   PRO  54          2HB       PRO  54   4.402  -7.342   8.732
  413   2HB   PRO  54          1HB       PRO  54   2.641  -7.475   8.854
  414   1HG   PRO  54          2HG       PRO  54   4.689  -9.621   8.637
  415   2HG   PRO  54          1HG       PRO  54   3.125  -9.634   9.464
  416   1HD   PRO  54          2HD       PRO  54   3.634 -10.817   6.988
  417   2HD   PRO  54          1HD       PRO  54   2.018 -10.389   7.598
  418    H    GLU  55           H        GLU  55   5.214  -9.177   5.992
  419    HA   GLU  55           HA       GLU  55   7.285  -7.159   5.664
  420   1HB   GLU  55          2HB       GLU  55   7.444 -10.044   4.782
  421   2HB   GLU  55          1HB       GLU  55   8.767  -8.955   5.198
  422   1HG   GLU  55          2HG       GLU  55   7.878  -8.868   7.545
  423   2HG   GLU  55          1HG       GLU  55   6.697 -10.096   7.093
  424    H    GLU  56           H        GLU  56   5.164  -9.162   3.677
  425    HA   GLU  56           HA       GLU  56   6.330  -8.562   1.164
  426   1HB   GLU  56          2HB       GLU  56   4.578 -10.400   1.848
  427   2HB   GLU  56          1HB       GLU  56   3.405  -9.154   1.423
  428   1HG   GLU  56          2HG       GLU  56   3.724 -10.280  -0.614
  429   2HG   GLU  56          1HG       GLU  56   4.813  -8.901  -0.755
  430    H    LEU  57           H        LEU  57   3.351  -7.239   2.705
  431    HA   LEU  57           HA       LEU  57   2.942  -5.303   0.672
  432   1HB   LEU  57          2HB       LEU  57   1.080  -4.718   1.782
  433   2HB   LEU  57          1HB       LEU  57   1.375  -6.218   2.617
  434    HG   LEU  57           HG       LEU  57   0.734  -4.612   4.246
  435   1HD1  LEU  57          1HD1      LEU  57   3.535  -4.243   4.905
  436   2HD1  LEU  57          2HD1      LEU  57   3.219  -5.885   4.344
  437   3HD1  LEU  57          3HD1      LEU  57   2.314  -5.230   5.707
  438   1HD2  LEU  57          1HD2      LEU  57   1.749  -2.724   2.530
  439   2HD2  LEU  57          2HD2      LEU  57   2.934  -2.692   3.838
  440   3HD2  LEU  57          3HD2      LEU  57   1.229  -2.399   4.184
  441    H    GLN  58           H        GLN  58   5.049  -5.327   3.443
  442    HA   GLN  58           HA       GLN  58   5.416  -2.505   3.672
  443   1HB   GLN  58          2HB       GLN  58   6.065  -4.141   5.450
  444   2HB   GLN  58          1HB       GLN  58   7.376  -4.692   4.409
  445   1HG   GLN  58          2HG       GLN  58   8.269  -3.052   5.963
  446   2HG   GLN  58          1HG       GLN  58   8.242  -2.334   4.353
  447   1HE2  GLN  58          1HE2      GLN  58   6.571  -0.688   3.906
  448   2HE2  GLN  58          2HE2      GLN  58   5.755   0.080   5.181
  449    H    GLU  59           H        GLU  59   7.212  -5.080   1.992
  450    HA   GLU  59           HA       GLU  59   9.235  -3.439   0.885
  451   1HB   GLU  59          2HB       GLU  59   8.100  -6.126   0.149
  452   2HB   GLU  59          1HB       GLU  59   9.286  -5.340  -0.892
  453   1HG   GLU  59          2HG       GLU  59  10.961  -5.400   0.750
  454   2HG   GLU  59          1HG       GLU  59   9.800  -5.596   2.063
  455    H    MET  60           H        MET  60   5.975  -4.270  -0.200
  456    HA   MET  60           HA       MET  60   6.146  -3.319  -2.848
  457   1HB   MET  60          2HB       MET  60   3.822  -3.570  -0.935
  458   2HB   MET  60          1HB       MET  60   3.626  -2.999  -2.593
  459   1HG   MET  60          2HG       MET  60   4.904  -5.129  -3.286
  460   2HG   MET  60          1HG       MET  60   4.586  -5.701  -1.649
  461   1HE   MET  60          1HE       MET  60   2.188  -6.346  -5.147
  462   2HE   MET  60          2HE       MET  60   3.261  -7.410  -4.241
  463   3HE   MET  60          3HE       MET  60   3.881  -5.898  -4.898
  464    H    ILE  61           H        ILE  61   5.250  -1.680   0.184
  465    HA   ILE  61           HA       ILE  61   4.485   0.796  -0.845
  466    HB   ILE  61           HB       ILE  61   5.859   0.069   1.747
  467   1HG1  ILE  61          2HG1      ILE  61   3.038   0.988   1.542
  468   2HG1  ILE  61          1HG1      ILE  61   3.399  -0.616   0.907
  469   1HG2  ILE  61          1HG2      ILE  61   4.707   2.698   0.795
  470   2HG2  ILE  61          2HG2      ILE  61   6.322   2.386   1.436
  471   3HG2  ILE  61          3HG2      ILE  61   4.920   2.314   2.504
  472   1HD1  ILE  61          1HD1      ILE  61   4.317  -1.326   3.007
  473   2HD1  ILE  61          2HD1      ILE  61   2.752  -0.585   3.347
  474   3HD1  ILE  61          3HD1      ILE  61   4.240   0.309   3.662
  475    H    ASP  62           H        ASP  62   7.653   0.207   0.696
  476    HA   ASP  62           HA       ASP  62   8.948   2.486  -0.178
  477   1HB   ASP  62          2HB       ASP  62   9.720   0.396   1.330
  478   2HB   ASP  62          1HB       ASP  62  10.595   0.015  -0.153
  479    H    GLU  63           H        GLU  63   8.479  -0.551  -1.938
  480    HA   GLU  63           HA       GLU  63  10.247  -0.008  -4.090
  481   1HB   GLU  63          2HB       GLU  63   7.943  -1.876  -3.673
  482   2HB   GLU  63          1HB       GLU  63   8.571  -1.642  -5.304
  483   1HG   GLU  63          2HG       GLU  63  10.823  -2.251  -4.551
  484   2HG   GLU  63          1HG       GLU  63  10.239  -2.436  -2.898
  485    H    VAL  64           H        VAL  64   6.667   0.234  -3.961
  486    HA   VAL  64           HA       VAL  64   6.419   1.480  -6.495
  487    HB   VAL  64           HB       VAL  64   4.129   1.957  -5.905
  488   1HG1  VAL  64          1HG1      VAL  64   4.024  -0.503  -4.477
  489   2HG1  VAL  64          2HG1      VAL  64   5.367  -0.611  -5.614
  490   3HG1  VAL  64          3HG1      VAL  64   3.747  -0.234  -6.197
  491   1HG2  VAL  64          1HG2      VAL  64   3.282   1.692  -3.631
  492   2HG2  VAL  64          2HG2      VAL  64   4.612   2.850  -3.619
  493   3HG2  VAL  64          3HG2      VAL  64   4.876   1.197  -3.064
  494    H    ASP  65           H        ASP  65   7.067   2.802  -3.306
  495    HA   ASP  65           HA       ASP  65   6.367   5.499  -3.911
  496   1HB   ASP  65          2HB       ASP  65   7.057   4.191  -1.608
  497   2HB   ASP  65          1HB       ASP  65   8.532   5.092  -1.944
  498    H    GLU  66           H        GLU  66   7.268   5.851  -5.967
  499    HA   GLU  66           HA       GLU  66  10.001   5.534  -6.629
  500   1HB   GLU  66          2HB       GLU  66   7.848   7.319  -7.768
  501   2HB   GLU  66          1HB       GLU  66   9.474   7.233  -8.445
  502   1HG   GLU  66          2HG       GLU  66   9.053   5.252  -9.446
  503   2HG   GLU  66          1HG       GLU  66   8.355   4.578  -7.975
  504    H    ASP  67           H        ASP  67   8.242   8.225  -5.152
  505    HA   ASP  67           HA       ASP  67  10.666   9.879  -5.157
  506   1HB   ASP  67          2HB       ASP  67   9.061  11.534  -3.955
  507   2HB   ASP  67          1HB       ASP  67   8.842  11.240  -5.677
  508    H    GLY  68           H        GLY  68   8.571   8.137  -2.901
  509   1HA   GLY  68          2HA       GLY  68   8.973   7.419  -0.741
  510   2HA   GLY  68          1HA       GLY  68  10.639   7.965  -0.924
  511    H    SER  69           H        SER  69   7.457   9.571  -0.984
  512    HA   SER  69           HA       SER  69   8.530  11.765   0.620
  513   1HB   SER  69          2HB       SER  69   6.289  12.809   0.132
  514   2HB   SER  69          1HB       SER  69   7.260  12.449  -1.291
  515    HG   SER  69           HG       SER  69   5.772  11.106  -1.911
  516    H    GLY  70           H        GLY  70   5.847   9.427   0.731
  517   1HA   GLY  70          2HA       GLY  70   5.777   8.564   3.231
  518   2HA   GLY  70          1HA       GLY  70   5.208  10.211   3.483
  519    H    THR  71           H        THR  71   3.951  10.010   0.666
  520    HA   THR  71           HA       THR  71   1.557   8.464   1.469
  521    HB   THR  71           HB       THR  71   0.205  10.065   0.216
  522    HG1  THR  71           HG1      THR  71   2.588  11.551  -0.167
  523   1HG2  THR  71          1HG2      THR  71   2.132  11.335   2.179
  524   2HG2  THR  71          2HG2      THR  71   0.565  10.610   2.545
  525   3HG2  THR  71          3HG2      THR  71   0.650  12.107   1.615
  526    H    VAL  72           H        VAL  72   0.436   7.345  -0.178
  527    HA   VAL  72           HA       VAL  72   2.131   6.684  -2.496
  528    HB   VAL  72           HB       VAL  72  -0.281   5.174  -1.472
  529   1HG1  VAL  72          1HG1      VAL  72   0.515   3.399  -2.914
  530   2HG1  VAL  72          2HG1      VAL  72   1.970   4.313  -3.310
  531   3HG1  VAL  72          3HG1      VAL  72   0.398   4.869  -3.881
  532   1HG2  VAL  72          1HG2      VAL  72   2.682   4.832  -0.934
  533   2HG2  VAL  72          2HG2      VAL  72   1.487   3.578  -0.609
  534   3HG2  VAL  72          3HG2      VAL  72   1.407   5.114   0.252
  535    H    ASP  73           H        ASP  73   1.673   7.682  -4.314
  536    HA   ASP  73           HA       ASP  73  -0.941   8.886  -4.763
  537   1HB   ASP  73          2HB       ASP  73   1.470   8.802  -6.598
  538   2HB   ASP  73          1HB       ASP  73   0.059   9.846  -6.762
  539    H    PHE  74           H        PHE  74  -1.823   8.612  -7.096
  540    HA   PHE  74           HA       PHE  74  -2.647   5.927  -7.398
  541   1HB   PHE  74          2HB       PHE  74  -3.769   8.117  -8.261
  542   2HB   PHE  74          1HB       PHE  74  -2.758   7.870  -9.685
  543    HD1  PHE  74           HD1      PHE  74  -4.008   6.938 -11.410
  544    HD2  PHE  74           HD2      PHE  74  -4.588   5.518  -7.401
  545    HE1  PHE  74           HE1      PHE  74  -5.594   5.225 -12.245
  546    HE2  PHE  74           HE2      PHE  74  -6.181   3.809  -8.234
  547    HZ   PHE  74           HZ       PHE  74  -6.686   3.662 -10.657
  548    H    ASP  75           H        ASP  75  -0.029   7.767  -8.889
  549    HA   ASP  75           HA       ASP  75   0.589   5.929 -10.969
  550   1HB   ASP  75          2HB       ASP  75   1.959   8.214  -9.654
  551   2HB   ASP  75          1HB       ASP  75   3.001   7.035 -10.450
  552    H    GLU  76           H        GLU  76   1.503   6.178  -7.577
  553    HA   GLU  76           HA       GLU  76   3.364   3.943  -7.711
  554   1HB   GLU  76          2HB       GLU  76   2.313   5.175  -5.168
  555   2HB   GLU  76          1HB       GLU  76   3.873   4.407  -5.458
  556   1HG   GLU  76          2HG       GLU  76   4.459   6.278  -7.011
  557   2HG   GLU  76          1HG       GLU  76   2.937   7.059  -6.597
  558    H    PHE  77           H        PHE  77   0.009   4.506  -7.101
  559    HA   PHE  77           HA       PHE  77  -0.519   2.104  -5.598
  560   1HB   PHE  77          2HB       PHE  77  -1.929   4.188  -5.511
  561   2HB   PHE  77          1HB       PHE  77  -2.460   3.836  -7.152
  562    HD1  PHE  77           HD1      PHE  77  -2.278   2.331  -3.723
  563    HD2  PHE  77           HD2      PHE  77  -4.274   2.407  -7.528
  564    HE1  PHE  77           HE1      PHE  77  -4.025   0.807  -2.840
  565    HE2  PHE  77           HE2      PHE  77  -6.018   0.879  -6.643
  566    HZ   PHE  77           HZ       PHE  77  -5.894   0.082  -4.298
  567    H    LEU  78           H        LEU  78  -0.656   3.082  -9.000
  568    HA   LEU  78           HA       LEU  78  -1.921   0.658  -9.908
  569   1HB   LEU  78          2HB       LEU  78  -0.548   2.916 -11.347
  570   2HB   LEU  78          1HB       LEU  78  -1.214   1.531 -12.180
  571    HG   LEU  78           HG       LEU  78  -2.605   3.835 -10.894
  572   1HD1  LEU  78          1HD1      LEU  78  -3.375   2.086 -13.240
  573   2HD1  LEU  78          2HD1      LEU  78  -2.267   3.452 -13.387
  574   3HD1  LEU  78          3HD1      LEU  78  -3.935   3.720 -12.880
  575   1HD2  LEU  78          1HD2      LEU  78  -3.582   2.111  -9.569
  576   2HD2  LEU  78          2HD2      LEU  78  -3.629   0.989 -10.929
  577   3HD2  LEU  78          3HD2      LEU  78  -4.717   2.376 -10.893
  578    H    VAL  79           H        VAL  79   1.419   1.878  -9.835
  579    HA   VAL  79           HA       VAL  79   2.608  -0.118 -11.410
  580    HB   VAL  79           HB       VAL  79   4.714   0.381 -10.113
  581   1HG1  VAL  79          1HG1      VAL  79   4.456   1.626 -12.081
  582   2HG1  VAL  79          2HG1      VAL  79   4.647   2.880 -10.854
  583   3HG1  VAL  79          3HG1      VAL  79   3.041   2.483 -11.465
  584   1HG2  VAL  79          1HG2      VAL  79   4.633   2.322  -8.580
  585   2HG2  VAL  79          2HG2      VAL  79   3.675   0.975  -7.967
  586   3HG2  VAL  79          3HG2      VAL  79   2.877   2.352  -8.723
  587    H    MET  80           H        MET  80   1.538  -0.186  -8.090
  588    HA   MET  80           HA       MET  80   2.933  -2.199  -6.894
  589   1HB   MET  80          2HB       MET  80   0.109  -1.314  -6.782
  590   2HB   MET  80          1HB       MET  80   0.448  -2.912  -6.118
  591   1HG   MET  80          2HG       MET  80   2.425  -1.730  -4.901
  592   2HG   MET  80          1HG       MET  80   1.545  -0.244  -5.258
  593   1HE   MET  80          1HE       MET  80  -0.773   0.290  -4.604
  594   2HE   MET  80          2HE       MET  80  -1.833  -0.650  -3.559
  595   3HE   MET  80          3HE       MET  80  -1.490  -1.217  -5.191
  596    H    MET  81           H        MET  81   0.416  -2.591  -9.370
  597    HA   MET  81           HA       MET  81   0.341  -5.453  -9.225
  598   1HB   MET  81          2HB       MET  81  -0.674  -3.443 -11.225
  599   2HB   MET  81          1HB       MET  81  -0.788  -5.177 -11.524
  600   1HG   MET  81          2HG       MET  81  -1.809  -3.896  -8.979
  601   2HG   MET  81          1HG       MET  81  -2.821  -4.108 -10.408
  602   1HE   MET  81          1HE       MET  81  -2.745  -5.345  -7.210
  603   2HE   MET  81          2HE       MET  81  -1.019  -5.611  -7.443
  604   3HE   MET  81          3HE       MET  81  -2.082  -6.982  -7.134
  605    H    VAL  82           H        VAL  82   1.707  -3.239 -11.692
  606    HA   VAL  82           HA       VAL  82   2.963  -5.279 -13.209
  607    HB   VAL  82           HB       VAL  82   4.324  -3.404 -14.189
  608   1HG1  VAL  82          1HG1      VAL  82   1.738  -4.080 -14.622
  609   2HG1  VAL  82          2HG1      VAL  82   2.569  -2.820 -15.532
  610   3HG1  VAL  82          3HG1      VAL  82   1.536  -2.387 -14.170
  611   1HG2  VAL  82          1HG2      VAL  82   4.423  -1.995 -12.155
  612   2HG2  VAL  82          2HG2      VAL  82   2.682  -1.735 -12.258
  613   3HG2  VAL  82          3HG2      VAL  82   3.742  -1.107 -13.517
  614    H    ARG  83           H        ARG  83   4.033  -3.475 -10.392
  615    HA   ARG  83           HA       ARG  83   6.808  -4.023 -10.564
  616   1HB   ARG  83          2HB       ARG  83   5.032  -3.485  -8.173
  617   2HB   ARG  83          1HB       ARG  83   6.788  -3.615  -8.079
  618   1HG   ARG  83          2HG       ARG  83   5.912  -1.820 -10.221
  619   2HG   ARG  83          1HG       ARG  83   5.365  -1.293  -8.629
  620   1HD   ARG  83          2HD       ARG  83   7.766  -1.679  -7.838
  621   2HD   ARG  83          1HD       ARG  83   8.199  -1.815  -9.539
  622    HE   ARG  83           HE       ARG  83   6.764   0.566  -9.265
  623   1HH1  ARG  83          2HH1      ARG  83   9.732  -0.844  -8.079
  624   2HH1  ARG  83          1HH1      ARG  83  10.532   0.680  -7.905
  625   1HH2  ARG  83          1HH2      ARG  83   7.834   2.550  -9.028
  626   2HH2  ARG  83          2HH2      ARG  83   9.462   2.596  -8.441
  627    H    CYS  84           H        CYS  84   4.096  -5.995  -9.654
  628    HA   CYS  84           HA       CYS  84   5.376  -7.896  -8.005
  629   1HB   CYS  84          2HB       CYS  84   2.966  -8.086  -9.811
  630   2HB   CYS  84          1HB       CYS  84   3.521  -9.440  -8.829
  631    HG   CYS  84           HG       CYS  84   2.458  -8.379  -6.869
  632    H    MET  85           H        MET  85   5.430  -7.447 -11.494
  633    HA   MET  85           HA       MET  85   6.228 -10.066 -12.211
  634   1HB   MET  85          2HB       MET  85   5.364  -8.646 -13.926
  635   2HB   MET  85          1HB       MET  85   6.526  -7.373 -13.552
  636   1HG   MET  85          2HG       MET  85   8.203  -8.389 -14.687
  637   2HG   MET  85          1HG       MET  85   7.693 -10.000 -14.198
  638   1HE   MET  85          1HE       MET  85   7.976  -7.759 -17.375
  639   2HE   MET  85          2HE       MET  85   7.044  -6.941 -16.123
  640   3HE   MET  85          3HE       MET  85   6.263  -7.401 -17.633
  641    H    LYS  86           H        LYS  86   8.050  -7.073 -11.537
  642    HA   LYS  86           HA       LYS  86  10.217  -6.696 -10.898
  643   1HB   LYS  86          2HB       LYS  86   9.693  -9.454  -9.941
  644   2HB   LYS  86          1HB       LYS  86  11.385  -8.972 -10.052
  645   1HG   LYS  86          2HG       LYS  86   9.549  -6.977  -8.843
  646   2HG   LYS  86          1HG       LYS  86   9.829  -8.439  -7.895
  647   1HD   LYS  86          2HD       LYS  86  12.250  -8.098  -8.030
  648   2HD   LYS  86          1HD       LYS  86  12.012  -6.677  -9.047
  649   1HE   LYS  86          2HE       LYS  86  11.420  -5.357  -7.287
  650   2HE   LYS  86          1HE       LYS  86  10.511  -6.647  -6.500
  651   1HZ   LYS  86          1HZ       LYS  86  12.603  -7.641  -5.803
  652   2HZ   LYS  86          2HZ       LYS  86  12.466  -6.051  -5.224
  653   3HZ   LYS  86          3HZ       LYS  86  13.471  -6.390  -6.552
  654    H    ASP  87           H        ASP  87  12.556  -7.495 -11.272
  655    HA   ASP  87           HA       ASP  87  12.951  -9.062 -13.688
  656   1HB   ASP  87          2HB       ASP  87  12.389  -6.599 -14.337
  657   2HB   ASP  87          1HB       ASP  87  14.017  -6.252 -13.757
  658    H    ASP  88           H        ASP  88  14.583 -10.333 -13.121
  659    HA   ASP  88           HA       ASP  88  16.469  -9.667 -11.072
  660   1HB   ASP  88          2HB       ASP  88  15.713 -12.016 -11.742
  661   2HB   ASP  88          1HB       ASP  88  16.802 -11.864 -13.120
  662    H    SER  89           HN       SER  89  17.942  -8.122 -11.371
  663    HA   SER  89           HA       SER  89  19.436  -8.078 -13.932
  664   1HB   SER  89          2HB       SER  89  17.933  -6.075 -13.491
  665   2HB   SER  89          1HB       SER  89  18.994  -5.685 -12.139
  666    HG   SER  89           HG       SER  89  20.308  -4.863 -13.547
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  17.025  -0.205 -14.313
    2   2H    MET   1          2H        MET   1  16.714  -1.745 -13.665
    3   3H    MET   1          3H        MET   1  15.451  -0.621 -13.837
    4    HA   MET   1           HA       MET   1  15.606  -0.717 -16.223
    5   1HB   MET   1          2HB       MET   1  18.152  -1.251 -16.026
    6   2HB   MET   1          1HB       MET   1  17.629  -2.933 -15.928
    7   1HG   MET   1          2HG       MET   1  16.839  -2.959 -18.104
    8   2HG   MET   1          1HG       MET   1  16.481  -1.233 -18.107
    9   1HE   MET   1          1HE       MET   1  19.931  -3.350 -17.348
   10   2HE   MET   1          2HE       MET   1  20.305  -3.455 -19.066
   11   3HE   MET   1          3HE       MET   1  18.757  -4.050 -18.470
   12    H    ASN   2           H        ASN   2  13.699  -1.654 -16.550
   13    HA   ASN   2           HA       ASN   2  13.374  -4.523 -16.137
   14   1HB   ASN   2          2HB       ASN   2  12.204  -2.524 -14.343
   15   2HB   ASN   2          1HB       ASN   2  11.006  -3.598 -15.056
   16   1HD2  ASN   2          1HD2      ASN   2  11.817  -6.063 -15.021
   17   2HD2  ASN   2          2HD2      ASN   2  12.520  -6.557 -13.556
   18    H    ASP   3           H        ASP   3  11.643  -5.412 -17.323
   19    HA   ASP   3           HA       ASP   3  10.420  -3.541 -19.265
   20   1HB   ASP   3          2HB       ASP   3  12.159  -5.563 -19.877
   21   2HB   ASP   3          1HB       ASP   3  10.598  -6.351 -20.095
   22    H    ILE   4           H        ILE   4   9.584  -5.256 -16.609
   23    HA   ILE   4           HA       ILE   4   7.260  -6.658 -17.543
   24    HB   ILE   4           HB       ILE   4   6.683  -7.033 -15.277
   25   1HG1  ILE   4          2HG1      ILE   4   6.965  -4.549 -14.666
   26   2HG1  ILE   4          1HG1      ILE   4   7.362  -5.726 -13.419
   27   1HG2  ILE   4          1HG2      ILE   4   9.100  -7.415 -14.230
   28   2HG2  ILE   4          2HG2      ILE   4   9.605  -7.072 -15.884
   29   3HG2  ILE   4          3HG2      ILE   4   8.503  -8.406 -15.558
   30   1HD1  ILE   4          1HD1      ILE   4   9.207  -4.028 -15.078
   31   2HD1  ILE   4          2HD1      ILE   4   9.790  -5.539 -14.381
   32   3HD1  ILE   4          3HD1      ILE   4   9.185  -4.260 -13.331
   33    H    TYR   5           H        TYR   5   7.971  -3.378 -16.640
   34    HA   TYR   5           HA       TYR   5   5.295  -2.488 -16.177
   35   1HB   TYR   5          2HB       TYR   5   7.676  -0.851 -17.093
   36   2HB   TYR   5          1HB       TYR   5   6.216  -0.247 -16.313
   37    HD1  TYR   5           HD1      TYR   5   5.628  -1.496 -14.009
   38    HD2  TYR   5           HD2      TYR   5   9.544  -1.210 -15.749
   39    HE1  TYR   5           HE1      TYR   5   6.647  -1.909 -11.788
   40    HE2  TYR   5           HE2      TYR   5  10.562  -1.623 -13.529
   41    HH   TYR   5           HH       TYR   5   9.294  -2.974 -11.148
   42    H    LYS   6           H        LYS   6   7.412  -2.706 -18.983
   43    HA   LYS   6           HA       LYS   6   5.702  -1.270 -20.790
   44   1HB   LYS   6          2HB       LYS   6   7.750  -3.351 -21.582
   45   2HB   LYS   6          1HB       LYS   6   7.182  -1.975 -22.524
   46   1HG   LYS   6          2HG       LYS   6   8.988  -1.965 -20.101
   47   2HG   LYS   6          1HG       LYS   6   9.305  -1.301 -21.704
   48   1HD   LYS   6          2HD       LYS   6   7.764   0.498 -21.370
   49   2HD   LYS   6          1HD       LYS   6   7.087  -0.261 -19.927
   50   1HE   LYS   6          2HE       LYS   6   8.935   0.275 -18.611
   51   2HE   LYS   6          1HE       LYS   6  10.016   0.402 -19.999
   52   1HZ   LYS   6          1HZ       LYS   6   7.816   2.297 -19.363
   53   2HZ   LYS   6          2HZ       LYS   6   8.907   2.429 -20.660
   54   3HZ   LYS   6          3HZ       LYS   6   9.462   2.574 -19.061
   55    H    ALA   7           H        ALA   7   6.247  -4.670 -20.014
   56    HA   ALA   7           HA       ALA   7   4.457  -5.743 -21.962
   57   1HB   ALA   7          1HB       ALA   7   5.732  -6.810 -19.459
   58   2HB   ALA   7          2HB       ALA   7   5.961  -7.327 -21.129
   59   3HB   ALA   7          3HB       ALA   7   4.474  -7.738 -20.275
   60    H    ALA   8           H        ALA   8   4.080  -4.553 -18.664
   61    HA   ALA   8           HA       ALA   8   1.415  -5.550 -18.291
   62   1HB   ALA   8          1HB       ALA   8   1.401  -3.860 -16.387
   63   2HB   ALA   8          2HB       ALA   8   3.063  -3.479 -16.841
   64   3HB   ALA   8          3HB       ALA   8   2.644  -5.107 -16.307
   65    H    VAL   9           H        VAL   9   2.823  -2.614 -19.632
   66    HA   VAL   9           HA       VAL   9   0.687  -0.844 -19.508
   67    HB   VAL   9           HB       VAL   9   2.890  -1.261 -21.510
   68   1HG1  VAL   9          1HG1      VAL   9   0.575   0.679 -21.718
   69   2HG1  VAL   9          2HG1      VAL   9   1.154  -0.453 -22.941
   70   3HG1  VAL   9          3HG1      VAL   9   2.122   0.959 -22.518
   71   1HG2  VAL   9          1HG2      VAL   9   2.746   0.003 -19.073
   72   2HG2  VAL   9          2HG2      VAL   9   2.453   1.338 -20.187
   73   3HG2  VAL   9          3HG2      VAL   9   3.927   0.379 -20.328
   74    H    GLU  10           H        GLU  10   1.347  -3.273 -22.039
   75    HA   GLU  10           HA       GLU  10  -1.040  -2.725 -23.519
   76   1HB   GLU  10          2HB       GLU  10   0.928  -5.010 -23.548
   77   2HB   GLU  10          1HB       GLU  10  -0.505  -4.996 -24.575
   78   1HG   GLU  10          2HG       GLU  10   0.295  -3.314 -25.909
   79   2HG   GLU  10          1HG       GLU  10   1.130  -2.514 -24.578
   80    H    GLN  11           H        GLN  11  -0.464  -4.497 -20.626
   81    HA   GLN  11           HA       GLN  11  -2.769  -6.261 -20.965
   82   1HB   GLN  11          2HB       GLN  11  -0.997  -5.893 -18.541
   83   2HB   GLN  11          1HB       GLN  11  -2.144  -7.202 -18.823
   84   1HG   GLN  11          2HG       GLN  11   0.013  -6.695 -20.842
   85   2HG   GLN  11          1HG       GLN  11   0.415  -7.554 -19.356
   86   1HE2  GLN  11          1HE2      GLN  11  -1.568  -7.721 -22.308
   87   2HE2  GLN  11          2HE2      GLN  11  -1.927  -9.375 -22.170
   88    H    LEU  12           H        LEU  12  -1.959  -3.223 -19.464
   89    HA   LEU  12           HA       LEU  12  -3.781  -2.982 -17.406
   90   1HB   LEU  12          2HB       LEU  12  -3.215  -0.801 -19.410
   91   2HB   LEU  12          1HB       LEU  12  -3.751  -0.603 -17.759
   92    HG   LEU  12           HG       LEU  12  -1.029  -1.415 -18.759
   93   1HD1  LEU  12          1HD1      LEU  12  -2.073   0.748 -16.909
   94   2HD1  LEU  12          2HD1      LEU  12  -1.432   0.972 -18.537
   95   3HD1  LEU  12          3HD1      LEU  12  -0.364   0.453 -17.233
   96   1HD2  LEU  12          1HD2      LEU  12  -2.225  -1.754 -15.995
   97   2HD2  LEU  12          2HD2      LEU  12  -0.485  -1.692 -16.282
   98   3HD2  LEU  12          3HD2      LEU  12  -1.451  -2.986 -16.994
   99    H    THR  13           H        THR  13  -5.872  -3.381 -17.343
  100    HA   THR  13           HA       THR  13  -7.534  -2.737 -19.711
  101    HB   THR  13           HB       THR  13  -9.097  -4.476 -18.377
  102    HG1  THR  13           HG1      THR  13  -8.007  -5.713 -17.093
  103   1HG2  THR  13          1HG2      THR  13  -6.835  -5.333 -20.197
  104   2HG2  THR  13          2HG2      THR  13  -8.323  -4.567 -20.754
  105   3HG2  THR  13          3HG2      THR  13  -8.383  -6.148 -19.975
  106    H    ASP  14           H        ASP  14  -9.778  -2.172 -19.235
  107    HA   ASP  14           HA       ASP  14  -9.985  -0.061 -17.363
  108   1HB   ASP  14          2HB       ASP  14 -11.383  -0.451 -19.490
  109   2HB   ASP  14          1HB       ASP  14 -12.357  -1.535 -18.498
  110    H    GLU  15           H        GLU  15 -10.801  -3.486 -17.195
  111    HA   GLU  15           HA       GLU  15 -12.421  -3.408 -14.869
  112   1HB   GLU  15          2HB       GLU  15 -10.880  -5.526 -16.306
  113   2HB   GLU  15          1HB       GLU  15 -11.438  -5.865 -14.668
  114   1HG   GLU  15          2HG       GLU  15 -13.730  -4.952 -15.517
  115   2HG   GLU  15          1HG       GLU  15 -13.067  -5.252 -17.123
  116    H    GLN  16           H        GLN  16  -8.940  -4.144 -15.263
  117    HA   GLN  16           HA       GLN  16  -8.374  -4.439 -12.501
  118   1HB   GLN  16          2HB       GLN  16  -6.566  -3.665 -14.804
  119   2HB   GLN  16          1HB       GLN  16  -5.996  -4.043 -13.179
  120   1HG   GLN  16          2HG       GLN  16  -7.181  -6.274 -13.388
  121   2HG   GLN  16          1HG       GLN  16  -7.453  -5.889 -15.088
  122   1HE2  GLN  16          1HE2      GLN  16  -5.329  -5.247 -16.319
  123   2HE2  GLN  16          2HE2      GLN  16  -3.936  -6.131 -15.922
  124    H    LYS  17           H        LYS  17  -8.088  -1.642 -14.686
  125    HA   LYS  17           HA       LYS  17  -7.053   0.126 -12.700
  126   1HB   LYS  17          2HB       LYS  17  -8.036   0.377 -15.479
  127   2HB   LYS  17          1HB       LYS  17  -8.168   1.827 -14.482
  128   1HG   LYS  17          2HG       LYS  17  -5.991   2.173 -15.026
  129   2HG   LYS  17          1HG       LYS  17  -5.651   0.923 -13.829
  130   1HD   LYS  17          2HD       LYS  17  -4.508   0.231 -15.803
  131   2HD   LYS  17          1HD       LYS  17  -5.957  -0.772 -15.728
  132   1HE   LYS  17          2HE       LYS  17  -6.008  -0.054 -17.949
  133   2HE   LYS  17          1HE       LYS  17  -7.022   1.158 -17.168
  134   1HZ   LYS  17          1HZ       LYS  17  -5.092   2.607 -16.997
  135   2HZ   LYS  17          2HZ       LYS  17  -5.391   2.184 -18.615
  136   3HZ   LYS  17          3HZ       LYS  17  -4.124   1.441 -17.760
  137    H    ASN  18           H        ASN  18 -10.279  -0.947 -13.488
  138    HA   ASN  18           HA       ASN  18 -11.679   1.257 -12.303
  139   1HB   ASN  18          2HB       ASN  18 -13.247   0.182 -13.530
  140   2HB   ASN  18          1HB       ASN  18 -12.360  -1.334 -13.502
  141   1HD2  ASN  18          1HD2      ASN  18 -13.057  -2.942 -12.054
  142   2HD2  ASN  18          2HD2      ASN  18 -14.321  -2.723 -10.940
  143    H    GLU  19           H        GLU  19 -10.693  -1.974 -11.195
  144    HA   GLU  19           HA       GLU  19 -11.758  -1.762  -8.559
  145   1HB   GLU  19          2HB       GLU  19  -9.429  -3.425  -9.568
  146   2HB   GLU  19          1HB       GLU  19 -10.232  -3.632  -8.012
  147   1HG   GLU  19          2HG       GLU  19 -11.786  -3.716 -10.593
  148   2HG   GLU  19          1HG       GLU  19 -10.989  -5.155  -9.963
  149    H    PHE  20           H        PHE  20  -8.594  -1.106  -9.991
  150    HA   PHE  20           HA       PHE  20  -7.255  -0.381  -7.592
  151   1HB   PHE  20          2HB       PHE  20  -6.738   0.043 -10.514
  152   2HB   PHE  20          1HB       PHE  20  -5.787   0.943  -9.338
  153    HD1  PHE  20           HD1      PHE  20  -3.834  -0.348 -10.352
  154    HD2  PHE  20           HD2      PHE  20  -6.985  -2.250  -8.137
  155    HE1  PHE  20           HE1      PHE  20  -2.389  -2.327  -9.989
  156    HE2  PHE  20           HE2      PHE  20  -5.544  -4.226  -7.778
  157    HZ   PHE  20           HZ       PHE  20  -3.241  -4.269  -8.702
  158    H    LYS  21           H        LYS  21  -8.992   1.533 -10.033
  159    HA   LYS  21           HA       LYS  21  -8.407   4.078  -8.905
  160   1HB   LYS  21          2HB       LYS  21  -9.206   3.771 -11.240
  161   2HB   LYS  21          1HB       LYS  21 -10.785   3.301 -10.613
  162   1HG   LYS  21          2HG       LYS  21 -10.772   5.685 -11.239
  163   2HG   LYS  21          1HG       LYS  21 -10.995   5.501  -9.500
  164   1HD   LYS  21          2HD       LYS  21  -8.909   6.342  -9.000
  165   2HD   LYS  21          1HD       LYS  21  -8.192   5.746 -10.498
  166   1HE   LYS  21          2HE       LYS  21  -9.099   7.529 -11.773
  167   2HE   LYS  21          1HE       LYS  21 -10.239   7.967 -10.500
  168   1HZ   LYS  21          1HZ       LYS  21  -8.415   8.675  -9.119
  169   2HZ   LYS  21          2HZ       LYS  21  -8.335   9.478 -10.614
  170   3HZ   LYS  21          3HZ       LYS  21  -7.284   8.185 -10.285
  171    H    ALA  22           H        ALA  22 -11.101   1.801  -8.492
  172    HA   ALA  22           HA       ALA  22 -12.681   3.484  -6.825
  173   1HB   ALA  22          1HB       ALA  22 -13.628   1.514  -7.951
  174   2HB   ALA  22          2HB       ALA  22 -13.874   1.425  -6.209
  175   3HB   ALA  22          3HB       ALA  22 -12.609   0.460  -6.971
  176    H    ALA  23           H        ALA  23 -10.280   0.945  -6.138
  177    HA   ALA  23           HA       ALA  23 -10.493   1.042  -3.304
  178   1HB   ALA  23          1HB       ALA  23  -9.414  -0.871  -4.139
  179   2HB   ALA  23          2HB       ALA  23  -8.097   0.076  -3.449
  180   3HB   ALA  23          3HB       ALA  23  -8.360   0.071  -5.194
  181    H    PHE  24           H        PHE  24  -8.936   3.098  -5.620
  182    HA   PHE  24           HA       PHE  24  -7.165   4.352  -3.675
  183   1HB   PHE  24          2HB       PHE  24  -6.728   3.986  -6.227
  184   2HB   PHE  24          1HB       PHE  24  -7.734   5.417  -6.431
  185    HD1  PHE  24           HD1      PHE  24  -4.535   4.115  -5.186
  186    HD2  PHE  24           HD2      PHE  24  -7.006   7.613  -5.563
  187    HE1  PHE  24           HE1      PHE  24  -2.588   5.552  -4.646
  188    HE2  PHE  24           HE2      PHE  24  -5.058   9.046  -5.022
  189    HZ   PHE  24           HZ       PHE  24  -2.850   8.016  -4.565
  190    H    ASP  25           H        ASP  25  -9.861   5.388  -5.786
  191    HA   ASP  25           HA       ASP  25 -10.174   7.970  -4.792
  192   1HB   ASP  25          2HB       ASP  25 -11.299   6.869  -6.829
  193   2HB   ASP  25          1HB       ASP  25 -12.525   6.317  -5.689
  194    H    ILE  26           H        ILE  26 -11.504   4.934  -3.496
  195    HA   ILE  26           HA       ILE  26 -13.388   6.053  -1.736
  196    HB   ILE  26           HB       ILE  26 -13.023   3.965  -0.351
  197   1HG1  ILE  26          2HG1      ILE  26 -11.635   2.342  -2.108
  198   2HG1  ILE  26          1HG1      ILE  26 -10.699   3.835  -2.147
  199   1HG2  ILE  26          1HG2      ILE  26 -13.667   3.997  -3.281
  200   2HG2  ILE  26          2HG2      ILE  26 -14.749   3.780  -1.906
  201   3HG2  ILE  26          3HG2      ILE  26 -13.683   2.467  -2.405
  202   1HD1  ILE  26          1HD1      ILE  26 -10.441   3.818   0.248
  203   2HD1  ILE  26          2HD1      ILE  26  -9.979   2.227  -0.354
  204   3HD1  ILE  26          3HD1      ILE  26 -11.553   2.460   0.407
  205    H    PHE  27           H        PHE  27  -9.909   5.579  -1.407
  206    HA   PHE  27           HA       PHE  27  -9.859   6.534   1.340
  207   1HB   PHE  27          2HB       PHE  27  -7.884   5.448  -0.587
  208   2HB   PHE  27          1HB       PHE  27  -7.263   6.637   0.557
  209    HD1  PHE  27           HD1      PHE  27  -7.996   6.294   3.071
  210    HD2  PHE  27           HD2      PHE  27  -8.057   3.215   0.077
  211    HE1  PHE  27           HE1      PHE  27  -7.961   4.563   4.848
  212    HE2  PHE  27           HE2      PHE  27  -8.023   1.486   1.853
  213    HZ   PHE  27           HZ       PHE  27  -7.974   2.160   4.239
  214    H    ILE  28           H        ILE  28  -9.380   7.791  -1.904
  215    HA   ILE  28           HA       ILE  28  -8.413  10.368  -0.896
  216    HB   ILE  28           HB       ILE  28  -8.943   9.635  -3.780
  217   1HG1  ILE  28          2HG1      ILE  28  -7.414   7.957  -3.223
  218   2HG1  ILE  28          1HG1      ILE  28  -6.357   9.264  -3.728
  219   1HG2  ILE  28          1HG2      ILE  28  -8.512  11.915  -3.728
  220   2HG2  ILE  28          2HG2      ILE  28  -6.879  11.271  -3.908
  221   3HG2  ILE  28          3HG2      ILE  28  -7.455  11.788  -2.323
  222   1HD1  ILE  28          1HD1      ILE  28  -6.928   8.277  -0.947
  223   2HD1  ILE  28          2HD1      ILE  28  -6.378   9.935  -1.202
  224   3HD1  ILE  28          3HD1      ILE  28  -5.371   8.579  -1.717
  225    H    GLN  29           H        GLN  29 -11.068   9.643  -0.155
  226    HA   GLN  29           HA       GLN  29 -12.961  10.942  -1.888
  227   1HB   GLN  29          2HB       GLN  29 -14.515  10.737   0.078
  228   2HB   GLN  29          1HB       GLN  29 -13.807   9.210  -0.441
  229   1HG   GLN  29          2HG       GLN  29 -12.448   9.044   1.432
  230   2HG   GLN  29          1HG       GLN  29 -12.391  10.789   1.677
  231   1HE2  GLN  29          1HE2      GLN  29 -13.958  11.722   3.069
  232   2HE2  GLN  29          2HE2      GLN  29 -15.198  10.831   3.810
  233    H    ASP  30           H        ASP  30 -10.938  11.899   0.810
  234    HA   ASP  30           HA       ASP  30 -11.605  14.698   0.310
  235   1HB   ASP  30          2HB       ASP  30 -12.989  13.494   2.300
  236   2HB   ASP  30          1HB       ASP  30 -11.551  13.991   3.190
  237    H    ALA  31           H        ALA  31  -9.255  13.189  -0.266
  238    HA   ALA  31           HA       ALA  31  -7.261  13.600   1.758
  239   1HB   ALA  31          1HB       ALA  31  -6.859  13.170  -1.211
  240   2HB   ALA  31          2HB       ALA  31  -7.077  11.871  -0.040
  241   3HB   ALA  31          3HB       ALA  31  -5.664  12.923   0.062
  242    H    GLU  32           H        GLU  32  -5.541  15.092   1.724
  243    HA   GLU  32           HA       GLU  32  -6.288  17.734   0.798
  244   1HB   GLU  32          2HB       GLU  32  -3.999  16.637   2.414
  245   2HB   GLU  32          1HB       GLU  32  -3.953  18.286   1.792
  246   1HG   GLU  32          2HG       GLU  32  -5.999  18.853   2.956
  247   2HG   GLU  32          1HG       GLU  32  -6.237  17.176   3.447
  248    H    ASP  33           H        ASP  33  -3.695  15.404   0.135
  249    HA   ASP  33           HA       ASP  33  -2.682  17.043  -2.073
  250   1HB   ASP  33          2HB       ASP  33  -1.714  14.419  -0.911
  251   2HB   ASP  33          1HB       ASP  33  -0.926  15.282  -2.231
  252    H    GLY  34           H        GLY  34  -4.190  13.874  -1.515
  253   1HA   GLY  34          2HA       GLY  34  -5.850  13.093  -3.141
  254   2HA   GLY  34          1HA       GLY  34  -4.806  13.722  -4.411
  255    H    CYS  35           H        CYS  35  -3.931  11.826  -1.538
  256    HA   CYS  35           HA       CYS  35  -3.475   9.406  -3.075
  257   1HB   CYS  35          2HB       CYS  35  -1.000   9.527  -1.958
  258   2HB   CYS  35          1HB       CYS  35  -1.344   9.986  -3.622
  259    HG   CYS  35           HG       CYS  35  -0.069  11.901  -2.094
  260    H    ILE  36           H        ILE  36  -2.329   7.728  -1.556
  261    HA   ILE  36           HA       ILE  36  -3.632   7.997   1.084
  262    HB   ILE  36           HB       ILE  36  -3.448   5.530   1.226
  263   1HG1  ILE  36          2HG1      ILE  36  -3.027   4.824  -1.469
  264   2HG1  ILE  36          1HG1      ILE  36  -1.731   5.950  -1.068
  265   1HG2  ILE  36          1HG2      ILE  36  -5.307   5.108  -0.141
  266   2HG2  ILE  36          2HG2      ILE  36  -4.737   6.191  -1.412
  267   3HG2  ILE  36          3HG2      ILE  36  -5.384   6.855   0.090
  268   1HD1  ILE  36          1HD1      ILE  36  -0.682   4.359   0.123
  269   2HD1  ILE  36          2HD1      ILE  36  -1.937   3.209  -0.338
  270   3HD1  ILE  36          3HD1      ILE  36  -2.104   4.154   1.146
  271    H    SER  37           H        SER  37  -2.393   6.493   2.752
  272    HA   SER  37           HA       SER  37   0.303   7.620   2.916
  273   1HB   SER  37          2HB       SER  37  -1.496   7.578   4.832
  274   2HB   SER  37          1HB       SER  37  -0.924   5.929   5.067
  275    HG   SER  37           HG       SER  37   0.760   6.747   6.000
  276    H    THR  38           H        THR  38   2.143   6.425   3.035
  277    HA   THR  38           HA       THR  38   2.250   3.928   1.722
  278    HB   THR  38           HB       THR  38   4.607   3.829   2.690
  279    HG1  THR  38           HG1      THR  38   4.681   5.027   4.437
  280   1HG2  THR  38          1HG2      THR  38   4.457   4.728   0.532
  281   2HG2  THR  38          2HG2      THR  38   5.240   6.023   1.438
  282   3HG2  THR  38          3HG2      THR  38   3.518   6.118   1.075
  283    H    LYS  39           H        LYS  39   1.848   4.791   5.093
  284    HA   LYS  39           HA       LYS  39   2.441   2.184   6.155
  285   1HB   LYS  39          2HB       LYS  39   0.981   4.544   7.365
  286   2HB   LYS  39          1HB       LYS  39   1.423   3.081   8.243
  287   1HG   LYS  39          2HG       LYS  39   3.590   3.714   8.431
  288   2HG   LYS  39          1HG       LYS  39   3.666   4.257   6.756
  289   1HD   LYS  39          2HD       LYS  39   3.910   6.271   7.915
  290   2HD   LYS  39          1HD       LYS  39   2.173   6.239   7.613
  291   1HE   LYS  39          2HE       LYS  39   2.193   6.706   9.888
  292   2HE   LYS  39          1HE       LYS  39   2.120   4.945   9.925
  293   1HZ   LYS  39          1HZ       LYS  39   4.550   6.631  10.188
  294   2HZ   LYS  39          2HZ       LYS  39   4.570   4.936  10.068
  295   3HZ   LYS  39          3HZ       LYS  39   3.831   5.688  11.400
  296    H    GLU  40           H        GLU  40  -0.484   3.861   5.055
  297    HA   GLU  40           HA       GLU  40  -2.195   1.722   6.038
  298   1HB   GLU  40          2HB       GLU  40  -4.039   3.065   5.342
  299   2HB   GLU  40          1HB       GLU  40  -2.880   4.140   6.111
  300   1HG   GLU  40          2HG       GLU  40  -2.644   5.343   4.227
  301   2HG   GLU  40          1HG       GLU  40  -2.325   3.897   3.273
  302    H    LEU  41           H        LEU  41  -0.146   1.572   3.625
  303    HA   LEU  41           HA       LEU  41  -1.585   1.066   1.270
  304   1HB   LEU  41          2HB       LEU  41   1.073   0.847   2.086
  305   2HB   LEU  41          1HB       LEU  41   0.621  -0.783   1.632
  306    HG   LEU  41           HG       LEU  41   0.390   1.671  -0.111
  307   1HD1  LEU  41          1HD1      LEU  41   2.139   0.397  -1.451
  308   2HD1  LEU  41          2HD1      LEU  41   2.312  -0.666  -0.053
  309   3HD1  LEU  41          3HD1      LEU  41   2.699   1.050   0.089
  310   1HD2  LEU  41          1HD2      LEU  41  -0.354   0.187  -1.851
  311   2HD2  LEU  41          2HD2      LEU  41  -1.355  -0.149  -0.438
  312   3HD2  LEU  41          3HD2      LEU  41  -0.028  -1.234  -0.857
  313    H    GLY  42           H        GLY  42  -0.901  -0.975   4.060
  314   1HA   GLY  42          2HA       GLY  42  -1.831  -3.437   3.006
  315   2HA   GLY  42          1HA       GLY  42  -1.707  -3.035   4.714
  316    H    LYS  43           H        LYS  43  -3.532  -0.590   3.939
  317    HA   LYS  43           HA       LYS  43  -6.020  -1.944   4.585
  318   1HB   LYS  43          2HB       LYS  43  -5.512   1.010   4.152
  319   2HB   LYS  43          1HB       LYS  43  -6.933   0.284   4.901
  320   1HG   LYS  43          2HG       LYS  43  -4.122  -0.055   5.982
  321   2HG   LYS  43          1HG       LYS  43  -5.231   1.196   6.540
  322   1HD   LYS  43          2HD       LYS  43  -6.742  -0.379   7.446
  323   2HD   LYS  43          1HD       LYS  43  -6.043  -1.710   6.524
  324   1HE   LYS  43          2HE       LYS  43  -4.288  -0.233   8.451
  325   2HE   LYS  43          1HE       LYS  43  -5.452  -1.392   9.090
  326   1HZ   LYS  43          1HZ       LYS  43  -4.530  -3.080   7.635
  327   2HZ   LYS  43          2HZ       LYS  43  -3.316  -2.430   8.629
  328   3HZ   LYS  43          3HZ       LYS  43  -3.421  -1.966   6.998
  329    H    VAL  44           H        VAL  44  -4.644  -0.055   1.885
  330    HA   VAL  44           HA       VAL  44  -7.055   0.000   0.357
  331    HB   VAL  44           HB       VAL  44  -5.562   0.568  -1.572
  332   1HG1  VAL  44          1HG1      VAL  44  -4.537   2.635  -0.276
  333   2HG1  VAL  44          2HG1      VAL  44  -5.529   2.017   1.044
  334   3HG1  VAL  44          3HG1      VAL  44  -6.282   2.479  -0.483
  335   1HG2  VAL  44          1HG2      VAL  44  -3.190   0.868  -1.214
  336   2HG2  VAL  44          2HG2      VAL  44  -3.599  -0.783  -0.748
  337   3HG2  VAL  44          3HG2      VAL  44  -3.348   0.448   0.492
  338    H    MET  45           H        MET  45  -4.328  -2.253   0.548
  339    HA   MET  45           HA       MET  45  -5.150  -3.864  -1.679
  340   1HB   MET  45          2HB       MET  45  -3.366  -4.566   0.666
  341   2HB   MET  45          1HB       MET  45  -3.535  -5.511  -0.813
  342   1HG   MET  45          2HG       MET  45  -2.758  -3.530  -2.120
  343   2HG   MET  45          1HG       MET  45  -2.488  -2.674  -0.604
  344   1HE   MET  45          1HE       MET  45  -1.453  -3.499   1.216
  345   2HE   MET  45          2HE       MET  45   0.206  -3.115   0.762
  346   3HE   MET  45          3HE       MET  45  -0.187  -4.728   1.354
  347    H    ARG  46           H        ARG  46  -5.861  -3.780   1.749
  348    HA   ARG  46           HA       ARG  46  -6.995  -6.339   2.078
  349   1HB   ARG  46          2HB       ARG  46  -6.848  -3.887   3.598
  350   2HB   ARG  46          1HB       ARG  46  -8.470  -4.570   3.701
  351   1HG   ARG  46          2HG       ARG  46  -6.052  -6.332   4.058
  352   2HG   ARG  46          1HG       ARG  46  -6.670  -5.378   5.406
  353   1HD   ARG  46          2HD       ARG  46  -8.384  -7.254   3.759
  354   2HD   ARG  46          1HD       ARG  46  -7.605  -7.721   5.266
  355    HE   ARG  46           HE       ARG  46  -9.048  -5.420   5.843
  356   1HH1  ARG  46          2HH1      ARG  46  -9.707  -8.629   4.634
  357   2HH1  ARG  46          1HH1      ARG  46 -11.309  -8.682   5.286
  358   1HH2  ARG  46          1HH2      ARG  46 -11.152  -5.508   6.687
  359   2HH2  ARG  46          2HH2      ARG  46 -12.126  -6.920   6.445
  360    H    MET  47           H        MET  47  -8.411  -3.262   1.015
  361    HA   MET  47           HA       MET  47 -11.087  -4.277   0.801
  362   1HB   MET  47          2HB       MET  47  -9.685  -1.764   0.013
  363   2HB   MET  47          1HB       MET  47 -11.211  -2.143  -0.786
  364   1HG   MET  47          2HG       MET  47 -12.321  -2.372   1.391
  365   2HG   MET  47          1HG       MET  47 -10.795  -2.055   2.217
  366   1HE   MET  47          1HE       MET  47 -13.980  -0.728   1.011
  367   2HE   MET  47          2HE       MET  47 -13.182  -0.662  -0.558
  368   3HE   MET  47          3HE       MET  47 -13.677   0.831   0.233
  369    H    LEU  48           H        LEU  48  -8.352  -3.937  -1.415
  370    HA   LEU  48           HA       LEU  48  -9.714  -4.511  -3.829
  371   1HB   LEU  48          2HB       LEU  48  -7.157  -3.820  -3.171
  372   2HB   LEU  48          1HB       LEU  48  -6.950  -5.506  -3.585
  373    HG   LEU  48           HG       LEU  48  -6.494  -4.233  -5.552
  374   1HD1  LEU  48          1HD1      LEU  48  -9.346  -5.227  -5.808
  375   2HD1  LEU  48          2HD1      LEU  48  -7.927  -6.274  -5.830
  376   3HD1  LEU  48          3HD1      LEU  48  -8.158  -5.076  -7.103
  377   1HD2  LEU  48          1HD2      LEU  48  -9.169  -2.882  -5.064
  378   2HD2  LEU  48          2HD2      LEU  48  -8.137  -2.616  -6.470
  379   3HD2  LEU  48          3HD2      LEU  48  -7.582  -2.138  -4.866
  380    H    GLY  49           H        GLY  49  -7.845  -6.627  -1.638
  381   1HA   GLY  49          2HA       GLY  49  -9.261  -8.807  -1.295
  382   2HA   GLY  49          1HA       GLY  49  -8.907  -9.006  -3.008
  383    H    GLN  50           H        GLN  50  -6.992  -7.936  -0.186
  384    HA   GLN  50           HA       GLN  50  -5.237 -10.245  -0.368
  385   1HB   GLN  50          2HB       GLN  50  -4.506  -7.641  -1.528
  386   2HB   GLN  50          1HB       GLN  50  -3.320  -8.280  -0.390
  387   1HG   GLN  50          2HG       GLN  50  -3.501 -10.493  -1.650
  388   2HG   GLN  50          1HG       GLN  50  -4.392  -9.605  -2.887
  389   1HE2  GLN  50          1HE2      GLN  50  -3.179  -8.326  -4.356
  390   2HE2  GLN  50          2HE2      GLN  50  -1.495  -8.127  -4.257
  391    H    ASN  51           H        ASN  51  -4.032 -10.570   1.505
  392    HA   ASN  51           HA       ASN  51  -4.189  -8.516   3.604
  393   1HB   ASN  51          2HB       ASN  51  -6.117 -10.195   3.790
  394   2HB   ASN  51          1HB       ASN  51  -4.888 -11.386   4.218
  395   1HD2  ASN  51          1HD2      ASN  51  -4.468 -11.516   6.426
  396   2HD2  ASN  51          2HD2      ASN  51  -4.728 -10.264   7.541
  397    HA   PRO  52           HA       PRO  52  -0.041 -10.504   3.563
  398   1HB   PRO  52          2HB       PRO  52   1.357  -8.157   3.405
  399   2HB   PRO  52          1HB       PRO  52   0.746  -9.029   1.994
  400   1HG   PRO  52          2HG       PRO  52  -0.223  -6.523   3.216
  401   2HG   PRO  52          1HG       PRO  52  -0.398  -7.106   1.555
  402   1HD   PRO  52          2HD       PRO  52  -2.378  -7.176   3.608
  403   2HD   PRO  52          1HD       PRO  52  -2.478  -7.935   2.002
  404    H    THR  53           H        THR  53   2.026  -9.347   4.879
  405    HA   THR  53           HA       THR  53   1.000  -8.947   7.629
  406    HB   THR  53           HB       THR  53   2.861 -10.078   8.466
  407    HG1  THR  53           HG1      THR  53   4.777  -9.786   7.673
  408   1HG2  THR  53          1HG2      THR  53   1.479 -11.611   7.089
  409   2HG2  THR  53          2HG2      THR  53   3.169 -12.111   7.162
  410   3HG2  THR  53          3HG2      THR  53   2.548 -11.307   5.719
  411    HA   PRO  54           HA       PRO  54   2.952  -4.997   7.870
  412   1HB   PRO  54          2HB       PRO  54   4.409  -5.061  10.192
  413   2HB   PRO  54          1HB       PRO  54   2.644  -4.937  10.133
  414   1HG   PRO  54          2HG       PRO  54   4.354  -7.286  10.774
  415   2HG   PRO  54          1HG       PRO  54   2.749  -6.857  11.386
  416   1HD   PRO  54          2HD       PRO  54   3.244  -8.778   9.429
  417   2HD   PRO  54          1HD       PRO  54   1.677  -7.977   9.690
  418    H    GLU  55           H        GLU  55   5.159  -7.706   8.231
  419    HA   GLU  55           HA       GLU  55   7.532  -6.150   7.585
  420   1HB   GLU  55          2HB       GLU  55   7.325  -9.163   7.613
  421   2HB   GLU  55          1HB       GLU  55   8.757  -8.165   7.862
  422   1HG   GLU  55          2HG       GLU  55   7.670  -7.255   9.946
  423   2HG   GLU  55          1HG       GLU  55   6.382  -8.439   9.724
  424    H    GLU  56           H        GLU  56   5.329  -8.431   6.023
  425    HA   GLU  56           HA       GLU  56   6.783  -8.712   3.588
  426   1HB   GLU  56          2HB       GLU  56   4.846 -10.168   4.560
  427   2HB   GLU  56          1HB       GLU  56   3.799  -9.006   3.746
  428   1HG   GLU  56          2HG       GLU  56   4.727  -9.515   1.608
  429   2HG   GLU  56          1HG       GLU  56   6.080 -10.392   2.324
  430    H    LEU  57           H        LEU  57   3.898  -6.763   4.439
  431    HA   LEU  57           HA       LEU  57   3.640  -5.480   1.943
  432   1HB   LEU  57          2HB       LEU  57   1.793  -4.749   2.925
  433   2HB   LEU  57          1HB       LEU  57   2.346  -5.380   4.455
  434    HG   LEU  57           HG       LEU  57   3.202  -2.652   3.518
  435   1HD1  LEU  57          1HD1      LEU  57   0.607  -3.471   4.828
  436   2HD1  LEU  57          2HD1      LEU  57   0.831  -2.490   3.379
  437   3HD1  LEU  57          3HD1      LEU  57   1.253  -1.835   4.961
  438   1HD2  LEU  57          1HD2      LEU  57   4.206  -2.626   5.537
  439   2HD2  LEU  57          2HD2      LEU  57   3.666  -4.283   5.806
  440   3HD2  LEU  57          3HD2      LEU  57   2.657  -2.935   6.325
  441    H    GLN  58           H        GLN  58   5.727  -4.814   4.688
  442    HA   GLN  58           HA       GLN  58   6.432  -2.162   4.229
  443   1HB   GLN  58          2HB       GLN  58   7.375  -4.230   5.867
  444   2HB   GLN  58          1HB       GLN  58   8.772  -3.731   4.916
  445   1HG   GLN  58          2HG       GLN  58   6.978  -1.894   6.534
  446   2HG   GLN  58          1HG       GLN  58   8.613  -2.388   6.971
  447   1HE2  GLN  58          1HE2      GLN  58   6.740  -0.230   4.930
  448   2HE2  GLN  58          2HE2      GLN  58   8.065   0.584   4.249
  449    H    GLU  59           H        GLU  59   7.746  -5.114   2.745
  450    HA   GLU  59           HA       GLU  59   9.746  -3.836   1.182
  451   1HB   GLU  59          2HB       GLU  59   8.302  -6.469   0.805
  452   2HB   GLU  59          1HB       GLU  59   9.655  -5.941  -0.196
  453   1HG   GLU  59          2HG       GLU  59  10.842  -5.565   2.130
  454   2HG   GLU  59          1HG       GLU  59   9.637  -6.717   2.704
  455    H    MET  60           H        MET  60   6.360  -4.695   0.532
  456    HA   MET  60           HA       MET  60   6.309  -4.037  -2.211
  457   1HB   MET  60          2HB       MET  60   4.229  -4.285  -0.072
  458   2HB   MET  60          1HB       MET  60   3.783  -3.552  -1.613
  459   1HG   MET  60          2HG       MET  60   5.028  -5.653  -2.623
  460   2HG   MET  60          1HG       MET  60   4.687  -6.355  -1.041
  461   1HE   MET  60          1HE       MET  60   1.194  -7.259  -0.941
  462   2HE   MET  60          2HE       MET  60   1.979  -6.010   0.021
  463   3HE   MET  60          3HE       MET  60   2.878  -7.454  -0.438
  464    H    ILE  61           H        ILE  61   5.678  -2.074   0.690
  465    HA   ILE  61           HA       ILE  61   4.789   0.275  -0.526
  466    HB   ILE  61           HB       ILE  61   6.393  -0.176   1.996
  467   1HG1  ILE  61          2HG1      ILE  61   3.561   0.729   1.945
  468   2HG1  ILE  61          1HG1      ILE  61   3.871  -0.935   1.452
  469   1HG2  ILE  61          1HG2      ILE  61   6.813   2.097   1.399
  470   2HG2  ILE  61          2HG2      ILE  61   5.521   2.137   2.601
  471   3HG2  ILE  61          3HG2      ILE  61   5.141   2.346   0.891
  472   1HD1  ILE  61          1HD1      ILE  61   3.444  -0.697   3.909
  473   2HD1  ILE  61          2HD1      ILE  61   4.902   0.290   4.022
  474   3HD1  ILE  61          3HD1      ILE  61   5.015  -1.400   3.528
  475    H    ASP  62           H        ASP  62   8.086  -0.146   0.771
  476    HA   ASP  62           HA       ASP  62   9.280   2.022  -0.465
  477   1HB   ASP  62          2HB       ASP  62  10.495  -0.660   0.231
  478   2HB   ASP  62          1HB       ASP  62  11.427   0.764  -0.225
  479    H    GLU  63           H        GLU  63   8.699  -1.211  -1.792
  480    HA   GLU  63           HA       GLU  63  10.305  -1.003  -4.102
  481   1HB   GLU  63          2HB       GLU  63   7.987  -2.691  -3.280
  482   2HB   GLU  63          1HB       GLU  63   8.410  -2.649  -4.991
  483   1HG   GLU  63          2HG       GLU  63  10.741  -3.252  -4.424
  484   2HG   GLU  63          1HG       GLU  63  10.301  -3.326  -2.718
  485    H    VAL  64           H        VAL  64   6.783  -0.451  -3.730
  486    HA   VAL  64           HA       VAL  64   6.461   0.524  -6.403
  487    HB   VAL  64           HB       VAL  64   4.207   1.105  -5.769
  488   1HG1  VAL  64          1HG1      VAL  64   5.388  -1.482  -4.942
  489   2HG1  VAL  64          2HG1      VAL  64   4.049  -1.152  -6.041
  490   3HG1  VAL  64          3HG1      VAL  64   3.781  -1.143  -4.298
  491   1HG2  VAL  64          1HG2      VAL  64   4.842   2.168  -3.582
  492   2HG2  VAL  64          2HG2      VAL  64   5.019   0.548  -2.901
  493   3HG2  VAL  64          3HG2      VAL  64   3.443   1.100  -3.466
  494    H    ASP  65           H        ASP  65   7.280   2.042  -3.354
  495    HA   ASP  65           HA       ASP  65   6.604   4.711  -4.111
  496   1HB   ASP  65          2HB       ASP  65   7.304   3.532  -1.743
  497   2HB   ASP  65          1HB       ASP  65   8.788   4.389  -2.155
  498    H    GLU  66           H        GLU  66   7.467   4.987  -6.168
  499    HA   GLU  66           HA       GLU  66  10.270   4.654  -6.725
  500   1HB   GLU  66          2HB       GLU  66   7.961   5.883  -8.207
  501   2HB   GLU  66          1HB       GLU  66   9.613   6.084  -8.794
  502   1HG   GLU  66          2HG       GLU  66   9.925   3.697  -8.959
  503   2HG   GLU  66          1HG       GLU  66   8.397   3.388  -8.135
  504    H    ASP  67           H        ASP  67   8.217   7.357  -5.754
  505    HA   ASP  67           HA       ASP  67  10.334   9.311  -6.109
  506   1HB   ASP  67          2HB       ASP  67   8.654  10.820  -4.851
  507   2HB   ASP  67          1HB       ASP  67   8.221  10.266  -6.466
  508    H    GLY  68           H        GLY  68   8.694   7.759  -3.352
  509   1HA   GLY  68          2HA       GLY  68   9.517   7.282  -1.234
  510   2HA   GLY  68          1HA       GLY  68  11.062   7.978  -1.715
  511    H    SER  69           H        SER  69   7.780   9.374  -1.657
  512    HA   SER  69           HA       SER  69   8.833  11.700  -0.218
  513   1HB   SER  69          2HB       SER  69   6.650  12.738  -0.763
  514   2HB   SER  69          1HB       SER  69   7.494  12.170  -2.198
  515    HG   SER  69           HG       SER  69   5.073  11.522  -1.364
  516    H    GLY  70           H        GLY  70   6.050   9.466   0.015
  517   1HA   GLY  70          2HA       GLY  70   6.112   8.676   2.581
  518   2HA   GLY  70          1HA       GLY  70   5.497  10.317   2.746
  519    H    THR  71           H        THR  71   4.077  10.200   0.151
  520    HA   THR  71           HA       THR  71   1.776   8.575   1.036
  521    HB   THR  71           HB       THR  71   0.376  10.067  -0.275
  522    HG1  THR  71           HG1      THR  71   2.720  11.538  -0.883
  523   1HG2  THR  71          1HG2      THR  71   2.384  11.544   1.449
  524   2HG2  THR  71          2HG2      THR  71   0.894  10.776   2.000
  525   3HG2  THR  71          3HG2      THR  71   0.821  12.190   0.949
  526    H    VAL  72           H        VAL  72   0.629   7.318  -0.444
  527    HA   VAL  72           HA       VAL  72   2.228   6.443  -2.760
  528    HB   VAL  72           HB       VAL  72  -0.178   5.088  -1.524
  529   1HG1  VAL  72          1HG1      VAL  72   0.442   4.564  -3.920
  530   2HG1  VAL  72          2HG1      VAL  72   0.500   3.180  -2.828
  531   3HG1  VAL  72          3HG1      VAL  72   1.993   3.979  -3.320
  532   1HG2  VAL  72          1HG2      VAL  72   1.522   5.107   0.161
  533   2HG2  VAL  72          2HG2      VAL  72   2.790   4.773  -1.018
  534   3HG2  VAL  72          3HG2      VAL  72   1.616   3.521  -0.606
  535    H    ASP  73           H        ASP  73   1.720   7.389  -4.603
  536    HA   ASP  73           HA       ASP  73  -0.948   8.464  -5.067
  537   1HB   ASP  73          2HB       ASP  73   1.589   8.490  -6.721
  538   2HB   ASP  73          1HB       ASP  73   0.067   9.194  -7.263
  539    H    PHE  74           H        PHE  74  -1.622   8.074  -7.548
  540    HA   PHE  74           HA       PHE  74  -2.502   5.380  -7.667
  541   1HB   PHE  74          2HB       PHE  74  -3.520   7.522  -8.752
  542   2HB   PHE  74          1HB       PHE  74  -2.433   7.155 -10.091
  543    HD1  PHE  74           HD1      PHE  74  -3.862   6.371 -11.786
  544    HD2  PHE  74           HD2      PHE  74  -4.213   4.784  -7.813
  545    HE1  PHE  74           HE1      PHE  74  -5.454   4.657 -12.610
  546    HE2  PHE  74           HE2      PHE  74  -5.797   3.067  -8.637
  547    HZ   PHE  74           HZ       PHE  74  -6.422   3.003 -11.035
  548    H    ASP  75           H        ASP  75   0.239   7.053  -9.136
  549    HA   ASP  75           HA       ASP  75   0.929   5.059 -11.038
  550   1HB   ASP  75          2HB       ASP  75   2.280   7.403  -9.814
  551   2HB   ASP  75          1HB       ASP  75   3.334   6.151 -10.469
  552    H    GLU  76           H        GLU  76   1.789   5.576  -7.650
  553    HA   GLU  76           HA       GLU  76   3.574   3.291  -7.531
  554   1HB   GLU  76          2HB       GLU  76   2.389   4.679  -5.132
  555   2HB   GLU  76          1HB       GLU  76   3.951   3.875  -5.281
  556   1HG   GLU  76          2HG       GLU  76   4.816   5.638  -6.676
  557   2HG   GLU  76          1HG       GLU  76   3.217   6.373  -6.834
  558    H    PHE  77           H        PHE  77   0.209   3.929  -7.147
  559    HA   PHE  77           HA       PHE  77  -0.417   1.644  -5.511
  560   1HB   PHE  77          2HB       PHE  77  -1.800   3.710  -5.540
  561   2HB   PHE  77          1HB       PHE  77  -2.235   3.372  -7.213
  562    HD1  PHE  77           HD1      PHE  77  -2.537   2.183  -3.707
  563    HD2  PHE  77           HD2      PHE  77  -3.827   1.681  -7.780
  564    HE1  PHE  77           HE1      PHE  77  -4.365   0.692  -2.948
  565    HE2  PHE  77           HE2      PHE  77  -5.652   0.188  -7.011
  566    HZ   PHE  77           HZ       PHE  77  -5.924  -0.305  -4.598
  567    H    LEU  78           H        LEU  78  -0.507   2.415  -8.984
  568    HA   LEU  78           HA       LEU  78  -1.747  -0.062  -9.755
  569   1HB   LEU  78          2HB       LEU  78  -0.221   1.992 -11.341
  570   2HB   LEU  78          1HB       LEU  78  -1.060   0.624 -12.045
  571    HG   LEU  78           HG       LEU  78  -2.662   2.427 -10.298
  572   1HD1  LEU  78          1HD1      LEU  78  -1.337   3.228 -12.863
  573   2HD1  LEU  78          2HD1      LEU  78  -1.663   4.191 -11.424
  574   3HD1  LEU  78          3HD1      LEU  78  -2.973   3.799 -12.537
  575   1HD2  LEU  78          1HD2      LEU  78  -3.670   1.808 -12.950
  576   2HD2  LEU  78          2HD2      LEU  78  -4.334   1.364 -11.377
  577   3HD2  LEU  78          3HD2      LEU  78  -3.114   0.343 -12.139
  578    H    VAL  79           H        VAL  79   1.611   1.086  -9.565
  579    HA   VAL  79           HA       VAL  79   2.861  -0.975 -11.002
  580    HB   VAL  79           HB       VAL  79   4.871  -0.510  -9.536
  581   1HG1  VAL  79          1HG1      VAL  79   4.847   0.698 -11.534
  582   2HG1  VAL  79          2HG1      VAL  79   4.914   1.986 -10.331
  583   3HG1  VAL  79          3HG1      VAL  79   3.382   1.577 -11.101
  584   1HG2  VAL  79          1HG2      VAL  79   3.542   0.185  -7.532
  585   2HG2  VAL  79          2HG2      VAL  79   3.063   1.639  -8.404
  586   3HG2  VAL  79          3HG2      VAL  79   4.758   1.371  -8.004
  587    H    MET  80           H        MET  80   1.489  -0.991  -7.808
  588    HA   MET  80           HA       MET  80   2.785  -3.050  -6.515
  589   1HB   MET  80          2HB       MET  80   0.029  -1.972  -6.491
  590   2HB   MET  80          1HB       MET  80   0.226  -3.591  -5.819
  591   1HG   MET  80          2HG       MET  80   2.223  -2.586  -4.512
  592   2HG   MET  80          1HG       MET  80   1.531  -1.020  -4.935
  593   1HE   MET  80          1HE       MET  80  -1.569  -1.468  -4.959
  594   2HE   MET  80          2HE       MET  80  -0.634  -0.127  -4.299
  595   3HE   MET  80          3HE       MET  80  -1.873  -0.895  -3.313
  596    H    MET  81           H        MET  81   0.406  -3.309  -9.140
  597    HA   MET  81           HA       MET  81   0.061  -6.137  -8.911
  598   1HB   MET  81          2HB       MET  81  -1.135  -6.017 -11.009
  599   2HB   MET  81          1HB       MET  81  -1.611  -4.660  -9.992
  600   1HG   MET  81          2HG       MET  81  -1.134  -3.336 -11.754
  601   2HG   MET  81          1HG       MET  81   0.562  -3.677 -11.437
  602   1HE   MET  81          1HE       MET  81  -2.361  -5.707 -14.205
  603   2HE   MET  81          2HE       MET  81  -2.068  -3.993 -14.483
  604   3HE   MET  81          3HE       MET  81  -2.606  -4.541 -12.897
  605    H    VAL  82           H        VAL  82   2.213  -4.125 -10.908
  606    HA   VAL  82           HA       VAL  82   3.242  -6.403 -12.368
  607    HB   VAL  82           HB       VAL  82   4.945  -4.772 -13.226
  608   1HG1  VAL  82          1HG1      VAL  82   2.212  -3.559 -13.500
  609   2HG1  VAL  82          2HG1      VAL  82   2.523  -5.180 -14.122
  610   3HG1  VAL  82          3HG1      VAL  82   3.448  -3.808 -14.734
  611   1HG2  VAL  82          1HG2      VAL  82   4.864  -3.322 -11.148
  612   2HG2  VAL  82          2HG2      VAL  82   3.306  -2.722 -11.717
  613   3HG2  VAL  82          3HG2      VAL  82   4.760  -2.438 -12.671
  614    H    ARG  83           H        ARG  83   4.134  -4.596  -9.498
  615    HA   ARG  83           HA       ARG  83   6.817  -5.399  -9.224
  616   1HB   ARG  83          2HB       ARG  83   4.707  -4.671  -7.190
  617   2HB   ARG  83          1HB       ARG  83   6.365  -5.064  -6.732
  618   1HG   ARG  83          2HG       ARG  83   5.960  -3.070  -8.922
  619   2HG   ARG  83          1HG       ARG  83   5.635  -2.553  -7.268
  620   1HD   ARG  83          2HD       ARG  83   7.865  -3.176  -6.570
  621   2HD   ARG  83          1HD       ARG  83   8.199  -3.909  -8.134
  622    HE   ARG  83           HE       ARG  83   7.513  -1.152  -8.432
  623   1HH1  ARG  83          2HH1      ARG  83  10.074  -3.295  -7.411
  624   2HH1  ARG  83          1HH1      ARG  83  11.335  -2.180  -7.806
  625   1HH2  ARG  83          1HH2      ARG  83   9.184   0.297  -8.941
  626   2HH2  ARG  83          2HH2      ARG  83  10.835  -0.151  -8.669
  627    H    CYS  84           H        CYS  84   3.813  -7.085  -8.610
  628    HA   CYS  84           HA       CYS  84   4.753  -9.139  -6.915
  629   1HB   CYS  84          2HB       CYS  84   2.458  -8.968  -8.858
  630   2HB   CYS  84          1HB       CYS  84   2.803 -10.457  -7.978
  631    HG   CYS  84           HG       CYS  84   2.357  -7.801  -6.394
  632    H    MET  85           H        MET  85   4.779  -8.795 -10.444
  633    HA   MET  85           HA       MET  85   5.622 -11.474 -10.984
  634   1HB   MET  85          2HB       MET  85   4.866  -9.226 -12.530
  635   2HB   MET  85          1HB       MET  85   6.502  -9.647 -13.032
  636   1HG   MET  85          2HG       MET  85   5.411 -12.124 -12.894
  637   2HG   MET  85          1HG       MET  85   3.980 -11.184 -13.319
  638   1HE   MET  85          1HE       MET  85   4.717  -8.908 -15.285
  639   2HE   MET  85          2HE       MET  85   3.453 -10.134 -15.254
  640   3HE   MET  85          3HE       MET  85   4.405  -9.898 -16.717
  641    H    LYS  86           H        LYS  86   7.510  -8.525 -11.698
  642    HA   LYS  86           HA       LYS  86   9.745  -8.051 -11.537
  643   1HB   LYS  86          2HB       LYS  86   9.177  -9.630  -9.089
  644   2HB   LYS  86          1HB       LYS  86  10.874  -9.449  -9.533
  645   1HG   LYS  86          2HG       LYS  86   9.054  -7.051  -9.533
  646   2HG   LYS  86          1HG       LYS  86   9.764  -7.624  -8.023
  647   1HD   LYS  86          2HD       LYS  86  12.015  -7.444  -8.989
  648   2HD   LYS  86          1HD       LYS  86  11.327  -6.911 -10.523
  649   1HE   LYS  86          2HE       LYS  86  10.178  -5.067  -9.036
  650   2HE   LYS  86          1HE       LYS  86  11.476  -5.447  -7.905
  651   1HZ   LYS  86          1HZ       LYS  86  12.118  -3.664  -9.392
  652   2HZ   LYS  86          2HZ       LYS  86  11.822  -4.647 -10.747
  653   3HZ   LYS  86          3HZ       LYS  86  13.080  -5.032  -9.671
  654    H    ASP  87           H        ASP  87  10.766  -8.766 -13.304
  655    HA   ASP  87           HA       ASP  87  11.055 -11.459 -14.092
  656   1HB   ASP  87          2HB       ASP  87  11.953  -8.868 -15.038
  657   2HB   ASP  87          1HB       ASP  87  13.230 -10.072 -15.197
  658    H    ASP  88           H        ASP  88  13.743  -9.323 -13.129
  659    HA   ASP  88           HA       ASP  88  14.790 -10.953 -11.079
  660   1HB   ASP  88          2HB       ASP  88  16.862 -11.734 -12.424
  661   2HB   ASP  88          1HB       ASP  88  15.373 -12.661 -12.594
  662    H    SER  89           HN       SER  89  14.378  -8.232 -11.438
  663    HA   SER  89           HA       SER  89  17.141  -7.171 -11.534
  664   1HB   SER  89          2HB       SER  89  14.621  -6.180 -12.733
  665   2HB   SER  89          1HB       SER  89  15.628  -4.961 -11.954
  666    HG   SER  89           HG       SER  89  16.040  -6.408 -14.250
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1  14.697   2.626 -19.471
    2   2H    MET   1          2H        MET   1  16.039   2.733 -20.507
    3   3H    MET   1          3H        MET   1  16.080   1.691 -19.166
    4    HA   MET   1           HA       MET   1  14.280   1.418 -21.515
    5   1HB   MET   1          2HB       MET   1  16.825   0.917 -21.738
    6   2HB   MET   1          1HB       MET   1  16.489  -0.472 -20.706
    7   1HG   MET   1          2HG       MET   1  16.189  -1.385 -22.835
    8   2HG   MET   1          1HG       MET   1  14.542  -0.921 -22.411
    9   1HE   MET   1          1HE       MET   1  16.311  -1.519 -24.954
   10   2HE   MET   1          2HE       MET   1  17.522  -0.242 -25.032
   11   3HE   MET   1          3HE       MET   1  16.202  -0.270 -26.200
   12    H    ASN   2           H        ASN   2  12.417   1.061 -20.323
   13    HA   ASN   2           HA       ASN   2  12.419  -1.386 -18.656
   14   1HB   ASN   2          2HB       ASN   2  11.262   1.310 -18.083
   15   2HB   ASN   2          1HB       ASN   2  10.367  -0.110 -17.545
   16   1HD2  ASN   2          1HD2      ASN   2  11.986  -1.842 -16.447
   17   2HD2  ASN   2          2HD2      ASN   2  13.076  -1.169 -15.335
   18    H    ASP   3           H        ASP   3  11.163  -2.916 -19.481
   19    HA   ASP   3           HA       ASP   3   8.835  -2.098 -21.119
   20   1HB   ASP   3          2HB       ASP   3  10.982  -3.298 -22.191
   21   2HB   ASP   3          1HB       ASP   3  10.105  -4.731 -21.654
   22    H    ILE   4           H        ILE   4   9.287  -3.053 -18.172
   23    HA   ILE   4           HA       ILE   4   7.802  -5.538 -18.093
   24    HB   ILE   4           HB       ILE   4   7.968  -5.467 -15.735
   25   1HG1  ILE   4          2HG1      ILE   4   7.225  -2.991 -15.631
   26   2HG1  ILE   4          1HG1      ILE   4   8.347  -3.555 -14.400
   27   1HG2  ILE   4          1HG2      ILE   4  10.454  -4.189 -16.907
   28   2HG2  ILE   4          2HG2      ILE   4  10.097  -5.914 -16.832
   29   3HG2  ILE   4          3HG2      ILE   4  10.374  -5.006 -15.346
   30   1HD1  ILE   4          1HD1      ILE   4   9.373  -1.576 -15.051
   31   2HD1  ILE   4          2HD1      ILE   4   8.845  -1.729 -16.726
   32   3HD1  ILE   4          3HD1      ILE   4  10.173  -2.720 -16.126
   33    H    TYR   5           H        TYR   5   7.100  -2.125 -17.933
   34    HA   TYR   5           HA       TYR   5   4.446  -2.369 -16.864
   35   1HB   TYR   5          2HB       TYR   5   5.621  -0.111 -18.509
   36   2HB   TYR   5          1HB       TYR   5   4.189  -0.034 -17.485
   37    HD1  TYR   5           HD1      TYR   5   4.573  -0.841 -14.982
   38    HD2  TYR   5           HD2      TYR   5   7.662   0.579 -17.606
   39    HE1  TYR   5           HE1      TYR   5   5.996  -0.312 -13.021
   40    HE2  TYR   5           HE2      TYR   5   9.085   1.103 -15.648
   41    HH   TYR   5           HH       TYR   5   8.910  -0.071 -12.877
   42    H    LYS   6           H        LYS   6   5.894  -2.295 -20.076
   43    HA   LYS   6           HA       LYS   6   3.393  -2.153 -21.506
   44   1HB   LYS   6          2HB       LYS   6   5.996  -3.187 -22.637
   45   2HB   LYS   6          1HB       LYS   6   4.673  -2.393 -23.488
   46   1HG   LYS   6          2HG       LYS   6   6.664  -1.153 -21.577
   47   2HG   LYS   6          1HG       LYS   6   6.379  -0.737 -23.267
   48   1HD   LYS   6          2HD       LYS   6   4.230   0.211 -22.759
   49   2HD   LYS   6          1HD       LYS   6   4.269  -0.434 -21.117
   50   1HE   LYS   6          2HE       LYS   6   5.828   1.138 -20.391
   51   2HE   LYS   6          1HE       LYS   6   6.465   1.408 -22.012
   52   1HZ   LYS   6          1HZ       LYS   6   4.396   2.517 -22.599
   53   2HZ   LYS   6          2HZ       LYS   6   5.140   3.280 -21.276
   54   3HZ   LYS   6          3HZ       LYS   6   3.796   2.271 -21.032
   55    H    ALA   7           H        ALA   7   5.601  -4.676 -20.453
   56    HA   ALA   7           HA       ALA   7   4.248  -6.825 -21.804
   57   1HB   ALA   7          1HB       ALA   7   6.484  -7.317 -21.295
   58   2HB   ALA   7          2HB       ALA   7   5.592  -8.211 -20.064
   59   3HB   ALA   7          3HB       ALA   7   6.351  -6.671 -19.660
   60    H    ALA   8           H        ALA   8   3.960  -5.227 -18.683
   61    HA   ALA   8           HA       ALA   8   2.230  -7.263 -17.564
   62   1HB   ALA   8          1HB       ALA   8   3.100  -4.535 -16.606
   63   2HB   ALA   8          2HB       ALA   8   3.601  -6.112 -15.991
   64   3HB   ALA   8          3HB       ALA   8   1.953  -5.543 -15.723
   65    H    VAL   9           H        VAL   9   1.861  -4.197 -19.265
   66    HA   VAL   9           HA       VAL   9  -0.800  -3.619 -18.545
   67    HB   VAL   9           HB       VAL   9   0.906  -2.184 -19.893
   68   1HG1  VAL   9          1HG1      VAL   9  -0.602  -3.095 -22.300
   69   2HG1  VAL   9          2HG1      VAL   9   0.734  -4.107 -21.757
   70   3HG1  VAL   9          3HG1      VAL   9   1.023  -2.421 -22.179
   71   1HG2  VAL   9          1HG2      VAL   9  -2.012  -2.241 -20.720
   72   2HG2  VAL   9          2HG2      VAL   9  -0.930  -0.850 -20.783
   73   3HG2  VAL   9          3HG2      VAL   9  -1.411  -1.524 -19.226
   74    H    GLU  10           H        GLU  10   0.510  -5.960 -20.782
   75    HA   GLU  10           HA       GLU  10  -1.984  -6.459 -22.154
   76   1HB   GLU  10          2HB       GLU  10   0.617  -8.004 -22.050
   77   2HB   GLU  10          1HB       GLU  10  -0.765  -8.463 -23.047
   78   1HG   GLU  10          2HG       GLU  10  -0.608  -6.491 -24.365
   79   2HG   GLU  10          1HG       GLU  10   0.462  -5.706 -23.202
   80    H    GLN  11           H        GLN  11  -0.491  -7.525 -19.207
   81    HA   GLN  11           HA       GLN  11  -1.979  -9.991 -18.982
   82   1HB   GLN  11          2HB       GLN  11  -0.482  -8.477 -16.831
   83   2HB   GLN  11          1HB       GLN  11  -1.020 -10.154 -16.755
   84   1HG   GLN  11          2HG       GLN  11   0.413 -10.614 -18.786
   85   2HG   GLN  11          1HG       GLN  11   1.065  -8.984 -18.618
   86   1HE2  GLN  11          1HE2      GLN  11   1.832  -8.536 -16.177
   87   2HE2  GLN  11          2HE2      GLN  11   2.732  -9.792 -15.478
   88    H    LEU  12           H        LEU  12  -2.142  -6.760 -17.513
   89    HA   LEU  12           HA       LEU  12  -4.676  -7.460 -16.212
   90   1HB   LEU  12          2HB       LEU  12  -4.458  -5.003 -15.402
   91   2HB   LEU  12          1HB       LEU  12  -3.464  -6.247 -14.686
   92    HG   LEU  12           HG       LEU  12  -1.595  -5.505 -16.209
   93   1HD1  LEU  12          1HD1      LEU  12  -2.003  -3.042 -16.993
   94   2HD1  LEU  12          2HD1      LEU  12  -3.709  -3.484 -16.915
   95   3HD1  LEU  12          3HD1      LEU  12  -2.618  -4.366 -17.983
   96   1HD2  LEU  12          1HD2      LEU  12  -1.760  -4.772 -13.855
   97   2HD2  LEU  12          2HD2      LEU  12  -2.775  -3.417 -14.349
   98   3HD2  LEU  12          3HD2      LEU  12  -1.092  -3.495 -14.870
   99    H    THR  13           H        THR  13  -6.456  -5.816 -16.324
  100    HA   THR  13           HA       THR  13  -6.712  -4.757 -19.082
  101    HB   THR  13           HB       THR  13  -9.288  -5.084 -18.383
  102    HG1  THR  13           HG1      THR  13  -9.120  -6.091 -16.494
  103   1HG2  THR  13          1HG2      THR  13  -7.835  -7.531 -19.309
  104   2HG2  THR  13          2HG2      THR  13  -7.762  -6.070 -20.294
  105   3HG2  THR  13          3HG2      THR  13  -9.321  -6.807 -19.925
  106    H    ASP  14           H        ASP  14  -8.605  -3.133 -19.176
  107    HA   ASP  14           HA       ASP  14  -7.933  -0.861 -17.633
  108   1HB   ASP  14          2HB       ASP  14  -9.176  -1.005 -19.912
  109   2HB   ASP  14          1HB       ASP  14 -10.626  -1.218 -18.931
  110    H    GLU  15           H        GLU  15 -10.262  -3.451 -17.198
  111    HA   GLU  15           HA       GLU  15 -11.955  -2.318 -15.264
  112   1HB   GLU  15          2HB       GLU  15 -11.089  -5.141 -15.842
  113   2HB   GLU  15          1HB       GLU  15 -12.115  -4.785 -14.453
  114   1HG   GLU  15          2HG       GLU  15 -13.895  -4.065 -15.777
  115   2HG   GLU  15          1HG       GLU  15 -12.850  -3.668 -17.142
  116    H    GLN  16           H        GLN  16  -8.855  -4.035 -14.909
  117    HA   GLN  16           HA       GLN  16  -8.742  -4.070 -12.089
  118   1HB   GLN  16          2HB       GLN  16  -6.746  -4.294 -14.293
  119   2HB   GLN  16          1HB       GLN  16  -6.133  -3.920 -12.681
  120   1HG   GLN  16          2HG       GLN  16  -7.347  -5.880 -11.775
  121   2HG   GLN  16          1HG       GLN  16  -7.919  -6.266 -13.399
  122   1HE2  GLN  16          1HE2      GLN  16  -4.790  -5.639 -11.690
  123   2HE2  GLN  16          2HE2      GLN  16  -3.919  -6.799 -12.572
  124    H    LYS  17           H        LYS  17  -7.604  -1.667 -14.456
  125    HA   LYS  17           HA       LYS  17  -6.477   0.133 -12.559
  126   1HB   LYS  17          2HB       LYS  17  -7.269   0.278 -15.428
  127   2HB   LYS  17          1HB       LYS  17  -7.112   1.804 -14.558
  128   1HG   LYS  17          2HG       LYS  17  -4.901   1.621 -15.050
  129   2HG   LYS  17          1HG       LYS  17  -4.868   0.466 -13.717
  130   1HD   LYS  17          2HD       LYS  17  -4.019  -0.939 -15.306
  131   2HD   LYS  17          1HD       LYS  17  -5.717  -1.149 -15.734
  132   1HE   LYS  17          2HE       LYS  17  -5.296   0.993 -17.218
  133   2HE   LYS  17          1HE       LYS  17  -3.609   0.496 -17.098
  134   1HZ   LYS  17          1HZ       LYS  17  -5.861  -1.174 -18.078
  135   2HZ   LYS  17          2HZ       LYS  17  -4.255  -1.703 -17.908
  136   3HZ   LYS  17          3HZ       LYS  17  -4.638  -0.486 -19.030
  137    H    ASN  18           H        ASN  18  -9.715  -0.336 -13.863
  138    HA   ASN  18           HA       ASN  18 -10.906   2.052 -12.899
  139   1HB   ASN  18          2HB       ASN  18 -11.813  -0.482 -14.054
  140   2HB   ASN  18          1HB       ASN  18 -12.920   0.143 -12.830
  141   1HD2  ASN  18          1HD2      ASN  18 -11.039   1.342 -15.677
  142   2HD2  ASN  18          2HD2      ASN  18 -12.239   2.428 -16.186
  143    H    GLU  19           H        GLU  19 -10.536  -1.202 -11.506
  144    HA   GLU  19           HA       GLU  19 -11.937  -0.703  -9.078
  145   1HB   GLU  19          2HB       GLU  19  -9.673  -2.659  -9.591
  146   2HB   GLU  19          1HB       GLU  19 -10.771  -2.687  -8.212
  147   1HG   GLU  19          2HG       GLU  19 -12.667  -2.811  -9.957
  148   2HG   GLU  19          1HG       GLU  19 -11.400  -3.218 -11.113
  149    H    PHE  20           H        PHE  20  -8.545  -0.458 -10.051
  150    HA   PHE  20           HA       PHE  20  -7.419   0.233  -7.561
  151   1HB   PHE  20          2HB       PHE  20  -6.618   0.651 -10.420
  152   2HB   PHE  20          1HB       PHE  20  -5.733   1.495  -9.153
  153    HD1  PHE  20           HD1      PHE  20  -3.697   0.216  -9.747
  154    HD2  PHE  20           HD2      PHE  20  -7.261  -1.741  -8.357
  155    HE1  PHE  20           HE1      PHE  20  -2.392  -1.835  -9.285
  156    HE2  PHE  20           HE2      PHE  20  -5.956  -3.792  -7.898
  157    HZ   PHE  20           HZ       PHE  20  -3.519  -3.842  -8.360
  158    H    LYS  21           H        LYS  21  -8.848   2.227 -10.130
  159    HA   LYS  21           HA       LYS  21  -8.242   4.754  -9.004
  160   1HB   LYS  21          2HB       LYS  21  -9.007   4.357 -11.372
  161   2HB   LYS  21          1HB       LYS  21 -10.631   4.087 -10.741
  162   1HG   LYS  21          2HG       LYS  21 -10.328   6.428 -11.498
  163   2HG   LYS  21          1HG       LYS  21 -10.650   6.343  -9.766
  164   1HD   LYS  21          2HD       LYS  21  -8.364   6.724  -9.215
  165   2HD   LYS  21          1HD       LYS  21  -7.838   6.424 -10.872
  166   1HE   LYS  21          2HE       LYS  21  -8.508   8.504 -11.612
  167   2HE   LYS  21          1HE       LYS  21  -9.810   8.621 -10.428
  168   1HZ   LYS  21          1HZ       LYS  21  -8.221   9.040  -8.707
  169   2HZ   LYS  21          2HZ       LYS  21  -7.936  10.133  -9.976
  170   3HZ   LYS  21          3HZ       LYS  21  -6.920   8.786  -9.766
  171    H    ALA  22           H        ALA  22 -11.148   2.695  -8.792
  172    HA   ALA  22           HA       ALA  22 -12.644   4.431  -7.118
  173   1HB   ALA  22          1HB       ALA  22 -12.777   1.445  -7.561
  174   2HB   ALA  22          2HB       ALA  22 -13.834   2.687  -8.232
  175   3HB   ALA  22          3HB       ALA  22 -13.900   2.309  -6.512
  176    H    ALA  23           H        ALA  23 -10.502   1.683  -6.414
  177    HA   ALA  23           HA       ALA  23 -10.795   1.657  -3.607
  178   1HB   ALA  23          1HB       ALA  23  -9.747  -0.233  -4.600
  179   2HB   ALA  23          2HB       ALA  23  -8.481   0.572  -3.671
  180   3HB   ALA  23          3HB       ALA  23  -8.549   0.769  -5.423
  181    H    PHE  24           H        PHE  24  -8.931   3.683  -5.760
  182    HA   PHE  24           HA       PHE  24  -7.228   4.784  -3.699
  183   1HB   PHE  24          2HB       PHE  24  -6.817   4.602  -6.296
  184   2HB   PHE  24          1HB       PHE  24  -7.713   6.117  -6.348
  185    HD1  PHE  24           HD1      PHE  24  -4.646   4.449  -5.159
  186    HD2  PHE  24           HD2      PHE  24  -6.805   8.161  -5.365
  187    HE1  PHE  24           HE1      PHE  24  -2.601   5.678  -4.482
  188    HE2  PHE  24           HE2      PHE  24  -4.761   9.388  -4.686
  189    HZ   PHE  24           HZ       PHE  24  -2.659   8.147  -4.247
  190    H    ASP  25           H        ASP  25  -9.826   6.100  -5.771
  191    HA   ASP  25           HA       ASP  25 -10.117   8.600  -4.641
  192   1HB   ASP  25          2HB       ASP  25 -11.987   6.765  -6.071
  193   2HB   ASP  25          1HB       ASP  25 -12.645   8.214  -5.311
  194    H    ILE  26           H        ILE  26 -11.685   5.572  -3.539
  195    HA   ILE  26           HA       ILE  26 -13.371   6.727  -1.609
  196    HB   ILE  26           HB       ILE  26 -13.328   4.504  -0.487
  197   1HG1  ILE  26          2HG1      ILE  26 -11.276   3.857  -2.629
  198   2HG1  ILE  26          1HG1      ILE  26 -10.942   3.987  -0.905
  199   1HG2  ILE  26          1HG2      ILE  26 -13.993   3.231  -2.675
  200   2HG2  ILE  26          2HG2      ILE  26 -13.717   4.787  -3.456
  201   3HG2  ILE  26          3HG2      ILE  26 -14.933   4.641  -2.188
  202   1HD1  ILE  26          1HD1      ILE  26 -12.607   1.920  -2.334
  203   2HD1  ILE  26          2HD1      ILE  26 -12.762   2.190  -0.598
  204   3HD1  ILE  26          3HD1      ILE  26 -11.220   1.666  -1.275
  205    H    PHE  27           H        PHE  27  -9.952   5.875  -1.450
  206    HA   PHE  27           HA       PHE  27  -9.759   6.459   1.393
  207   1HB   PHE  27          2HB       PHE  27  -7.903   5.486  -0.724
  208   2HB   PHE  27          1HB       PHE  27  -7.193   6.327   0.653
  209    HD1  PHE  27           HD1      PHE  27  -9.317   3.449  -0.348
  210    HD2  PHE  27           HD2      PHE  27  -7.127   5.331   2.832
  211    HE1  PHE  27           HE1      PHE  27  -9.575   1.409   1.037
  212    HE2  PHE  27           HE2      PHE  27  -7.384   3.289   4.214
  213    HZ   PHE  27           HZ       PHE  27  -8.608   1.328   3.318
  214    H    ILE  28           H        ILE  28  -9.275   8.136  -1.647
  215    HA   ILE  28           HA       ILE  28  -7.876  10.362  -0.364
  216    HB   ILE  28           HB       ILE  28  -8.764  10.175  -3.247
  217   1HG1  ILE  28          2HG1      ILE  28  -7.390   8.293  -3.128
  218   2HG1  ILE  28          1HG1      ILE  28  -6.230   9.554  -3.513
  219   1HG2  ILE  28          1HG2      ILE  28  -6.453  11.554  -3.262
  220   2HG2  ILE  28          2HG2      ILE  28  -7.028  11.979  -1.647
  221   3HG2  ILE  28          3HG2      ILE  28  -8.024  12.333  -3.060
  222   1HD1  ILE  28          1HD1      ILE  28  -5.984   9.783  -0.922
  223   2HD1  ILE  28          2HD1      ILE  28  -5.185   8.439  -1.738
  224   3HD1  ILE  28          3HD1      ILE  28  -6.705   8.174  -0.884
  225    H    GLN  29           H        GLN  29 -10.650   9.786   0.412
  226    HA   GLN  29           HA       GLN  29 -12.381  11.717  -0.813
  227   1HB   GLN  29          2HB       GLN  29 -13.823  11.335   1.221
  228   2HB   GLN  29          1HB       GLN  29 -13.433   9.874   0.318
  229   1HG   GLN  29          2HG       GLN  29 -11.811   9.188   1.924
  230   2HG   GLN  29          1HG       GLN  29 -11.789  10.775   2.691
  231   1HE2  GLN  29          1HE2      GLN  29 -13.009   7.682   3.087
  232   2HE2  GLN  29          2HE2      GLN  29 -14.342   8.047   4.072
  233    H    ASP  30           H        ASP  30 -10.112  11.732   1.863
  234    HA   ASP  30           HA       ASP  30 -10.280  14.646   1.985
  235   1HB   ASP  30          2HB       ASP  30 -10.201  14.430   4.574
  236   2HB   ASP  30          1HB       ASP  30 -11.758  14.296   3.763
  237    H    ALA  31           H        ALA  31  -8.317  13.041   0.859
  238    HA   ALA  31           HA       ALA  31  -6.155  12.469   2.627
  239   1HB   ALA  31          1HB       ALA  31  -4.833  12.156   0.628
  240   2HB   ALA  31          2HB       ALA  31  -6.016  13.035  -0.342
  241   3HB   ALA  31          3HB       ALA  31  -6.431  11.467   0.349
  242    H    GLU  32           H        GLU  32  -4.036  13.537   2.541
  243    HA   GLU  32           HA       GLU  32  -4.318  16.398   2.914
  244   1HB   GLU  32          2HB       GLU  32  -1.955  14.532   3.188
  245   2HB   GLU  32          1HB       GLU  32  -1.866  16.268   3.485
  246   1HG   GLU  32          2HG       GLU  32  -3.289  16.152   5.352
  247   2HG   GLU  32          1HG       GLU  32  -3.958  14.595   4.862
  248    H    ASP  33           H        ASP  33  -2.462  14.257   0.753
  249    HA   ASP  33           HA       ASP  33  -2.116  16.557  -1.083
  250   1HB   ASP  33          2HB       ASP  33  -0.185  14.327  -0.427
  251   2HB   ASP  33          1HB       ASP  33   0.005  15.388  -1.822
  252    H    GLY  34           H        GLY  34  -4.224  14.402  -0.975
  253   1HA   GLY  34          2HA       GLY  34  -5.448  13.219  -2.527
  254   2HA   GLY  34          1HA       GLY  34  -4.395  13.887  -3.767
  255    H    CYS  35           H        CYS  35  -3.628  11.798  -0.985
  256    HA   CYS  35           HA       CYS  35  -3.154   9.494  -2.692
  257   1HB   CYS  35          2HB       CYS  35  -0.750   9.439  -1.448
  258   2HB   CYS  35          1HB       CYS  35  -0.988  10.080  -3.069
  259    HG   CYS  35           HG       CYS  35  -0.154  12.223  -2.146
  260    H    ILE  36           H        ILE  36  -2.268   7.631  -1.354
  261    HA   ILE  36           HA       ILE  36  -3.636   7.668   1.262
  262    HB   ILE  36           HB       ILE  36  -3.542   5.196   1.129
  263   1HG1  ILE  36          2HG1      ILE  36  -3.011   4.772  -1.604
  264   2HG1  ILE  36          1HG1      ILE  36  -1.702   5.806  -1.031
  265   1HG2  ILE  36          1HG2      ILE  36  -5.309   4.984  -0.430
  266   2HG2  ILE  36          2HG2      ILE  36  -4.678   6.278  -1.450
  267   3HG2  ILE  36          3HG2      ILE  36  -5.402   6.659   0.113
  268   1HD1  ILE  36          1HD1      ILE  36  -2.147   3.879   0.995
  269   2HD1  ILE  36          2HD1      ILE  36  -0.750   4.015  -0.074
  270   3HD1  ILE  36          3HD1      ILE  36  -2.118   3.003  -0.537
  271    H    SER  37           H        SER  37  -2.547   5.989   2.844
  272    HA   SER  37           HA       SER  37   0.201   6.934   3.219
  273   1HB   SER  37          2HB       SER  37  -1.570   7.000   5.067
  274   2HB   SER  37          1HB       SER  37  -1.400   5.249   5.145
  275    HG   SER  37           HG       SER  37   0.465   7.275   5.729
  276    H    THR  38           H        THR  38   1.922   5.518   3.663
  277    HA   THR  38           HA       THR  38   2.090   3.222   2.029
  278    HB   THR  38           HB       THR  38   4.208   2.741   3.265
  279    HG1  THR  38           HG1      THR  38   4.184   3.452   5.237
  280   1HG2  THR  38          1HG2      THR  38   3.513   5.161   1.816
  281   2HG2  THR  38          2HG2      THR  38   4.965   4.168   1.700
  282   3HG2  THR  38          3HG2      THR  38   4.861   5.436   2.920
  283    H    LYS  39           H        LYS  39   1.549   3.591   5.523
  284    HA   LYS  39           HA       LYS  39   1.452   0.784   6.079
  285   1HB   LYS  39          2HB       LYS  39   0.663   1.422   8.274
  286   2HB   LYS  39          1HB       LYS  39   1.939   2.539   7.793
  287   1HG   LYS  39          2HG       LYS  39   0.173   4.141   7.016
  288   2HG   LYS  39          1HG       LYS  39  -1.049   3.048   7.665
  289   1HD   LYS  39          2HD       LYS  39   1.195   3.922   9.450
  290   2HD   LYS  39          1HD       LYS  39  -0.127   5.046   9.136
  291   1HE   LYS  39          2HE       LYS  39  -1.720   3.164   9.778
  292   2HE   LYS  39          1HE       LYS  39  -0.306   2.279  10.351
  293   1HZ   LYS  39          1HZ       LYS  39  -1.316   3.496  12.153
  294   2HZ   LYS  39          2HZ       LYS  39  -1.200   4.954  11.287
  295   3HZ   LYS  39          3HZ       LYS  39   0.207   4.157  11.810
  296    H    GLU  40           H        GLU  40  -0.861   3.101   4.883
  297    HA   GLU  40           HA       GLU  40  -3.205   1.556   5.570
  298   1HB   GLU  40          2HB       GLU  40  -2.720   4.015   3.905
  299   2HB   GLU  40          1HB       GLU  40  -4.287   3.207   3.900
  300   1HG   GLU  40          2HG       GLU  40  -3.006   3.808   6.540
  301   2HG   GLU  40          1HG       GLU  40  -3.759   5.132   5.653
  302    H    LEU  41           H        LEU  41  -0.811   0.984   3.343
  303    HA   LEU  41           HA       LEU  41  -2.212   0.370   0.974
  304   1HB   LEU  41          2HB       LEU  41   0.377   0.434   1.594
  305   2HB   LEU  41          1HB       LEU  41   0.123  -1.288   1.776
  306    HG   LEU  41           HG       LEU  41   0.975  -0.684  -0.458
  307   1HD1  LEU  41          1HD1      LEU  41  -0.404  -2.176  -1.612
  308   2HD1  LEU  41          2HD1      LEU  41  -1.872  -1.557  -0.854
  309   3HD1  LEU  41          3HD1      LEU  41  -0.768  -2.578   0.066
  310   1HD2  LEU  41          1HD2      LEU  41  -0.302   0.653  -1.982
  311   2HD2  LEU  41          2HD2      LEU  41  -0.252   1.561  -0.471
  312   3HD2  LEU  41          3HD2      LEU  41  -1.702   0.657  -0.909
  313    H    GLY  42           H        GLY  42  -1.463  -1.586   3.849
  314   1HA   GLY  42          2HA       GLY  42  -2.402  -4.069   2.914
  315   2HA   GLY  42          1HA       GLY  42  -2.330  -3.584   4.605
  316    H    LYS  43           H        LYS  43  -4.144  -1.217   3.925
  317    HA   LYS  43           HA       LYS  43  -6.638  -2.559   4.479
  318   1HB   LYS  43          2HB       LYS  43  -5.708  -0.206   5.286
  319   2HB   LYS  43          1HB       LYS  43  -6.519   0.352   3.823
  320   1HG   LYS  43          2HG       LYS  43  -8.593  -0.055   4.663
  321   2HG   LYS  43          1HG       LYS  43  -8.084  -1.533   5.479
  322   1HD   LYS  43          2HD       LYS  43  -8.324  -0.265   7.363
  323   2HD   LYS  43          1HD       LYS  43  -6.715   0.313   6.928
  324   1HE   LYS  43          2HE       LYS  43  -7.651   2.234   5.780
  325   2HE   LYS  43          1HE       LYS  43  -9.289   1.622   6.001
  326   1HZ   LYS  43          1HZ       LYS  43  -8.709   3.330   7.631
  327   2HZ   LYS  43          2HZ       LYS  43  -7.433   2.363   8.199
  328   3HZ   LYS  43          3HZ       LYS  43  -9.040   1.842   8.375
  329    H    VAL  44           H        VAL  44  -5.336  -0.585   1.808
  330    HA   VAL  44           HA       VAL  44  -7.688  -0.647   0.225
  331    HB   VAL  44           HB       VAL  44  -6.150  -0.030  -1.673
  332   1HG1  VAL  44          1HG1      VAL  44  -7.120   1.772  -0.484
  333   2HG1  VAL  44          2HG1      VAL  44  -5.395   2.136  -0.497
  334   3HG1  VAL  44          3HG1      VAL  44  -6.142   1.460   0.951
  335   1HG2  VAL  44          1HG2      VAL  44  -3.810   0.447  -1.153
  336   2HG2  VAL  44          2HG2      VAL  44  -4.148  -1.249  -0.810
  337   3HG2  VAL  44          3HG2      VAL  44  -4.045  -0.086   0.513
  338    H    MET  45           H        MET  45  -4.900  -2.812   0.454
  339    HA   MET  45           HA       MET  45  -5.430  -4.388  -1.825
  340   1HB   MET  45          2HB       MET  45  -4.210  -5.371   0.766
  341   2HB   MET  45          1HB       MET  45  -4.024  -6.083  -0.836
  342   1HG   MET  45          2HG       MET  45  -3.255  -3.225  -0.587
  343   2HG   MET  45          1HG       MET  45  -2.209  -4.385   0.231
  344   1HE   MET  45          1HE       MET  45  -4.067  -3.304  -2.659
  345   2HE   MET  45          2HE       MET  45  -4.230  -4.907  -3.374
  346   3HE   MET  45          3HE       MET  45  -3.149  -3.728  -4.115
  347    H    ARG  46           H        ARG  46  -6.691  -4.469   1.460
  348    HA   ARG  46           HA       ARG  46  -8.012  -6.967   1.346
  349   1HB   ARG  46          2HB       ARG  46  -8.113  -4.584   3.080
  350   2HB   ARG  46          1HB       ARG  46  -9.616  -5.502   3.004
  351   1HG   ARG  46          2HG       ARG  46  -8.528  -7.517   3.706
  352   2HG   ARG  46          1HG       ARG  46  -6.929  -6.804   3.495
  353   1HD   ARG  46          2HD       ARG  46  -8.866  -5.500   5.375
  354   2HD   ARG  46          1HD       ARG  46  -8.016  -6.950   5.898
  355    HE   ARG  46           HE       ARG  46  -6.157  -5.103   4.806
  356   1HH1  ARG  46          2HH1      ARG  46  -8.223  -5.589   7.580
  357   2HH1  ARG  46          1HH1      ARG  46  -7.215  -4.675   8.648
  358   1HH2  ARG  46          1HH2      ARG  46  -4.851  -3.909   6.226
  359   2HH2  ARG  46          2HH2      ARG  46  -5.311  -3.726   7.884
  360    H    MET  47           H        MET  47  -9.013  -3.706   0.399
  361    HA   MET  47           HA       MET  47 -11.726  -4.303  -0.179
  362   1HB   MET  47          2HB       MET  47 -10.253  -2.007  -0.117
  363   2HB   MET  47          1HB       MET  47 -10.436  -2.242  -1.855
  364   1HG   MET  47          2HG       MET  47 -12.911  -2.733  -0.353
  365   2HG   MET  47          1HG       MET  47 -12.318  -1.079  -0.203
  366   1HE   MET  47          1HE       MET  47 -14.956  -2.199  -1.397
  367   2HE   MET  47          2HE       MET  47 -15.236  -1.373  -2.929
  368   3HE   MET  47          3HE       MET  47 -14.759  -0.445  -1.510
  369    H    LEU  48           H        LEU  48  -8.746  -4.654  -2.017
  370    HA   LEU  48           HA       LEU  48 -10.103  -5.215  -4.517
  371   1HB   LEU  48          2HB       LEU  48  -7.232  -5.361  -3.638
  372   2HB   LEU  48          1HB       LEU  48  -7.750  -5.927  -5.211
  373    HG   LEU  48           HG       LEU  48  -8.359  -3.118  -4.314
  374   1HD1  LEU  48          1HD1      LEU  48  -5.957  -3.367  -4.013
  375   2HD1  LEU  48          2HD1      LEU  48  -6.252  -2.448  -5.488
  376   3HD1  LEU  48          3HD1      LEU  48  -5.807  -4.152  -5.585
  377   1HD2  LEU  48          1HD2      LEU  48  -8.415  -2.716  -6.719
  378   2HD2  LEU  48          2HD2      LEU  48  -9.446  -4.098  -6.349
  379   3HD2  LEU  48          3HD2      LEU  48  -7.843  -4.353  -7.039
  380    H    GLY  49           H        GLY  49  -8.404  -7.096  -2.009
  381   1HA   GLY  49          2HA       GLY  49  -9.811  -9.341  -1.849
  382   2HA   GLY  49          1HA       GLY  49  -9.023  -9.602  -3.399
  383    H    GLN  50           H        GLN  50  -6.573  -8.110  -2.408
  384    HA   GLN  50           HA       GLN  50  -5.254 -10.424  -1.251
  385   1HB   GLN  50          2HB       GLN  50  -4.384  -7.822  -2.416
  386   2HB   GLN  50          1HB       GLN  50  -3.297  -8.607  -1.270
  387   1HG   GLN  50          2HG       GLN  50  -2.594  -9.633  -3.216
  388   2HG   GLN  50          1HG       GLN  50  -3.876 -10.750  -2.747
  389   1HE2  GLN  50          1HE2      GLN  50  -3.022  -8.167  -5.020
  390   2HE2  GLN  50          2HE2      GLN  50  -4.354  -8.396  -6.047
  391    H    ASN  51           H        ASN  51  -3.870 -10.276   0.645
  392    HA   ASN  51           HA       ASN  51  -4.344  -8.131   2.542
  393   1HB   ASN  51          2HB       ASN  51  -6.332  -9.734   2.737
  394   2HB   ASN  51          1HB       ASN  51  -5.184 -10.906   3.382
  395   1HD2  ASN  51          1HD2      ASN  51  -6.007 -10.868   5.566
  396   2HD2  ASN  51          2HD2      ASN  51  -5.885  -9.494   6.556
  397    HA   PRO  52           HA       PRO  52  -0.278 -10.220   3.081
  398   1HB   PRO  52          2HB       PRO  52   1.227  -7.961   2.753
  399   2HB   PRO  52          1HB       PRO  52   0.684  -8.975   1.410
  400   1HG   PRO  52          2HG       PRO  52  -0.264  -6.310   2.250
  401   2HG   PRO  52          1HG       PRO  52  -0.336  -7.080   0.659
  402   1HD   PRO  52          2HD       PRO  52  -2.468  -6.838   2.541
  403   2HD   PRO  52          1HD       PRO  52  -2.480  -7.774   1.028
  404    H    THR  53           H        THR  53   1.721  -8.991   4.430
  405    HA   THR  53           HA       THR  53   0.499  -8.333   7.036
  406    HB   THR  53           HB       THR  53   2.488  -9.086   8.071
  407    HG1  THR  53           HG1      THR  53   4.387  -8.953   7.159
  408   1HG2  THR  53          1HG2      THR  53   2.090 -10.790   5.602
  409   2HG2  THR  53          2HG2      THR  53   1.224 -10.952   7.131
  410   3HG2  THR  53          3HG2      THR  53   2.953 -11.293   7.055
  411    HA   PRO  54           HA       PRO  54   1.933  -4.174   6.925
  412   1HB   PRO  54          2HB       PRO  54   3.056  -3.822   9.404
  413   2HB   PRO  54          1HB       PRO  54   1.312  -3.867   9.099
  414   1HG   PRO  54          2HG       PRO  54   3.095  -5.977  10.226
  415   2HG   PRO  54          1HG       PRO  54   1.406  -5.604  10.611
  416   1HD   PRO  54          2HD       PRO  54   2.193  -7.708   8.998
  417   2HD   PRO  54          1HD       PRO  54   0.593  -6.934   8.908
  418    H    GLU  55           H        GLU  55   4.277  -6.600   7.843
  419    HA   GLU  55           HA       GLU  55   6.586  -4.895   7.360
  420   1HB   GLU  55          2HB       GLU  55   6.632  -7.901   7.632
  421   2HB   GLU  55          1HB       GLU  55   7.915  -6.749   7.996
  422   1HG   GLU  55          2HG       GLU  55   6.464  -5.806   9.822
  423   2HG   GLU  55          1HG       GLU  55   5.318  -7.112   9.516
  424    H    GLU  56           H        GLU  56   4.741  -7.412   5.710
  425    HA   GLU  56           HA       GLU  56   6.572  -7.748   3.527
  426   1HB   GLU  56          2HB       GLU  56   4.829  -9.431   4.293
  427   2HB   GLU  56          1HB       GLU  56   3.625  -8.408   3.509
  428   1HG   GLU  56          2HG       GLU  56   4.944  -8.588   1.380
  429   2HG   GLU  56          1HG       GLU  56   6.006  -9.742   2.188
  430    H    LEU  57           H        LEU  57   3.368  -6.135   3.783
  431    HA   LEU  57           HA       LEU  57   3.328  -5.096   1.177
  432   1HB   LEU  57          2HB       LEU  57   1.620  -3.587   1.929
  433   2HB   LEU  57          1HB       LEU  57   1.363  -5.159   2.644
  434    HG   LEU  57           HG       LEU  57   2.744  -3.997   4.648
  435   1HD1  LEU  57          1HD1      LEU  57   1.663  -1.811   2.932
  436   2HD1  LEU  57          2HD1      LEU  57   3.066  -1.812   3.999
  437   3HD1  LEU  57          3HD1      LEU  57   1.446  -1.642   4.673
  438   1HD2  LEU  57          1HD2      LEU  57   0.470  -5.068   4.678
  439   2HD2  LEU  57          2HD2      LEU  57  -0.209  -3.531   4.143
  440   3HD2  LEU  57          3HD2      LEU  57   0.589  -3.643   5.711
  441    H    GLN  58           H        GLN  58   4.900  -3.901   4.088
  442    HA   GLN  58           HA       GLN  58   5.383  -1.249   3.414
  443   1HB   GLN  58          2HB       GLN  58   5.999  -2.519   5.573
  444   2HB   GLN  58          1HB       GLN  58   7.492  -2.942   4.737
  445   1HG   GLN  58          2HG       GLN  58   7.874  -0.911   6.020
  446   2HG   GLN  58          1HG       GLN  58   7.878  -0.501   4.306
  447   1HE2  GLN  58          1HE2      GLN  58   6.154   0.838   3.496
  448   2HE2  GLN  58          2HE2      GLN  58   4.995   1.542   4.516
  449    H    GLU  59           H        GLU  59   7.210  -4.144   2.456
  450    HA   GLU  59           HA       GLU  59   9.308  -2.772   1.113
  451   1HB   GLU  59          2HB       GLU  59   8.250  -5.590   0.912
  452   2HB   GLU  59          1HB       GLU  59   9.601  -5.018  -0.068
  453   1HG   GLU  59          2HG       GLU  59  10.463  -4.155   2.316
  454   2HG   GLU  59          1HG       GLU  59   9.460  -5.492   2.877
  455    H    MET  60           H        MET  60   6.029  -3.452   0.201
  456    HA   MET  60           HA       MET  60   6.450  -3.326  -2.648
  457   1HB   MET  60          2HB       MET  60   3.889  -3.003  -1.059
  458   2HB   MET  60          1HB       MET  60   4.001  -3.234  -2.803
  459   1HG   MET  60          2HG       MET  60   5.191  -5.211  -0.848
  460   2HG   MET  60          1HG       MET  60   3.522  -5.330  -1.400
  461   1HE   MET  60          1HE       MET  60   3.054  -7.044  -3.417
  462   2HE   MET  60          2HE       MET  60   3.985  -7.566  -2.015
  463   3HE   MET  60          3HE       MET  60   4.492  -8.053  -3.630
  464    H    ILE  61           H        ILE  61   5.001  -1.107  -0.244
  465    HA   ILE  61           HA       ILE  61   4.597   1.074  -2.005
  466    HB   ILE  61           HB       ILE  61   5.330   1.501   0.878
  467   1HG1  ILE  61          2HG1      ILE  61   2.568   1.202   0.843
  468   2HG1  ILE  61          1HG1      ILE  61   3.150  -0.164  -0.114
  469   1HG2  ILE  61          1HG2      ILE  61   4.891   3.519  -0.240
  470   2HG2  ILE  61          2HG2      ILE  61   3.362   3.142   0.553
  471   3HG2  ILE  61          3HG2      ILE  61   3.565   2.822  -1.170
  472   1HD1  ILE  61          1HD1      ILE  61   4.949  -0.315   1.831
  473   2HD1  ILE  61          2HD1      ILE  61   3.355  -1.062   2.008
  474   3HD1  ILE  61          3HD1      ILE  61   3.681   0.504   2.752
  475    H    ASP  62           H        ASP  62   7.145   0.546   0.415
  476    HA   ASP  62           HA       ASP  62   8.799   2.685  -0.074
  477   1HB   ASP  62          2HB       ASP  62   9.039   0.664   1.579
  478   2HB   ASP  62          1HB       ASP  62  10.049  -0.014   0.303
  479    H    GLU  63           H        GLU  63   8.572  -0.289  -1.998
  480    HA   GLU  63           HA       GLU  63  10.835   0.345  -3.661
  481   1HB   GLU  63          2HB       GLU  63   8.780  -1.794  -3.558
  482   2HB   GLU  63          1HB       GLU  63   9.514  -1.480  -5.129
  483   1HG   GLU  63          2HG       GLU  63  11.770  -1.539  -3.835
  484   2HG   GLU  63          1HG       GLU  63  10.847  -2.349  -2.571
  485    H    VAL  64           H        VAL  64   7.293   0.379  -4.197
  486    HA   VAL  64           HA       VAL  64   7.490   1.450  -6.835
  487    HB   VAL  64           HB       VAL  64   5.092   1.732  -6.753
  488   1HG1  VAL  64          1HG1      VAL  64   4.791  -0.496  -6.902
  489   2HG1  VAL  64          2HG1      VAL  64   5.116  -0.722  -5.184
  490   3HG1  VAL  64          3HG1      VAL  64   6.451  -0.673  -6.335
  491   1HG2  VAL  64          1HG2      VAL  64   5.344   1.165  -3.783
  492   2HG2  VAL  64          2HG2      VAL  64   3.833   1.378  -4.664
  493   3HG2  VAL  64          3HG2      VAL  64   4.955   2.730  -4.494
  494    H    ASP  65           H        ASP  65   7.448   2.956  -3.680
  495    HA   ASP  65           HA       ASP  65   6.525   5.519  -4.470
  496   1HB   ASP  65          2HB       ASP  65   7.149   4.386  -2.061
  497   2HB   ASP  65          1HB       ASP  65   8.520   5.467  -2.298
  498    H    GLU  66           H        GLU  66   7.498   6.120  -6.360
  499    HA   GLU  66           HA       GLU  66  10.230   6.017  -6.984
  500   1HB   GLU  66          2HB       GLU  66   7.962   7.715  -7.981
  501   2HB   GLU  66          1HB       GLU  66   9.607   7.989  -8.555
  502   1HG   GLU  66          2HG       GLU  66   8.462   5.206  -8.556
  503   2HG   GLU  66          1HG       GLU  66   8.072   6.322  -9.865
  504    H    ASP  67           H        ASP  67   8.352   8.712  -5.595
  505    HA   ASP  67           HA       ASP  67  10.711  10.376  -5.377
  506   1HB   ASP  67          2HB       ASP  67   9.125  11.896  -4.067
  507   2HB   ASP  67          1HB       ASP  67   8.726  11.606  -5.759
  508    H    GLY  68           H        GLY  68   8.789   8.351  -3.215
  509   1HA   GLY  68          2HA       GLY  68   9.351   7.435  -1.168
  510   2HA   GLY  68          1HA       GLY  68  10.947   8.162  -1.330
  511    H    SER  69           H        SER  69   7.629   9.469  -1.141
  512    HA   SER  69           HA       SER  69   8.568  11.528   0.711
  513   1HB   SER  69          2HB       SER  69   6.302  12.503   0.384
  514   2HB   SER  69          1HB       SER  69   7.179  12.288  -1.127
  515    HG   SER  69           HG       SER  69   4.996  11.524  -1.209
  516    H    GLY  70           H        GLY  70   6.049   9.017   0.555
  517   1HA   GLY  70          2HA       GLY  70   6.085   7.771   2.869
  518   2HA   GLY  70          1HA       GLY  70   5.499   9.337   3.425
  519    H    THR  71           H        THR  71   4.103   9.674   0.741
  520    HA   THR  71           HA       THR  71   1.733   8.036   1.389
  521    HB   THR  71           HB       THR  71   0.416   9.737   0.227
  522    HG1  THR  71           HG1      THR  71   2.832  11.190  -0.061
  523   1HG2  THR  71          1HG2      THR  71   0.868  11.653   1.762
  524   2HG2  THR  71          2HG2      THR  71   2.373  10.868   2.243
  525   3HG2  THR  71          3HG2      THR  71   0.825  10.100   2.596
  526    H    VAL  72           H        VAL  72   0.574   7.036  -0.307
  527    HA   VAL  72           HA       VAL  72   2.264   6.414  -2.634
  528    HB   VAL  72           HB       VAL  72  -0.257   4.982  -1.803
  529   1HG1  VAL  72          1HG1      VAL  72   0.622   4.687  -4.136
  530   2HG1  VAL  72          2HG1      VAL  72   0.633   3.197  -3.191
  531   3HG1  VAL  72          3HG1      VAL  72   2.132   4.093  -3.443
  532   1HG2  VAL  72          1HG2      VAL  72   1.147   4.713   0.083
  533   2HG2  VAL  72          2HG2      VAL  72   2.604   4.649  -0.909
  534   3HG2  VAL  72          3HG2      VAL  72   1.482   3.287  -0.900
  535    H    ASP  73           H        ASP  73   1.864   7.360  -4.480
  536    HA   ASP  73           HA       ASP  73  -0.646   8.778  -4.925
  537   1HB   ASP  73          2HB       ASP  73   1.694   8.481  -6.827
  538   2HB   ASP  73          1HB       ASP  73   0.413   9.691  -6.888
  539    H    PHE  74           H        PHE  74  -1.630   8.511  -7.199
  540    HA   PHE  74           HA       PHE  74  -2.600   5.876  -7.459
  541   1HB   PHE  74          2HB       PHE  74  -3.674   8.045  -8.319
  542   2HB   PHE  74          1HB       PHE  74  -2.614   7.879  -9.717
  543    HD1  PHE  74           HD1      PHE  74  -4.162   7.357 -11.434
  544    HD2  PHE  74           HD2      PHE  74  -4.206   5.119  -7.767
  545    HE1  PHE  74           HE1      PHE  74  -5.736   5.729 -12.444
  546    HE2  PHE  74           HE2      PHE  74  -5.776   3.492  -8.779
  547    HZ   PHE  74           HZ       PHE  74  -6.544   3.795 -11.117
  548    H    ASP  75           H        ASP  75   0.096   7.540  -9.004
  549    HA   ASP  75           HA       ASP  75   0.593   5.591 -11.030
  550   1HB   ASP  75          2HB       ASP  75   2.077   7.902  -9.869
  551   2HB   ASP  75          1HB       ASP  75   3.012   6.689 -10.741
  552    H    GLU  76           H        GLU  76   1.814   6.090  -7.734
  553    HA   GLU  76           HA       GLU  76   3.654   3.872  -7.816
  554   1HB   GLU  76          2HB       GLU  76   2.572   5.065  -5.273
  555   2HB   GLU  76          1HB       GLU  76   4.168   4.382  -5.580
  556   1HG   GLU  76          2HG       GLU  76   4.624   6.289  -7.141
  557   2HG   GLU  76          1HG       GLU  76   3.075   6.990  -6.679
  558    H    PHE  77           H        PHE  77   0.293   4.292  -7.163
  559    HA   PHE  77           HA       PHE  77  -0.094   1.917  -5.583
  560   1HB   PHE  77          2HB       PHE  77  -1.606   3.853  -5.413
  561   2HB   PHE  77          1HB       PHE  77  -2.080   3.638  -7.095
  562    HD1  PHE  77           HD1      PHE  77  -1.922   1.779  -3.840
  563    HD2  PHE  77           HD2      PHE  77  -3.904   2.279  -7.621
  564    HE1  PHE  77           HE1      PHE  77  -3.657   0.151  -3.147
  565    HE2  PHE  77           HE2      PHE  77  -5.641   0.649  -6.923
  566    HZ   PHE  77           HZ       PHE  77  -5.516  -0.415  -4.687
  567    H    LEU  78           H        LEU  78  -0.388   2.779  -9.008
  568    HA   LEU  78           HA       LEU  78  -1.568   0.258  -9.768
  569   1HB   LEU  78          2HB       LEU  78  -0.336   2.470 -11.392
  570   2HB   LEU  78          1HB       LEU  78  -1.151   1.079 -12.076
  571    HG   LEU  78           HG       LEU  78  -2.684   2.692 -10.102
  572   1HD1  LEU  78          1HD1      LEU  78  -1.451   4.351 -11.542
  573   2HD1  LEU  78          2HD1      LEU  78  -3.206   4.424 -11.699
  574   3HD1  LEU  78          3HD1      LEU  78  -2.242   3.635 -12.947
  575   1HD2  LEU  78          1HD2      LEU  78  -4.510   1.933 -11.336
  576   2HD2  LEU  78          2HD2      LEU  78  -3.372   0.606 -11.565
  577   3HD2  LEU  78          3HD2      LEU  78  -3.581   1.816 -12.832
  578    H    VAL  79           H        VAL  79   1.687   1.689  -9.941
  579    HA   VAL  79           HA       VAL  79   2.909  -0.319 -11.483
  580    HB   VAL  79           HB       VAL  79   5.049   0.397 -10.374
  581   1HG1  VAL  79          1HG1      VAL  79   4.338   1.477 -12.415
  582   2HG1  VAL  79          2HG1      VAL  79   4.922   2.729 -11.317
  583   3HG1  VAL  79          3HG1      VAL  79   3.189   2.486 -11.534
  584   1HG2  VAL  79          1HG2      VAL  79   3.164   2.270  -8.919
  585   2HG2  VAL  79          2HG2      VAL  79   4.919   2.420  -8.932
  586   3HG2  VAL  79          3HG2      VAL  79   4.158   1.016  -8.185
  587    H    MET  80           H        MET  80   2.038  -0.263  -8.107
  588    HA   MET  80           HA       MET  80   3.651  -2.113  -6.899
  589   1HB   MET  80          2HB       MET  80   0.805  -1.359  -6.614
  590   2HB   MET  80          1HB       MET  80   1.251  -2.917  -5.921
  591   1HG   MET  80          2HG       MET  80   2.536  -1.970  -4.291
  592   2HG   MET  80          1HG       MET  80   3.136  -0.704  -5.361
  593   1HE   MET  80          1HE       MET  80  -0.736  -1.523  -4.947
  594   2HE   MET  80          2HE       MET  80  -1.000  -0.806  -3.359
  595   3HE   MET  80          3HE       MET  80   0.139  -2.139  -3.538
  596    H    MET  81           H        MET  81   1.041  -2.787  -9.203
  597    HA   MET  81           HA       MET  81   1.155  -5.644  -8.887
  598   1HB   MET  81          2HB       MET  81  -0.079  -3.876 -11.008
  599   2HB   MET  81          1HB       MET  81  -0.209  -5.635 -11.015
  600   1HG   MET  81          2HG       MET  81  -0.995  -4.002  -8.599
  601   2HG   MET  81          1HG       MET  81  -2.132  -4.327  -9.906
  602   1HE   MET  81          1HE       MET  81  -1.764  -6.705  -6.350
  603   2HE   MET  81          2HE       MET  81  -2.034  -5.012  -6.757
  604   3HE   MET  81          3HE       MET  81  -0.393  -5.654  -6.734
  605    H    VAL  82           H        VAL  82   2.144  -3.486 -11.569
  606    HA   VAL  82           HA       VAL  82   3.446  -5.481 -13.094
  607    HB   VAL  82           HB       VAL  82   4.559  -3.578 -14.261
  608   1HG1  VAL  82          1HG1      VAL  82   1.824  -2.544 -14.044
  609   2HG1  VAL  82          2HG1      VAL  82   1.884  -4.296 -14.237
  610   3HG1  VAL  82          3HG1      VAL  82   2.654  -3.252 -15.433
  611   1HG2  VAL  82          1HG2      VAL  82   3.746  -1.271 -13.532
  612   2HG2  VAL  82          2HG2      VAL  82   4.934  -2.028 -12.472
  613   3HG2  VAL  82          3HG2      VAL  82   3.229  -2.028 -12.028
  614    H    ARG  83           H        ARG  83   4.579  -3.503 -10.418
  615    HA   ARG  83           HA       ARG  83   7.358  -3.758 -10.757
  616   1HB   ARG  83          2HB       ARG  83   5.648  -3.440  -8.292
  617   2HB   ARG  83          1HB       ARG  83   7.408  -3.504  -8.213
  618   1HG   ARG  83          2HG       ARG  83   6.374  -1.674 -10.274
  619   2HG   ARG  83          1HG       ARG  83   5.943  -1.213  -8.627
  620   1HD   ARG  83          2HD       ARG  83   8.455  -1.685  -8.099
  621   2HD   ARG  83          1HD       ARG  83   8.678  -1.546  -9.839
  622    HE   ARG  83           HE       ARG  83   7.203   0.686  -8.883
  623   1HH1  ARG  83          2HH1      ARG  83  10.408  -0.704  -8.856
  624   2HH1  ARG  83          1HH1      ARG  83  11.205   0.823  -8.685
  625   1HH2  ARG  83          1HH2      ARG  83   8.268   2.677  -8.656
  626   2HH2  ARG  83          2HH2      ARG  83   9.997   2.732  -8.572
  627    H    CYS  84           H        CYS  84   4.978  -6.059  -9.685
  628    HA   CYS  84           HA       CYS  84   6.582  -7.829  -8.199
  629   1HB   CYS  84          2HB       CYS  84   4.004  -7.828  -8.599
  630   2HB   CYS  84          1HB       CYS  84   4.395  -8.830  -9.997
  631    HG   CYS  84           HG       CYS  84   5.358 -10.637  -8.433
  632    H    MET  85           H        MET  85   6.285  -7.337 -11.661
  633    HA   MET  85           HA       MET  85   7.289  -9.742 -12.660
  634   1HB   MET  85          2HB       MET  85   7.231  -6.925 -13.623
  635   2HB   MET  85          1HB       MET  85   8.321  -8.041 -14.447
  636   1HG   MET  85          2HG       MET  85   6.222  -9.629 -14.460
  637   2HG   MET  85          1HG       MET  85   5.326  -8.127 -14.238
  638   1HE   MET  85          1HE       MET  85   8.361  -9.593 -16.268
  639   2HE   MET  85          2HE       MET  85   7.616  -9.634 -17.865
  640   3HE   MET  85          3HE       MET  85   6.890 -10.537 -16.538
  641    H    LYS  86           H        LYS  86   9.113  -6.783 -11.810
  642    HA   LYS  86           HA       LYS  86  11.626  -8.303 -11.968
  643   1HB   LYS  86          2HB       LYS  86  12.725  -6.088 -11.696
  644   2HB   LYS  86          1HB       LYS  86  11.656  -6.149 -13.094
  645   1HG   LYS  86          2HG       LYS  86  10.539  -4.369 -12.288
  646   2HG   LYS  86          1HG       LYS  86  10.068  -5.323 -10.883
  647   1HD   LYS  86          2HD       LYS  86  11.205  -3.410 -10.015
  648   2HD   LYS  86          1HD       LYS  86  12.349  -4.746  -9.890
  649   1HE   LYS  86          2HE       LYS  86  13.600  -4.004 -11.757
  650   2HE   LYS  86          1HE       LYS  86  12.302  -2.948 -12.313
  651   1HZ   LYS  86          1HZ       LYS  86  14.120  -1.735 -11.224
  652   2HZ   LYS  86          2HZ       LYS  86  13.815  -2.582  -9.782
  653   3HZ   LYS  86          3HZ       LYS  86  12.641  -1.531 -10.420
  654    H    ASP  87           H        ASP  87  12.922  -8.730 -10.240
  655    HA   ASP  87           HA       ASP  87  11.800  -8.081  -7.581
  656   1HB   ASP  87          2HB       ASP  87  12.194 -10.540  -8.435
  657   2HB   ASP  87          1HB       ASP  87  13.868 -10.212  -7.986
  658    H    ASP  88           H        ASP  88  13.366  -6.180  -9.011
  659    HA   ASP  88           HA       ASP  88  15.335  -4.954  -8.963
  660   1HB   ASP  88          2HB       ASP  88  15.805  -4.164  -6.590
  661   2HB   ASP  88          1HB       ASP  88  14.164  -3.917  -7.179
  662    H    SER  89           HN       SER  89  16.181  -7.441  -9.517
  663    HA   SER  89           HA       SER  89  18.578  -7.753  -7.806
  664   1HB   SER  89          2HB       SER  89  16.901  -9.910  -9.097
  665   2HB   SER  89          1HB       SER  89  18.511 -10.193  -8.439
  666    HG   SER  89           HG       SER  89  17.715 -10.083  -6.490
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1  10.953   2.831 -17.685
    2   2H    MET   1          2H        MET   1  11.810   4.069 -16.900
    3   3H    MET   1          3H        MET   1  10.949   2.921 -15.991
    4    HA   MET   1           HA       MET   1  13.405   2.485 -17.598
    5   1HB   MET   1          2HB       MET   1  12.716   2.565 -14.681
    6   2HB   MET   1          1HB       MET   1  14.000   1.480 -15.218
    7   1HG   MET   1          2HG       MET   1  15.079   3.426 -16.380
    8   2HG   MET   1          1HG       MET   1  13.858   4.477 -15.660
    9   1HE   MET   1          1HE       MET   1  17.282   5.104 -13.775
   10   2HE   MET   1          2HE       MET   1  16.103   5.755 -14.909
   11   3HE   MET   1          3HE       MET   1  17.168   4.445 -15.412
   12    H    ASN   2           H        ASN   2  11.065   0.845 -15.422
   13    HA   ASN   2           HA       ASN   2  11.828  -1.787 -16.196
   14   1HB   ASN   2          2HB       ASN   2   9.639  -0.584 -14.595
   15   2HB   ASN   2          1HB       ASN   2   9.314  -2.169 -15.292
   16   1HD2  ASN   2          1HD2      ASN   2  11.218  -3.817 -14.934
   17   2HD2  ASN   2          2HD2      ASN   2  11.964  -3.769 -13.410
   18    H    ASP   3           H        ASP   3  11.494  -2.745 -18.072
   19    HA   ASP   3           HA       ASP   3   9.550  -1.700 -19.967
   20   1HB   ASP   3          2HB       ASP   3  11.660  -3.847 -20.116
   21   2HB   ASP   3          1HB       ASP   3  10.482  -3.609 -21.407
   22    H    ILE   4           H        ILE   4   9.436  -3.995 -17.465
   23    HA   ILE   4           HA       ILE   4   7.623  -5.821 -18.801
   24    HB   ILE   4           HB       ILE   4   7.487  -7.019 -16.758
   25   1HG1  ILE   4          2HG1      ILE   4   8.715  -5.844 -14.698
   26   2HG1  ILE   4          1HG1      ILE   4   8.213  -4.380 -15.546
   27   1HG2  ILE   4          1HG2      ILE   4   9.753  -6.903 -17.960
   28   2HG2  ILE   4          2HG2      ILE   4   9.762  -7.499 -16.300
   29   3HG2  ILE   4          3HG2      ILE   4  10.265  -5.843 -16.645
   30   1HD1  ILE   4          1HD1      ILE   4   6.562  -5.343 -13.824
   31   2HD1  ILE   4          2HD1      ILE   4   6.280  -6.635 -14.990
   32   3HD1  ILE   4          3HD1      ILE   4   5.913  -4.962 -15.420
   33    H    TYR   5           H        TYR   5   7.417  -2.852 -17.022
   34    HA   TYR   5           HA       TYR   5   4.767  -2.995 -16.056
   35   1HB   TYR   5          2HB       TYR   5   6.354  -0.587 -17.001
   36   2HB   TYR   5          1HB       TYR   5   4.830  -0.499 -16.128
   37    HD1  TYR   5           HD1      TYR   5   6.689  -3.318 -15.002
   38    HD2  TYR   5           HD2      TYR   5   6.431   0.948 -14.621
   39    HE1  TYR   5           HE1      TYR   5   7.936  -3.438 -12.875
   40    HE2  TYR   5           HE2      TYR   5   7.667   0.829 -12.480
   41    HH   TYR   5           HH       TYR   5   9.506  -1.249 -11.533
   42    H    LYS   6           H        LYS   6   6.148  -2.235 -19.176
   43    HA   LYS   6           HA       LYS   6   3.642  -1.374 -20.366
   44   1HB   LYS   6          2HB       LYS   6   6.127  -2.208 -21.872
   45   2HB   LYS   6          1HB       LYS   6   4.858  -1.103 -22.392
   46   1HG   LYS   6          2HG       LYS   6   6.989  -0.637 -20.295
   47   2HG   LYS   6          1HG       LYS   6   6.684   0.294 -21.760
   48   1HD   LYS   6          2HD       LYS   6   4.641   1.188 -20.874
   49   2HD   LYS   6          1HD       LYS   6   4.667   0.064 -19.516
   50   1HE   LYS   6          2HE       LYS   6   6.278   1.251 -18.377
   51   2HE   LYS   6          1HE       LYS   6   7.033   1.850 -19.854
   52   1HZ   LYS   6          1HZ       LYS   6   5.877   3.610 -18.656
   53   2HZ   LYS   6          2HZ       LYS   6   4.415   2.752 -18.772
   54   3HZ   LYS   6          3HZ       LYS   6   5.171   3.343 -20.174
   55    H    ALA   7           H        ALA   7   5.696  -4.233 -20.323
   56    HA   ALA   7           HA       ALA   7   4.196  -5.788 -22.181
   57   1HB   ALA   7          1HB       ALA   7   5.710  -7.077 -19.943
   58   2HB   ALA   7          2HB       ALA   7   6.604  -6.151 -21.149
   59   3HB   ALA   7          3HB       ALA   7   5.624  -7.531 -21.646
   60    H    ALA   8           H        ALA   8   3.806  -5.048 -18.791
   61    HA   ALA   8           HA       ALA   8   1.965  -7.216 -18.257
   62   1HB   ALA   8          1HB       ALA   8   2.064  -6.569 -16.065
   63   2HB   ALA   8          2HB       ALA   8   2.065  -4.850 -16.461
   64   3HB   ALA   8          3HB       ALA   8   3.548  -5.791 -16.616
   65    H    VAL   9           H        VAL   9   1.774  -3.800 -19.135
   66    HA   VAL   9           HA       VAL   9  -0.850  -3.184 -18.489
   67    HB   VAL   9           HB       VAL   9   0.912  -2.324 -20.779
   68   1HG1  VAL   9          1HG1      VAL   9  -1.945  -1.507 -20.199
   69   2HG1  VAL   9          2HG1      VAL   9  -1.283  -2.125 -21.714
   70   3HG1  VAL   9          3HG1      VAL   9  -0.838  -0.515 -21.150
   71   1HG2  VAL   9          1HG2      VAL   9   0.810  -1.635 -18.109
   72   2HG2  VAL   9          2HG2      VAL   9  -0.172  -0.375 -18.858
   73   3HG2  VAL   9          3HG2      VAL   9   1.492  -0.629 -19.387
   74    H    GLU  10           H        GLU  10   0.321  -4.643 -21.530
   75    HA   GLU  10           HA       GLU  10  -2.198  -4.974 -22.742
   76   1HB   GLU  10          2HB       GLU  10  -1.076  -6.502 -24.267
   77   2HB   GLU  10          1HB       GLU  10  -0.035  -5.115 -23.947
   78   1HG   GLU  10          2HG       GLU  10   1.315  -6.371 -22.411
   79   2HG   GLU  10          1HG       GLU  10   0.176  -7.717 -22.415
   80    H    GLN  11           H        GLN  11  -0.637  -6.769 -20.201
   81    HA   GLN  11           HA       GLN  11  -2.247  -9.151 -20.593
   82   1HB   GLN  11          2HB       GLN  11  -0.408  -8.370 -18.319
   83   2HB   GLN  11          1HB       GLN  11  -1.174  -9.946 -18.513
   84   1HG   GLN  11          2HG       GLN  11  -0.056 -10.063 -20.802
   85   2HG   GLN  11          1HG       GLN  11   0.889  -8.659 -20.310
   86   1HE2  GLN  11          1HE2      GLN  11   1.712  -9.094 -17.785
   87   2HE2  GLN  11          2HE2      GLN  11   2.510 -10.583 -17.616
   88    H    LEU  12           H        LEU  12  -2.083  -6.426 -18.347
   89    HA   LEU  12           HA       LEU  12  -4.212  -7.283 -16.657
   90   1HB   LEU  12          2HB       LEU  12  -3.101  -4.520 -17.136
   91   2HB   LEU  12          1HB       LEU  12  -4.213  -4.946 -15.856
   92    HG   LEU  12           HG       LEU  12  -1.905  -6.673 -15.751
   93   1HD1  LEU  12          1HD1      LEU  12  -1.043  -4.476 -16.918
   94   2HD1  LEU  12          2HD1      LEU  12  -0.124  -5.178 -15.586
   95   3HD1  LEU  12          3HD1      LEU  12  -1.179  -3.795 -15.297
   96   1HD2  LEU  12          1HD2      LEU  12  -1.933  -6.035 -13.469
   97   2HD2  LEU  12          2HD2      LEU  12  -3.622  -5.927 -13.963
   98   3HD2  LEU  12          3HD2      LEU  12  -2.647  -4.463 -13.830
   99    H    THR  13           H        THR  13  -6.298  -6.323 -16.450
  100    HA   THR  13           HA       THR  13  -7.447  -5.511 -19.052
  101    HB   THR  13           HB       THR  13  -9.630  -6.117 -17.607
  102    HG1  THR  13           HG1      THR  13  -8.763  -6.820 -15.768
  103   1HG2  THR  13          1HG2      THR  13  -9.077  -7.093 -19.759
  104   2HG2  THR  13          2HG2      THR  13  -9.497  -8.383 -18.633
  105   3HG2  THR  13          3HG2      THR  13  -7.805  -8.070 -19.026
  106    H    ASP  14           H        ASP  14  -9.434  -4.115 -18.838
  107    HA   ASP  14           HA       ASP  14  -8.773  -1.644 -17.623
  108   1HB   ASP  14          2HB       ASP  14 -11.392  -2.703 -18.709
  109   2HB   ASP  14          1HB       ASP  14 -11.174  -1.047 -18.141
  110    H    GLU  15           H        GLU  15 -10.653  -4.413 -16.564
  111    HA   GLU  15           HA       GLU  15 -12.079  -3.287 -14.427
  112   1HB   GLU  15          2HB       GLU  15 -11.018  -6.057 -14.946
  113   2HB   GLU  15          1HB       GLU  15 -11.867  -5.670 -13.449
  114   1HG   GLU  15          2HG       GLU  15 -13.659  -4.624 -15.067
  115   2HG   GLU  15          1HG       GLU  15 -12.909  -5.677 -16.267
  116    H    GLN  16           H        GLN  16  -8.770  -4.587 -14.562
  117    HA   GLN  16           HA       GLN  16  -8.159  -4.493 -11.820
  118   1HB   GLN  16          2HB       GLN  16  -6.515  -4.374 -14.324
  119   2HB   GLN  16          1HB       GLN  16  -5.745  -4.028 -12.776
  120   1HG   GLN  16          2HG       GLN  16  -7.481  -6.412 -12.746
  121   2HG   GLN  16          1HG       GLN  16  -6.087  -6.548 -13.816
  122   1HE2  GLN  16          1HE2      GLN  16  -6.818  -5.395 -10.461
  123   2HE2  GLN  16          2HE2      GLN  16  -5.384  -6.008  -9.792
  124    H    LYS  17           H        LYS  17  -7.690  -2.012 -14.344
  125    HA   LYS  17           HA       LYS  17  -6.639  -0.050 -12.554
  126   1HB   LYS  17          2HB       LYS  17  -7.536  -0.094 -15.381
  127   2HB   LYS  17          1HB       LYS  17  -7.590   1.469 -14.567
  128   1HG   LYS  17          2HG       LYS  17  -5.394   1.554 -15.213
  129   2HG   LYS  17          1HG       LYS  17  -5.161   0.621 -13.734
  130   1HD   LYS  17          2HD       LYS  17  -5.725  -1.403 -15.419
  131   2HD   LYS  17          1HD       LYS  17  -5.033  -0.266 -16.577
  132   1HE   LYS  17          2HE       LYS  17  -3.619  -0.807 -13.975
  133   2HE   LYS  17          1HE       LYS  17  -3.441  -1.926 -15.326
  134   1HZ   LYS  17          1HZ       LYS  17  -1.711  -0.266 -15.381
  135   2HZ   LYS  17          2HZ       LYS  17  -2.858   0.987 -15.377
  136   3HZ   LYS  17          3HZ       LYS  17  -2.740  -0.057 -16.713
  137    H    ASN  18           H        ASN  18  -9.887  -0.944 -13.581
  138    HA   ASN  18           HA       ASN  18 -11.273   1.357 -12.682
  139   1HB   ASN  18          2HB       ASN  18 -12.003  -1.442 -13.367
  140   2HB   ASN  18          1HB       ASN  18 -13.127  -0.568 -12.328
  141   1HD2  ASN  18          1HD2      ASN  18 -12.346  -1.113 -15.569
  142   2HD2  ASN  18          2HD2      ASN  18 -13.107   0.246 -16.243
  143    H    GLU  19           H        GLU  19 -10.462  -1.722 -11.092
  144    HA   GLU  19           HA       GLU  19 -11.700  -1.125  -8.590
  145   1HB   GLU  19          2HB       GLU  19  -9.393  -3.004  -9.184
  146   2HB   GLU  19          1HB       GLU  19 -10.347  -2.980  -7.700
  147   1HG   GLU  19          2HG       GLU  19 -12.367  -3.211  -9.427
  148   2HG   GLU  19          1HG       GLU  19 -11.105  -3.931 -10.425
  149    H    PHE  20           H        PHE  20  -8.401  -0.822  -9.845
  150    HA   PHE  20           HA       PHE  20  -7.134   0.093  -7.506
  151   1HB   PHE  20          2HB       PHE  20  -6.557   0.329 -10.436
  152   2HB   PHE  20          1HB       PHE  20  -5.615   1.292  -9.302
  153    HD1  PHE  20           HD1      PHE  20  -3.589   0.033  -9.973
  154    HD2  PHE  20           HD2      PHE  20  -6.951  -1.920  -8.150
  155    HE1  PHE  20           HE1      PHE  20  -2.174  -1.932  -9.471
  156    HE2  PHE  20           HE2      PHE  20  -5.535  -3.886  -7.645
  157    HZ   PHE  20           HZ       PHE  20  -3.146  -3.894  -8.303
  158    H    LYS  21           H        LYS  21  -8.745   1.892 -10.124
  159    HA   LYS  21           HA       LYS  21  -8.142   4.489  -9.173
  160   1HB   LYS  21          2HB       LYS  21  -8.998   3.953 -11.477
  161   2HB   LYS  21          1HB       LYS  21 -10.590   3.686 -10.764
  162   1HG   LYS  21          2HG       LYS  21 -10.352   5.993 -11.661
  163   2HG   LYS  21          1HG       LYS  21 -10.625   5.989  -9.919
  164   1HD   LYS  21          2HD       LYS  21  -8.317   6.414  -9.458
  165   2HD   LYS  21          1HD       LYS  21  -7.854   6.082 -11.128
  166   1HE   LYS  21          2HE       LYS  21  -9.164   8.050 -11.873
  167   2HE   LYS  21          1HE       LYS  21  -9.577   8.396 -10.194
  168   1HZ   LYS  21          1HZ       LYS  21  -6.826   8.304 -11.314
  169   2HZ   LYS  21          2HZ       LYS  21  -7.227   8.641  -9.698
  170   3HZ   LYS  21          3HZ       LYS  21  -7.691   9.712 -10.932
  171    H    ALA  22           H        ALA  22 -11.073   2.481  -8.768
  172    HA   ALA  22           HA       ALA  22 -12.453   4.311  -7.100
  173   1HB   ALA  22          1HB       ALA  22 -12.736   1.299  -7.082
  174   2HB   ALA  22          2HB       ALA  22 -13.497   2.351  -8.277
  175   3HB   ALA  22          3HB       ALA  22 -13.936   2.489  -6.575
  176    H    ALA  23           H        ALA  23 -10.322   1.560  -6.384
  177    HA   ALA  23           HA       ALA  23 -10.558   1.595  -3.573
  178   1HB   ALA  23          1HB       ALA  23  -9.537  -0.300  -4.666
  179   2HB   ALA  23          2HB       ALA  23  -8.338   0.432  -3.599
  180   3HB   ALA  23          3HB       ALA  23  -8.263   0.717  -5.339
  181    H    PHE  24           H        PHE  24  -8.763   3.627  -5.778
  182    HA   PHE  24           HA       PHE  24  -7.039   4.727  -3.715
  183   1HB   PHE  24          2HB       PHE  24  -6.554   4.493  -6.280
  184   2HB   PHE  24          1HB       PHE  24  -7.475   5.989  -6.411
  185    HD1  PHE  24           HD1      PHE  24  -4.467   4.415  -4.915
  186    HD2  PHE  24           HD2      PHE  24  -6.584   8.085  -5.626
  187    HE1  PHE  24           HE1      PHE  24  -2.468   5.705  -4.215
  188    HE2  PHE  24           HE2      PHE  24  -4.589   9.376  -4.920
  189    HZ   PHE  24           HZ       PHE  24  -2.529   8.184  -4.216
  190    H    ASP  25           H        ASP  25  -9.635   5.984  -5.823
  191    HA   ASP  25           HA       ASP  25  -9.904   8.525  -4.750
  192   1HB   ASP  25          2HB       ASP  25 -11.097   7.389  -6.779
  193   2HB   ASP  25          1HB       ASP  25 -12.346   7.001  -5.595
  194    H    ILE  26           H        ILE  26 -11.411   5.505  -3.577
  195    HA   ILE  26           HA       ILE  26 -13.201   6.637  -1.742
  196    HB   ILE  26           HB       ILE  26 -13.057   4.479  -0.510
  197   1HG1  ILE  26          2HG1      ILE  26 -10.906   3.864  -2.564
  198   2HG1  ILE  26          1HG1      ILE  26 -10.635   4.085  -0.837
  199   1HG2  ILE  26          1HG2      ILE  26 -13.556   4.787  -3.412
  200   2HG2  ILE  26          2HG2      ILE  26 -14.621   4.186  -2.142
  201   3HG2  ILE  26          3HG2      ILE  26 -13.402   3.126  -2.845
  202   1HD1  ILE  26          1HD1      ILE  26 -12.328   2.192  -0.485
  203   2HD1  ILE  26          2HD1      ILE  26 -10.761   1.730  -1.151
  204   3HD1  ILE  26          3HD1      ILE  26 -12.162   1.872  -2.212
  205    H    PHE  27           H        PHE  27  -9.739   6.054  -1.455
  206    HA   PHE  27           HA       PHE  27  -9.734   6.819   1.368
  207   1HB   PHE  27          2HB       PHE  27  -7.636   5.821  -0.542
  208   2HB   PHE  27          1HB       PHE  27  -7.181   6.559   0.994
  209    HD1  PHE  27           HD1      PHE  27  -8.320   5.643   3.138
  210    HD2  PHE  27           HD2      PHE  27  -8.294   3.565  -0.618
  211    HE1  PHE  27           HE1      PHE  27  -8.841   3.519   4.308
  212    HE2  PHE  27           HE2      PHE  27  -8.815   1.442   0.548
  213    HZ   PHE  27           HZ       PHE  27  -9.089   1.418   3.012
  214    H    ILE  28           H        ILE  28  -9.090   8.224  -1.769
  215    HA   ILE  28           HA       ILE  28  -7.737  10.555  -0.633
  216    HB   ILE  28           HB       ILE  28  -8.580  10.110  -3.503
  217   1HG1  ILE  28          2HG1      ILE  28  -7.147   8.300  -3.230
  218   2HG1  ILE  28          1HG1      ILE  28  -6.003   9.567  -3.645
  219   1HG2  ILE  28          1HG2      ILE  28  -6.767  12.025  -2.072
  220   2HG2  ILE  28          2HG2      ILE  28  -7.961  12.349  -3.330
  221   3HG2  ILE  28          3HG2      ILE  28  -6.426  11.582  -3.746
  222   1HD1  ILE  28          1HD1      ILE  28  -6.572   8.368  -0.942
  223   2HD1  ILE  28          2HD1      ILE  28  -5.850   9.971  -1.080
  224   3HD1  ILE  28          3HD1      ILE  28  -5.021   8.568  -1.757
  225    H    GLN  29           H        GLN  29 -10.789   9.710  -0.424
  226    HA   GLN  29           HA       GLN  29 -12.258  11.837  -1.619
  227   1HB   GLN  29          2HB       GLN  29 -14.104  11.124  -0.175
  228   2HB   GLN  29          1HB       GLN  29 -13.327   9.725  -0.914
  229   1HG   GLN  29          2HG       GLN  29 -12.016   9.362   1.154
  230   2HG   GLN  29          1HG       GLN  29 -12.811  10.750   1.895
  231   1HE2  GLN  29          1HE2      GLN  29 -14.193   9.829   3.438
  232   2HE2  GLN  29          2HE2      GLN  29 -15.322   8.606   3.099
  233    H    ASP  30           H        ASP  30 -10.591  11.459   1.458
  234    HA   ASP  30           HA       ASP  30 -11.442  14.187   2.223
  235   1HB   ASP  30          2HB       ASP  30 -10.926  13.529   4.552
  236   2HB   ASP  30          1HB       ASP  30 -12.180  12.519   3.836
  237    H    ALA  31           H        ALA  31  -8.876  12.683   0.812
  238    HA   ALA  31           HA       ALA  31  -6.680  13.666   2.353
  239   1HB   ALA  31          1HB       ALA  31  -6.472  11.805   0.714
  240   2HB   ALA  31          2HB       ALA  31  -5.309  13.103   0.427
  241   3HB   ALA  31          3HB       ALA  31  -6.745  12.963  -0.588
  242    H    GLU  32           H        GLU  32  -5.315  15.411   1.916
  243    HA   GLU  32           HA       GLU  32  -6.666  17.695   0.651
  244   1HB   GLU  32          2HB       GLU  32  -4.234  17.562   2.450
  245   2HB   GLU  32          1HB       GLU  32  -4.896  19.048   1.768
  246   1HG   GLU  32          2HG       GLU  32  -6.495  17.125   3.484
  247   2HG   GLU  32          1HG       GLU  32  -5.685  18.559   4.114
  248    H    ASP  33           H        ASP  33  -3.688  15.799   0.465
  249    HA   ASP  33           HA       ASP  33  -2.609  17.420  -1.699
  250   1HB   ASP  33          2HB       ASP  33  -1.670  14.914  -0.301
  251   2HB   ASP  33          1HB       ASP  33  -0.854  15.555  -1.727
  252    H    GLY  34           H        GLY  34  -3.907  14.130  -1.276
  253   1HA   GLY  34          2HA       GLY  34  -5.452  13.330  -3.040
  254   2HA   GLY  34          1HA       GLY  34  -4.316  13.988  -4.211
  255    H    CYS  35           H        CYS  35  -3.647  12.103  -1.264
  256    HA   CYS  35           HA       CYS  35  -2.986   9.713  -2.773
  257   1HB   CYS  35          2HB       CYS  35  -0.624   9.900  -1.442
  258   2HB   CYS  35          1HB       CYS  35  -0.837  10.357  -3.127
  259    HG   CYS  35           HG       CYS  35  -0.951  12.439  -0.789
  260    H    ILE  36           H        ILE  36  -2.031   8.008  -1.258
  261    HA   ILE  36           HA       ILE  36  -3.480   8.170   1.312
  262    HB   ILE  36           HB       ILE  36  -3.277   5.700   1.355
  263   1HG1  ILE  36          2HG1      ILE  36  -2.619   5.124  -1.329
  264   2HG1  ILE  36          1HG1      ILE  36  -1.382   6.248  -0.771
  265   1HG2  ILE  36          1HG2      ILE  36  -5.184   6.951   0.209
  266   2HG2  ILE  36          2HG2      ILE  36  -4.947   5.280  -0.300
  267   3HG2  ILE  36          3HG2      ILE  36  -4.371   6.601  -1.316
  268   1HD1  ILE  36          1HD1      ILE  36  -1.945   4.293   1.286
  269   2HD1  ILE  36          2HD1      ILE  36  -0.417   4.656   0.486
  270   3HD1  ILE  36          3HD1      ILE  36  -1.531   3.488  -0.230
  271    H    SER  37           H        SER  37  -2.303   6.551   2.977
  272    HA   SER  37           HA       SER  37   0.332   7.750   3.401
  273   1HB   SER  37          2HB       SER  37  -1.546   7.460   5.204
  274   2HB   SER  37          1HB       SER  37  -0.952   5.805   5.296
  275    HG   SER  37           HG       SER  37   0.161   7.131   6.755
  276    H    THR  38           H        THR  38   2.210   6.683   3.255
  277    HA   THR  38           HA       THR  38   2.457   4.297   1.803
  278    HB   THR  38           HB       THR  38   4.822   4.252   2.781
  279    HG1  THR  38           HG1      THR  38   5.095   5.449   4.460
  280   1HG2  THR  38          1HG2      THR  38   3.604   6.561   1.294
  281   2HG2  THR  38          2HG2      THR  38   4.633   5.267   0.682
  282   3HG2  THR  38          3HG2      THR  38   5.328   6.556   1.666
  283    H    LYS  39           H        LYS  39   2.558   4.856   5.314
  284    HA   LYS  39           HA       LYS  39   3.046   2.137   6.018
  285   1HB   LYS  39          2HB       LYS  39   2.524   2.816   8.290
  286   2HB   LYS  39          1HB       LYS  39   3.516   4.056   7.524
  287   1HG   LYS  39          2HG       LYS  39   1.143   5.064   6.865
  288   2HG   LYS  39          1HG       LYS  39   0.619   4.145   8.275
  289   1HD   LYS  39          2HD       LYS  39   3.073   5.840   8.524
  290   2HD   LYS  39          1HD       LYS  39   1.500   6.639   8.528
  291   1HE   LYS  39          2HE       LYS  39   0.755   5.217  10.383
  292   2HE   LYS  39          1HE       LYS  39   2.291   4.351  10.358
  293   1HZ   LYS  39          1HZ       LYS  39   2.237   6.075  12.066
  294   2HZ   LYS  39          2HZ       LYS  39   1.972   7.259  10.877
  295   3HZ   LYS  39          3HZ       LYS  39   3.433   6.392  10.906
  296    H    GLU  40           H        GLU  40   0.166   3.837   5.064
  297    HA   GLU  40           HA       GLU  40  -1.596   1.830   6.262
  298   1HB   GLU  40          2HB       GLU  40  -2.115   4.394   4.761
  299   2HB   GLU  40          1HB       GLU  40  -3.397   3.259   5.182
  300   1HG   GLU  40          2HG       GLU  40  -1.470   4.330   7.250
  301   2HG   GLU  40          1HG       GLU  40  -2.971   5.166   6.848
  302    H    LEU  41           H        LEU  41   0.289   1.724   3.616
  303    HA   LEU  41           HA       LEU  41  -1.674   0.906   1.649
  304   1HB   LEU  41          2HB       LEU  41   0.824   1.876   1.394
  305   2HB   LEU  41          1HB       LEU  41   1.176   0.165   1.315
  306    HG   LEU  41           HG       LEU  41  -0.589   1.770  -0.539
  307   1HD1  LEU  41          1HD1      LEU  41   1.823   0.030  -1.111
  308   2HD1  LEU  41          2HD1      LEU  41   1.932   1.766  -0.824
  309   3HD1  LEU  41          3HD1      LEU  41   1.029   1.156  -2.211
  310   1HD2  LEU  41          1HD2      LEU  41  -1.180  -0.289  -1.643
  311   2HD2  LEU  41          2HD2      LEU  41  -1.542  -0.510   0.068
  312   3HD2  LEU  41          3HD2      LEU  41  -0.082  -1.219  -0.624
  313    H    GLY  42           H        GLY  42  -2.578  -0.600   3.313
  314   1HA   GLY  42          2HA       GLY  42  -1.590  -3.305   2.796
  315   2HA   GLY  42          1HA       GLY  42  -1.694  -2.809   4.484
  316    H    LYS  43           H        LYS  43  -3.973  -1.314   4.563
  317    HA   LYS  43           HA       LYS  43  -6.032  -3.308   4.488
  318   1HB   LYS  43          2HB       LYS  43  -7.486  -1.489   5.310
  319   2HB   LYS  43          1HB       LYS  43  -5.986  -1.596   6.231
  320   1HG   LYS  43          2HG       LYS  43  -5.271   0.446   5.549
  321   2HG   LYS  43          1HG       LYS  43  -5.816   0.188   3.893
  322   1HD   LYS  43          2HD       LYS  43  -7.222   1.910   4.649
  323   2HD   LYS  43          1HD       LYS  43  -8.208   0.464   4.871
  324   1HE   LYS  43          2HE       LYS  43  -7.578   0.363   7.237
  325   2HE   LYS  43          1HE       LYS  43  -6.516   1.756   7.032
  326   1HZ   LYS  43          1HZ       LYS  43  -8.674   2.372   7.959
  327   2HZ   LYS  43          2HZ       LYS  43  -9.452   1.762   6.577
  328   3HZ   LYS  43          3HZ       LYS  43  -8.416   3.102   6.450
  329    H    VAL  44           H        VAL  44  -4.878  -0.882   2.293
  330    HA   VAL  44           HA       VAL  44  -7.281  -0.560   0.771
  331    HB   VAL  44           HB       VAL  44  -5.852   0.553  -0.872
  332   1HG1  VAL  44          1HG1      VAL  44  -4.708   1.366   1.785
  333   2HG1  VAL  44          2HG1      VAL  44  -6.440   1.529   1.501
  334   3HG1  VAL  44          3HG1      VAL  44  -5.296   2.383   0.466
  335   1HG2  VAL  44          1HG2      VAL  44  -3.903  -0.841  -0.943
  336   2HG2  VAL  44          2HG2      VAL  44  -3.621  -0.650   0.789
  337   3HG2  VAL  44          3HG2      VAL  44  -3.361   0.710  -0.303
  338    H    MET  45           H        MET  45  -4.452  -2.682   0.574
  339    HA   MET  45           HA       MET  45  -5.266  -3.890  -1.920
  340   1HB   MET  45          2HB       MET  45  -3.291  -5.091   0.019
  341   2HB   MET  45          1HB       MET  45  -3.374  -5.295  -1.729
  342   1HG   MET  45          2HG       MET  45  -3.003  -2.512  -0.738
  343   2HG   MET  45          1HG       MET  45  -1.636  -3.605  -0.553
  344   1HE   MET  45          1HE       MET  45  -3.704  -2.066  -4.273
  345   2HE   MET  45          2HE       MET  45  -4.270  -2.132  -2.603
  346   3HE   MET  45          3HE       MET  45  -4.397  -3.561  -3.627
  347    H    ARG  46           H        ARG  46  -5.708  -4.506   1.492
  348    HA   ARG  46           HA       ARG  46  -6.565  -7.199   1.345
  349   1HB   ARG  46          2HB       ARG  46  -6.476  -6.889   3.573
  350   2HB   ARG  46          1HB       ARG  46  -6.320  -5.153   3.337
  351   1HG   ARG  46          2HG       ARG  46  -8.703  -4.854   3.349
  352   2HG   ARG  46          1HG       ARG  46  -8.981  -6.596   3.322
  353   1HD   ARG  46          2HD       ARG  46  -7.254  -5.765   5.532
  354   2HD   ARG  46          1HD       ARG  46  -8.841  -5.009   5.599
  355    HE   ARG  46           HE       ARG  46  -8.240  -7.806   6.018
  356   1HH1  ARG  46          2HH1      ARG  46 -10.683  -5.505   5.036
  357   2HH1  ARG  46          1HH1      ARG  46 -12.003  -6.534   5.471
  358   1HH2  ARG  46          1HH2      ARG  46  -9.988  -9.136   6.577
  359   2HH2  ARG  46          2HH2      ARG  46 -11.613  -8.583   6.342
  360    H    MET  47           H        MET  47  -8.249  -4.099   1.171
  361    HA   MET  47           HA       MET  47 -10.877  -5.230   0.890
  362   1HB   MET  47          2HB       MET  47  -9.699  -2.488   0.619
  363   2HB   MET  47          1HB       MET  47 -11.314  -2.798  -0.020
  364   1HG   MET  47          2HG       MET  47 -12.113  -3.524   2.133
  365   2HG   MET  47          1HG       MET  47 -10.480  -3.512   2.803
  366   1HE   MET  47          1HE       MET  47 -11.964  -0.809   4.834
  367   2HE   MET  47          2HE       MET  47 -12.005  -2.541   4.509
  368   3HE   MET  47          3HE       MET  47 -13.312  -1.512   3.929
  369    H    LEU  48           H        LEU  48  -8.302  -4.318  -1.323
  370    HA   LEU  48           HA       LEU  48  -9.687  -4.112  -3.737
  371   1HB   LEU  48          2HB       LEU  48  -7.072  -4.012  -3.021
  372   2HB   LEU  48          1HB       LEU  48  -7.116  -5.569  -3.816
  373    HG   LEU  48           HG       LEU  48  -6.437  -3.934  -5.431
  374   1HD1  LEU  48          1HD1      LEU  48  -8.161  -5.673  -6.105
  375   2HD1  LEU  48          2HD1      LEU  48  -8.103  -4.241  -7.134
  376   3HD1  LEU  48          3HD1      LEU  48  -9.384  -4.414  -5.933
  377   1HD2  LEU  48          1HD2      LEU  48  -8.987  -2.403  -4.850
  378   2HD2  LEU  48          2HD2      LEU  48  -7.640  -1.900  -5.871
  379   3HD2  LEU  48          3HD2      LEU  48  -7.433  -1.993  -4.122
  380    H    GLY  49           H        GLY  49  -8.328  -7.016  -2.161
  381   1HA   GLY  49          2HA       GLY  49 -10.311  -8.811  -2.777
  382   2HA   GLY  49          1HA       GLY  49  -9.281  -8.811  -4.203
  383    H    GLN  50           H        GLN  50  -6.781  -8.407  -2.895
  384    HA   GLN  50           HA       GLN  50  -6.291 -11.119  -1.965
  385   1HB   GLN  50          2HB       GLN  50  -4.589  -8.788  -2.759
  386   2HB   GLN  50          1HB       GLN  50  -3.880 -10.042  -1.744
  387   1HG   GLN  50          2HG       GLN  50  -3.430 -10.788  -3.936
  388   2HG   GLN  50          1HG       GLN  50  -4.861 -11.708  -3.472
  389   1HE2  GLN  50          1HE2      GLN  50  -6.362 -11.752  -5.147
  390   2HE2  GLN  50          2HE2      GLN  50  -6.660 -10.476  -6.223
  391    H    ASN  51           H        ASN  51  -4.480 -11.144  -0.108
  392    HA   ASN  51           HA       ASN  51  -5.018  -9.257   2.036
  393   1HB   ASN  51          2HB       ASN  51  -6.818 -11.189   2.000
  394   2HB   ASN  51          1HB       ASN  51  -5.520 -12.126   2.739
  395   1HD2  ASN  51          1HD2      ASN  51  -5.657 -12.063   4.982
  396   2HD2  ASN  51          2HD2      ASN  51  -6.175 -10.726   5.889
  397    HA   PRO  52           HA       PRO  52  -0.776 -11.041   2.128
  398   1HB   PRO  52          2HB       PRO  52   0.509  -8.629   2.165
  399   2HB   PRO  52          1HB       PRO  52   0.007  -9.443   0.679
  400   1HG   PRO  52          2HG       PRO  52  -1.149  -7.073   2.011
  401   2HG   PRO  52          1HG       PRO  52  -1.197  -7.540   0.305
  402   1HD   PRO  52          2HD       PRO  52  -3.294  -7.840   2.201
  403   2HD   PRO  52          1HD       PRO  52  -3.242  -8.527   0.561
  404    H    THR  53           H        THR  53   1.168  -9.936   3.574
  405    HA   THR  53           HA       THR  53   0.059  -9.733   6.306
  406    HB   THR  53           HB       THR  53   2.093 -10.643   7.117
  407    HG1  THR  53           HG1      THR  53   3.935 -10.350   6.143
  408   1HG2  THR  53          1HG2      THR  53   0.796 -12.372   6.062
  409   2HG2  THR  53          2HG2      THR  53   2.491 -12.658   5.669
  410   3HG2  THR  53          3HG2      THR  53   1.417 -11.933   4.471
  411    HA   PRO  54           HA       PRO  54   1.563  -5.621   6.791
  412   1HB   PRO  54          2HB       PRO  54   2.864  -5.678   9.206
  413   2HB   PRO  54          1HB       PRO  54   1.102  -5.674   9.023
  414   1HG   PRO  54          2HG       PRO  54   2.937  -7.936   9.664
  415   2HG   PRO  54          1HG       PRO  54   1.283  -7.632  10.222
  416   1HD   PRO  54          2HD       PRO  54   1.939  -9.444   8.237
  417   2HD   PRO  54          1HD       PRO  54   0.342  -8.677   8.393
  418    H    GLU  55           H        GLU  55   3.938  -8.168   7.131
  419    HA   GLU  55           HA       GLU  55   6.243  -6.435   6.808
  420   1HB   GLU  55          2HB       GLU  55   6.190  -9.435   6.440
  421   2HB   GLU  55          1HB       GLU  55   7.559  -8.418   6.885
  422   1HG   GLU  55          2HG       GLU  55   6.289  -7.809   8.995
  423   2HG   GLU  55          1HG       GLU  55   5.127  -9.065   8.569
  424    H    GLU  56           H        GLU  56   4.284  -8.614   4.826
  425    HA   GLU  56           HA       GLU  56   5.864  -8.548   2.475
  426   1HB   GLU  56          2HB       GLU  56   3.092  -9.347   3.165
  427   2HB   GLU  56          1HB       GLU  56   3.391  -8.949   1.473
  428   1HG   GLU  56          2HG       GLU  56   4.994 -10.648   1.223
  429   2HG   GLU  56          1HG       GLU  56   5.268 -10.775   2.960
  430    H    LEU  57           H        LEU  57   2.815  -6.797   3.212
  431    HA   LEU  57           HA       LEU  57   2.806  -5.148   0.956
  432   1HB   LEU  57          2HB       LEU  57   1.276  -3.728   2.137
  433   2HB   LEU  57          1HB       LEU  57   0.901  -5.399   2.484
  434    HG   LEU  57           HG       LEU  57   2.469  -4.862   4.609
  435   1HD1  LEU  57          1HD1      LEU  57   2.032  -2.315   3.409
  436   2HD1  LEU  57          2HD1      LEU  57   2.810  -2.664   4.953
  437   3HD1  LEU  57          3HD1      LEU  57   1.072  -2.369   4.887
  438   1HD2  LEU  57          1HD2      LEU  57   0.327  -5.759   4.971
  439   2HD2  LEU  57          2HD2      LEU  57  -0.473  -4.437   4.124
  440   3HD2  LEU  57          3HD2      LEU  57   0.213  -4.170   5.726
  441    H    GLN  58           H        GLN  58   4.584  -4.822   3.974
  442    HA   GLN  58           HA       GLN  58   5.303  -2.122   3.870
  443   1HB   GLN  58          2HB       GLN  58   6.020  -4.339   5.436
  444   2HB   GLN  58          1HB       GLN  58   7.534  -3.749   4.752
  445   1HG   GLN  58          2HG       GLN  58   5.489  -2.049   6.216
  446   2HG   GLN  58          1HG       GLN  58   7.012  -2.622   6.894
  447   1HE2  GLN  58          1HE2      GLN  58   5.568  -0.274   4.702
  448   2HE2  GLN  58          2HE2      GLN  58   6.998   0.580   4.378
  449    H    GLU  59           H        GLU  59   6.882  -4.942   2.383
  450    HA   GLU  59           HA       GLU  59   9.077  -3.561   1.249
  451   1HB   GLU  59          2HB       GLU  59   7.706  -6.133   0.437
  452   2HB   GLU  59          1HB       GLU  59   9.188  -5.540  -0.313
  453   1HG   GLU  59          2HG       GLU  59  10.463  -5.899   1.593
  454   2HG   GLU  59          1HG       GLU  59   9.079  -5.735   2.676
  455    H    MET  60           H        MET  60   5.815  -4.249   0.025
  456    HA   MET  60           HA       MET  60   6.220  -3.377  -2.636
  457   1HB   MET  60          2HB       MET  60   3.837  -3.803  -0.890
  458   2HB   MET  60          1HB       MET  60   3.624  -2.835  -2.348
  459   1HG   MET  60          2HG       MET  60   3.304  -4.880  -3.321
  460   2HG   MET  60          1HG       MET  60   5.066  -4.892  -3.366
  461   1HE   MET  60          1HE       MET  60   4.620  -7.076  -3.875
  462   2HE   MET  60          2HE       MET  60   3.818  -8.310  -2.907
  463   3HE   MET  60          3HE       MET  60   5.541  -8.014  -2.692
  464    H    ILE  61           H        ILE  61   5.131  -1.648   0.278
  465    HA   ILE  61           HA       ILE  61   4.483   0.818  -0.833
  466    HB   ILE  61           HB       ILE  61   5.690   0.108   1.844
  467   1HG1  ILE  61          2HG1      ILE  61   2.918   1.105   1.470
  468   2HG1  ILE  61          1HG1      ILE  61   3.260  -0.509   0.854
  469   1HG2  ILE  61          1HG2      ILE  61   4.819   2.381   2.531
  470   2HG2  ILE  61          2HG2      ILE  61   4.626   2.751   0.817
  471   3HG2  ILE  61          3HG2      ILE  61   6.230   2.420   1.473
  472   1HD1  ILE  61          1HD1      ILE  61   3.994  -1.270   2.995
  473   2HD1  ILE  61          2HD1      ILE  61   2.475  -0.417   3.269
  474   3HD1  ILE  61          3HD1      ILE  61   4.008   0.367   3.649
  475    H    ASP  62           H        ASP  62   7.553   0.203   0.884
  476    HA   ASP  62           HA       ASP  62   8.925   2.453   0.032
  477   1HB   ASP  62          2HB       ASP  62  10.025  -0.294   0.673
  478   2HB   ASP  62          1HB       ASP  62  11.006   1.159   0.502
  479    H    GLU  63           H        GLU  63   8.549  -0.659  -1.621
  480    HA   GLU  63           HA       GLU  63  10.472  -0.222  -3.661
  481   1HB   GLU  63          2HB       GLU  63   8.187  -2.087  -3.260
  482   2HB   GLU  63          1HB       GLU  63   8.775  -1.873  -4.909
  483   1HG   GLU  63          2HG       GLU  63  10.691  -2.397  -2.638
  484   2HG   GLU  63          1HG       GLU  63   9.874  -3.725  -3.461
  485    H    VAL  64           H        VAL  64   6.920   0.256  -3.656
  486    HA   VAL  64           HA       VAL  64   6.869   1.330  -6.308
  487    HB   VAL  64           HB       VAL  64   4.557   1.866  -5.910
  488   1HG1  VAL  64          1HG1      VAL  64   4.276  -0.507  -4.371
  489   2HG1  VAL  64          2HG1      VAL  64   5.703  -0.712  -5.383
  490   3HG1  VAL  64          3HG1      VAL  64   4.147  -0.331  -6.121
  491   1HG2  VAL  64          1HG2      VAL  64   3.529   1.830  -3.734
  492   2HG2  VAL  64          2HG2      VAL  64   4.973   2.834  -3.597
  493   3HG2  VAL  64          3HG2      VAL  64   4.989   1.178  -2.991
  494    H    ASP  65           H        ASP  65   7.501   2.747  -3.187
  495    HA   ASP  65           HA       ASP  65   6.771   5.422  -3.820
  496   1HB   ASP  65          2HB       ASP  65   7.591   4.162  -1.532
  497   2HB   ASP  65          1HB       ASP  65   9.030   5.084  -1.956
  498    H    GLU  66           H        GLU  66   7.561   5.880  -5.869
  499    HA   GLU  66           HA       GLU  66  10.315   5.576  -6.597
  500   1HB   GLU  66          2HB       GLU  66   8.057   7.151  -7.848
  501   2HB   GLU  66          1HB       GLU  66   9.666   7.015  -8.558
  502   1HG   GLU  66          2HG       GLU  66   9.281   4.907  -9.295
  503   2HG   GLU  66          1HG       GLU  66   8.557   4.419  -7.762
  504    H    ASP  67           H        ASP  67   8.369   8.262  -5.349
  505    HA   ASP  67           HA       ASP  67  10.625  10.104  -5.564
  506   1HB   ASP  67          2HB       ASP  67   8.978  11.674  -4.318
  507   2HB   ASP  67          1HB       ASP  67   8.640  11.254  -5.993
  508    H    GLY  68           H        GLY  68   8.906   8.298  -3.062
  509   1HA   GLY  68          2HA       GLY  68   9.551   7.735  -0.917
  510   2HA   GLY  68          1HA       GLY  68  11.132   8.428  -1.269
  511    H    SER  69           H        SER  69   7.873   9.858  -1.275
  512    HA   SER  69           HA       SER  69   8.866  12.134   0.252
  513   1HB   SER  69          2HB       SER  69   6.560  13.049  -0.172
  514   2HB   SER  69          1HB       SER  69   7.481  12.689  -1.628
  515    HG   SER  69           HG       SER  69   6.053  11.226  -2.126
  516    H    GLY  70           H        GLY  70   6.237   9.741   0.516
  517   1HA   GLY  70          2HA       GLY  70   6.332   8.921   3.051
  518   2HA   GLY  70          1HA       GLY  70   5.693  10.547   3.273
  519    H    THR  71           H        THR  71   4.299  10.337   0.596
  520    HA   THR  71           HA       THR  71   2.015   8.681   1.489
  521    HB   THR  71           HB       THR  71   0.586  10.216   0.218
  522    HG1  THR  71           HG1      THR  71   1.754  11.025  -1.386
  523   1HG2  THR  71          1HG2      THR  71   0.994  12.280   1.582
  524   2HG2  THR  71          2HG2      THR  71   2.523  11.573   2.111
  525   3HG2  THR  71          3HG2      THR  71   0.996  10.797   2.537
  526    H    VAL  72           H        VAL  72   0.816   7.545  -0.140
  527    HA   VAL  72           HA       VAL  72   2.488   6.813  -2.457
  528    HB   VAL  72           HB       VAL  72   0.074   5.338  -1.390
  529   1HG1  VAL  72          1HG1      VAL  72   0.822   3.546  -2.812
  530   2HG1  VAL  72          2HG1      VAL  72   2.329   4.388  -3.176
  531   3HG1  VAL  72          3HG1      VAL  72   0.799   5.007  -3.801
  532   1HG2  VAL  72          1HG2      VAL  72   3.035   4.917  -0.876
  533   2HG2  VAL  72          2HG2      VAL  72   1.773   3.767  -0.437
  534   3HG2  VAL  72          3HG2      VAL  72   1.816   5.359   0.320
  535    H    ASP  73           H        ASP  73   2.003   7.719  -4.314
  536    HA   ASP  73           HA       ASP  73  -0.602   8.945  -4.768
  537   1HB   ASP  73          2HB       ASP  73   1.756   8.749  -6.664
  538   2HB   ASP  73          1HB       ASP  73   0.373   9.836  -6.798
  539    H    PHE  74           H        PHE  74  -1.515   8.598  -7.082
  540    HA   PHE  74           HA       PHE  74  -2.414   5.927  -7.286
  541   1HB   PHE  74          2HB       PHE  74  -3.502   8.085  -8.205
  542   2HB   PHE  74          1HB       PHE  74  -2.452   7.859  -9.602
  543    HD1  PHE  74           HD1      PHE  74  -3.913   7.188 -11.320
  544    HD2  PHE  74           HD2      PHE  74  -4.133   5.265  -7.487
  545    HE1  PHE  74           HE1      PHE  74  -5.503   5.524 -12.244
  546    HE2  PHE  74           HE2      PHE  74  -5.718   3.602  -8.410
  547    HZ   PHE  74           HZ       PHE  74  -6.407   3.730 -10.789
  548    H    ASP  75           H        ASP  75   0.256   7.639  -8.843
  549    HA   ASP  75           HA       ASP  75   0.829   5.691 -10.843
  550   1HB   ASP  75          2HB       ASP  75   2.242   8.026  -9.662
  551   2HB   ASP  75          1HB       ASP  75   3.248   6.802 -10.434
  552    H    GLU  76           H        GLU  76   1.923   6.191  -7.516
  553    HA   GLU  76           HA       GLU  76   3.750   3.947  -7.537
  554   1HB   GLU  76          2HB       GLU  76   2.658   5.263  -5.053
  555   2HB   GLU  76          1HB       GLU  76   4.231   4.500  -5.293
  556   1HG   GLU  76          2HG       GLU  76   4.796   6.313  -6.931
  557   2HG   GLU  76          1HG       GLU  76   3.273   7.101  -6.525
  558    H    PHE  77           H        PHE  77   0.390   4.464  -6.963
  559    HA   PHE  77           HA       PHE  77  -0.083   2.124  -5.351
  560   1HB   PHE  77          2HB       PHE  77  -1.562   4.085  -5.224
  561   2HB   PHE  77          1HB       PHE  77  -1.992   3.885  -6.919
  562    HD1  PHE  77           HD1      PHE  77  -2.252   2.364  -3.532
  563    HD2  PHE  77           HD2      PHE  77  -3.574   2.234  -7.626
  564    HE1  PHE  77           HE1      PHE  77  -4.060   0.783  -2.904
  565    HE2  PHE  77           HE2      PHE  77  -5.379   0.652  -6.991
  566    HZ   PHE  77           HZ       PHE  77  -5.622  -0.071  -4.631
  567    H    LEU  78           H        LEU  78  -0.395   2.953  -8.804
  568    HA   LEU  78           HA       LEU  78  -1.554   0.423  -9.534
  569   1HB   LEU  78          2HB       LEU  78  -0.317   2.639 -11.143
  570   2HB   LEU  78          1HB       LEU  78  -0.992   1.195 -11.866
  571    HG   LEU  78           HG       LEU  78  -2.776   2.662 -10.009
  572   1HD1  LEU  78          1HD1      LEU  78  -1.627   3.833 -12.521
  573   2HD1  LEU  78          2HD1      LEU  78  -2.015   4.626 -10.996
  574   3HD1  LEU  78          3HD1      LEU  78  -3.308   4.167 -12.105
  575   1HD2  LEU  78          1HD2      LEU  78  -4.423   1.786 -11.380
  576   2HD2  LEU  78          2HD2      LEU  78  -3.147   0.601 -11.664
  577   3HD2  LEU  78          3HD2      LEU  78  -3.424   1.896 -12.830
  578    H    VAL  79           H        VAL  79   1.734   1.768  -9.575
  579    HA   VAL  79           HA       VAL  79   2.985  -0.196 -11.134
  580    HB   VAL  79           HB       VAL  79   5.077   0.378  -9.861
  581   1HG1  VAL  79          1HG1      VAL  79   4.790   2.943 -10.493
  582   2HG1  VAL  79          2HG1      VAL  79   3.298   2.355 -11.228
  583   3HG1  VAL  79          3HG1      VAL  79   4.851   1.701 -11.744
  584   1HG2  VAL  79          1HG2      VAL  79   4.960   2.241  -8.260
  585   2HG2  VAL  79          2HG2      VAL  79   3.993   0.879  -7.693
  586   3HG2  VAL  79          3HG2      VAL  79   3.205   2.277  -8.421
  587    H    MET  80           H        MET  80   1.950  -0.288  -7.790
  588    HA   MET  80           HA       MET  80   3.402  -2.278  -6.618
  589   1HB   MET  80          2HB       MET  80   0.593  -1.402  -6.437
  590   2HB   MET  80          1HB       MET  80   0.894  -3.043  -5.864
  591   1HG   MET  80          2HG       MET  80   2.809  -2.110  -4.493
  592   2HG   MET  80          1HG       MET  80   2.241  -0.498  -4.926
  593   1HE   MET  80          1HE       MET  80   0.134   0.253  -4.854
  594   2HE   MET  80          2HE       MET  80  -0.625   0.379  -3.270
  595   3HE   MET  80          3HE       MET  80  -1.280  -0.735  -4.467
  596    H    MET  81           H        MET  81   0.869  -2.720  -9.067
  597    HA   MET  81           HA       MET  81   0.763  -5.560  -8.949
  598   1HB   MET  81          2HB       MET  81  -0.172  -3.470 -10.850
  599   2HB   MET  81          1HB       MET  81  -0.016  -5.112 -11.473
  600   1HG   MET  81          2HG       MET  81  -1.389  -4.682  -8.841
  601   2HG   MET  81          1HG       MET  81  -2.266  -4.341 -10.331
  602   1HE   MET  81          1HE       MET  81  -2.335  -6.283  -7.833
  603   2HE   MET  81          2HE       MET  81  -0.932  -7.339  -7.975
  604   3HE   MET  81          3HE       MET  81  -2.543  -7.983  -8.279
  605    H    VAL  82           H        VAL  82   2.304  -3.437 -11.388
  606    HA   VAL  82           HA       VAL  82   3.667  -5.539 -12.716
  607    HB   VAL  82           HB       VAL  82   5.029  -3.726 -13.753
  608   1HG1  VAL  82          1HG1      VAL  82   2.057  -3.806 -13.690
  609   2HG1  VAL  82          2HG1      VAL  82   3.164  -4.031 -15.045
  610   3HG1  VAL  82          3HG1      VAL  82   2.793  -2.405 -14.471
  611   1HG2  VAL  82          1HG2      VAL  82   3.351  -1.901 -12.005
  612   2HG2  VAL  82          2HG2      VAL  82   4.542  -1.401 -13.203
  613   3HG2  VAL  82          3HG2      VAL  82   5.061  -2.236 -11.740
  614    H    ARG  83           H        ARG  83   4.557  -3.527  -9.963
  615    HA   ARG  83           HA       ARG  83   7.332  -4.009  -9.908
  616   1HB   ARG  83          2HB       ARG  83   5.335  -3.408  -7.728
  617   2HB   ARG  83          1HB       ARG  83   7.052  -3.632  -7.388
  618   1HG   ARG  83          2HG       ARG  83   7.275  -1.913  -9.432
  619   2HG   ARG  83          1HG       ARG  83   5.683  -1.428  -8.855
  620   1HD   ARG  83          2HD       ARG  83   6.727  -0.201  -7.287
  621   2HD   ARG  83          1HD       ARG  83   7.195  -1.716  -6.527
  622    HE   ARG  83           HE       ARG  83   9.360  -1.382  -7.299
  623   1HH1  ARG  83          2HH1      ARG  83   7.152   0.745  -8.980
  624   2HH1  ARG  83          1HH1      ARG  83   8.411   1.639  -9.758
  625   1HH2  ARG  83          1HH2      ARG  83  10.991  -0.187  -8.327
  626   2HH2  ARG  83          2HH2      ARG  83  10.577   1.113  -9.394
  627    H    CYS  84           H        CYS  84   4.629  -6.041  -9.039
  628    HA   CYS  84           HA       CYS  84   5.953  -7.874  -7.335
  629   1HB   CYS  84          2HB       CYS  84   3.545  -8.156  -9.134
  630   2HB   CYS  84          1HB       CYS  84   4.138  -9.486  -8.137
  631    HG   CYS  84           HG       CYS  84   3.867  -7.670  -6.073
  632    H    MET  85           H        MET  85   5.926  -7.493 -10.817
  633    HA   MET  85           HA       MET  85   7.348 -10.045 -11.184
  634   1HB   MET  85          2HB       MET  85   5.736  -8.265 -12.929
  635   2HB   MET  85          1HB       MET  85   7.119  -9.052 -13.692
  636   1HG   MET  85          2HG       MET  85   6.050 -11.126 -12.256
  637   2HG   MET  85          1HG       MET  85   4.599 -10.228 -12.700
  638   1HE   MET  85          1HE       MET  85   4.711  -9.814 -16.394
  639   2HE   MET  85          2HE       MET  85   4.342  -9.134 -14.811
  640   3HE   MET  85          3HE       MET  85   3.505 -10.585 -15.355
  641    H    LYS  86           H        LYS  86   8.841  -8.281  -9.770
  642    HA   LYS  86           HA       LYS  86  10.609  -6.835 -11.608
  643   1HB   LYS  86          2HB       LYS  86  10.174  -6.865  -8.658
  644   2HB   LYS  86          1HB       LYS  86  11.790  -6.460  -9.237
  645   1HG   LYS  86          2HG       LYS  86   9.423  -5.141 -10.523
  646   2HG   LYS  86          1HG       LYS  86   9.966  -4.566  -8.947
  647   1HD   LYS  86          2HD       LYS  86  11.925  -4.957 -11.204
  648   2HD   LYS  86          1HD       LYS  86  10.993  -3.466 -11.064
  649   1HE   LYS  86          2HE       LYS  86  12.448  -4.510  -8.654
  650   2HE   LYS  86          1HE       LYS  86  13.354  -3.654  -9.900
  651   1HZ   LYS  86          1HZ       LYS  86  10.959  -2.621  -8.479
  652   2HZ   LYS  86          2HZ       LYS  86  11.823  -1.797  -9.689
  653   3HZ   LYS  86          3HZ       LYS  86  12.562  -2.141  -8.199
  654    H    ASP  87           H        ASP  87  10.912  -9.280  -9.019
  655    HA   ASP  87           HA       ASP  87  13.561 -10.053  -9.944
  656   1HB   ASP  87          2HB       ASP  87  12.708 -10.002  -7.484
  657   2HB   ASP  87          1HB       ASP  87  11.963 -11.551  -7.879
  658    H    ASP  88           H        ASP  88  10.337 -11.544  -9.655
  659    HA   ASP  88           HA       ASP  88   9.337 -13.289 -10.751
  660   1HB   ASP  88          2HB       ASP  88  10.479 -11.814 -12.711
  661   2HB   ASP  88          1HB       ASP  88  11.310 -13.350 -12.962
  662    H    SER  89           HN       SER  89  11.315 -13.904  -8.788
  663    HA   SER  89           HA       SER  89  11.811 -16.665  -9.470
  664   1HB   SER  89          2HB       SER  89  14.008 -14.682  -9.568
  665   2HB   SER  89          1HB       SER  89  14.348 -16.155  -8.666
  666    HG   SER  89           HG       SER  89  13.715 -15.797 -11.379
  Start of MODEL   23
    1   1H    MET   1          1H        MET   1  12.981   4.596 -14.119
    2   2H    MET   1          2H        MET   1  12.302   3.435 -13.080
    3   3H    MET   1          3H        MET   1  11.594   3.742 -14.594
    4    HA   MET   1           HA       MET   1  13.535   2.877 -15.727
    5   1HB   MET   1          2HB       MET   1  15.007   3.553 -13.675
    6   2HB   MET   1          1HB       MET   1  14.572   1.964 -13.046
    7   1HG   MET   1          2HG       MET   1  15.527   0.855 -14.953
    8   2HG   MET   1          1HG       MET   1  15.735   2.382 -15.809
    9   1HE   MET   1          1HE       MET   1  17.718  -0.268 -14.041
   10   2HE   MET   1          2HE       MET   1  16.509   0.239 -12.864
   11   3HE   MET   1          3HE       MET   1  18.220   0.494 -12.525
   12    H    ASN   2           H        ASN   2  11.566   1.728 -16.253
   13    HA   ASN   2           HA       ASN   2  11.554  -0.984 -15.136
   14   1HB   ASN   2          2HB       ASN   2   9.231   0.921 -15.049
   15   2HB   ASN   2          1HB       ASN   2   8.957  -0.816 -15.182
   16   1HD2  ASN   2          1HD2      ASN   2  10.452  -2.116 -13.500
   17   2HD2  ASN   2          2HD2      ASN   2  10.473  -1.470 -11.932
   18    H    ASP   3           H        ASP   3  11.450  -2.437 -16.702
   19    HA   ASP   3           HA       ASP   3  10.609  -1.568 -19.395
   20   1HB   ASP   3          2HB       ASP   3  11.898  -3.447 -20.256
   21   2HB   ASP   3          1HB       ASP   3  12.910  -2.473 -19.193
   22    H    ILE   4           H        ILE   4   9.877  -3.875 -16.845
   23    HA   ILE   4           HA       ILE   4   8.109  -5.425 -18.550
   24    HB   ILE   4           HB       ILE   4   7.616  -6.754 -16.622
   25   1HG1  ILE   4          2HG1      ILE   4   8.831  -5.902 -14.404
   26   2HG1  ILE   4          1HG1      ILE   4   8.570  -4.326 -15.155
   27   1HG2  ILE   4          1HG2      ILE   4   9.904  -6.958 -17.648
   28   2HG2  ILE   4          2HG2      ILE   4   9.826  -7.472 -15.963
   29   3HG2  ILE   4          3HG2      ILE   4  10.511  -5.901 -16.375
   30   1HD1  ILE   4          1HD1      ILE   4   6.349  -6.360 -14.891
   31   2HD1  ILE   4          2HD1      ILE   4   6.211  -4.633 -15.224
   32   3HD1  ILE   4          3HD1      ILE   4   6.700  -5.185 -13.624
   33    H    TYR   5           H        TYR   5   7.903  -2.585 -16.587
   34    HA   TYR   5           HA       TYR   5   5.126  -2.655 -15.949
   35   1HB   TYR   5          2HB       TYR   5   7.086  -0.365 -16.241
   36   2HB   TYR   5          1HB       TYR   5   5.405  -0.126 -15.776
   37    HD1  TYR   5           HD1      TYR   5   5.968   0.782 -13.583
   38    HD2  TYR   5           HD2      TYR   5   7.277  -3.133 -14.745
   39    HE1  TYR   5           HE1      TYR   5   6.569   0.281 -11.233
   40    HE2  TYR   5           HE2      TYR   5   7.882  -3.638 -12.412
   41    HH   TYR   5           HH       TYR   5   6.820  -1.843  -9.812
   42    H    LYS   6           H        LYS   6   6.989  -1.711 -18.738
   43    HA   LYS   6           HA       LYS   6   4.794  -0.401 -20.109
   44   1HB   LYS   6          2HB       LYS   6   7.338  -1.408 -21.395
   45   2HB   LYS   6          1HB       LYS   6   6.300  -0.086 -21.924
   46   1HG   LYS   6          2HG       LYS   6   8.180  -0.153 -19.558
   47   2HG   LYS   6          1HG       LYS   6   8.164   0.982 -20.906
   48   1HD   LYS   6          2HD       LYS   6   6.160   2.031 -20.119
   49   2HD   LYS   6          1HD       LYS   6   5.867   0.745 -18.948
   50   1HE   LYS   6          2HE       LYS   6   7.555   1.476 -17.514
   51   2HE   LYS   6          1HE       LYS   6   8.423   2.316 -18.798
   52   1HZ   LYS   6          1HZ       LYS   6   5.791   3.144 -17.696
   53   2HZ   LYS   6          2HZ       LYS   6   6.693   3.972 -18.876
   54   3HZ   LYS   6          3HZ       LYS   6   7.281   3.844 -17.288
   55    H    ALA   7           H        ALA   7   6.445  -3.517 -20.181
   56    HA   ALA   7           HA       ALA   7   4.885  -4.592 -22.354
   57   1HB   ALA   7          1HB       ALA   7   5.812  -6.811 -21.375
   58   2HB   ALA   7          2HB       ALA   7   6.767  -5.767 -20.323
   59   3HB   ALA   7          3HB       ALA   7   6.954  -5.661 -22.073
   60    H    ALA   8           H        ALA   8   4.508  -4.360 -18.884
   61    HA   ALA   8           HA       ALA   8   2.427  -6.374 -18.728
   62   1HB   ALA   8          1HB       ALA   8   3.655  -4.468 -16.744
   63   2HB   ALA   8          2HB       ALA   8   3.727  -6.230 -16.767
   64   3HB   ALA   8          3HB       ALA   8   2.219  -5.416 -16.351
   65    H    VAL   9           H        VAL   9   2.634  -2.853 -18.980
   66    HA   VAL   9           HA       VAL   9   0.038  -2.190 -18.156
   67    HB   VAL   9           HB       VAL   9   2.015  -0.631 -18.776
   68   1HG1  VAL   9          1HG1      VAL   9   1.873  -1.593 -21.228
   69   2HG1  VAL   9          2HG1      VAL   9   2.233   0.111 -20.970
   70   3HG1  VAL   9          3HG1      VAL   9   0.601  -0.389 -21.411
   71   1HG2  VAL   9          1HG2      VAL   9  -0.817   0.066 -19.615
   72   2HG2  VAL   9          2HG2      VAL   9   0.442   1.215 -19.163
   73   3HG2  VAL   9          3HG2      VAL   9  -0.210   0.102 -17.960
   74    H    GLU  10           H        GLU  10   1.187  -3.485 -21.221
   75    HA   GLU  10           HA       GLU  10  -1.253  -3.036 -22.667
   76   1HB   GLU  10          2HB       GLU  10   1.126  -4.831 -23.169
   77   2HB   GLU  10          1HB       GLU  10  -0.259  -4.747 -24.258
   78   1HG   GLU  10          2HG       GLU  10   0.149  -2.160 -24.159
   79   2HG   GLU  10          1HG       GLU  10   1.762  -2.616 -23.609
   80    H    GLN  11           H        GLN  11  -0.155  -5.454 -20.421
   81    HA   GLN  11           HA       GLN  11  -2.076  -7.467 -21.246
   82   1HB   GLN  11          2HB       GLN  11  -0.330  -7.320 -18.775
   83   2HB   GLN  11          1HB       GLN  11  -1.275  -8.720 -19.284
   84   1HG   GLN  11          2HG       GLN  11   0.020  -8.916 -21.332
   85   2HG   GLN  11          1HG       GLN  11   0.889  -7.426 -20.966
   86   1HE2  GLN  11          1HE2      GLN  11   2.948  -7.877 -20.181
   87   2HE2  GLN  11          2HE2      GLN  11   3.340  -9.186 -19.175
   88    H    LEU  12           H        LEU  12  -1.697  -5.132 -18.616
   89    HA   LEU  12           HA       LEU  12  -3.908  -5.875 -17.054
   90   1HB   LEU  12          2HB       LEU  12  -2.608  -3.190 -17.469
   91   2HB   LEU  12          1HB       LEU  12  -3.867  -3.477 -16.288
   92    HG   LEU  12           HG       LEU  12  -1.730  -5.406 -15.975
   93   1HD1  LEU  12          1HD1      LEU  12   0.075  -3.926 -15.389
   94   2HD1  LEU  12          2HD1      LEU  12  -0.936  -2.502 -15.635
   95   3HD1  LEU  12          3HD1      LEU  12  -0.448  -3.486 -17.014
   96   1HD2  LEU  12          1HD2      LEU  12  -2.991  -3.227 -14.292
   97   2HD2  LEU  12          2HD2      LEU  12  -1.726  -4.289 -13.674
   98   3HD2  LEU  12          3HD2      LEU  12  -3.270  -4.964 -14.193
   99    H    THR  13           H        THR  13  -6.039  -5.502 -17.162
  100    HA   THR  13           HA       THR  13  -7.086  -4.229 -19.601
  101    HB   THR  13           HB       THR  13  -9.296  -5.228 -18.452
  102    HG1  THR  13           HG1      THR  13  -8.501  -6.148 -16.678
  103   1HG2  THR  13          1HG2      THR  13  -7.971  -5.777 -20.664
  104   2HG2  THR  13          2HG2      THR  13  -9.190  -6.894 -20.050
  105   3HG2  THR  13          3HG2      THR  13  -7.479  -7.210 -19.763
  106    H    ASP  14           H        ASP  14  -9.225  -3.074 -19.298
  107    HA   ASP  14           HA       ASP  14  -8.870  -0.778 -17.682
  108   1HB   ASP  14          2HB       ASP  14 -11.353  -1.888 -19.014
  109   2HB   ASP  14          1HB       ASP  14 -11.267  -0.302 -18.247
  110    H    GLU  15           H        GLU  15 -10.488  -3.847 -17.155
  111    HA   GLU  15           HA       GLU  15 -12.107  -3.223 -14.955
  112   1HB   GLU  15          2HB       GLU  15 -10.882  -5.686 -16.057
  113   2HB   GLU  15          1HB       GLU  15 -11.346  -5.750 -14.356
  114   1HG   GLU  15          2HG       GLU  15 -13.265  -4.627 -16.382
  115   2HG   GLU  15          1HG       GLU  15 -13.115  -6.374 -16.191
  116    H    GLN  16           H        GLN  16  -8.702  -4.303 -15.051
  117    HA   GLN  16           HA       GLN  16  -8.266  -4.350 -12.255
  118   1HB   GLN  16          2HB       GLN  16  -6.482  -4.145 -14.655
  119   2HB   GLN  16          1HB       GLN  16  -5.801  -3.835 -13.058
  120   1HG   GLN  16          2HG       GLN  16  -6.164  -6.008 -12.326
  121   2HG   GLN  16          1HG       GLN  16  -7.505  -6.270 -13.441
  122   1HE2  GLN  16          1HE2      GLN  16  -4.214  -6.963 -12.952
  123   2HE2  GLN  16          2HE2      GLN  16  -3.827  -7.423 -14.540
  124    H    LYS  17           H        LYS  17  -7.700  -1.787 -14.671
  125    HA   LYS  17           HA       LYS  17  -6.680   0.160 -12.907
  126   1HB   LYS  17          2HB       LYS  17  -7.933   0.195 -15.604
  127   2HB   LYS  17          1HB       LYS  17  -7.939   1.714 -14.710
  128   1HG   LYS  17          2HG       LYS  17  -5.873   1.876 -15.737
  129   2HG   LYS  17          1HG       LYS  17  -5.404   1.053 -14.250
  130   1HD   LYS  17          2HD       LYS  17  -5.849  -1.138 -15.559
  131   2HD   LYS  17          1HD       LYS  17  -5.796  -0.124 -17.001
  132   1HE   LYS  17          2HE       LYS  17  -3.591   0.087 -14.973
  133   2HE   LYS  17          1HE       LYS  17  -3.587  -1.253 -16.119
  134   1HZ   LYS  17          1HZ       LYS  17  -2.353   0.600 -17.004
  135   2HZ   LYS  17          2HZ       LYS  17  -3.681   1.639 -16.797
  136   3HZ   LYS  17          3HZ       LYS  17  -3.758   0.370 -17.925
  137    H    ASN  18           H        ASN  18  -9.966  -0.810 -13.713
  138    HA   ASN  18           HA       ASN  18 -11.319   1.321 -12.388
  139   1HB   ASN  18          2HB       ASN  18 -12.076  -0.830 -13.989
  140   2HB   ASN  18          1HB       ASN  18 -12.772  -1.210 -12.413
  141   1HD2  ASN  18          1HD2      ASN  18 -12.644   1.355 -14.915
  142   2HD2  ASN  18          2HD2      ASN  18 -14.105   2.088 -14.456
  143    H    GLU  19           H        GLU  19 -10.208  -1.900 -11.406
  144    HA   GLU  19           HA       GLU  19 -11.425  -2.038  -8.866
  145   1HB   GLU  19          2HB       GLU  19  -8.750  -3.175  -9.748
  146   2HB   GLU  19          1HB       GLU  19  -9.624  -3.639  -8.289
  147   1HG   GLU  19          2HG       GLU  19 -11.576  -3.956 -10.174
  148   2HG   GLU  19          1HG       GLU  19 -10.138  -4.372 -11.106
  149    H    PHE  20           H        PHE  20  -8.178  -0.922  -9.821
  150    HA   PHE  20           HA       PHE  20  -7.430  -0.030  -7.216
  151   1HB   PHE  20          2HB       PHE  20  -6.343   0.850  -9.900
  152   2HB   PHE  20          1HB       PHE  20  -5.569   1.094  -8.337
  153    HD1  PHE  20           HD1      PHE  20  -5.512  -0.898 -11.156
  154    HD2  PHE  20           HD2      PHE  20  -5.520  -1.245  -6.876
  155    HE1  PHE  20           HE1      PHE  20  -4.475  -3.139 -11.335
  156    HE2  PHE  20           HE2      PHE  20  -4.487  -3.491  -7.057
  157    HZ   PHE  20           HZ       PHE  20  -3.966  -4.439  -9.286
  158    H    LYS  21           H        LYS  21  -9.042   1.527  -9.943
  159    HA   LYS  21           HA       LYS  21  -8.766   4.209  -9.188
  160   1HB   LYS  21          2HB       LYS  21  -9.654   3.544 -11.376
  161   2HB   LYS  21          1HB       LYS  21 -11.097   2.891 -10.606
  162   1HG   LYS  21          2HG       LYS  21 -11.457   5.180 -11.539
  163   2HG   LYS  21          1HG       LYS  21 -11.718   5.112  -9.797
  164   1HD   LYS  21          2HD       LYS  21 -10.394   7.088 -10.324
  165   2HD   LYS  21          1HD       LYS  21  -9.381   5.934  -9.457
  166   1HE   LYS  21          2HE       LYS  21  -7.965   5.761 -11.204
  167   2HE   LYS  21          1HE       LYS  21  -9.292   5.437 -12.319
  168   1HZ   LYS  21          1HZ       LYS  21  -9.714   7.797 -12.476
  169   2HZ   LYS  21          2HZ       LYS  21  -8.097   7.471 -12.883
  170   3HZ   LYS  21          3HZ       LYS  21  -8.477   8.129 -11.364
  171    H    ALA  22           H        ALA  22 -11.501   1.998  -8.498
  172    HA   ALA  22           HA       ALA  22 -12.881   3.810  -6.806
  173   1HB   ALA  22          1HB       ALA  22 -12.992   0.784  -6.846
  174   2HB   ALA  22          2HB       ALA  22 -13.992   1.866  -7.813
  175   3HB   ALA  22          3HB       ALA  22 -14.159   1.846  -6.058
  176    H    ALA  23           H        ALA  23 -10.582   1.185  -6.125
  177    HA   ALA  23           HA       ALA  23 -10.698   1.315  -3.304
  178   1HB   ALA  23          1HB       ALA  23  -8.589   0.098  -3.325
  179   2HB   ALA  23          2HB       ALA  23  -8.341   0.508  -5.023
  180   3HB   ALA  23          3HB       ALA  23  -9.665  -0.559  -4.558
  181    H    PHE  24           H        PHE  24  -9.095   3.335  -5.654
  182    HA   PHE  24           HA       PHE  24  -7.312   4.557  -3.701
  183   1HB   PHE  24          2HB       PHE  24  -6.906   4.207  -6.276
  184   2HB   PHE  24          1HB       PHE  24  -7.842   5.690  -6.435
  185    HD1  PHE  24           HD1      PHE  24  -4.758   4.193  -5.036
  186    HD2  PHE  24           HD2      PHE  24  -6.948   7.826  -5.719
  187    HE1  PHE  24           HE1      PHE  24  -2.741   5.518  -4.464
  188    HE2  PHE  24           HE2      PHE  24  -4.932   9.149  -5.144
  189    HZ   PHE  24           HZ       PHE  24  -2.829   7.995  -4.517
  190    H    ASP  25           H        ASP  25 -10.020   5.634  -5.774
  191    HA   ASP  25           HA       ASP  25 -10.283   8.224  -4.802
  192   1HB   ASP  25          2HB       ASP  25 -11.498   7.073  -6.771
  193   2HB   ASP  25          1HB       ASP  25 -12.696   6.600  -5.566
  194    H    ILE  26           H        ILE  26 -11.704   5.232  -3.461
  195    HA   ILE  26           HA       ILE  26 -13.469   6.395  -1.630
  196    HB   ILE  26           HB       ILE  26 -13.160   4.332  -0.258
  197   1HG1  ILE  26          2HG1      ILE  26 -11.093   3.677  -2.384
  198   2HG1  ILE  26          1HG1      ILE  26 -10.746   4.014  -0.690
  199   1HG2  ILE  26          1HG2      ILE  26 -13.861   4.459  -3.122
  200   2HG2  ILE  26          2HG2      ILE  26 -14.785   3.822  -1.762
  201   3HG2  ILE  26          3HG2      ILE  26 -13.538   2.834  -2.521
  202   1HD1  ILE  26          1HD1      ILE  26 -12.254   1.667  -1.845
  203   2HD1  ILE  26          2HD1      ILE  26 -12.332   2.084  -0.132
  204   3HD1  ILE  26          3HD1      ILE  26 -10.790   1.639  -0.863
  205    H    PHE  27           H        PHE  27  -9.982   5.888  -1.398
  206    HA   PHE  27           HA       PHE  27  -9.876   6.881   1.339
  207   1HB   PHE  27          2HB       PHE  27  -7.907   5.741  -0.594
  208   2HB   PHE  27          1HB       PHE  27  -7.300   6.784   0.694
  209    HD1  PHE  27           HD1      PHE  27  -7.494   6.146   3.042
  210    HD2  PHE  27           HD2      PHE  27  -9.006   3.609  -0.077
  211    HE1  PHE  27           HE1      PHE  27  -7.711   4.281   4.663
  212    HE2  PHE  27           HE2      PHE  27  -9.223   1.746   1.543
  213    HZ   PHE  27           HZ       PHE  27  -8.577   2.083   3.913
  214    H    ILE  28           H        ILE  28  -9.391   8.085  -1.925
  215    HA   ILE  28           HA       ILE  28  -8.227  10.591  -0.940
  216    HB   ILE  28           HB       ILE  28  -8.869   9.940  -3.815
  217   1HG1  ILE  28          2HG1      ILE  28  -7.475   8.128  -3.321
  218   2HG1  ILE  28          1HG1      ILE  28  -6.326   9.351  -3.835
  219   1HG2  ILE  28          1HG2      ILE  28  -6.688  11.402  -3.969
  220   2HG2  ILE  28          2HG2      ILE  28  -7.167  11.924  -2.352
  221   3HG2  ILE  28          3HG2      ILE  28  -8.253  12.176  -3.719
  222   1HD1  ILE  28          1HD1      ILE  28  -6.880   8.332  -1.069
  223   2HD1  ILE  28          2HD1      ILE  28  -6.273   9.974  -1.277
  224   3HD1  ILE  28          3HD1      ILE  28  -5.331   8.605  -1.866
  225    H    GLN  29           H        GLN  29 -11.015   9.927  -0.285
  226    HA   GLN  29           HA       GLN  29 -12.768  11.444  -1.960
  227   1HB   GLN  29          2HB       GLN  29 -14.349  11.352  -0.019
  228   2HB   GLN  29          1HB       GLN  29 -13.744   9.772  -0.508
  229   1HG   GLN  29          2HG       GLN  29 -12.259   9.647   1.347
  230   2HG   GLN  29          1HG       GLN  29 -12.432  11.367   1.701
  231   1HE2  GLN  29          1HE2      GLN  29 -13.496   8.333   2.693
  232   2HE2  GLN  29          2HE2      GLN  29 -14.933   8.805   3.462
  233    H    ASP  30           H        ASP  30 -10.856  12.152   0.916
  234    HA   ASP  30           HA       ASP  30 -11.020  15.010   0.343
  235   1HB   ASP  30          2HB       ASP  30 -11.960  13.792   2.953
  236   2HB   ASP  30          1HB       ASP  30 -11.514  15.490   2.787
  237    H    ALA  31           H        ALA  31  -8.896  13.252  -0.019
  238    HA   ALA  31           HA       ALA  31  -7.132  13.137   2.223
  239   1HB   ALA  31          1HB       ALA  31  -6.588  12.879  -0.744
  240   2HB   ALA  31          2HB       ALA  31  -6.867  11.563   0.396
  241   3HB   ALA  31          3HB       ALA  31  -5.408  12.544   0.523
  242    H    GLU  32           H        GLU  32  -5.155  14.258   2.516
  243    HA   GLU  32           HA       GLU  32  -5.368  17.090   2.106
  244   1HB   GLU  32          2HB       GLU  32  -3.207  15.344   3.291
  245   2HB   GLU  32          1HB       GLU  32  -3.037  17.094   3.143
  246   1HG   GLU  32          2HG       GLU  32  -5.455  15.865   4.469
  247   2HG   GLU  32          1HG       GLU  32  -3.972  16.173   5.372
  248    H    ASP  33           H        ASP  33  -3.199  14.565   0.845
  249    HA   ASP  33           HA       ASP  33  -2.218  16.491  -1.179
  250   1HB   ASP  33          2HB       ASP  33  -0.983  13.926  -0.149
  251   2HB   ASP  33          1HB       ASP  33  -0.321  14.893  -1.465
  252    H    GLY  34           H        GLY  34  -4.703  14.565  -1.106
  253   1HA   GLY  34          2HA       GLY  34  -5.919  13.412  -2.682
  254   2HA   GLY  34          1HA       GLY  34  -4.792  14.032  -3.883
  255    H    CYS  35           H        CYS  35  -3.708  12.113  -1.152
  256    HA   CYS  35           HA       CYS  35  -3.518   9.673  -2.772
  257   1HB   CYS  35          2HB       CYS  35  -1.111  10.995  -1.495
  258   2HB   CYS  35          1HB       CYS  35  -1.120   9.426  -2.292
  259    HG   CYS  35           HG       CYS  35  -1.168  12.151  -3.709
  260    H    ILE  36           H        ILE  36  -2.248   7.976  -1.321
  261    HA   ILE  36           HA       ILE  36  -3.522   8.079   1.347
  262    HB   ILE  36           HB       ILE  36  -3.304   5.608   1.348
  263   1HG1  ILE  36          2HG1      ILE  36  -2.935   5.072  -1.401
  264   2HG1  ILE  36          1HG1      ILE  36  -1.638   6.177  -0.948
  265   1HG2  ILE  36          1HG2      ILE  36  -5.278   6.979   0.321
  266   2HG2  ILE  36          2HG2      ILE  36  -5.198   5.243   0.021
  267   3HG2  ILE  36          3HG2      ILE  36  -4.666   6.377  -1.220
  268   1HD1  ILE  36          1HD1      ILE  36  -1.968   4.248   1.147
  269   2HD1  ILE  36          2HD1      ILE  36  -0.564   4.522   0.119
  270   3HD1  ILE  36          3HD1      ILE  36  -1.822   3.396  -0.393
  271    H    SER  37           H        SER  37  -2.184   6.483   2.898
  272    HA   SER  37           HA       SER  37   0.490   7.667   3.026
  273   1HB   SER  37          2HB       SER  37  -1.216   7.499   5.002
  274   2HB   SER  37          1HB       SER  37  -0.646   5.837   5.117
  275    HG   SER  37           HG       SER  37   1.329   6.538   5.638
  276    H    THR  38           H        THR  38   2.370   6.473   3.140
  277    HA   THR  38           HA       THR  38   2.567   4.153   1.574
  278    HB   THR  38           HB       THR  38   4.857   3.901   2.690
  279    HG1  THR  38           HG1      THR  38   5.039   4.964   4.474
  280   1HG2  THR  38          1HG2      THR  38   3.901   6.380   1.277
  281   2HG2  THR  38          2HG2      THR  38   4.841   5.036   0.633
  282   3HG2  THR  38          3HG2      THR  38   5.596   6.197   1.725
  283    H    LYS  39           H        LYS  39   2.516   4.525   5.117
  284    HA   LYS  39           HA       LYS  39   2.692   1.713   5.647
  285   1HB   LYS  39          2HB       LYS  39   2.247   2.309   7.959
  286   2HB   LYS  39          1HB       LYS  39   3.397   3.454   7.272
  287   1HG   LYS  39          2HG       LYS  39   2.004   5.061   8.053
  288   2HG   LYS  39          1HG       LYS  39   0.972   4.640   6.689
  289   1HD   LYS  39          2HD       LYS  39  -0.454   4.510   8.584
  290   2HD   LYS  39          1HD       LYS  39  -0.038   2.836   8.222
  291   1HE   LYS  39          2HE       LYS  39   0.280   3.005  10.558
  292   2HE   LYS  39          1HE       LYS  39   1.907   3.158   9.898
  293   1HZ   LYS  39          1HZ       LYS  39   1.317   4.839  11.615
  294   2HZ   LYS  39          2HZ       LYS  39   0.170   5.478  10.537
  295   3HZ   LYS  39          3HZ       LYS  39   1.822   5.504  10.140
  296    H    GLU  40           H        GLU  40   0.081   3.867   4.846
  297    HA   GLU  40           HA       GLU  40  -2.002   2.168   5.943
  298   1HB   GLU  40          2HB       GLU  40  -1.984   4.711   4.341
  299   2HB   GLU  40          1HB       GLU  40  -3.472   3.792   4.560
  300   1HG   GLU  40          2HG       GLU  40  -2.918   3.822   7.075
  301   2HG   GLU  40          1HG       GLU  40  -1.747   5.080   6.677
  302    H    LEU  41           H        LEU  41  -0.034   1.577   3.441
  303    HA   LEU  41           HA       LEU  41  -1.700   1.105   1.222
  304   1HB   LEU  41          2HB       LEU  41   0.998   0.648   1.896
  305   2HB   LEU  41          1HB       LEU  41   0.344  -0.904   1.418
  306    HG   LEU  41           HG       LEU  41   0.250   1.626  -0.230
  307   1HD1  LEU  41          1HD1      LEU  41   1.843   0.336  -1.688
  308   2HD1  LEU  41          2HD1      LEU  41   1.945  -0.880  -0.413
  309   3HD1  LEU  41          3HD1      LEU  41   2.513   0.763  -0.113
  310   1HD2  LEU  41          1HD2      LEU  41  -0.385  -1.185  -1.134
  311   2HD2  LEU  41          2HD2      LEU  41  -0.784   0.336  -1.931
  312   3HD2  LEU  41          3HD2      LEU  41  -1.632  -0.136  -0.458
  313    H    GLY  42           H        GLY  42  -0.905  -0.890   4.029
  314   1HA   GLY  42          2HA       GLY  42  -2.033  -3.326   3.215
  315   2HA   GLY  42          1HA       GLY  42  -1.867  -2.800   4.885
  316    H    LYS  43           H        LYS  43  -3.581  -0.354   4.177
  317    HA   LYS  43           HA       LYS  43  -6.119  -1.565   4.852
  318   1HB   LYS  43          2HB       LYS  43  -5.122   0.689   5.705
  319   2HB   LYS  43          1HB       LYS  43  -5.750   1.344   4.193
  320   1HG   LYS  43          2HG       LYS  43  -7.533   1.655   5.685
  321   2HG   LYS  43          1HG       LYS  43  -7.966   0.161   4.858
  322   1HD   LYS  43          2HD       LYS  43  -8.207  -0.670   6.962
  323   2HD   LYS  43          1HD       LYS  43  -6.449  -0.801   6.921
  324   1HE   LYS  43          2HE       LYS  43  -6.143   1.156   8.174
  325   2HE   LYS  43          1HE       LYS  43  -7.744   1.777   7.777
  326   1HZ   LYS  43          1HZ       LYS  43  -7.205  -0.591   9.489
  327   2HZ   LYS  43          2HZ       LYS  43  -8.732   0.065   9.139
  328   3HZ   LYS  43          3HZ       LYS  43  -7.614   0.954  10.058
  329    H    VAL  44           H        VAL  44  -4.731   0.182   2.077
  330    HA   VAL  44           HA       VAL  44  -7.190   0.174   0.585
  331    HB   VAL  44           HB       VAL  44  -5.690   0.838  -1.351
  332   1HG1  VAL  44          1HG1      VAL  44  -5.841   2.340   1.253
  333   2HG1  VAL  44          2HG1      VAL  44  -6.737   2.622  -0.240
  334   3HG1  VAL  44          3HG1      VAL  44  -5.028   3.047  -0.144
  335   1HG2  VAL  44          1HG2      VAL  44  -3.384   1.468  -0.817
  336   2HG2  VAL  44          2HG2      VAL  44  -3.621  -0.247  -0.484
  337   3HG2  VAL  44          3HG2      VAL  44  -3.593   0.914   0.844
  338    H    MET  45           H        MET  45  -4.308  -1.906   0.678
  339    HA   MET  45           HA       MET  45  -4.961  -3.462  -1.616
  340   1HB   MET  45          2HB       MET  45  -3.301  -4.172   0.813
  341   2HB   MET  45          1HB       MET  45  -3.385  -5.131  -0.667
  342   1HG   MET  45          2HG       MET  45  -2.615  -3.121  -1.945
  343   2HG   MET  45          1HG       MET  45  -2.403  -2.278  -0.414
  344   1HE   MET  45          1HE       MET  45  -1.460  -3.172   1.435
  345   2HE   MET  45          2HE       MET  45   0.261  -2.903   1.165
  346   3HE   MET  45          3HE       MET  45  -0.314  -4.510   1.597
  347    H    ARG  46           H        ARG  46  -5.907  -3.604   1.753
  348    HA   ARG  46           HA       ARG  46  -6.958  -6.212   1.861
  349   1HB   ARG  46          2HB       ARG  46  -7.341  -3.711   3.407
  350   2HB   ARG  46          1HB       ARG  46  -8.648  -4.891   3.511
  351   1HG   ARG  46          2HG       ARG  46  -6.404  -6.479   3.757
  352   2HG   ARG  46          1HG       ARG  46  -5.926  -5.015   4.614
  353   1HD   ARG  46          2HD       ARG  46  -8.508  -6.522   5.102
  354   2HD   ARG  46          1HD       ARG  46  -7.062  -6.684   6.089
  355    HE   ARG  46           HE       ARG  46  -8.944  -4.485   6.121
  356   1HH1  ARG  46          2HH1      ARG  46  -5.661  -5.481   6.792
  357   2HH1  ARG  46          1HH1      ARG  46  -5.392  -4.236   7.963
  358   1HH2  ARG  46          1HH2      ARG  46  -8.565  -2.865   7.663
  359   2HH2  ARG  46          2HH2      ARG  46  -7.028  -2.760   8.455
  360    H    MET  47           H        MET  47  -8.417  -3.146   0.826
  361    HA   MET  47           HA       MET  47 -11.027  -4.181   0.340
  362   1HB   MET  47          2HB       MET  47  -9.575  -1.668  -0.229
  363   2HB   MET  47          1HB       MET  47 -10.868  -2.062  -1.363
  364   1HG   MET  47          2HG       MET  47 -11.966  -0.847   0.338
  365   2HG   MET  47          1HG       MET  47 -12.303  -2.530   0.742
  366   1HE   MET  47          1HE       MET  47 -10.379  -3.809   2.994
  367   2HE   MET  47          2HE       MET  47 -12.030  -3.564   2.429
  368   3HE   MET  47          3HE       MET  47 -11.554  -2.972   4.019
  369    H    LEU  48           H        LEU  48  -8.100  -3.906  -1.627
  370    HA   LEU  48           HA       LEU  48  -9.234  -4.519  -4.147
  371   1HB   LEU  48          2HB       LEU  48  -6.549  -4.414  -2.984
  372   2HB   LEU  48          1HB       LEU  48  -6.711  -5.632  -4.228
  373    HG   LEU  48           HG       LEU  48  -5.866  -3.512  -5.133
  374   1HD1  LEU  48          1HD1      LEU  48  -8.614  -4.443  -5.964
  375   2HD1  LEU  48          2HD1      LEU  48  -7.064  -4.749  -6.747
  376   3HD1  LEU  48          3HD1      LEU  48  -7.792  -3.146  -6.831
  377   1HD2  LEU  48          1HD2      LEU  48  -8.555  -2.335  -4.387
  378   2HD2  LEU  48          2HD2      LEU  48  -7.169  -1.493  -5.081
  379   3HD2  LEU  48          3HD2      LEU  48  -7.097  -2.095  -3.425
  380    H    GLY  49           H        GLY  49  -7.725  -6.601  -1.677
  381   1HA   GLY  49          2HA       GLY  49  -9.144  -8.744  -1.397
  382   2HA   GLY  49          1HA       GLY  49  -8.732  -8.992  -3.091
  383    H    GLN  50           H        GLN  50  -6.875  -7.886  -0.244
  384    HA   GLN  50           HA       GLN  50  -5.181 -10.249  -0.317
  385   1HB   GLN  50          2HB       GLN  50  -4.348  -7.691  -1.499
  386   2HB   GLN  50          1HB       GLN  50  -3.222  -8.321  -0.296
  387   1HG   GLN  50          2HG       GLN  50  -3.156 -10.481  -1.463
  388   2HG   GLN  50          1HG       GLN  50  -4.311  -9.884  -2.654
  389   1HE2  GLN  50          1HE2      GLN  50  -3.510  -8.570  -4.366
  390   2HE2  GLN  50          2HE2      GLN  50  -1.875  -8.143  -4.523
  391    H    ASN  51           H        ASN  51  -4.379 -10.710   1.656
  392    HA   ASN  51           HA       ASN  51  -4.410  -8.587   3.713
  393   1HB   ASN  51          2HB       ASN  51  -6.428 -10.197   3.790
  394   2HB   ASN  51          1HB       ASN  51  -5.270 -11.407   4.340
  395   1HD2  ASN  51          1HD2      ASN  51  -5.673 -11.556   6.575
  396   2HD2  ASN  51          2HD2      ASN  51  -5.692 -10.227   7.630
  397    HA   PRO  52           HA       PRO  52  -0.395 -10.861   3.825
  398   1HB   PRO  52          2HB       PRO  52   1.181  -8.646   3.525
  399   2HB   PRO  52          1HB       PRO  52   0.519  -9.567   2.169
  400   1HG   PRO  52          2HG       PRO  52  -0.263  -6.912   3.194
  401   2HG   PRO  52          1HG       PRO  52  -0.471  -7.602   1.578
  402   1HD   PRO  52          2HD       PRO  52  -2.463  -7.370   3.610
  403   2HD   PRO  52          1HD       PRO  52  -2.613  -8.223   2.056
  404    H    THR  53           H        THR  53   1.747  -9.761   5.077
  405    HA   THR  53           HA       THR  53   0.750  -9.192   7.803
  406    HB   THR  53           HB       THR  53   2.666 -10.236   8.661
  407    HG1  THR  53           HG1      THR  53   4.557 -10.114   7.734
  408   1HG2  THR  53          1HG2      THR  53   2.904 -12.361   7.503
  409   2HG2  THR  53          2HG2      THR  53   2.230 -11.664   6.030
  410   3HG2  THR  53          3HG2      THR  53   1.216 -11.855   7.461
  411    HA   PRO  54           HA       PRO  54   2.667  -5.214   7.850
  412   1HB   PRO  54          2HB       PRO  54   4.139  -5.162  10.161
  413   2HB   PRO  54          1HB       PRO  54   2.372  -5.051  10.109
  414   1HG   PRO  54          2HG       PRO  54   4.103  -7.358  10.843
  415   2HG   PRO  54          1HG       PRO  54   2.501  -6.911  11.451
  416   1HD   PRO  54          2HD       PRO  54   2.987  -8.917   9.583
  417   2HD   PRO  54          1HD       PRO  54   1.419  -8.110   9.814
  418    H    GLU  55           H        GLU  55   4.874  -7.901   8.284
  419    HA   GLU  55           HA       GLU  55   7.250  -6.372   7.595
  420   1HB   GLU  55          2HB       GLU  55   7.031  -9.385   7.695
  421   2HB   GLU  55          1HB       GLU  55   8.467  -8.386   7.915
  422   1HG   GLU  55          2HG       GLU  55   7.385  -7.415   9.975
  423   2HG   GLU  55          1HG       GLU  55   6.100  -8.609   9.791
  424    H    GLU  56           H        GLU  56   5.061  -8.712   6.079
  425    HA   GLU  56           HA       GLU  56   6.530  -8.998   3.649
  426   1HB   GLU  56          2HB       GLU  56   3.675  -9.584   4.424
  427   2HB   GLU  56          1HB       GLU  56   4.255  -9.818   2.775
  428   1HG   GLU  56          2HG       GLU  56   5.798 -10.984   5.079
  429   2HG   GLU  56          1HG       GLU  56   4.371 -11.821   4.466
  430    H    LEU  57           H        LEU  57   3.610  -7.090   4.477
  431    HA   LEU  57           HA       LEU  57   3.342  -5.843   1.958
  432   1HB   LEU  57          2HB       LEU  57   1.472  -5.136   2.912
  433   2HB   LEU  57          1HB       LEU  57   2.015  -5.751   4.451
  434    HG   LEU  57           HG       LEU  57   2.811  -3.005   3.501
  435   1HD1  LEU  57          1HD1      LEU  57   0.871  -2.164   4.840
  436   2HD1  LEU  57          2HD1      LEU  57   0.296  -3.825   4.980
  437   3HD1  LEU  57          3HD1      LEU  57   0.383  -3.052   3.397
  438   1HD2  LEU  57          1HD2      LEU  57   3.889  -3.013   5.481
  439   2HD2  LEU  57          2HD2      LEU  57   3.269  -4.627   5.833
  440   3HD2  LEU  57          3HD2      LEU  57   2.337  -3.205   6.298
  441    H    GLN  58           H        GLN  58   5.407  -5.130   4.702
  442    HA   GLN  58           HA       GLN  58   6.064  -2.466   4.262
  443   1HB   GLN  58          2HB       GLN  58   7.076  -4.548   5.857
  444   2HB   GLN  58          1HB       GLN  58   8.448  -3.975   4.909
  445   1HG   GLN  58          2HG       GLN  58   6.589  -2.214   6.540
  446   2HG   GLN  58          1HG       GLN  58   8.215  -2.699   7.020
  447   1HE2  GLN  58          1HE2      GLN  58   6.382  -0.563   4.905
  448   2HE2  GLN  58          2HE2      GLN  58   7.719   0.293   4.302
  449    H    GLU  59           H        GLU  59   7.407  -5.374   2.723
  450    HA   GLU  59           HA       GLU  59   9.385  -4.059   1.169
  451   1HB   GLU  59          2HB       GLU  59   8.038  -6.729   1.056
  452   2HB   GLU  59          1HB       GLU  59   8.974  -6.191  -0.338
  453   1HG   GLU  59          2HG       GLU  59  10.751  -5.582   1.566
  454   2HG   GLU  59          1HG       GLU  59   9.898  -6.868   2.420
  455    H    MET  60           H        MET  60   6.013  -4.974   0.480
  456    HA   MET  60           HA       MET  60   5.942  -4.242  -2.237
  457   1HB   MET  60          2HB       MET  60   3.752  -4.268  -0.148
  458   2HB   MET  60          1HB       MET  60   3.462  -3.973  -1.862
  459   1HG   MET  60          2HG       MET  60   4.574  -6.164  -2.369
  460   2HG   MET  60          1HG       MET  60   4.667  -6.468  -0.633
  461   1HE   MET  60          1HE       MET  60   3.086  -8.847  -1.094
  462   2HE   MET  60          2HE       MET  60   3.556  -8.258  -2.687
  463   3HE   MET  60          3HE       MET  60   1.880  -8.707  -2.380
  464    H    ILE  61           H        ILE  61   5.305  -2.339   0.702
  465    HA   ILE  61           HA       ILE  61   4.377   0.020  -0.462
  466    HB   ILE  61           HB       ILE  61   6.011  -0.459   2.035
  467   1HG1  ILE  61          2HG1      ILE  61   3.165   0.407   2.018
  468   2HG1  ILE  61          1HG1      ILE  61   3.500  -1.243   1.497
  469   1HG2  ILE  61          1HG2      ILE  61   6.399   1.829   1.485
  470   2HG2  ILE  61          2HG2      ILE  61   5.108   1.834   2.690
  471   3HG2  ILE  61          3HG2      ILE  61   4.725   2.070   0.984
  472   1HD1  ILE  61          1HD1      ILE  61   4.577  -0.068   4.068
  473   2HD1  ILE  61          2HD1      ILE  61   4.610  -1.755   3.557
  474   3HD1  ILE  61          3HD1      ILE  61   3.077  -0.992   3.977
  475    H    ASP  62           H        ASP  62   7.692  -0.394   0.787
  476    HA   ASP  62           HA       ASP  62   8.839   1.809  -0.458
  477   1HB   ASP  62          2HB       ASP  62  10.109  -0.840   0.267
  478   2HB   ASP  62          1HB       ASP  62  11.010   0.604  -0.189
  479    H    GLU  63           H        GLU  63   8.260  -1.427  -1.761
  480    HA   GLU  63           HA       GLU  63   9.875  -1.242  -4.075
  481   1HB   GLU  63          2HB       GLU  63   7.554  -2.931  -3.247
  482   2HB   GLU  63          1HB       GLU  63   7.993  -2.904  -4.954
  483   1HG   GLU  63          2HG       GLU  63  10.327  -3.490  -4.343
  484   2HG   GLU  63          1HG       GLU  63   9.846  -3.580  -2.649
  485    H    VAL  64           H        VAL  64   6.393  -0.565  -3.608
  486    HA   VAL  64           HA       VAL  64   6.032   0.326  -6.319
  487    HB   VAL  64           HB       VAL  64   3.784   0.905  -5.683
  488   1HG1  VAL  64          1HG1      VAL  64   3.559  -1.339  -5.868
  489   2HG1  VAL  64          2HG1      VAL  64   3.442  -1.324  -4.109
  490   3HG1  VAL  64          3HG1      VAL  64   4.989  -1.656  -4.886
  491   1HG2  VAL  64          1HG2      VAL  64   4.524   0.360  -2.799
  492   2HG2  VAL  64          2HG2      VAL  64   3.020   1.040  -3.419
  493   3HG2  VAL  64          3HG2      VAL  64   4.507   1.985  -3.485
  494    H    ASP  65           H        ASP  65   7.118   1.885  -3.410
  495    HA   ASP  65           HA       ASP  65   6.306   4.543  -4.039
  496   1HB   ASP  65          2HB       ASP  65   7.466   3.375  -1.848
  497   2HB   ASP  65          1HB       ASP  65   8.826   4.258  -2.534
  498    H    GLU  66           H        GLU  66   6.775   4.959  -6.170
  499    HA   GLU  66           HA       GLU  66   9.370   4.550  -7.323
  500   1HB   GLU  66          2HB       GLU  66   6.961   6.115  -8.258
  501   2HB   GLU  66          1HB       GLU  66   8.437   5.936  -9.208
  502   1HG   GLU  66          2HG       GLU  66   8.089   3.672  -9.580
  503   2HG   GLU  66          1HG       GLU  66   7.157   3.465  -8.097
  504    H    ASP  67           H        ASP  67   7.706   7.347  -5.910
  505    HA   ASP  67           HA       ASP  67  10.010   9.057  -6.535
  506   1HB   ASP  67          2HB       ASP  67   8.505  10.814  -5.303
  507   2HB   ASP  67          1HB       ASP  67   8.121  10.322  -6.950
  508    H    GLY  68           H        GLY  68   8.300   7.725  -3.723
  509   1HA   GLY  68          2HA       GLY  68   9.083   7.326  -1.581
  510   2HA   GLY  68          1HA       GLY  68  10.677   7.865  -2.108
  511    H    SER  69           H        SER  69   7.525   9.509  -2.098
  512    HA   SER  69           HA       SER  69   8.745  11.866  -0.885
  513   1HB   SER  69          2HB       SER  69   6.489  12.886  -1.321
  514   2HB   SER  69          1HB       SER  69   7.300  12.285  -2.763
  515    HG   SER  69           HG       SER  69   4.920  11.617  -1.837
  516    H    GLY  70           H        GLY  70   5.965   9.725  -0.263
  517   1HA   GLY  70          2HA       GLY  70   6.203   9.194   2.374
  518   2HA   GLY  70          1HA       GLY  70   5.535  10.825   2.387
  519    H    THR  71           H        THR  71   4.000  10.496  -0.048
  520    HA   THR  71           HA       THR  71   1.822   8.779   0.980
  521    HB   THR  71           HB       THR  71   0.287  10.228  -0.233
  522    HG1  THR  71           HG1      THR  71   1.173  11.072  -1.947
  523   1HG2  THR  71          1HG2      THR  71   0.753  12.381   0.954
  524   2HG2  THR  71          2HG2      THR  71   2.343  11.749   1.389
  525   3HG2  THR  71          3HG2      THR  71   0.884  10.967   2.001
  526    H    VAL  72           H        VAL  72   0.627   7.507  -0.509
  527    HA   VAL  72           HA       VAL  72   2.210   6.695  -2.853
  528    HB   VAL  72           HB       VAL  72  -0.205   5.301  -1.683
  529   1HG1  VAL  72          1HG1      VAL  72   2.053   4.237  -3.397
  530   2HG1  VAL  72          2HG1      VAL  72   0.520   4.805  -4.058
  531   3HG1  VAL  72          3HG1      VAL  72   0.552   3.414  -2.974
  532   1HG2  VAL  72          1HG2      VAL  72   1.584   3.755  -0.709
  533   2HG2  VAL  72          2HG2      VAL  72   1.428   5.331   0.070
  534   3HG2  VAL  72          3HG2      VAL  72   2.747   5.034  -1.061
  535    H    ASP  73           H        ASP  73   1.683   7.504  -4.755
  536    HA   ASP  73           HA       ASP  73  -0.909   8.759  -5.205
  537   1HB   ASP  73          2HB       ASP  73   1.503   8.413  -7.011
  538   2HB   ASP  73          1HB       ASP  73   0.049   9.307  -7.442
  539    H    PHE  74           H        PHE  74  -1.799   8.282  -7.570
  540    HA   PHE  74           HA       PHE  74  -2.788   5.615  -7.529
  541   1HB   PHE  74          2HB       PHE  74  -3.881   7.706  -8.582
  542   2HB   PHE  74          1HB       PHE  74  -2.850   7.382  -9.976
  543    HD1  PHE  74           HD1      PHE  74  -4.357   6.605 -11.619
  544    HD2  PHE  74           HD2      PHE  74  -4.476   4.931  -7.665
  545    HE1  PHE  74           HE1      PHE  74  -5.951   4.873 -12.397
  546    HE2  PHE  74           HE2      PHE  74  -6.064   3.200  -8.446
  547    HZ   PHE  74           HZ       PHE  74  -6.805   3.169 -10.810
  548    H    ASP  75           H        ASP  75  -0.151   7.198  -9.268
  549    HA   ASP  75           HA       ASP  75   0.390   5.115 -11.127
  550   1HB   ASP  75          2HB       ASP  75   1.880   7.478 -10.069
  551   2HB   ASP  75          1HB       ASP  75   2.802   6.220 -10.891
  552    H    GLU  76           H        GLU  76   1.496   5.817  -7.845
  553    HA   GLU  76           HA       GLU  76   3.323   3.579  -7.707
  554   1HB   GLU  76          2HB       GLU  76   2.179   5.004  -5.314
  555   2HB   GLU  76          1HB       GLU  76   3.769   4.267  -5.502
  556   1HG   GLU  76          2HG       GLU  76   4.237   6.026  -7.284
  557   2HG   GLU  76          1HG       GLU  76   2.755   6.827  -6.761
  558    H    PHE  77           H        PHE  77  -0.045   4.115  -7.207
  559    HA   PHE  77           HA       PHE  77  -0.510   1.859  -5.477
  560   1HB   PHE  77          2HB       PHE  77  -1.943   3.926  -5.550
  561   2HB   PHE  77          1HB       PHE  77  -2.498   3.424  -7.143
  562    HD1  PHE  77           HD1      PHE  77  -2.152   2.100  -3.643
  563    HD2  PHE  77           HD2      PHE  77  -4.379   2.084  -7.318
  564    HE1  PHE  77           HE1      PHE  77  -3.865   0.640  -2.600
  565    HE2  PHE  77           HE2      PHE  77  -6.090   0.625  -6.270
  566    HZ   PHE  77           HZ       PHE  77  -5.834  -0.096  -3.912
  567    H    LEU  78           H        LEU  78  -0.822   2.540  -8.951
  568    HA   LEU  78           HA       LEU  78  -1.994  -0.012  -9.577
  569   1HB   LEU  78          2HB       LEU  78  -0.700   2.066 -11.324
  570   2HB   LEU  78          1HB       LEU  78  -1.562   0.662 -11.916
  571    HG   LEU  78           HG       LEU  78  -3.002   2.503 -10.060
  572   1HD1  LEU  78          1HD1      LEU  78  -3.644   3.790 -12.218
  573   2HD1  LEU  78          2HD1      LEU  78  -2.152   3.126 -12.882
  574   3HD1  LEU  78          3HD1      LEU  78  -2.097   4.161 -11.456
  575   1HD2  LEU  78          1HD2      LEU  78  -3.602   0.306 -11.776
  576   2HD2  LEU  78          2HD2      LEU  78  -4.395   1.729 -12.454
  577   3HD2  LEU  78          3HD2      LEU  78  -4.720   1.245 -10.790
  578    H    VAL  79           H        VAL  79   1.310   1.262  -9.505
  579    HA   VAL  79           HA       VAL  79   2.568  -0.693 -11.079
  580    HB   VAL  79           HB       VAL  79   4.610  -0.252  -9.638
  581   1HG1  VAL  79          1HG1      VAL  79   3.059   1.908 -11.056
  582   2HG1  VAL  79          2HG1      VAL  79   4.440   0.983 -11.642
  583   3HG1  VAL  79          3HG1      VAL  79   4.668   2.216 -10.404
  584   1HG2  VAL  79          1HG2      VAL  79   3.223   0.397  -7.612
  585   2HG2  VAL  79          2HG2      VAL  79   2.869   1.910  -8.445
  586   3HG2  VAL  79          3HG2      VAL  79   4.531   1.507  -8.016
  587    H    MET  80           H        MET  80   1.254  -0.890  -7.874
  588    HA   MET  80           HA       MET  80   2.575  -2.934  -6.627
  589   1HB   MET  80          2HB       MET  80  -0.250  -2.058  -6.719
  590   2HB   MET  80          1HB       MET  80   0.029  -3.688  -6.105
  591   1HG   MET  80          2HG       MET  80   1.897  -2.572  -4.668
  592   2HG   MET  80          1HG       MET  80   1.048  -1.069  -5.026
  593   1HE   MET  80          1HE       MET  80  -1.078  -0.345  -4.240
  594   2HE   MET  80          2HE       MET  80  -2.318  -1.294  -3.424
  595   3HE   MET  80          3HE       MET  80  -1.943  -1.615  -5.114
  596    H    MET  81           H        MET  81   0.456  -3.224  -9.443
  597    HA   MET  81           HA       MET  81   0.320  -6.100  -9.373
  598   1HB   MET  81          2HB       MET  81  -0.517  -3.973 -11.309
  599   2HB   MET  81          1HB       MET  81  -0.420  -5.645 -11.861
  600   1HG   MET  81          2HG       MET  81  -1.842  -5.040  -9.288
  601   2HG   MET  81          1HG       MET  81  -2.664  -4.732 -10.819
  602   1HE   MET  81          1HE       MET  81  -2.496  -8.366  -8.485
  603   2HE   MET  81          2HE       MET  81  -2.013  -6.709  -8.132
  604   3HE   MET  81          3HE       MET  81  -0.821  -7.856  -8.740
  605    H    VAL  82           H        VAL  82   2.017  -3.771 -11.495
  606    HA   VAL  82           HA       VAL  82   3.447  -5.768 -12.934
  607    HB   VAL  82           HB       VAL  82   4.859  -3.854 -13.736
  608   1HG1  VAL  82          1HG1      VAL  82   3.240  -3.287 -15.248
  609   2HG1  VAL  82          2HG1      VAL  82   2.055  -2.908 -13.996
  610   3HG1  VAL  82          3HG1      VAL  82   2.355  -4.585 -14.448
  611   1HG2  VAL  82          1HG2      VAL  82   4.297  -1.601 -13.072
  612   2HG2  VAL  82          2HG2      VAL  82   4.606  -2.519 -11.599
  613   3HG2  VAL  82          3HG2      VAL  82   2.949  -2.171 -12.091
  614    H    ARG  83           H        ARG  83   4.240  -3.935 -10.004
  615    HA   ARG  83           HA       ARG  83   7.004  -4.417  -9.927
  616   1HB   ARG  83          2HB       ARG  83   6.887  -4.019  -7.524
  617   2HB   ARG  83          1HB       ARG  83   5.872  -2.862  -8.380
  618   1HG   ARG  83          2HG       ARG  83   3.927  -3.750  -7.561
  619   2HG   ARG  83          1HG       ARG  83   4.562  -5.392  -7.517
  620   1HD   ARG  83          2HD       ARG  83   5.728  -3.358  -5.657
  621   2HD   ARG  83          1HD       ARG  83   4.149  -4.032  -5.275
  622    HE   ARG  83           HE       ARG  83   6.689  -5.395  -5.119
  623   1HH1  ARG  83          2HH1      ARG  83   3.244  -5.785  -5.561
  624   2HH1  ARG  83          1HH1      ARG  83   3.232  -7.417  -4.987
  625   1HH2  ARG  83          1HH2      ARG  83   6.642  -7.534  -4.370
  626   2HH2  ARG  83          2HH2      ARG  83   5.147  -8.404  -4.316
  627    H    CYS  84           H        CYS  84   4.353  -6.598  -9.393
  628    HA   CYS  84           HA       CYS  84   5.681  -8.542  -7.800
  629   1HB   CYS  84          2HB       CYS  84   3.137  -8.295  -8.458
  630   2HB   CYS  84          1HB       CYS  84   3.600  -9.339  -9.802
  631    HG   CYS  84           HG       CYS  84   3.279 -10.233  -6.926
  632    H    MET  85           H        MET  85   5.472  -7.996 -11.294
  633    HA   MET  85           HA       MET  85   6.637 -10.429 -12.150
  634   1HB   MET  85          2HB       MET  85   6.259  -7.726 -13.372
  635   2HB   MET  85          1HB       MET  85   7.382  -8.844 -14.143
  636   1HG   MET  85          2HG       MET  85   5.484  -9.575 -15.191
  637   2HG   MET  85          1HG       MET  85   5.300 -10.520 -13.713
  638   1HE   MET  85          1HE       MET  85   1.735  -9.850 -13.625
  639   2HE   MET  85          2HE       MET  85   2.921 -10.475 -12.482
  640   3HE   MET  85          3HE       MET  85   3.056 -10.881 -14.191
  641    H    LYS  86           H        LYS  86   8.095  -7.210 -11.581
  642    HA   LYS  86           HA       LYS  86  10.772  -8.096 -12.072
  643   1HB   LYS  86          2HB       LYS  86   9.472  -5.602 -11.164
  644   2HB   LYS  86          1HB       LYS  86  11.102  -5.861 -10.542
  645   1HG   LYS  86          2HG       LYS  86  11.521  -6.543 -13.113
  646   2HG   LYS  86          1HG       LYS  86  10.192  -5.404 -13.339
  647   1HD   LYS  86          2HD       LYS  86  11.392  -3.627 -12.339
  648   2HD   LYS  86          1HD       LYS  86  12.571  -4.719 -11.615
  649   1HE   LYS  86          2HE       LYS  86  13.629  -5.142 -13.684
  650   2HE   LYS  86          1HE       LYS  86  12.258  -4.533 -14.610
  651   1HZ   LYS  86          1HZ       LYS  86  14.176  -2.989 -14.495
  652   2HZ   LYS  86          2HZ       LYS  86  13.929  -2.852 -12.820
  653   3HZ   LYS  86          3HZ       LYS  86  12.734  -2.322 -13.906
  654    H    ASP  87           H        ASP  87   9.503  -6.770  -9.013
  655    HA   ASP  87           HA       ASP  87  10.018  -7.220  -6.825
  656   1HB   ASP  87          2HB       ASP  87   8.725  -9.343  -7.715
  657   2HB   ASP  87          1HB       ASP  87  10.284 -10.130  -7.462
  658    H    ASP  88           H        ASP  88  12.066  -6.190  -6.899
  659    HA   ASP  88           HA       ASP  88  14.473  -7.560  -7.576
  660   1HB   ASP  88          2HB       ASP  88  14.050  -5.001  -7.340
  661   2HB   ASP  88          1HB       ASP  88  14.387  -5.269  -5.630
  662    H    SER  89           HN       SER  89  15.106  -9.332  -6.538
  663    HA   SER  89           HA       SER  89  15.006  -9.346  -3.576
  664   1HB   SER  89          2HB       SER  89  13.497 -11.013  -4.877
  665   2HB   SER  89          1HB       SER  89  15.001 -11.858  -5.234
  666    HG   SER  89           HG       SER  89  15.133 -12.464  -3.213
  Start of MODEL   24
    1   1H    MET   1          1H        MET   1  16.320   2.040 -20.251
    2   2H    MET   1          2H        MET   1  16.044   3.261 -21.398
    3   3H    MET   1          3H        MET   1  15.375   1.715 -21.622
    4    HA   MET   1           HA       MET   1  14.696   3.470 -19.328
    5   1HB   MET   1          2HB       MET   1  12.598   3.972 -20.548
    6   2HB   MET   1          1HB       MET   1  14.009   4.569 -21.420
    7   1HG   MET   1          2HG       MET   1  13.371   1.823 -22.165
    8   2HG   MET   1          1HG       MET   1  12.011   2.909 -22.452
    9   1HE   MET   1          1HE       MET   1  13.158   1.279 -24.299
   10   2HE   MET   1          2HE       MET   1  14.466   1.779 -25.366
   11   3HE   MET   1          3HE       MET   1  12.838   2.397 -25.631
   12    H    ASN   2           H        ASN   2  12.634   2.767 -18.353
   13    HA   ASN   2           HA       ASN   2  12.612  -0.091 -17.961
   14   1HB   ASN   2          2HB       ASN   2  11.096   2.226 -16.805
   15   2HB   ASN   2          1HB       ASN   2  10.477   0.589 -16.580
   16   1HD2  ASN   2          1HD2      ASN   2  12.366  -1.032 -15.863
   17   2HD2  ASN   2          2HD2      ASN   2  13.396  -0.433 -14.655
   18    H    ASP   3           H        ASP   3  11.578  -1.493 -19.206
   19    HA   ASP   3           HA       ASP   3   9.157  -0.595 -20.661
   20   1HB   ASP   3          2HB       ASP   3  11.374  -2.458 -21.504
   21   2HB   ASP   3          1HB       ASP   3   9.797  -2.468 -22.293
   22    H    ILE   4           H        ILE   4   9.655  -2.057 -17.962
   23    HA   ILE   4           HA       ILE   4   8.367  -4.625 -18.449
   24    HB   ILE   4           HB       ILE   4   8.693  -5.136 -16.176
   25   1HG1  ILE   4          2HG1      ILE   4   7.762  -2.874 -15.385
   26   2HG1  ILE   4          1HG1      ILE   4   9.035  -3.591 -14.406
   27   1HG2  ILE   4          1HG2      ILE   4  10.785  -5.135 -17.386
   28   2HG2  ILE   4          2HG2      ILE   4  11.080  -4.534 -15.755
   29   3HG2  ILE   4          3HG2      ILE   4  10.996  -3.407 -17.108
   30   1HD1  ILE   4          1HD1      ILE   4  10.631  -2.158 -15.929
   31   2HD1  ILE   4          2HD1      ILE   4   9.770  -1.384 -14.601
   32   3HD1  ILE   4          3HD1      ILE   4   9.172  -1.223 -16.250
   33    H    TYR   5           H        TYR   5   7.498  -1.403 -17.434
   34    HA   TYR   5           HA       TYR   5   4.965  -2.030 -16.269
   35   1HB   TYR   5          2HB       TYR   5   5.830   0.568 -17.567
   36   2HB   TYR   5          1HB       TYR   5   4.512   0.349 -16.417
   37    HD1  TYR   5           HD1      TYR   5   5.288  -0.982 -14.186
   38    HD2  TYR   5           HD2      TYR   5   7.830   1.387 -16.708
   39    HE1  TYR   5           HE1      TYR   5   6.875  -0.686 -12.305
   40    HE2  TYR   5           HE2      TYR   5   9.420   1.681 -14.829
   41    HH   TYR   5           HH       TYR   5   8.902   1.488 -11.933
   42    H    LYS   6           H        LYS   6   6.105  -1.354 -19.524
   43    HA   LYS   6           HA       LYS   6   3.475  -1.103 -20.692
   44   1HB   LYS   6          2HB       LYS   6   5.993  -1.771 -22.213
   45   2HB   LYS   6          1HB       LYS   6   4.574  -0.893 -22.776
   46   1HG   LYS   6          2HG       LYS   6   6.710   0.058 -20.857
   47   2HG   LYS   6          1HG       LYS   6   6.242   0.771 -22.400
   48   1HD   LYS   6          2HD       LYS   6   4.176   1.570 -21.527
   49   2HD   LYS   6          1HD       LYS   6   4.304   0.553 -20.091
   50   1HE   LYS   6          2HE       LYS   6   4.870   2.821 -19.455
   51   2HE   LYS   6          1HE       LYS   6   6.347   1.859 -19.425
   52   1HZ   LYS   6          1HZ       LYS   6   6.483   4.090 -20.558
   53   2HZ   LYS   6          2HZ       LYS   6   5.523   3.436 -21.796
   54   3HZ   LYS   6          3HZ       LYS   6   7.049   2.769 -21.458
   55    H    ALA   7           H        ALA   7   5.883  -3.635 -20.296
   56    HA   ALA   7           HA       ALA   7   4.500  -5.584 -21.900
   57   1HB   ALA   7          1HB       ALA   7   6.797  -6.008 -21.713
   58   2HB   ALA   7          2HB       ALA   7   6.086  -7.172 -20.596
   59   3HB   ALA   7          3HB       ALA   7   6.811  -5.688 -19.979
   60    H    ALA   8           H        ALA   8   4.388  -4.552 -18.555
   61    HA   ALA   8           HA       ALA   8   2.909  -6.904 -17.681
   62   1HB   ALA   8          1HB       ALA   8   4.418  -5.952 -16.068
   63   2HB   ALA   8          2HB       ALA   8   2.770  -5.656 -15.511
   64   3HB   ALA   8          3HB       ALA   8   3.697  -4.353 -16.261
   65    H    VAL   9           H        VAL   9   2.286  -3.456 -18.331
   66    HA   VAL   9           HA       VAL   9  -0.379  -3.382 -17.436
   67    HB   VAL   9           HB       VAL   9   1.134  -1.429 -18.171
   68   1HG1  VAL   9          1HG1      VAL   9  -0.198  -1.948 -20.837
   69   2HG1  VAL   9          2HG1      VAL   9   1.463  -2.422 -20.491
   70   3HG1  VAL   9          3HG1      VAL   9   1.010  -0.721 -20.451
   71   1HG2  VAL   9          1HG2      VAL   9  -1.197  -1.168 -17.416
   72   2HG2  VAL   9          2HG2      VAL   9  -1.772  -1.531 -19.044
   73   3HG2  VAL   9          3HG2      VAL   9  -0.846  -0.061 -18.742
   74    H    GLU  10           H        GLU  10   1.028  -4.578 -20.423
   75    HA   GLU  10           HA       GLU  10  -1.405  -4.799 -21.905
   76   1HB   GLU  10          2HB       GLU  10   1.349  -5.967 -22.175
   77   2HB   GLU  10          1HB       GLU  10   0.028  -6.587 -23.167
   78   1HG   GLU  10          2HG       GLU  10  -0.437  -4.052 -23.660
   79   2HG   GLU  10          1HG       GLU  10   1.232  -3.833 -23.134
   80    H    GLN  11           H        GLN  11   0.097  -6.727 -19.410
   81    HA   GLN  11           HA       GLN  11  -1.381  -9.143 -20.014
   82   1HB   GLN  11          2HB       GLN  11   0.044  -8.420 -17.442
   83   2HB   GLN  11          1HB       GLN  11  -0.442 -10.031 -17.968
   84   1HG   GLN  11          2HG       GLN  11   1.511  -8.280 -19.486
   85   2HG   GLN  11          1HG       GLN  11   1.997  -9.530 -18.343
   86   1HE2  GLN  11          1HE2      GLN  11   0.977  -8.951 -21.607
   87   2HE2  GLN  11          2HE2      GLN  11   0.882 -10.577 -22.086
   88    H    LEU  12           H        LEU  12  -1.654  -6.424 -17.782
   89    HA   LEU  12           HA       LEU  12  -3.925  -7.481 -16.368
   90   1HB   LEU  12          2HB       LEU  12  -2.845  -4.667 -16.522
   91   2HB   LEU  12          1HB       LEU  12  -4.077  -5.218 -15.408
   92    HG   LEU  12           HG       LEU  12  -1.725  -6.880 -15.179
   93   1HD1  LEU  12          1HD1      LEU  12  -1.302  -3.918 -14.686
   94   2HD1  LEU  12          2HD1      LEU  12  -0.615  -4.805 -16.046
   95   3HD1  LEU  12          3HD1      LEU  12  -0.141  -5.214 -14.398
   96   1HD2  LEU  12          1HD2      LEU  12  -2.911  -4.878 -13.234
   97   2HD2  LEU  12          2HD2      LEU  12  -1.974  -6.321 -12.845
   98   3HD2  LEU  12          3HD2      LEU  12  -3.596  -6.478 -13.518
   99    H    THR  13           H        THR  13  -6.002  -6.266 -16.279
  100    HA   THR  13           HA       THR  13  -6.862  -5.528 -19.011
  101    HB   THR  13           HB       THR  13  -9.202  -5.955 -17.760
  102    HG1  THR  13           HG1      THR  13  -8.963  -7.668 -16.328
  103   1HG2  THR  13          1HG2      THR  13  -8.759  -7.113 -19.750
  104   2HG2  THR  13          2HG2      THR  13  -8.885  -8.409 -18.560
  105   3HG2  THR  13          3HG2      THR  13  -7.299  -7.862 -19.102
  106    H    ASP  14           H        ASP  14  -8.765  -4.005 -19.047
  107    HA   ASP  14           HA       ASP  14  -8.051  -1.542 -17.801
  108   1HB   ASP  14          2HB       ASP  14 -10.489  -2.425 -19.353
  109   2HB   ASP  14          1HB       ASP  14 -10.319  -0.792 -18.707
  110    H    GLU  15           H        GLU  15 -10.318  -4.107 -17.065
  111    HA   GLU  15           HA       GLU  15 -11.919  -2.781 -15.164
  112   1HB   GLU  15          2HB       GLU  15 -12.573  -4.981 -14.423
  113   2HB   GLU  15          1HB       GLU  15 -12.432  -4.992 -16.173
  114   1HG   GLU  15          2HG       GLU  15 -11.093  -6.783 -15.966
  115   2HG   GLU  15          1HG       GLU  15  -9.885  -5.713 -15.268
  116    H    GLN  16           H        GLN  16  -8.805  -4.382 -14.917
  117    HA   GLN  16           HA       GLN  16  -8.567  -4.442 -12.097
  118   1HB   GLN  16          2HB       GLN  16  -6.410  -4.243 -14.217
  119   2HB   GLN  16          1HB       GLN  16  -6.117  -4.598 -12.514
  120   1HG   GLN  16          2HG       GLN  16  -8.108  -6.269 -14.011
  121   2HG   GLN  16          1HG       GLN  16  -6.390  -6.566 -14.266
  122   1HE2  GLN  16          1HE2      GLN  16  -5.691  -8.225 -12.921
  123   2HE2  GLN  16          2HE2      GLN  16  -6.206  -8.465 -11.322
  124    H    LYS  17           H        LYS  17  -7.569  -2.022 -14.510
  125    HA   LYS  17           HA       LYS  17  -6.441  -0.191 -12.633
  126   1HB   LYS  17          2HB       LYS  17  -7.292  -0.033 -15.501
  127   2HB   LYS  17          1HB       LYS  17  -6.982   1.463 -14.619
  128   1HG   LYS  17          2HG       LYS  17  -4.812   1.111 -15.199
  129   2HG   LYS  17          1HG       LYS  17  -4.822  -0.061 -13.881
  130   1HD   LYS  17          2HD       LYS  17  -4.064  -1.409 -15.603
  131   2HD   LYS  17          1HD       LYS  17  -5.802  -1.661 -15.763
  132   1HE   LYS  17          2HE       LYS  17  -5.800   0.294 -17.408
  133   2HE   LYS  17          1HE       LYS  17  -4.040   0.181 -17.394
  134   1HZ   LYS  17          1HZ       LYS  17  -4.239  -2.145 -18.071
  135   2HZ   LYS  17          2HZ       LYS  17  -4.954  -1.101 -19.205
  136   3HZ   LYS  17          3HZ       LYS  17  -5.926  -1.991 -18.135
  137    H    ASN  18           H        ASN  18  -9.676  -0.679 -13.956
  138    HA   ASN  18           HA       ASN  18 -10.847   1.734 -13.031
  139   1HB   ASN  18          2HB       ASN  18 -12.419   0.857 -14.389
  140   2HB   ASN  18          1HB       ASN  18 -11.745  -0.760 -14.252
  141   1HD2  ASN  18          1HD2      ASN  18 -12.811  -2.240 -12.865
  142   2HD2  ASN  18          2HD2      ASN  18 -14.172  -1.837 -11.933
  143    H    GLU  19           H        GLU  19 -10.616  -1.524 -11.614
  144    HA   GLU  19           HA       GLU  19 -12.031  -0.985  -9.217
  145   1HB   GLU  19          2HB       GLU  19  -9.779  -2.963  -9.689
  146   2HB   GLU  19          1HB       GLU  19 -10.865  -2.962  -8.299
  147   1HG   GLU  19          2HG       GLU  19 -11.960  -3.060 -11.101
  148   2HG   GLU  19          1HG       GLU  19 -11.422  -4.531 -10.296
  149    H    PHE  20           H        PHE  20  -8.601  -0.810 -10.075
  150    HA   PHE  20           HA       PHE  20  -7.556  -0.091  -7.564
  151   1HB   PHE  20          2HB       PHE  20  -6.653   0.341 -10.397
  152   2HB   PHE  20          1HB       PHE  20  -5.780   1.104  -9.073
  153    HD1  PHE  20           HD1      PHE  20  -7.398  -2.036  -8.230
  154    HD2  PHE  20           HD2      PHE  20  -3.831  -0.292  -9.867
  155    HE1  PHE  20           HE1      PHE  20  -6.173  -4.149  -7.818
  156    HE2  PHE  20           HE2      PHE  20  -2.609  -2.399  -9.455
  157    HZ   PHE  20           HZ       PHE  20  -3.778  -4.334  -8.428
  158    H    LYS  21           H        LYS  21  -8.849   1.903 -10.212
  159    HA   LYS  21           HA       LYS  21  -8.219   4.419  -9.075
  160   1HB   LYS  21          2HB       LYS  21  -9.131   3.681 -11.489
  161   2HB   LYS  21          1HB       LYS  21 -10.652   4.198 -10.760
  162   1HG   LYS  21          2HG       LYS  21  -8.223   5.934 -10.468
  163   2HG   LYS  21          1HG       LYS  21  -9.118   5.960 -11.987
  164   1HD   LYS  21          2HD       LYS  21 -10.472   6.322  -9.306
  165   2HD   LYS  21          1HD       LYS  21  -9.820   7.678 -10.225
  166   1HE   LYS  21          2HE       LYS  21 -11.704   7.722 -11.455
  167   2HE   LYS  21          1HE       LYS  21 -11.333   6.102 -12.044
  168   1HZ   LYS  21          1HZ       LYS  21 -12.447   5.171 -10.126
  169   2HZ   LYS  21          2HZ       LYS  21 -13.501   6.205 -10.965
  170   3HZ   LYS  21          3HZ       LYS  21 -12.773   6.721  -9.519
  171    H    ALA  22           H        ALA  22 -11.270   2.550  -9.068
  172    HA   ALA  22           HA       ALA  22 -12.733   4.368  -7.472
  173   1HB   ALA  22          1HB       ALA  22 -14.305   2.580  -7.113
  174   2HB   ALA  22          2HB       ALA  22 -13.097   1.364  -7.533
  175   3HB   ALA  22          3HB       ALA  22 -13.721   2.453  -8.773
  176    H    ALA  23           H        ALA  23 -10.757   1.539  -6.634
  177    HA   ALA  23           HA       ALA  23 -11.216   1.593  -3.836
  178   1HB   ALA  23          1HB       ALA  23 -10.288  -0.406  -4.730
  179   2HB   ALA  23          2HB       ALA  23  -9.008   0.314  -3.756
  180   3HB   ALA  23          3HB       ALA  23  -8.970   0.466  -5.512
  181    H    PHE  24           H        PHE  24  -9.170   3.478  -5.930
  182    HA   PHE  24           HA       PHE  24  -7.496   4.471  -3.766
  183   1HB   PHE  24          2HB       PHE  24  -6.840   4.129  -6.282
  184   2HB   PHE  24          1HB       PHE  24  -7.619   5.692  -6.511
  185    HD1  PHE  24           HD1      PHE  24  -6.677   7.733  -5.528
  186    HD2  PHE  24           HD2      PHE  24  -4.808   3.907  -4.940
  187    HE1  PHE  24           HE1      PHE  24  -4.631   8.859  -4.698
  188    HE2  PHE  24           HE2      PHE  24  -2.766   5.036  -4.105
  189    HZ   PHE  24           HZ       PHE  24  -2.678   7.511  -3.986
  190    H    ASP  25           H        ASP  25  -9.816   5.877  -6.097
  191    HA   ASP  25           HA       ASP  25  -9.941   8.458  -5.102
  192   1HB   ASP  25          2HB       ASP  25 -11.167   7.197  -7.139
  193   2HB   ASP  25          1HB       ASP  25 -12.517   7.303  -6.010
  194    H    ILE  26           H        ILE  26 -11.751   5.606  -3.945
  195    HA   ILE  26           HA       ILE  26 -13.577   6.932  -2.280
  196    HB   ILE  26           HB       ILE  26 -13.634   4.822  -0.945
  197   1HG1  ILE  26          2HG1      ILE  26 -11.453   3.969  -2.879
  198   2HG1  ILE  26          1HG1      ILE  26 -11.225   4.261  -1.157
  199   1HG2  ILE  26          1HG2      ILE  26 -13.989   3.393  -3.219
  200   2HG2  ILE  26          2HG2      ILE  26 -13.962   5.024  -3.890
  201   3HG2  ILE  26          3HG2      ILE  26 -15.142   4.598  -2.649
  202   1HD1  ILE  26          1HD1      ILE  26 -11.508   1.913  -1.339
  203   2HD1  ILE  26          2HD1      ILE  26 -12.841   2.085  -2.480
  204   3HD1  ILE  26          3HD1      ILE  26 -13.071   2.513  -0.785
  205    H    PHE  27           H        PHE  27 -10.208   6.014  -1.680
  206    HA   PHE  27           HA       PHE  27 -10.296   6.925   1.078
  207   1HB   PHE  27          2HB       PHE  27  -8.069   5.906  -0.691
  208   2HB   PHE  27          1HB       PHE  27  -7.802   6.476   0.954
  209    HD1  PHE  27           HD1      PHE  27  -8.336   3.606  -0.923
  210    HD2  PHE  27           HD2      PHE  27  -9.698   5.503   2.681
  211    HE1  PHE  27           HE1      PHE  27  -9.088   1.410  -0.051
  212    HE2  PHE  27           HE2      PHE  27 -10.445   3.306   3.555
  213    HZ   PHE  27           HZ       PHE  27 -10.143   1.260   2.188
  214    H    ILE  28           H        ILE  28  -9.370   8.184  -2.059
  215    HA   ILE  28           HA       ILE  28  -8.079  10.539  -0.882
  216    HB   ILE  28           HB       ILE  28  -8.570  10.036  -3.818
  217   1HG1  ILE  28          2HG1      ILE  28  -7.368   8.099  -3.282
  218   2HG1  ILE  28          1HG1      ILE  28  -6.094   9.237  -3.693
  219   1HG2  ILE  28          1HG2      ILE  28  -7.780  12.208  -3.616
  220   2HG2  ILE  28          2HG2      ILE  28  -6.267  11.312  -3.774
  221   3HG2  ILE  28          3HG2      ILE  28  -6.823  11.835  -2.182
  222   1HD1  ILE  28          1HD1      ILE  28  -6.898   8.199  -0.998
  223   2HD1  ILE  28          2HD1      ILE  28  -6.161   9.797  -1.116
  224   3HD1  ILE  28          3HD1      ILE  28  -5.282   8.374  -1.686
  225    H    GLN  29           H        GLN  29 -10.891  10.136  -0.370
  226    HA   GLN  29           HA       GLN  29 -12.435  11.844  -2.092
  227   1HB   GLN  29          2HB       GLN  29 -14.150  11.705  -0.259
  228   2HB   GLN  29          1HB       GLN  29 -13.621  10.138  -0.870
  229   1HG   GLN  29          2HG       GLN  29 -12.228   9.755   1.034
  230   2HG   GLN  29          1HG       GLN  29 -12.364  11.432   1.559
  231   1HE2  GLN  29          1HE2      GLN  29 -13.656  11.502   3.396
  232   2HE2  GLN  29          2HE2      GLN  29 -15.090  10.620   3.610
  233    H    ASP  30           H        ASP  30 -10.527  12.258   0.822
  234    HA   ASP  30           HA       ASP  30 -10.770  15.158   0.554
  235   1HB   ASP  30          2HB       ASP  30 -12.410  13.942   2.359
  236   2HB   ASP  30          1HB       ASP  30 -10.984  14.241   3.354
  237    H    ALA  31           H        ALA  31  -8.618  13.323   0.003
  238    HA   ALA  31           HA       ALA  31  -6.729  13.275   2.148
  239   1HB   ALA  31          1HB       ALA  31  -6.545  11.711   0.280
  240   2HB   ALA  31          2HB       ALA  31  -5.090  12.704   0.379
  241   3HB   ALA  31          3HB       ALA  31  -6.314  13.052  -0.842
  242    H    GLU  32           H        GLU  32  -4.828  14.516   2.390
  243    HA   GLU  32           HA       GLU  32  -5.167  17.318   1.936
  244   1HB   GLU  32          2HB       GLU  32  -2.899  15.658   3.021
  245   2HB   GLU  32          1HB       GLU  32  -2.731  17.394   2.768
  246   1HG   GLU  32          2HG       GLU  32  -4.275  17.929   4.411
  247   2HG   GLU  32          1HG       GLU  32  -5.139  16.401   4.247
  248    H    ASP  33           H        ASP  33  -2.865  14.929   0.638
  249    HA   ASP  33           HA       ASP  33  -2.050  16.851  -1.440
  250   1HB   ASP  33          2HB       ASP  33  -0.326  15.589  -0.089
  251   2HB   ASP  33          1HB       ASP  33  -0.882  14.117  -0.883
  252    H    GLY  34           H        GLY  34  -3.484  13.642  -1.030
  253   1HA   GLY  34          2HA       GLY  34  -5.278  13.067  -2.648
  254   2HA   GLY  34          1HA       GLY  34  -4.194  13.642  -3.910
  255    H    CYS  35           H        CYS  35  -3.544  11.604  -1.068
  256    HA   CYS  35           HA       CYS  35  -3.179   9.219  -2.681
  257   1HB   CYS  35          2HB       CYS  35  -0.763   9.132  -1.438
  258   2HB   CYS  35          1HB       CYS  35  -0.990   9.679  -3.096
  259    HG   CYS  35           HG       CYS  35  -0.786  11.646  -0.666
  260    H    ILE  36           H        ILE  36  -2.253   7.406  -1.215
  261    HA   ILE  36           HA       ILE  36  -3.615   7.623   1.403
  262    HB   ILE  36           HB       ILE  36  -3.621   5.142   1.395
  263   1HG1  ILE  36          2HG1      ILE  36  -3.159   4.529  -1.304
  264   2HG1  ILE  36          1HG1      ILE  36  -1.819   5.581  -0.850
  265   1HG2  ILE  36          1HG2      ILE  36  -4.853   6.646  -0.913
  266   2HG2  ILE  36          2HG2      ILE  36  -5.623   6.085   0.571
  267   3HG2  ILE  36          3HG2      ILE  36  -5.161   4.925  -0.675
  268   1HD1  ILE  36          1HD1      ILE  36  -2.327   3.707   1.285
  269   2HD1  ILE  36          2HD1      ILE  36  -0.860   3.925   0.331
  270   3HD1  ILE  36          3HD1      ILE  36  -2.124   2.834  -0.239
  271    H    SER  37           H        SER  37  -2.537   5.949   3.027
  272    HA   SER  37           HA       SER  37   0.256   6.817   3.263
  273   1HB   SER  37          2HB       SER  37  -1.550   6.901   5.165
  274   2HB   SER  37          1HB       SER  37  -1.170   5.191   5.345
  275    HG   SER  37           HG       SER  37   0.115   6.892   6.549
  276    H    THR  38           H        THR  38   1.959   5.463   3.138
  277    HA   THR  38           HA       THR  38   1.760   2.986   1.817
  278    HB   THR  38           HB       THR  38   4.130   2.617   2.610
  279    HG1  THR  38           HG1      THR  38   3.965   5.230   3.648
  280   1HG2  THR  38          1HG2      THR  38   4.939   4.833   1.483
  281   2HG2  THR  38          2HG2      THR  38   3.220   5.116   1.212
  282   3HG2  THR  38          3HG2      THR  38   3.996   3.684   0.535
  283    H    LYS  39           H        LYS  39   2.002   3.776   5.261
  284    HA   LYS  39           HA       LYS  39   2.192   1.090   6.195
  285   1HB   LYS  39          2HB       LYS  39   1.692   2.042   8.399
  286   2HB   LYS  39          1HB       LYS  39   2.888   3.022   7.553
  287   1HG   LYS  39          2HG       LYS  39   1.430   4.783   7.226
  288   2HG   LYS  39          1HG       LYS  39   0.008   3.744   7.202
  289   1HD   LYS  39          2HD       LYS  39  -0.030   3.544   9.560
  290   2HD   LYS  39          1HD       LYS  39   1.625   4.131   9.719
  291   1HE   LYS  39          2HE       LYS  39  -0.414   5.929   8.460
  292   2HE   LYS  39          1HE       LYS  39  -0.423   5.739  10.212
  293   1HZ   LYS  39          1HZ       LYS  39   1.922   6.352  10.245
  294   2HZ   LYS  39          2HZ       LYS  39   0.977   7.581   9.550
  295   3HZ   LYS  39          3HZ       LYS  39   1.907   6.561   8.561
  296    H    GLU  40           H        GLU  40  -0.476   3.033   5.095
  297    HA   GLU  40           HA       GLU  40  -2.430   1.227   6.351
  298   1HB   GLU  40          2HB       GLU  40  -2.606   3.964   5.132
  299   2HB   GLU  40          1HB       GLU  40  -4.050   2.964   5.278
  300   1HG   GLU  40          2HG       GLU  40  -3.922   2.898   7.630
  301   2HG   GLU  40          1HG       GLU  40  -2.224   3.376   7.641
  302    H    LEU  41           H        LEU  41  -0.637   0.975   3.703
  303    HA   LEU  41           HA       LEU  41  -2.496   0.711   1.574
  304   1HB   LEU  41          2HB       LEU  41   0.231   0.580   1.781
  305   2HB   LEU  41          1HB       LEU  41  -0.186  -1.097   1.504
  306    HG   LEU  41           HG       LEU  41  -0.828   1.260  -0.273
  307   1HD1  LEU  41          1HD1      LEU  41   0.599   0.053  -1.876
  308   2HD1  LEU  41          2HD1      LEU  41   0.861  -1.225  -0.688
  309   3HD1  LEU  41          3HD1      LEU  41   1.485   0.398  -0.392
  310   1HD2  LEU  41          1HD2      LEU  41  -1.980  -0.282  -1.731
  311   2HD2  LEU  41          2HD2      LEU  41  -2.676  -0.471  -0.121
  312   3HD2  LEU  41          3HD2      LEU  41  -1.519  -1.657  -0.728
  313    H    GLY  42           H        GLY  42  -1.104  -1.638   3.858
  314   1HA   GLY  42          2HA       GLY  42  -2.358  -3.954   2.859
  315   2HA   GLY  42          1HA       GLY  42  -1.804  -3.735   4.516
  316    H    LYS  43           H        LYS  43  -3.657  -1.268   4.635
  317    HA   LYS  43           HA       LYS  43  -5.973  -2.699   5.634
  318   1HB   LYS  43          2HB       LYS  43  -5.001  -0.848   6.930
  319   2HB   LYS  43          1HB       LYS  43  -5.323   0.260   5.599
  320   1HG   LYS  43          2HG       LYS  43  -7.715  -1.226   6.303
  321   2HG   LYS  43          1HG       LYS  43  -7.058  -0.383   7.707
  322   1HD   LYS  43          2HD       LYS  43  -6.814   1.481   5.657
  323   2HD   LYS  43          1HD       LYS  43  -8.369   0.713   5.335
  324   1HE   LYS  43          2HE       LYS  43  -8.988   2.396   6.829
  325   2HE   LYS  43          1HE       LYS  43  -8.743   1.033   7.921
  326   1HZ   LYS  43          1HZ       LYS  43  -6.718   3.115   7.289
  327   2HZ   LYS  43          2HZ       LYS  43  -6.511   1.816   8.365
  328   3HZ   LYS  43          3HZ       LYS  43  -7.636   3.040   8.712
  329    H    VAL  44           H        VAL  44  -5.203  -0.391   3.030
  330    HA   VAL  44           HA       VAL  44  -7.925  -0.097   2.177
  331    HB   VAL  44           HB       VAL  44  -6.955   0.973   0.160
  332   1HG1  VAL  44          1HG1      VAL  44  -6.183   2.903   1.299
  333   2HG1  VAL  44          2HG1      VAL  44  -5.505   1.951   2.621
  334   3HG1  VAL  44          3HG1      VAL  44  -7.253   2.108   2.453
  335   1HG2  VAL  44          1HG2      VAL  44  -4.278   0.408   1.459
  336   2HG2  VAL  44          2HG2      VAL  44  -4.562   1.218  -0.080
  337   3HG2  VAL  44          3HG2      VAL  44  -4.905  -0.504   0.086
  338    H    MET  45           H        MET  45  -5.266  -2.248   1.281
  339    HA   MET  45           HA       MET  45  -6.360  -3.327  -1.076
  340   1HB   MET  45          2HB       MET  45  -4.643  -4.799   0.938
  341   2HB   MET  45          1HB       MET  45  -4.867  -5.211  -0.760
  342   1HG   MET  45          2HG       MET  45  -3.915  -2.452  -0.192
  343   2HG   MET  45          1HG       MET  45  -2.771  -3.757   0.112
  344   1HE   MET  45          1HE       MET  45  -5.205  -2.121  -1.988
  345   2HE   MET  45          2HE       MET  45  -5.631  -3.577  -2.887
  346   3HE   MET  45          3HE       MET  45  -4.710  -2.300  -3.680
  347    H    ARG  46           H        ARG  46  -7.075  -3.943   2.294
  348    HA   ARG  46           HA       ARG  46  -8.321  -6.444   2.121
  349   1HB   ARG  46          2HB       ARG  46  -8.700  -4.086   3.944
  350   2HB   ARG  46          1HB       ARG  46  -9.773  -5.480   4.062
  351   1HG   ARG  46          2HG       ARG  46  -7.800  -6.960   4.329
  352   2HG   ARG  46          1HG       ARG  46  -6.747  -5.546   4.265
  353   1HD   ARG  46          2HD       ARG  46  -7.071  -6.015   6.584
  354   2HD   ARG  46          1HD       ARG  46  -8.072  -4.613   6.222
  355    HE   ARG  46           HE       ARG  46  -9.571  -7.025   5.919
  356   1HH1  ARG  46          2HH1      ARG  46  -8.213  -4.877   8.315
  357   2HH1  ARG  46          1HH1      ARG  46  -9.398  -5.266   9.515
  358   1HH2  ARG  46          1HH2      ARG  46 -11.112  -7.518   7.503
  359   2HH2  ARG  46          2HH2      ARG  46 -11.036  -6.758   9.059
  360    H    MET  47           H        MET  47  -9.651  -3.187   1.615
  361    HA   MET  47           HA       MET  47 -12.333  -4.003   1.136
  362   1HB   MET  47          2HB       MET  47 -10.749  -1.517   0.685
  363   2HB   MET  47          1HB       MET  47 -12.259  -1.700  -0.208
  364   1HG   MET  47          2HG       MET  47 -13.077  -0.735   1.725
  365   2HG   MET  47          1HG       MET  47 -13.170  -2.433   2.188
  366   1HE   MET  47          1HE       MET  47 -13.354  -0.127   3.883
  367   2HE   MET  47          2HE       MET  47 -11.988   0.966   3.675
  368   3HE   MET  47          3HE       MET  47 -12.119   0.002   5.143
  369    H    LEU  48           H        LEU  48  -9.501  -3.647  -0.945
  370    HA   LEU  48           HA       LEU  48 -10.947  -3.957  -3.415
  371   1HB   LEU  48          2HB       LEU  48  -8.757  -2.812  -3.248
  372   2HB   LEU  48          1HB       LEU  48  -8.008  -4.335  -2.829
  373    HG   LEU  48           HG       LEU  48  -9.115  -5.051  -5.172
  374   1HD1  LEU  48          1HD1      LEU  48  -8.492  -2.095  -5.461
  375   2HD1  LEU  48          2HD1      LEU  48 -10.108  -2.798  -5.513
  376   3HD1  LEU  48          3HD1      LEU  48  -8.933  -3.195  -6.767
  377   1HD2  LEU  48          1HD2      LEU  48  -6.584  -3.414  -5.193
  378   2HD2  LEU  48          2HD2      LEU  48  -6.933  -4.917  -6.047
  379   3HD2  LEU  48          3HD2      LEU  48  -6.656  -4.935  -4.304
  380    H    GLY  49           H        GLY  49  -8.548  -6.081  -1.816
  381   1HA   GLY  49          2HA       GLY  49  -9.847  -8.430  -1.564
  382   2HA   GLY  49          1HA       GLY  49  -9.514  -8.396  -3.292
  383    H    GLN  50           H        GLN  50  -7.559  -7.294  -0.517
  384    HA   GLN  50           HA       GLN  50  -5.650  -9.460  -0.833
  385   1HB   GLN  50          2HB       GLN  50  -5.171  -6.760  -1.956
  386   2HB   GLN  50          1HB       GLN  50  -3.855  -7.430  -0.991
  387   1HG   GLN  50          2HG       GLN  50  -4.104  -9.564  -2.373
  388   2HG   GLN  50          1HG       GLN  50  -5.145  -8.632  -3.450
  389   1HE2  GLN  50          1HE2      GLN  50  -1.850  -9.324  -2.652
  390   2HE2  GLN  50          2HE2      GLN  50  -1.138  -8.178  -3.682
  391    H    ASN  51           H        ASN  51  -4.205  -9.618   0.929
  392    HA   ASN  51           HA       ASN  51  -4.194  -7.566   2.974
  393   1HB   ASN  51          2HB       ASN  51  -6.322  -9.062   3.269
  394   2HB   ASN  51          1HB       ASN  51  -5.181 -10.248   3.899
  395   1HD2  ASN  51          1HD2      ASN  51  -5.960 -10.035   6.114
  396   2HD2  ASN  51          2HD2      ASN  51  -5.672  -8.632   7.024
  397    HA   PRO  52           HA       PRO  52  -0.364 -10.091   2.939
  398   1HB   PRO  52          2HB       PRO  52   1.336  -7.969   2.664
  399   2HB   PRO  52          1HB       PRO  52   0.563  -8.782   1.297
  400   1HG   PRO  52          2HG       PRO  52  -0.004  -6.135   2.469
  401   2HG   PRO  52          1HG       PRO  52  -0.318  -6.731   0.834
  402   1HD   PRO  52          2HD       PRO  52  -2.210  -6.472   2.958
  403   2HD   PRO  52          1HD       PRO  52  -2.479  -7.234   1.372
  404    H    THR  53           H        THR  53   1.873  -9.194   4.181
  405    HA   THR  53           HA       THR  53   0.970  -8.658   6.942
  406    HB   THR  53           HB       THR  53   2.937  -9.753   7.699
  407    HG1  THR  53           HG1      THR  53   4.573 -10.336   6.117
  408   1HG2  THR  53          1HG2      THR  53   2.963 -11.904   6.448
  409   2HG2  THR  53          2HG2      THR  53   1.993 -11.146   5.184
  410   3HG2  THR  53          3HG2      THR  53   1.329 -11.346   6.807
  411    HA   PRO  54           HA       PRO  54   3.056  -4.774   7.013
  412   1HB   PRO  54          2HB       PRO  54   4.424  -4.802   9.390
  413   2HB   PRO  54          1HB       PRO  54   2.672  -4.587   9.257
  414   1HG   PRO  54          2HG       PRO  54   4.227  -6.987  10.078
  415   2HG   PRO  54          1HG       PRO  54   2.621  -6.451  10.597
  416   1HD   PRO  54          2HD       PRO  54   3.106  -8.484   8.750
  417   2HD   PRO  54          1HD       PRO  54   1.568  -7.605   8.913
  418    H    GLU  55           H        GLU  55   5.092  -7.580   7.576
  419    HA   GLU  55           HA       GLU  55   7.564  -6.178   6.949
  420   1HB   GLU  55          2HB       GLU  55   8.611  -8.414   7.134
  421   2HB   GLU  55          1HB       GLU  55   7.665  -8.007   8.562
  422   1HG   GLU  55          2HG       GLU  55   5.781  -9.353   7.699
  423   2HG   GLU  55          1HG       GLU  55   6.725  -9.757   6.266
  424    H    GLU  56           H        GLU  56   5.220  -8.253   5.337
  425    HA   GLU  56           HA       GLU  56   6.833  -8.712   2.996
  426   1HB   GLU  56          2HB       GLU  56   4.960 -10.217   3.808
  427   2HB   GLU  56          1HB       GLU  56   3.833  -8.997   3.216
  428   1HG   GLU  56          2HG       GLU  56   5.005  -9.167   0.967
  429   2HG   GLU  56          1HG       GLU  56   5.852 -10.578   1.606
  430    H    LEU  57           H        LEU  57   3.918  -6.734   3.651
  431    HA   LEU  57           HA       LEU  57   3.838  -5.497   1.112
  432   1HB   LEU  57          2HB       LEU  57   1.928  -4.705   1.907
  433   2HB   LEU  57          1HB       LEU  57   2.298  -5.440   3.446
  434    HG   LEU  57           HG       LEU  57   3.219  -2.649   2.742
  435   1HD1  LEU  57          1HD1      LEU  57   1.233  -1.762   3.722
  436   2HD1  LEU  57          2HD1      LEU  57   0.720  -3.350   4.292
  437   3HD1  LEU  57          3HD1      LEU  57   0.691  -2.980   2.568
  438   1HD2  LEU  57          1HD2      LEU  57   4.091  -2.681   4.826
  439   2HD2  LEU  57          2HD2      LEU  57   3.703  -4.400   4.905
  440   3HD2  LEU  57          3HD2      LEU  57   2.551  -3.209   5.507
  441    H    GLN  58           H        GLN  58   5.750  -4.805   3.965
  442    HA   GLN  58           HA       GLN  58   6.411  -2.131   3.575
  443   1HB   GLN  58          2HB       GLN  58   7.357  -4.228   5.204
  444   2HB   GLN  58          1HB       GLN  58   8.769  -3.596   4.358
  445   1HG   GLN  58          2HG       GLN  58   6.758  -1.923   5.896
  446   2HG   GLN  58          1HG       GLN  58   8.363  -2.372   6.472
  447   1HE2  GLN  58          1HE2      GLN  58   6.610  -0.260   4.250
  448   2HE2  GLN  58          2HE2      GLN  58   7.960   0.646   3.761
  449    H    GLU  59           H        GLU  59   7.860  -5.018   2.087
  450    HA   GLU  59           HA       GLU  59   9.930  -3.691   0.685
  451   1HB   GLU  59          2HB       GLU  59   8.635  -6.343   0.578
  452   2HB   GLU  59          1HB       GLU  59   9.348  -5.800  -0.940
  453   1HG   GLU  59          2HG       GLU  59  10.923  -5.504   1.598
  454   2HG   GLU  59          1HG       GLU  59  10.831  -7.086   0.821
  455    H    MET  60           H        MET  60   6.600  -4.518  -0.225
  456    HA   MET  60           HA       MET  60   6.682  -3.605  -2.888
  457   1HB   MET  60          2HB       MET  60   4.394  -3.769  -0.917
  458   2HB   MET  60          1HB       MET  60   4.186  -3.348  -2.617
  459   1HG   MET  60          2HG       MET  60   5.586  -5.548  -3.023
  460   2HG   MET  60          1HG       MET  60   5.024  -5.960  -1.403
  461   1HE   MET  60          1HE       MET  60   1.499  -6.570  -1.449
  462   2HE   MET  60          2HE       MET  60   1.844  -4.852  -1.261
  463   3HE   MET  60          3HE       MET  60   2.952  -6.044  -0.590
  464    H    ILE  61           H        ILE  61   6.022  -1.906   0.158
  465    HA   ILE  61           HA       ILE  61   5.092   0.533  -0.769
  466    HB   ILE  61           HB       ILE  61   6.904  -0.086   1.574
  467   1HG1  ILE  61          2HG1      ILE  61   4.817  -1.158   1.904
  468   2HG1  ILE  61          1HG1      ILE  61   4.681   0.350   2.798
  469   1HG2  ILE  61          1HG2      ILE  61   5.976   2.148   2.425
  470   2HG2  ILE  61          2HG2      ILE  61   5.536   2.471   0.747
  471   3HG2  ILE  61          3HG2      ILE  61   7.227   2.221   1.183
  472   1HD1  ILE  61          1HD1      ILE  61   2.649   0.152   1.566
  473   2HD1  ILE  61          2HD1      ILE  61   3.504  -0.324   0.099
  474   3HD1  ILE  61          3HD1      ILE  61   3.616   1.335   0.685
  475    H    ASP  62           H        ASP  62   8.468   0.082   0.282
  476    HA   ASP  62           HA       ASP  62   9.515   2.351  -0.969
  477   1HB   ASP  62          2HB       ASP  62  10.615   0.751   0.749
  478   2HB   ASP  62          1HB       ASP  62  11.137  -0.165  -0.664
  479    H    GLU  63           H        GLU  63   8.981  -0.896  -2.259
  480    HA   GLU  63           HA       GLU  63  10.536  -0.682  -4.604
  481   1HB   GLU  63          2HB       GLU  63   8.246  -2.393  -3.739
  482   2HB   GLU  63          1HB       GLU  63   8.690  -2.383  -5.447
  483   1HG   GLU  63          2HG       GLU  63  11.017  -2.946  -4.854
  484   2HG   GLU  63          1HG       GLU  63  10.584  -2.949  -3.145
  485    H    VAL  64           H        VAL  64   7.144   0.213  -3.980
  486    HA   VAL  64           HA       VAL  64   6.871   1.130  -6.755
  487    HB   VAL  64           HB       VAL  64   4.512   1.354  -6.310
  488   1HG1  VAL  64          1HG1      VAL  64   5.800  -0.986  -6.474
  489   2HG1  VAL  64          2HG1      VAL  64   4.055  -0.901  -6.240
  490   3HG1  VAL  64          3HG1      VAL  64   5.116  -1.183  -4.861
  491   1HG2  VAL  64          1HG2      VAL  64   4.555   2.260  -4.063
  492   2HG2  VAL  64          2HG2      VAL  64   5.293   0.786  -3.435
  493   3HG2  VAL  64          3HG2      VAL  64   3.632   0.757  -4.025
  494    H    ASP  65           H        ASP  65   7.458   2.468  -3.606
  495    HA   ASP  65           HA       ASP  65   6.334   5.050  -4.100
  496   1HB   ASP  65          2HB       ASP  65   7.297   3.822  -1.856
  497   2HB   ASP  65          1HB       ASP  65   8.612   4.933  -2.230
  498    H    GLU  66           H        GLU  66   7.068   5.565  -6.175
  499    HA   GLU  66           HA       GLU  66   9.795   5.717  -6.944
  500   1HB   GLU  66          2HB       GLU  66   7.263   6.952  -7.998
  501   2HB   GLU  66          1HB       GLU  66   8.830   7.394  -8.674
  502   1HG   GLU  66          2HG       GLU  66   8.159   4.487  -8.336
  503   2HG   GLU  66          1HG       GLU  66   7.473   5.373  -9.698
  504    H    ASP  67           H        ASP  67   7.667   7.945  -5.251
  505    HA   ASP  67           HA       ASP  67   9.470  10.201  -5.509
  506   1HB   ASP  67          2HB       ASP  67   7.159   9.922  -3.575
  507   2HB   ASP  67          1HB       ASP  67   7.915  11.410  -4.138
  508    H    GLY  68           H        GLY  68   8.539   7.891  -2.971
  509   1HA   GLY  68          2HA       GLY  68   9.758   7.126  -1.150
  510   2HA   GLY  68          1HA       GLY  68  11.103   8.143  -1.664
  511    H    SER  69           H        SER  69   7.794   9.226  -1.113
  512    HA   SER  69           HA       SER  69   8.750  11.192   0.821
  513   1HB   SER  69          2HB       SER  69   6.367  12.042   0.617
  514   2HB   SER  69          1HB       SER  69   7.322  12.096  -0.860
  515    HG   SER  69           HG       SER  69   5.919  10.800  -1.720
  516    H    GLY  70           H        GLY  70   6.093   8.815   0.607
  517   1HA   GLY  70          2HA       GLY  70   6.279   7.393   2.861
  518   2HA   GLY  70          1HA       GLY  70   5.684   8.922   3.499
  519    H    THR  71           H        THR  71   4.185   9.367   0.896
  520    HA   THR  71           HA       THR  71   1.834   7.724   1.581
  521    HB   THR  71           HB       THR  71   0.552   9.433   0.322
  522    HG1  THR  71           HG1      THR  71   1.757  11.339  -0.265
  523   1HG2  THR  71          1HG2      THR  71   0.927  11.301   1.917
  524   2HG2  THR  71          2HG2      THR  71   2.429  10.533   2.434
  525   3HG2  THR  71          3HG2      THR  71   0.883   9.735   2.729
  526    H    VAL  72           H        VAL  72   0.607   6.721  -0.076
  527    HA   VAL  72           HA       VAL  72   2.203   6.050  -2.467
  528    HB   VAL  72           HB       VAL  72  -0.247   4.639  -1.389
  529   1HG1  VAL  72          1HG1      VAL  72   1.849   3.605  -3.306
  530   2HG1  VAL  72          2HG1      VAL  72   0.415   4.462  -3.870
  531   3HG1  VAL  72          3HG1      VAL  72   0.245   2.946  -2.985
  532   1HG2  VAL  72          1HG2      VAL  72   1.450   2.904  -0.683
  533   2HG2  VAL  72          2HG2      VAL  72   1.525   4.409   0.235
  534   3HG2  VAL  72          3HG2      VAL  72   2.712   4.088  -1.030
  535    H    ASP  73           H        ASP  73   1.695   7.102  -4.265
  536    HA   ASP  73           HA       ASP  73  -0.896   8.410  -4.539
  537   1HB   ASP  73          2HB       ASP  73   1.455   8.301  -6.451
  538   2HB   ASP  73          1HB       ASP  73   0.030   9.324  -6.628
  539    H    PHE  74           H        PHE  74  -1.868   8.212  -6.875
  540    HA   PHE  74           HA       PHE  74  -2.831   5.567  -7.152
  541   1HB   PHE  74          2HB       PHE  74  -3.958   7.735  -7.925
  542   2HB   PHE  74          1HB       PHE  74  -2.915   7.645  -9.342
  543    HD1  PHE  74           HD1      PHE  74  -4.572   7.229 -11.008
  544    HD2  PHE  74           HD2      PHE  74  -4.340   4.720  -7.529
  545    HE1  PHE  74           HE1      PHE  74  -6.138   5.624 -12.061
  546    HE2  PHE  74           HE2      PHE  74  -5.896   3.112  -8.587
  547    HZ   PHE  74           HZ       PHE  74  -6.795   3.561 -10.853
  548    H    ASP  75           H        ASP  75  -0.208   7.324  -8.734
  549    HA   ASP  75           HA       ASP  75   0.282   5.409 -10.792
  550   1HB   ASP  75          2HB       ASP  75   1.780   7.718  -9.620
  551   2HB   ASP  75          1HB       ASP  75   2.669   6.549 -10.595
  552    H    GLU  76           H        GLU  76   1.482   5.858  -7.491
  553    HA   GLU  76           HA       GLU  76   3.384   3.681  -7.649
  554   1HB   GLU  76          2HB       GLU  76   2.343   4.829  -5.070
  555   2HB   GLU  76          1HB       GLU  76   3.942   4.181  -5.427
  556   1HG   GLU  76          2HG       GLU  76   4.268   6.124  -7.022
  557   2HG   GLU  76          1HG       GLU  76   2.766   6.802  -6.392
  558    H    PHE  77           H        PHE  77   0.034   4.061  -6.938
  559    HA   PHE  77           HA       PHE  77  -0.315   1.662  -5.390
  560   1HB   PHE  77          2HB       PHE  77  -1.839   3.574  -5.160
  561   2HB   PHE  77          1HB       PHE  77  -2.309   3.419  -6.849
  562    HD1  PHE  77           HD1      PHE  77  -2.329   1.643  -3.559
  563    HD2  PHE  77           HD2      PHE  77  -3.989   1.904  -7.519
  564    HE1  PHE  77           HE1      PHE  77  -4.088   0.008  -2.934
  565    HE2  PHE  77           HE2      PHE  77  -5.747   0.269  -6.889
  566    HZ   PHE  77           HZ       PHE  77  -5.796  -0.676  -4.597
  567    H    LEU  78           H        LEU  78  -0.824   2.591  -8.795
  568    HA   LEU  78           HA       LEU  78  -1.893   0.028  -9.550
  569   1HB   LEU  78          2HB       LEU  78  -0.904   2.398 -11.107
  570   2HB   LEU  78          1HB       LEU  78  -1.453   0.929 -11.888
  571    HG   LEU  78           HG       LEU  78  -3.340   2.043  -9.916
  572   1HD1  LEU  78          1HD1      LEU  78  -2.290   3.638 -12.212
  573   2HD1  LEU  78          2HD1      LEU  78  -2.891   4.179 -10.647
  574   3HD1  LEU  78          3HD1      LEU  78  -4.024   3.682 -11.903
  575   1HD2  LEU  78          1HD2      LEU  78  -3.624   0.127 -11.639
  576   2HD2  LEU  78          2HD2      LEU  78  -3.775   1.413 -12.837
  577   3HD2  LEU  78          3HD2      LEU  78  -4.929   1.307 -11.508
  578    H    VAL  79           H        VAL  79   1.310   1.542  -9.713
  579    HA   VAL  79           HA       VAL  79   2.566  -0.302 -11.405
  580    HB   VAL  79           HB       VAL  79   4.693   0.321 -10.205
  581   1HG1  VAL  79          1HG1      VAL  79   2.785   2.303 -11.411
  582   2HG1  VAL  79          2HG1      VAL  79   4.250   1.608 -12.102
  583   3HG1  VAL  79          3HG1      VAL  79   4.368   2.838 -10.844
  584   1HG2  VAL  79          1HG2      VAL  79   3.794   0.762  -7.988
  585   2HG2  VAL  79          2HG2      VAL  79   2.752   2.030  -8.627
  586   3HG2  VAL  79          3HG2      VAL  79   4.501   2.247  -8.621
  587    H    MET  80           H        MET  80   1.691  -0.575  -8.034
  588    HA   MET  80           HA       MET  80   3.328  -2.510  -7.017
  589   1HB   MET  80          2HB       MET  80   0.486  -1.809  -6.647
  590   2HB   MET  80          1HB       MET  80   0.924  -3.440  -6.136
  591   1HG   MET  80          2HG       MET  80   2.926  -2.297  -4.942
  592   2HG   MET  80          1HG       MET  80   2.009  -0.806  -5.149
  593   1HE   MET  80          1HE       MET  80  -0.162  -0.187  -3.910
  594   2HE   MET  80          2HE       MET  80  -1.282  -1.409  -3.315
  595   3HE   MET  80          3HE       MET  80  -0.821  -1.401  -5.015
  596    H    MET  81           H        MET  81   0.794  -2.999  -9.442
  597    HA   MET  81           HA       MET  81   1.010  -5.887  -9.359
  598   1HB   MET  81          2HB       MET  81  -0.466  -3.952 -11.136
  599   2HB   MET  81          1HB       MET  81  -0.406  -5.677 -11.497
  600   1HG   MET  81          2HG       MET  81  -1.243  -4.653  -8.781
  601   2HG   MET  81          1HG       MET  81  -2.401  -4.854 -10.095
  602   1HE   MET  81          1HE       MET  81  -1.661  -5.969  -7.156
  603   2HE   MET  81          2HE       MET  81  -1.857  -7.717  -7.076
  604   3HE   MET  81          3HE       MET  81  -3.202  -6.711  -7.607
  605    H    VAL  82           H        VAL  82   1.951  -3.344 -11.685
  606    HA   VAL  82           HA       VAL  82   3.214  -5.180 -13.490
  607    HB   VAL  82           HB       VAL  82   4.136  -3.108 -14.566
  608   1HG1  VAL  82          1HG1      VAL  82   2.167  -2.865 -15.672
  609   2HG1  VAL  82          2HG1      VAL  82   1.279  -2.472 -14.200
  610   3HG1  VAL  82          3HG1      VAL  82   1.606  -4.156 -14.610
  611   1HG2  VAL  82          1HG2      VAL  82   4.183  -1.815 -12.370
  612   2HG2  VAL  82          2HG2      VAL  82   2.434  -1.648 -12.534
  613   3HG2  VAL  82          3HG2      VAL  82   3.505  -0.947 -13.746
  614    H    ARG  83           H        ARG  83   4.372  -3.330 -10.727
  615    HA   ARG  83           HA       ARG  83   7.145  -3.433 -11.336
  616   1HB   ARG  83          2HB       ARG  83   7.518  -2.955  -8.959
  617   2HB   ARG  83          1HB       ARG  83   6.251  -1.921  -9.614
  618   1HG   ARG  83          2HG       ARG  83   5.081  -2.612  -7.784
  619   2HG   ARG  83          1HG       ARG  83   4.771  -4.046  -8.760
  620   1HD   ARG  83          2HD       ARG  83   7.231  -4.626  -7.687
  621   2HD   ARG  83          1HD       ARG  83   6.476  -3.723  -6.378
  622    HE   ARG  83           HE       ARG  83   4.667  -5.676  -7.387
  623   1HH1  ARG  83          2HH1      ARG  83   7.585  -5.343  -5.503
  624   2HH1  ARG  83          1HH1      ARG  83   7.293  -6.766  -4.565
  625   1HH2  ARG  83          1HH2      ARG  83   4.300  -7.536  -6.146
  626   2HH2  ARG  83          2HH2      ARG  83   5.438  -8.007  -4.927
  627    H    CYS  84           H        CYS  84   4.932  -5.839 -10.176
  628    HA   CYS  84           HA       CYS  84   6.829  -7.559  -8.906
  629   1HB   CYS  84          2HB       CYS  84   4.218  -7.597  -8.784
  630   2HB   CYS  84          1HB       CYS  84   4.337  -8.578 -10.245
  631    HG   CYS  84           HG       CYS  84   4.939  -9.552  -7.456
  632    H    MET  85           H        MET  85   5.750  -7.063 -12.206
  633    HA   MET  85           HA       MET  85   7.441  -9.293 -13.144
  634   1HB   MET  85          2HB       MET  85   5.119  -7.804 -14.364
  635   2HB   MET  85          1HB       MET  85   6.207  -8.782 -15.350
  636   1HG   MET  85          2HG       MET  85   5.631 -10.777 -14.209
  637   2HG   MET  85          1HG       MET  85   4.903  -9.896 -12.866
  638   1HE   MET  85          1HE       MET  85   2.135  -9.454 -12.827
  639   2HE   MET  85          2HE       MET  85   1.765  -8.365 -14.162
  640   3HE   MET  85          3HE       MET  85   3.243  -8.135 -13.231
  641    H    LYS  86           H        LYS  86   9.141  -7.566 -12.405
  642    HA   LYS  86           HA       LYS  86   9.663  -5.632 -14.568
  643   1HB   LYS  86          2HB       LYS  86  11.292  -4.619 -13.003
  644   2HB   LYS  86          1HB       LYS  86   9.669  -4.676 -12.320
  645   1HG   LYS  86          2HG       LYS  86  10.250  -6.204 -10.716
  646   2HG   LYS  86          1HG       LYS  86  11.378  -7.045 -11.777
  647   1HD   LYS  86          2HD       LYS  86  12.751  -6.005 -10.143
  648   2HD   LYS  86          1HD       LYS  86  12.873  -4.964 -11.561
  649   1HE   LYS  86          2HE       LYS  86  11.593  -3.282 -10.612
  650   2HE   LYS  86          1HE       LYS  86  10.702  -4.400  -9.581
  651   1HZ   LYS  86          1HZ       LYS  86  12.612  -4.655  -8.186
  652   2HZ   LYS  86          2HZ       LYS  86  12.296  -2.995  -8.360
  653   3HZ   LYS  86          3HZ       LYS  86  13.570  -3.715  -9.224
  654    H    ASP  87           H        ASP  87  10.084  -8.326 -15.201
  655    HA   ASP  87           HA       ASP  87  11.644  -9.733 -16.130
  656   1HB   ASP  87          2HB       ASP  87  12.395  -7.185 -16.849
  657   2HB   ASP  87          1HB       ASP  87  13.868  -7.810 -16.105
  658    H    ASP  88           H        ASP  88  11.487  -9.453 -13.164
  659    HA   ASP  88           HA       ASP  88  12.570 -10.234 -11.296
  660   1HB   ASP  88          2HB       ASP  88  13.250 -11.963 -13.365
  661   2HB   ASP  88          1HB       ASP  88  14.807 -11.543 -12.653
  662    H    SER  89           HN       SER  89  15.422 -10.698 -10.959
  663    HA   SER  89           HA       SER  89  17.413  -9.613 -10.580
  664   1HB   SER  89          2HB       SER  89  16.859  -8.617 -12.973
  665   2HB   SER  89          1HB       SER  89  16.558  -7.149 -12.048
  666    HG   SER  89           HG       SER  89  18.782  -7.529 -12.801
  Start of MODEL   25
    1   1H    MET   1          1H        MET   1  16.481   2.442 -17.660
    2   2H    MET   1          2H        MET   1  15.644   1.166 -18.405
    3   3H    MET   1          3H        MET   1  16.064   1.067 -16.762
    4    HA   MET   1           HA       MET   1  14.596   2.938 -16.261
    5   1HB   MET   1          2HB       MET   1  14.589   3.058 -19.176
    6   2HB   MET   1          1HB       MET   1  12.951   3.027 -18.524
    7   1HG   MET   1          2HG       MET   1  13.516   5.325 -18.546
    8   2HG   MET   1          1HG       MET   1  13.773   4.836 -16.872
    9   1HE   MET   1          1HE       MET   1  14.804   6.060 -19.995
   10   2HE   MET   1          2HE       MET   1  16.144   4.982 -20.373
   11   3HE   MET   1          3HE       MET   1  16.472   6.630 -19.846
   12    H    ASN   2           H        ASN   2  12.218   2.608 -15.991
   13    HA   ASN   2           HA       ASN   2  11.661  -0.206 -15.608
   14   1HB   ASN   2          2HB       ASN   2  10.358   2.360 -14.838
   15   2HB   ASN   2          1HB       ASN   2   9.329   0.932 -14.949
   16   1HD2  ASN   2          1HD2      ASN   2  10.590  -1.130 -13.872
   17   2HD2  ASN   2          2HD2      ASN   2  11.231  -0.802 -12.336
   18    H    ASP   3           H        ASP   3  10.979  -1.438 -17.220
   19    HA   ASP   3           HA       ASP   3   8.931  -0.358 -19.063
   20   1HB   ASP   3          2HB       ASP   3  11.303  -2.077 -19.828
   21   2HB   ASP   3          1HB       ASP   3   9.988  -1.619 -20.910
   22    H    ILE   4           H        ILE   4   9.206  -2.396 -16.626
   23    HA   ILE   4           HA       ILE   4   8.106  -4.784 -17.895
   24    HB   ILE   4           HB       ILE   4   8.192  -5.830 -15.751
   25   1HG1  ILE   4          2HG1      ILE   4   9.061  -4.262 -13.789
   26   2HG1  ILE   4          1HG1      ILE   4   8.272  -3.003 -14.741
   27   1HG2  ILE   4          1HG2      ILE   4  10.545  -5.476 -15.120
   28   2HG2  ILE   4          2HG2      ILE   4  10.570  -3.972 -16.037
   29   3HG2  ILE   4          3HG2      ILE   4  10.360  -5.511 -16.872
   30   1HD1  ILE   4          1HD1      ILE   4   6.878  -4.256 -12.937
   31   2HD1  ILE   4          2HD1      ILE   4   6.838  -5.572 -14.110
   32   3HD1  ILE   4          3HD1      ILE   4   6.156  -4.000 -14.525
   33    H    TYR   5           H        TYR   5   7.016  -1.914 -16.271
   34    HA   TYR   5           HA       TYR   5   4.433  -2.794 -15.471
   35   1HB   TYR   5          2HB       TYR   5   5.142   0.022 -16.320
   36   2HB   TYR   5          1HB       TYR   5   3.885  -0.481 -15.197
   37    HD1  TYR   5           HD1      TYR   5   5.357  -2.496 -13.563
   38    HD2  TYR   5           HD2      TYR   5   6.579   1.356 -15.010
   39    HE1  TYR   5           HE1      TYR   5   6.958  -2.301 -11.689
   40    HE2  TYR   5           HE2      TYR   5   8.177   1.550 -13.132
   41    HH   TYR   5           HH       TYR   5   9.153  -1.007 -11.265
   42    H    LYS   6           H        LYS   6   5.802  -1.638 -18.474
   43    HA   LYS   6           HA       LYS   6   3.257  -1.299 -19.821
   44   1HB   LYS   6          2HB       LYS   6   5.936  -1.569 -21.185
   45   2HB   LYS   6          1HB       LYS   6   4.506  -0.705 -21.744
   46   1HG   LYS   6          2HG       LYS   6   6.389   0.066 -19.504
   47   2HG   LYS   6          1HG       LYS   6   6.008   0.979 -20.962
   48   1HD   LYS   6          2HD       LYS   6   3.762   1.413 -20.193
   49   2HD   LYS   6          1HD       LYS   6   3.960   0.305 -18.833
   50   1HE   LYS   6          2HE       LYS   6   5.175   1.809 -17.608
   51   2HE   LYS   6          1HE       LYS   6   5.966   2.488 -19.029
   52   1HZ   LYS   6          1HZ       LYS   6   4.412   4.043 -17.973
   53   2HZ   LYS   6          2HZ       LYS   6   3.132   2.967 -18.274
   54   3HZ   LYS   6          3HZ       LYS   6   3.968   3.683 -19.570
   55    H    ALA   7           H        ALA   7   5.804  -3.718 -19.621
   56    HA   ALA   7           HA       ALA   7   4.718  -5.459 -21.631
   57   1HB   ALA   7          1HB       ALA   7   6.989  -5.842 -21.248
   58   2HB   ALA   7          2HB       ALA   7   6.233  -7.166 -20.360
   59   3HB   ALA   7          3HB       ALA   7   6.811  -5.741 -19.496
   60    H    ALA   8           H        ALA   8   4.230  -5.031 -18.183
   61    HA   ALA   8           HA       ALA   8   2.756  -7.520 -17.882
   62   1HB   ALA   8          1HB       ALA   8   3.287  -5.240 -15.967
   63   2HB   ALA   8          2HB       ALA   8   4.100  -6.805 -16.006
   64   3HB   ALA   8          3HB       ALA   8   2.401  -6.706 -15.547
   65    H    VAL   9           H        VAL   9   2.046  -4.148 -18.527
   66    HA   VAL   9           HA       VAL   9  -0.586  -3.991 -17.578
   67    HB   VAL   9           HB       VAL   9   0.908  -2.132 -18.589
   68   1HG1  VAL   9          1HG1      VAL   9   0.909  -1.774 -20.867
   69   2HG1  VAL   9          2HG1      VAL   9  -0.637  -2.585 -21.104
   70   3HG1  VAL   9          3HG1      VAL   9   0.828  -3.534 -20.861
   71   1HG2  VAL   9          1HG2      VAL   9  -2.026  -2.224 -19.348
   72   2HG2  VAL   9          2HG2      VAL   9  -1.058  -0.782 -19.043
   73   3HG2  VAL   9          3HG2      VAL   9  -1.433  -1.887 -17.721
   74    H    GLU  10           H        GLU  10   0.684  -5.513 -20.479
   75    HA   GLU  10           HA       GLU  10  -1.799  -5.822 -21.850
   76   1HB   GLU  10          2HB       GLU  10   0.873  -7.198 -22.064
   77   2HB   GLU  10          1HB       GLU  10  -0.509  -7.712 -23.030
   78   1HG   GLU  10          2HG       GLU  10  -0.737  -5.435 -23.939
   79   2HG   GLU  10          1HG       GLU  10   0.632  -4.903 -22.962
   80    H    GLN  11           H        GLN  11  -0.281  -7.545 -19.227
   81    HA   GLN  11           HA       GLN  11  -1.843  -9.958 -19.534
   82   1HB   GLN  11          2HB       GLN  11  -0.275  -9.009 -17.123
   83   2HB   GLN  11          1HB       GLN  11  -0.858 -10.646 -17.418
   84   1HG   GLN  11          2HG       GLN  11   1.070  -9.202 -19.260
   85   2HG   GLN  11          1HG       GLN  11   1.584 -10.292 -17.974
   86   1HE2  GLN  11          1HE2      GLN  11   0.955 -10.246 -21.248
   87   2HE2  GLN  11          2HE2      GLN  11   0.549 -11.879 -21.471
   88    H    LEU  12           H        LEU  12  -1.955  -7.042 -17.536
   89    HA   LEU  12           HA       LEU  12  -4.236  -7.919 -15.999
   90   1HB   LEU  12          2HB       LEU  12  -3.213  -5.104 -16.301
   91   2HB   LEU  12          1HB       LEU  12  -4.184  -5.754 -15.001
   92    HG   LEU  12           HG       LEU  12  -1.680  -7.203 -15.250
   93   1HD1  LEU  12          1HD1      LEU  12  -0.274  -5.274 -14.433
   94   2HD1  LEU  12          2HD1      LEU  12  -1.586  -4.196 -14.908
   95   3HD1  LEU  12          3HD1      LEU  12  -0.752  -5.161 -16.126
   96   1HD2  LEU  12          1HD2      LEU  12  -1.740  -5.831 -12.831
   97   2HD2  LEU  12          2HD2      LEU  12  -2.406  -7.438 -13.118
   98   3HD2  LEU  12          3HD2      LEU  12  -3.445  -6.019 -13.235
   99    H    THR  13           H        THR  13  -6.128  -6.203 -15.886
  100    HA   THR  13           HA       THR  13  -7.015  -5.645 -18.661
  101    HB   THR  13           HB       THR  13  -9.375  -5.954 -17.447
  102    HG1  THR  13           HG1      THR  13  -9.241  -7.005 -15.653
  103   1HG2  THR  13          1HG2      THR  13  -8.807  -7.177 -19.414
  104   2HG2  THR  13          2HG2      THR  13  -9.273  -8.374 -18.205
  105   3HG2  THR  13          3HG2      THR  13  -7.567  -8.100 -18.565
  106    H    ASP  14           H        ASP  14  -8.824  -4.031 -18.732
  107    HA   ASP  14           HA       ASP  14  -8.031  -1.598 -17.504
  108   1HB   ASP  14          2HB       ASP  14  -9.452  -2.027 -19.669
  109   2HB   ASP  14          1HB       ASP  14 -10.814  -2.010 -18.547
  110    H    GLU  15           H        GLU  15 -10.349  -4.089 -16.653
  111    HA   GLU  15           HA       GLU  15 -11.923  -2.732 -14.776
  112   1HB   GLU  15          2HB       GLU  15 -11.081  -5.628 -14.948
  113   2HB   GLU  15          1HB       GLU  15 -12.227  -5.030 -13.749
  114   1HG   GLU  15          2HG       GLU  15 -13.890  -4.749 -15.283
  115   2HG   GLU  15          1HG       GLU  15 -12.779  -4.194 -16.534
  116    H    GLN  16           H        GLN  16  -8.758  -4.335 -14.400
  117    HA   GLN  16           HA       GLN  16  -8.618  -4.156 -11.585
  118   1HB   GLN  16          2HB       GLN  16  -6.387  -4.793 -11.749
  119   2HB   GLN  16          1HB       GLN  16  -7.056  -5.435 -13.244
  120   1HG   GLN  16          2HG       GLN  16  -5.279  -4.358 -14.185
  121   2HG   GLN  16          1HG       GLN  16  -6.329  -2.950 -14.078
  122   1HE2  GLN  16          1HE2      GLN  16  -4.061  -4.747 -11.899
  123   2HE2  GLN  16          2HE2      GLN  16  -3.376  -3.347 -11.232
  124    H    LYS  17           H        LYS  17  -7.882  -1.827 -14.130
  125    HA   LYS  17           HA       LYS  17  -6.692   0.116 -12.361
  126   1HB   LYS  17          2HB       LYS  17  -7.512   0.051 -15.228
  127   2HB   LYS  17          1HB       LYS  17  -7.387   1.629 -14.450
  128   1HG   LYS  17          2HG       LYS  17  -5.174   1.492 -14.922
  129   2HG   LYS  17          1HG       LYS  17  -5.100   0.359 -13.572
  130   1HD   LYS  17          2HD       LYS  17  -4.140  -0.915 -15.265
  131   2HD   LYS  17          1HD       LYS  17  -5.831  -1.398 -15.402
  132   1HE   LYS  17          2HE       LYS  17  -6.147  -0.244 -17.370
  133   2HE   LYS  17          1HE       LYS  17  -4.976   1.005 -16.948
  134   1HZ   LYS  17          1HZ       LYS  17  -4.324  -1.779 -17.754
  135   2HZ   LYS  17          2HZ       LYS  17  -3.195  -0.578 -17.341
  136   3HZ   LYS  17          3HZ       LYS  17  -4.157  -0.402 -18.729
  137    H    ASN  18           H        ASN  18  -9.897  -0.534 -13.685
  138    HA   ASN  18           HA       ASN  18 -11.199   1.837 -12.870
  139   1HB   ASN  18          2HB       ASN  18 -11.979  -0.811 -13.849
  140   2HB   ASN  18          1HB       ASN  18 -13.127  -0.151 -12.684
  141   1HD2  ASN  18          1HD2      ASN  18 -11.657   0.380 -15.867
  142   2HD2  ASN  18          2HD2      ASN  18 -12.732   1.602 -16.349
  143    H    GLU  19           H        GLU  19 -10.658  -1.272 -11.248
  144    HA   GLU  19           HA       GLU  19 -12.112  -0.615  -8.862
  145   1HB   GLU  19          2HB       GLU  19  -9.925  -2.681  -9.258
  146   2HB   GLU  19          1HB       GLU  19 -11.054  -2.606  -7.905
  147   1HG   GLU  19          2HG       GLU  19 -12.125  -2.715 -10.707
  148   2HG   GLU  19          1HG       GLU  19 -11.561  -4.199  -9.940
  149    H    PHE  20           H        PHE  20  -8.735  -0.466  -9.882
  150    HA   PHE  20           HA       PHE  20  -7.565   0.233  -7.416
  151   1HB   PHE  20          2HB       PHE  20  -6.781   0.558 -10.287
  152   2HB   PHE  20          1HB       PHE  20  -5.866   1.420  -9.055
  153    HD1  PHE  20           HD1      PHE  20  -3.868   0.070  -9.627
  154    HD2  PHE  20           HD2      PHE  20  -7.462  -1.747  -8.137
  155    HE1  PHE  20           HE1      PHE  20  -2.610  -1.994  -9.111
  156    HE2  PHE  20           HE2      PHE  20  -6.203  -3.813  -7.622
  157    HZ   PHE  20           HZ       PHE  20  -3.778  -3.940  -8.104
  158    H    LYS  21           H        LYS  21  -8.926   2.242 -10.022
  159    HA   LYS  21           HA       LYS  21  -8.234   4.747  -8.889
  160   1HB   LYS  21          2HB       LYS  21  -9.231   4.082 -11.277
  161   2HB   LYS  21          1HB       LYS  21 -10.741   4.524 -10.480
  162   1HG   LYS  21          2HG       LYS  21  -8.291   6.291 -10.402
  163   2HG   LYS  21          1HG       LYS  21  -9.512   6.426 -11.667
  164   1HD   LYS  21          2HD       LYS  21 -11.179   6.536  -9.630
  165   2HD   LYS  21          1HD       LYS  21  -9.735   7.018  -8.738
  166   1HE   LYS  21          2HE       LYS  21  -9.650   8.520 -11.108
  167   2HE   LYS  21          1HE       LYS  21 -11.338   8.570 -10.599
  168   1HZ   LYS  21          1HZ       LYS  21 -10.682   9.347  -8.449
  169   2HZ   LYS  21          2HZ       LYS  21  -9.958  10.345  -9.618
  170   3HZ   LYS  21          3HZ       LYS  21  -9.036   9.163  -8.818
  171    H    ALA  22           H        ALA  22 -11.231   2.823  -8.748
  172    HA   ALA  22           HA       ALA  22 -12.692   4.588  -7.098
  173   1HB   ALA  22          1HB       ALA  22 -13.950   2.459  -6.433
  174   2HB   ALA  22          2HB       ALA  22 -12.861   1.604  -7.525
  175   3HB   ALA  22          3HB       ALA  22 -13.931   2.859  -8.151
  176    H    ALA  23           H        ALA  23 -10.572   1.838  -6.319
  177    HA   ALA  23           HA       ALA  23 -10.892   1.902  -3.507
  178   1HB   ALA  23          1HB       ALA  23  -9.877  -0.049  -4.331
  179   2HB   ALA  23          2HB       ALA  23  -8.540   0.813  -3.570
  180   3HB   ALA  23          3HB       ALA  23  -8.731   0.852  -5.324
  181    H    PHE  24           H        PHE  24  -8.956   3.798  -5.718
  182    HA   PHE  24           HA       PHE  24  -7.275   4.948  -3.657
  183   1HB   PHE  24          2HB       PHE  24  -6.756   4.606  -6.213
  184   2HB   PHE  24          1HB       PHE  24  -7.611   6.135  -6.397
  185    HD1  PHE  24           HD1      PHE  24  -4.660   4.474  -4.921
  186    HD2  PHE  24           HD2      PHE  24  -6.680   8.217  -5.541
  187    HE1  PHE  24           HE1      PHE  24  -2.619   5.694  -4.215
  188    HE2  PHE  24           HE2      PHE  24  -4.640   9.435  -4.835
  189    HZ   PHE  24           HZ       PHE  24  -2.610   8.174  -4.174
  190    H    ASP  25           H        ASP  25  -9.753   6.217  -5.903
  191    HA   ASP  25           HA       ASP  25  -9.994   8.787  -4.926
  192   1HB   ASP  25          2HB       ASP  25 -11.150   7.717  -6.949
  193   2HB   ASP  25          1HB       ASP  25 -12.400   7.205  -5.815
  194    H    ILE  26           H        ILE  26 -11.664   5.874  -3.678
  195    HA   ILE  26           HA       ILE  26 -13.402   7.162  -1.895
  196    HB   ILE  26           HB       ILE  26 -13.377   5.042  -0.584
  197   1HG1  ILE  26          2HG1      ILE  26 -11.254   4.252  -2.606
  198   2HG1  ILE  26          1HG1      ILE  26 -10.992   4.485  -0.881
  199   1HG2  ILE  26          1HG2      ILE  26 -14.961   4.805  -2.216
  200   2HG2  ILE  26          2HG2      ILE  26 -13.819   3.623  -2.854
  201   3HG2  ILE  26          3HG2      ILE  26 -13.848   5.260  -3.507
  202   1HD1  ILE  26          1HD1      ILE  26 -12.603   2.331  -2.248
  203   2HD1  ILE  26          2HD1      ILE  26 -12.816   2.702  -0.537
  204   3HD1  ILE  26          3HD1      ILE  26 -11.253   2.143  -1.130
  205    H    PHE  27           H        PHE  27  -9.998   6.283  -1.526
  206    HA   PHE  27           HA       PHE  27  -9.881   7.143   1.242
  207   1HB   PHE  27          2HB       PHE  27  -7.923   6.065  -0.745
  208   2HB   PHE  27          1HB       PHE  27  -7.306   6.966   0.638
  209    HD1  PHE  27           HD1      PHE  27  -7.479   6.097   2.893
  210    HD2  PHE  27           HD2      PHE  27  -9.215   3.979  -0.416
  211    HE1  PHE  27           HE1      PHE  27  -7.795   4.102   4.333
  212    HE2  PHE  27           HE2      PHE  27  -9.531   1.984   1.022
  213    HZ   PHE  27           HZ       PHE  27  -8.821   2.047   3.398
  214    H    ILE  28           H        ILE  28  -9.247   8.495  -1.939
  215    HA   ILE  28           HA       ILE  28  -8.042  10.918  -0.803
  216    HB   ILE  28           HB       ILE  28  -8.605  10.415  -3.726
  217   1HG1  ILE  28          2HG1      ILE  28  -7.317   8.514  -3.250
  218   2HG1  ILE  28          1HG1      ILE  28  -6.104   9.701  -3.703
  219   1HG2  ILE  28          1HG2      ILE  28  -6.339  11.769  -3.723
  220   2HG2  ILE  28          2HG2      ILE  28  -6.879  12.257  -2.115
  221   3HG2  ILE  28          3HG2      ILE  28  -7.879  12.608  -3.525
  222   1HD1  ILE  28          1HD1      ILE  28  -6.742   8.592  -0.996
  223   2HD1  ILE  28          2HD1      ILE  28  -6.117  10.238  -1.109
  224   3HD1  ILE  28          3HD1      ILE  28  -5.171   8.890  -1.742
  225    H    GLN  29           H        GLN  29 -10.814  10.346  -0.204
  226    HA   GLN  29           HA       GLN  29 -12.558  11.876  -1.863
  227   1HB   GLN  29          2HB       GLN  29 -14.087  11.834   0.152
  228   2HB   GLN  29          1HB       GLN  29 -13.570  10.249  -0.419
  229   1HG   GLN  29          2HG       GLN  29 -12.038   9.977   1.366
  230   2HG   GLN  29          1HG       GLN  29 -12.060  11.696   1.761
  231   1HE2  GLN  29          1HE2      GLN  29 -13.071  11.893   3.768
  232   2HE2  GLN  29          2HE2      GLN  29 -14.515  11.114   4.202
  233    H    ASP  30           H        ASP  30 -10.507  12.630   0.892
  234    HA   ASP  30           HA       ASP  30 -10.724  15.464   0.317
  235   1HB   ASP  30          2HB       ASP  30 -12.525  14.513   2.145
  236   2HB   ASP  30          1HB       ASP  30 -11.172  14.947   3.187
  237    H    ALA  31           H        ALA  31  -8.570  13.732   0.033
  238    HA   ALA  31           HA       ALA  31  -6.840  13.704   2.307
  239   1HB   ALA  31          1HB       ALA  31  -6.531  12.110   0.485
  240   2HB   ALA  31          2HB       ALA  31  -5.082  13.098   0.667
  241   3HB   ALA  31          3HB       ALA  31  -6.216  13.428  -0.643
  242    H    GLU  32           H        GLU  32  -4.956  14.933   2.668
  243    HA   GLU  32           HA       GLU  32  -5.240  17.731   2.199
  244   1HB   GLU  32          2HB       GLU  32  -3.036  16.050   3.380
  245   2HB   GLU  32          1HB       GLU  32  -2.854  17.791   3.158
  246   1HG   GLU  32          2HG       GLU  32  -4.690  18.268   4.607
  247   2HG   GLU  32          1HG       GLU  32  -5.219  16.586   4.606
  248    H    ASP  33           H        ASP  33  -2.906  15.327   0.989
  249    HA   ASP  33           HA       ASP  33  -1.974  17.263  -1.020
  250   1HB   ASP  33          2HB       ASP  33  -0.123  15.730  -1.418
  251   2HB   ASP  33          1HB       ASP  33  -0.258  16.069   0.306
  252    H    GLY  34           H        GLY  34  -3.753  14.254  -0.723
  253   1HA   GLY  34          2HA       GLY  34  -5.387  13.730  -2.450
  254   2HA   GLY  34          1HA       GLY  34  -4.232  14.308  -3.644
  255    H    CYS  35           H        CYS  35  -3.404  12.226  -0.908
  256    HA   CYS  35           HA       CYS  35  -3.250   9.857  -2.632
  257   1HB   CYS  35          2HB       CYS  35  -0.865  10.940  -1.117
  258   2HB   CYS  35          1HB       CYS  35  -0.925   9.404  -1.965
  259    HG   CYS  35           HG       CYS  35  -1.299  10.792  -4.215
  260    H    ILE  36           H        ILE  36  -2.235   7.994  -1.170
  261    HA   ILE  36           HA       ILE  36  -3.772   8.065   1.355
  262    HB   ILE  36           HB       ILE  36  -3.662   5.595   1.280
  263   1HG1  ILE  36          2HG1      ILE  36  -2.955   5.115  -1.407
  264   2HG1  ILE  36          1HG1      ILE  36  -1.690   6.164  -0.767
  265   1HG2  ILE  36          1HG2      ILE  36  -5.368   5.351  -0.308
  266   2HG2  ILE  36          2HG2      ILE  36  -4.638   6.513  -1.414
  267   3HG2  ILE  36          3HG2      ILE  36  -5.431   7.075   0.057
  268   1HD1  ILE  36          1HD1      ILE  36  -0.798   4.378   0.260
  269   2HD1  ILE  36          2HD1      ILE  36  -2.155   3.366  -0.239
  270   3HD1  ILE  36          3HD1      ILE  36  -2.242   4.284   1.268
  271    H    SER  37           H        SER  37  -2.723   6.426   3.018
  272    HA   SER  37           HA       SER  37  -0.024   7.448   3.490
  273   1HB   SER  37          2HB       SER  37  -1.691   7.527   5.326
  274   2HB   SER  37          1HB       SER  37  -1.800   5.771   5.283
  275    HG   SER  37           HG       SER  37  -0.042   5.707   6.419
  276    H    THR  38           H        THR  38   1.779   6.239   3.534
  277    HA   THR  38           HA       THR  38   1.975   3.861   2.064
  278    HB   THR  38           HB       THR  38   4.232   3.633   3.271
  279    HG1  THR  38           HG1      THR  38   4.722   5.085   4.738
  280   1HG2  THR  38          1HG2      THR  38   3.357   6.055   1.706
  281   2HG2  THR  38          2HG2      THR  38   4.254   4.647   1.138
  282   3HG2  THR  38          3HG2      THR  38   5.042   5.832   2.180
  283    H    LYS  39           H        LYS  39   1.639   4.400   5.547
  284    HA   LYS  39           HA       LYS  39   1.965   1.677   6.333
  285   1HB   LYS  39          2HB       LYS  39   0.621   4.009   7.718
  286   2HB   LYS  39          1HB       LYS  39   0.871   2.431   8.463
  287   1HG   LYS  39          2HG       LYS  39   2.900   3.181   9.104
  288   2HG   LYS  39          1HG       LYS  39   3.373   3.080   7.408
  289   1HD   LYS  39          2HD       LYS  39   2.192   5.444   7.266
  290   2HD   LYS  39          1HD       LYS  39   2.524   5.474   8.998
  291   1HE   LYS  39          2HE       LYS  39   4.887   5.176   8.627
  292   2HE   LYS  39          1HE       LYS  39   4.633   4.869   6.910
  293   1HZ   LYS  39          1HZ       LYS  39   3.770   7.131   6.689
  294   2HZ   LYS  39          2HZ       LYS  39   5.369   7.125   7.264
  295   3HZ   LYS  39          3HZ       LYS  39   4.080   7.418   8.332
  296    H    GLU  40           H        GLU  40  -0.763   3.562   5.167
  297    HA   GLU  40           HA       GLU  40  -2.678   1.465   5.883
  298   1HB   GLU  40          2HB       GLU  40  -2.970   4.211   4.660
  299   2HB   GLU  40          1HB       GLU  40  -4.314   3.080   4.794
  300   1HG   GLU  40          2HG       GLU  40  -3.718   2.909   7.287
  301   2HG   GLU  40          1HG       GLU  40  -2.708   4.331   7.026
  302    H    LEU  41           H        LEU  41  -0.469   1.496   3.577
  303    HA   LEU  41           HA       LEU  41  -2.044   1.166   1.193
  304   1HB   LEU  41          2HB       LEU  41   0.323   1.931   1.188
  305   2HB   LEU  41          1HB       LEU  41   0.808   0.336   1.715
  306    HG   LEU  41           HG       LEU  41   0.306  -0.632  -0.359
  307   1HD1  LEU  41          1HD1      LEU  41  -1.867   0.039  -0.894
  308   2HD1  LEU  41          2HD1      LEU  41  -0.925   0.887  -2.121
  309   3HD1  LEU  41          3HD1      LEU  41  -1.495   1.750  -0.694
  310   1HD2  LEU  41          1HD2      LEU  41   1.879   1.735  -0.268
  311   2HD2  LEU  41          2HD2      LEU  41   0.999   1.764  -1.795
  312   3HD2  LEU  41          3HD2      LEU  41   2.026   0.387  -1.395
  313    H    GLY  42           H        GLY  42  -0.840  -0.940   3.727
  314   1HA   GLY  42          2HA       GLY  42  -1.224  -3.404   2.302
  315   2HA   GLY  42          1HA       GLY  42  -0.990  -3.228   4.037
  316    H    LYS  43           H        LYS  43  -3.327  -1.195   3.922
  317    HA   LYS  43           HA       LYS  43  -5.403  -3.147   4.493
  318   1HB   LYS  43          2HB       LYS  43  -5.505  -0.125   4.643
  319   2HB   LYS  43          1HB       LYS  43  -6.674  -1.250   5.335
  320   1HG   LYS  43          2HG       LYS  43  -3.905  -1.807   6.150
  321   2HG   LYS  43          1HG       LYS  43  -4.479  -0.222   6.664
  322   1HD   LYS  43          2HD       LYS  43  -6.421  -2.416   7.036
  323   2HD   LYS  43          1HD       LYS  43  -4.967  -2.543   8.025
  324   1HE   LYS  43          2HE       LYS  43  -5.419  -0.597   9.193
  325   2HE   LYS  43          1HE       LYS  43  -6.315   0.123   7.856
  326   1HZ   LYS  43          1HZ       LYS  43  -8.117  -1.432   8.270
  327   2HZ   LYS  43          2HZ       LYS  43  -7.785  -0.516   9.661
  328   3HZ   LYS  43          3HZ       LYS  43  -7.255  -2.126   9.555
  329    H    VAL  44           H        VAL  44  -4.713  -0.683   2.036
  330    HA   VAL  44           HA       VAL  44  -7.315  -0.696   0.873
  331    HB   VAL  44           HB       VAL  44  -6.177   0.349  -1.112
  332   1HG1  VAL  44          1HG1      VAL  44  -5.212   2.286   0.490
  333   2HG1  VAL  44          2HG1      VAL  44  -6.109   1.354   1.687
  334   3HG1  VAL  44          3HG1      VAL  44  -6.939   2.007   0.275
  335   1HG2  VAL  44          1HG2      VAL  44  -3.972  -0.818  -0.727
  336   2HG2  VAL  44          2HG2      VAL  44  -3.722   0.242   0.659
  337   3HG2  VAL  44          3HG2      VAL  44  -3.835   0.924  -0.962
  338    H    MET  45           H        MET  45  -4.401  -2.630   0.299
  339    HA   MET  45           HA       MET  45  -5.258  -3.841  -2.124
  340   1HB   MET  45          2HB       MET  45  -3.397  -4.907   0.013
  341   2HB   MET  45          1HB       MET  45  -3.600  -5.606  -1.593
  342   1HG   MET  45          2HG       MET  45  -2.919  -3.417  -2.585
  343   2HG   MET  45          1HG       MET  45  -2.607  -2.815  -0.958
  344   1HE   MET  45          1HE       MET  45  -0.330  -5.335   0.512
  345   2HE   MET  45          2HE       MET  45  -1.588  -4.113   0.677
  346   3HE   MET  45          3HE       MET  45   0.075  -3.619   0.364
  347    H    ARG  46           H        ARG  46  -5.826  -4.563   1.265
  348    HA   ARG  46           HA       ARG  46  -6.950  -7.145   0.961
  349   1HB   ARG  46          2HB       ARG  46  -7.055  -5.033   3.074
  350   2HB   ARG  46          1HB       ARG  46  -8.225  -6.352   3.147
  351   1HG   ARG  46          2HG       ARG  46  -6.493  -8.006   3.236
  352   2HG   ARG  46          1HG       ARG  46  -5.251  -6.821   2.829
  353   1HD   ARG  46          2HD       ARG  46  -5.388  -5.776   4.943
  354   2HD   ARG  46          1HD       ARG  46  -6.950  -6.508   5.300
  355    HE   ARG  46           HE       ARG  46  -4.946  -8.517   4.976
  356   1HH1  ARG  46          2HH1      ARG  46  -6.097  -6.066   7.183
  357   2HH1  ARG  46          1HH1      ARG  46  -5.518  -6.886   8.592
  358   1HH2  ARG  46          1HH2      ARG  46  -4.197  -9.574   6.838
  359   2HH2  ARG  46          2HH2      ARG  46  -4.446  -8.866   8.398
  360    H    MET  47           H        MET  47  -8.346  -3.894   0.818
  361    HA   MET  47           HA       MET  47 -11.070  -4.738   0.616
  362   1HB   MET  47          2HB       MET  47  -9.599  -2.171   0.130
  363   2HB   MET  47          1HB       MET  47 -11.245  -2.344  -0.481
  364   1HG   MET  47          2HG       MET  47 -11.775  -3.217   1.929
  365   2HG   MET  47          1HG       MET  47 -10.273  -2.402   2.365
  366   1HE   MET  47          1HE       MET  47  -9.895   0.241   2.242
  367   2HE   MET  47          2HE       MET  47 -10.598  -0.581   3.631
  368   3HE   MET  47          3HE       MET  47 -11.266   0.959   3.097
  369    H    LEU  48           H        LEU  48  -8.500  -4.096  -1.726
  370    HA   LEU  48           HA       LEU  48 -10.121  -4.163  -4.062
  371   1HB   LEU  48          2HB       LEU  48  -7.502  -3.581  -3.546
  372   2HB   LEU  48          1HB       LEU  48  -7.355  -5.145  -4.311
  373    HG   LEU  48           HG       LEU  48  -7.101  -3.460  -5.998
  374   1HD1  LEU  48          1HD1      LEU  48  -8.995  -3.996  -7.499
  375   2HD1  LEU  48          2HD1      LEU  48  -9.892  -4.639  -6.123
  376   3HD1  LEU  48          3HD1      LEU  48  -8.412  -5.433  -6.659
  377   1HD2  LEU  48          1HD2      LEU  48  -9.562  -2.304  -4.707
  378   2HD2  LEU  48          2HD2      LEU  48  -9.203  -1.945  -6.395
  379   3HD2  LEU  48          3HD2      LEU  48  -8.052  -1.500  -5.135
  380    H    GLY  49           H        GLY  49  -7.958  -6.632  -2.638
  381   1HA   GLY  49          2HA       GLY  49  -9.440  -8.859  -2.611
  382   2HA   GLY  49          1HA       GLY  49  -9.114  -8.709  -4.335
  383    H    GLN  50           H        GLN  50  -7.224  -8.280  -1.334
  384    HA   GLN  50           HA       GLN  50  -5.350 -10.368  -2.169
  385   1HB   GLN  50          2HB       GLN  50  -4.740  -7.467  -2.193
  386   2HB   GLN  50          1HB       GLN  50  -3.537  -8.499  -1.420
  387   1HG   GLN  50          2HG       GLN  50  -2.989  -9.567  -3.379
  388   2HG   GLN  50          1HG       GLN  50  -4.623  -9.433  -4.032
  389   1HE2  GLN  50          1HE2      GLN  50  -1.490  -7.874  -3.873
  390   2HE2  GLN  50          2HE2      GLN  50  -1.884  -6.555  -4.866
  391    H    ASN  51           H        ASN  51  -3.729 -10.817  -0.435
  392    HA   ASN  51           HA       ASN  51  -4.370  -9.828   2.226
  393   1HB   ASN  51          2HB       ASN  51  -5.896 -11.883   1.544
  394   2HB   ASN  51          1HB       ASN  51  -4.450 -12.806   1.950
  395   1HD2  ASN  51          1HD2      ASN  51  -4.854 -13.620   4.029
  396   2HD2  ASN  51          2HD2      ASN  51  -5.367 -12.677   5.343
  397    HA   PRO  52           HA       PRO  52   0.052 -11.064   1.602
  398   1HB   PRO  52          2HB       PRO  52   1.114  -8.561   1.896
  399   2HB   PRO  52          1HB       PRO  52   0.566  -9.216   0.348
  400   1HG   PRO  52          2HG       PRO  52  -0.677  -7.160   2.063
  401   2HG   PRO  52          1HG       PRO  52  -0.841  -7.422   0.321
  402   1HD   PRO  52          2HD       PRO  52  -2.707  -8.172   2.343
  403   2HD   PRO  52          1HD       PRO  52  -2.769  -8.604   0.618
  404    H    THR  53           H        THR  53   1.995  -9.904   3.091
  405    HA   THR  53           HA       THR  53   1.042 -10.216   5.876
  406    HB   THR  53           HB       THR  53   3.096 -11.177   6.442
  407    HG1  THR  53           HG1      THR  53   4.926 -10.533   5.619
  408   1HG2  THR  53          1HG2      THR  53   1.888 -12.638   4.860
  409   2HG2  THR  53          2HG2      THR  53   3.636 -12.846   4.732
  410   3HG2  THR  53          3HG2      THR  53   2.769 -11.902   3.521
  411    HA   PRO  54           HA       PRO  54   2.388  -6.135   6.869
  412   1HB   PRO  54          2HB       PRO  54   3.877  -6.426   9.150
  413   2HB   PRO  54          1HB       PRO  54   2.112  -6.557   9.099
  414   1HG   PRO  54          2HG       PRO  54   4.163  -8.701   9.302
  415   2HG   PRO  54          1HG       PRO  54   2.519  -8.648   9.956
  416   1HD   PRO  54          2HD       PRO  54   3.286 -10.052   7.670
  417   2HD   PRO  54          1HD       PRO  54   1.615  -9.582   8.062
  418    H    GLU  55           H        GLU  55   4.952  -8.512   6.687
  419    HA   GLU  55           HA       GLU  55   7.071  -6.536   6.418
  420   1HB   GLU  55          2HB       GLU  55   7.287  -9.486   5.807
  421   2HB   GLU  55          1HB       GLU  55   8.571  -8.372   6.269
  422   1HG   GLU  55          2HG       GLU  55   7.417  -8.076   8.489
  423   2HG   GLU  55          1HG       GLU  55   6.299  -9.356   8.016
  424    H    GLU  56           H        GLU  56   5.182  -8.724   4.376
  425    HA   GLU  56           HA       GLU  56   6.634  -8.260   1.968
  426   1HB   GLU  56          2HB       GLU  56   4.889 -10.141   2.616
  427   2HB   GLU  56          1HB       GLU  56   3.742  -9.012   1.898
  428   1HG   GLU  56          2HG       GLU  56   4.514 -10.498   0.149
  429   2HG   GLU  56          1HG       GLU  56   5.225  -8.910  -0.136
  430    H    LEU  57           H        LEU  57   3.468  -6.993   3.114
  431    HA   LEU  57           HA       LEU  57   3.090  -5.282   0.895
  432   1HB   LEU  57          2HB       LEU  57   1.146  -4.736   1.849
  433   2HB   LEU  57          1HB       LEU  57   1.507  -6.058   2.921
  434    HG   LEU  57           HG       LEU  57   0.681  -4.266   4.244
  435   1HD1  LEU  57          1HD1      LEU  57   2.227  -4.511   5.848
  436   2HD1  LEU  57          2HD1      LEU  57   3.428  -3.607   4.927
  437   3HD1  LEU  57          3HD1      LEU  57   3.221  -5.336   4.648
  438   1HD2  LEU  57          1HD2      LEU  57   1.690  -2.608   2.283
  439   2HD2  LEU  57          2HD2      LEU  57   2.753  -2.269   3.650
  440   3HD2  LEU  57          3HD2      LEU  57   1.009  -2.069   3.818
  441    H    GLN  58           H        GLN  58   5.061  -4.938   3.742
  442    HA   GLN  58           HA       GLN  58   5.335  -2.094   3.670
  443   1HB   GLN  58          2HB       GLN  58   5.908  -3.501   5.660
  444   2HB   GLN  58          1HB       GLN  58   7.300  -4.117   4.771
  445   1HG   GLN  58          2HG       GLN  58   8.038  -2.281   6.183
  446   2HG   GLN  58          1HG       GLN  58   8.103  -1.755   4.502
  447   1HE2  GLN  58          1HE2      GLN  58   6.427  -0.228   3.759
  448   2HE2  GLN  58          2HE2      GLN  58   5.505   0.655   4.878
  449    H    GLU  59           H        GLU  59   7.223  -4.798   2.346
  450    HA   GLU  59           HA       GLU  59   9.305  -3.244   1.204
  451   1HB   GLU  59          2HB       GLU  59   8.232  -5.976   0.459
  452   2HB   GLU  59          1HB       GLU  59   9.684  -5.262  -0.243
  453   1HG   GLU  59          2HG       GLU  59  10.832  -5.277   1.831
  454   2HG   GLU  59          1HG       GLU  59   9.346  -5.529   2.747
  455    H    MET  60           H        MET  60   6.109  -4.203   0.047
  456    HA   MET  60           HA       MET  60   6.424  -3.543  -2.680
  457   1HB   MET  60          2HB       MET  60   4.025  -3.680  -0.861
  458   2HB   MET  60          1HB       MET  60   3.872  -3.170  -2.542
  459   1HG   MET  60          2HG       MET  60   4.874  -5.274  -3.301
  460   2HG   MET  60          1HG       MET  60   5.119  -5.781  -1.631
  461   1HE   MET  60          1HE       MET  60   1.696  -4.107  -3.417
  462   2HE   MET  60          2HE       MET  60   1.455  -5.657  -4.219
  463   3HE   MET  60          3HE       MET  60   2.994  -4.815  -4.389
  464    H    ILE  61           H        ILE  61   5.333  -1.611   0.101
  465    HA   ILE  61           HA       ILE  61   4.599   0.731  -1.212
  466    HB   ILE  61           HB       ILE  61   5.842   0.305   1.509
  467   1HG1  ILE  61          2HG1      ILE  61   3.025   1.145   1.084
  468   2HG1  ILE  61          1HG1      ILE  61   3.431  -0.503   0.606
  469   1HG2  ILE  61          1HG2      ILE  61   6.283   2.589   0.964
  470   2HG2  ILE  61          2HG2      ILE  61   4.840   2.594   1.978
  471   3HG2  ILE  61          3HG2      ILE  61   4.689   2.794   0.233
  472   1HD1  ILE  61          1HD1      ILE  61   4.074   0.693   3.313
  473   2HD1  ILE  61          2HD1      ILE  61   4.307  -0.982   2.812
  474   3HD1  ILE  61          3HD1      ILE  61   2.677  -0.331   2.983
  475    H    ASP  62           H        ASP  62   7.681   0.372   0.550
  476    HA   ASP  62           HA       ASP  62   8.993   2.577  -0.479
  477   1HB   ASP  62          2HB       ASP  62  10.014  -0.066   0.531
  478   2HB   ASP  62          1HB       ASP  62  11.123   1.175  -0.047
  479    H    GLU  63           H        GLU  63   8.704  -0.649  -1.919
  480    HA   GLU  63           HA       GLU  63  10.634  -0.306  -3.968
  481   1HB   GLU  63          2HB       GLU  63   8.310  -2.151  -3.560
  482   2HB   GLU  63          1HB       GLU  63   9.109  -2.099  -5.132
  483   1HG   GLU  63          2HG       GLU  63  10.776  -2.336  -2.643
  484   2HG   GLU  63          1HG       GLU  63   9.972  -3.768  -3.286
  485    H    VAL  64           H        VAL  64   7.098   0.192  -3.960
  486    HA   VAL  64           HA       VAL  64   7.107   1.126  -6.702
  487    HB   VAL  64           HB       VAL  64   4.734   1.446  -6.448
  488   1HG1  VAL  64          1HG1      VAL  64   4.514  -0.925  -4.950
  489   2HG1  VAL  64          2HG1      VAL  64   6.087  -1.014  -5.738
  490   3HG1  VAL  64          3HG1      VAL  64   4.629  -0.785  -6.703
  491   1HG2  VAL  64          1HG2      VAL  64   3.604   1.229  -4.293
  492   2HG2  VAL  64          2HG2      VAL  64   4.829   2.494  -4.185
  493   3HG2  VAL  64          3HG2      VAL  64   5.140   0.903  -3.491
  494    H    ASP  65           H        ASP  65   7.405   2.610  -3.561
  495    HA   ASP  65           HA       ASP  65   6.478   5.204  -4.283
  496   1HB   ASP  65          2HB       ASP  65   7.199   4.035  -1.914
  497   2HB   ASP  65          1HB       ASP  65   8.579   5.089  -2.218
  498    H    GLU  66           H        GLU  66   7.370   5.759  -6.232
  499    HA   GLU  66           HA       GLU  66  10.128   5.624  -6.878
  500   1HB   GLU  66          2HB       GLU  66   7.781   7.088  -8.046
  501   2HB   GLU  66          1HB       GLU  66   9.410   7.393  -8.645
  502   1HG   GLU  66          2HG       GLU  66   8.390   4.571  -8.366
  503   2HG   GLU  66          1HG       GLU  66   7.999   5.527  -9.795
  504    H    ASP  67           H        ASP  67   8.132   8.273  -5.586
  505    HA   ASP  67           HA       ASP  67  10.409  10.088  -5.588
  506   1HB   ASP  67          2HB       ASP  67   8.718  11.597  -4.312
  507   2HB   ASP  67          1HB       ASP  67   8.460  11.283  -6.025
  508    H    GLY  68           H        GLY  68   8.566   8.216  -3.210
  509   1HA   GLY  68          2HA       GLY  68   9.132   7.561  -1.066
  510   2HA   GLY  68          1HA       GLY  68  10.746   8.212  -1.352
  511    H    SER  69           H        SER  69   7.511   9.709  -1.350
  512    HA   SER  69           HA       SER  69   8.532  11.941   0.214
  513   1HB   SER  69          2HB       SER  69   6.188  12.838  -0.144
  514   2HB   SER  69          1HB       SER  69   7.126  12.565  -1.607
  515    HG   SER  69           HG       SER  69   5.693  11.152  -2.192
  516    H    GLY  70           H        GLY  70   5.841   9.614   0.471
  517   1HA   GLY  70          2HA       GLY  70   6.028   8.734   3.008
  518   2HA   GLY  70          1HA       GLY  70   5.340  10.340   3.245
  519    H    THR  71           H        THR  71   3.874  10.265   0.694
  520    HA   THR  71           HA       THR  71   1.673   8.472   1.512
  521    HB   THR  71           HB       THR  71   0.161   9.979   0.389
  522    HG1  THR  71           HG1      THR  71   2.439  11.499  -0.351
  523   1HG2  THR  71          1HG2      THR  71   1.157  10.577   2.689
  524   2HG2  THR  71          2HG2      THR  71   0.337  11.863   1.805
  525   3HG2  THR  71          3HG2      THR  71   2.100  11.789   1.822
  526    H    VAL  72           H        VAL  72   0.547   7.288  -0.095
  527    HA   VAL  72           HA       VAL  72   2.250   6.580  -2.382
  528    HB   VAL  72           HB       VAL  72  -0.288   5.219  -1.467
  529   1HG1  VAL  72          1HG1      VAL  72   0.694   4.919  -3.851
  530   2HG1  VAL  72          2HG1      VAL  72   0.337   3.465  -2.918
  531   3HG1  VAL  72          3HG1      VAL  72   1.998   4.045  -3.046
  532   1HG2  VAL  72          1HG2      VAL  72   1.184   3.610  -0.339
  533   2HG2  VAL  72          2HG2      VAL  72   1.452   5.227   0.311
  534   3HG2  VAL  72          3HG2      VAL  72   2.602   4.535  -0.835
  535    H    ASP  73           H        ASP  73   1.882   7.392  -4.315
  536    HA   ASP  73           HA       ASP  73  -0.562   8.873  -4.869
  537   1HB   ASP  73          2HB       ASP  73   1.790   8.305  -6.696
  538   2HB   ASP  73          1HB       ASP  73   0.518   9.493  -6.965
  539    H    PHE  74           H        PHE  74  -1.520   8.530  -7.140
  540    HA   PHE  74           HA       PHE  74  -2.669   5.943  -7.258
  541   1HB   PHE  74          2HB       PHE  74  -3.600   8.162  -8.193
  542   2HB   PHE  74          1HB       PHE  74  -2.585   7.847  -9.597
  543    HD1  PHE  74           HD1      PHE  74  -4.257   7.427 -11.233
  544    HD2  PHE  74           HD2      PHE  74  -4.299   5.267  -7.520
  545    HE1  PHE  74           HE1      PHE  74  -5.985   5.899 -12.139
  546    HE2  PHE  74           HE2      PHE  74  -6.023   3.739  -8.431
  547    HZ   PHE  74           HZ       PHE  74  -6.865   4.052 -10.740
  548    H    ASP  75           H        ASP  75   0.074   7.423  -8.913
  549    HA   ASP  75           HA       ASP  75   0.458   5.357 -10.848
  550   1HB   ASP  75          2HB       ASP  75   2.038   7.677  -9.850
  551   2HB   ASP  75          1HB       ASP  75   2.922   6.383 -10.656
  552    H    GLU  76           H        GLU  76   1.699   5.950  -7.582
  553    HA   GLU  76           HA       GLU  76   3.491   3.685  -7.591
  554   1HB   GLU  76          2HB       GLU  76   2.434   5.001  -5.096
  555   2HB   GLU  76          1HB       GLU  76   4.006   4.251  -5.365
  556   1HG   GLU  76          2HG       GLU  76   4.513   6.088  -7.018
  557   2HG   GLU  76          1HG       GLU  76   3.012   6.870  -6.525
  558    H    PHE  77           H        PHE  77   0.148   4.256  -6.891
  559    HA   PHE  77           HA       PHE  77  -0.304   1.923  -5.275
  560   1HB   PHE  77          2HB       PHE  77  -1.743   3.879  -5.058
  561   2HB   PHE  77          1HB       PHE  77  -2.208   3.760  -6.751
  562    HD1  PHE  77           HD1      PHE  77  -2.339   1.966  -3.479
  563    HD2  PHE  77           HD2      PHE  77  -3.966   2.339  -7.441
  564    HE1  PHE  77           HE1      PHE  77  -4.175   0.413  -2.875
  565    HE2  PHE  77           HE2      PHE  77  -5.803   0.786  -6.831
  566    HZ   PHE  77           HZ       PHE  77  -5.907  -0.176  -4.549
  567    H    LEU  78           H        LEU  78  -0.607   2.722  -8.719
  568    HA   LEU  78           HA       LEU  78  -1.892   0.216  -9.381
  569   1HB   LEU  78          2HB       LEU  78  -0.722   2.428 -11.044
  570   2HB   LEU  78          1HB       LEU  78  -1.421   0.982 -11.743
  571    HG   LEU  78           HG       LEU  78  -3.158   2.400  -9.817
  572   1HD1  LEU  78          1HD1      LEU  78  -2.880   3.617 -12.547
  573   2HD1  LEU  78          2HD1      LEU  78  -1.801   4.141 -11.253
  574   3HD1  LEU  78          3HD1      LEU  78  -3.546   4.319 -11.074
  575   1HD2  LEU  78          1HD2      LEU  78  -3.749   1.647 -12.676
  576   2HD2  LEU  78          2HD2      LEU  78  -4.844   1.685 -11.294
  577   3HD2  LEU  78          3HD2      LEU  78  -3.640   0.403 -11.430
  578    H    VAL  79           H        VAL  79   1.395   1.554  -9.679
  579    HA   VAL  79           HA       VAL  79   2.527  -0.518 -11.205
  580    HB   VAL  79           HB       VAL  79   4.708   0.139 -10.152
  581   1HG1  VAL  79          1HG1      VAL  79   4.138   2.742 -10.857
  582   2HG1  VAL  79          2HG1      VAL  79   2.863   1.840 -11.675
  583   3HG1  VAL  79          3HG1      VAL  79   4.556   1.454 -11.986
  584   1HG2  VAL  79          1HG2      VAL  79   3.984   0.786  -7.946
  585   2HG2  VAL  79          2HG2      VAL  79   2.891   2.000  -8.604
  586   3HG2  VAL  79          3HG2      VAL  79   4.633   2.223  -8.735
  587    H    MET  80           H        MET  80   1.724  -0.353  -7.819
  588    HA   MET  80           HA       MET  80   3.276  -2.220  -6.584
  589   1HB   MET  80          2HB       MET  80   0.420  -1.437  -6.310
  590   2HB   MET  80          1HB       MET  80   0.949  -2.890  -5.464
  591   1HG   MET  80          2HG       MET  80   2.472  -1.719  -4.131
  592   2HG   MET  80          1HG       MET  80   2.581  -0.374  -5.267
  593   1HE   MET  80          1HE       MET  80   0.625  -2.165  -2.507
  594   2HE   MET  80          2HE       MET  80  -0.494  -2.335  -3.857
  595   3HE   MET  80          3HE       MET  80  -0.939  -1.342  -2.473
  596    H    MET  81           H        MET  81   0.653  -2.900  -8.872
  597    HA   MET  81           HA       MET  81   0.719  -5.751  -8.379
  598   1HB   MET  81          2HB       MET  81  -0.729  -3.956 -10.287
  599   2HB   MET  81          1HB       MET  81  -0.645  -5.686 -10.630
  600   1HG   MET  81          2HG       MET  81  -1.295  -5.756  -7.996
  601   2HG   MET  81          1HG       MET  81  -2.086  -4.255  -8.471
  602   1HE   MET  81          1HE       MET  81  -2.541  -7.989  -8.149
  603   2HE   MET  81          2HE       MET  81  -4.277  -7.787  -8.375
  604   3HE   MET  81          3HE       MET  81  -3.403  -6.699  -7.299
  605    H    VAL  82           H        VAL  82   1.734  -3.652 -11.084
  606    HA   VAL  82           HA       VAL  82   2.878  -5.785 -12.597
  607    HB   VAL  82           HB       VAL  82   4.035  -3.881 -13.856
  608   1HG1  VAL  82          1HG1      VAL  82   2.079  -3.462 -15.088
  609   2HG1  VAL  82          2HG1      VAL  82   1.053  -3.508 -13.654
  610   3HG1  VAL  82          3HG1      VAL  82   1.735  -5.000 -14.300
  611   1HG2  VAL  82          1HG2      VAL  82   3.878  -2.297 -11.866
  612   2HG2  VAL  82          2HG2      VAL  82   2.151  -2.173 -12.207
  613   3HG2  VAL  82          3HG2      VAL  82   3.327  -1.632 -13.404
  614    H    ARG  83           H        ARG  83   4.231  -3.576 -10.175
  615    HA   ARG  83           HA       ARG  83   6.964  -4.034 -10.694
  616   1HB   ARG  83          2HB       ARG  83   7.369  -3.310  -8.379
  617   2HB   ARG  83          1HB       ARG  83   6.218  -2.250  -9.190
  618   1HG   ARG  83          2HG       ARG  83   4.687  -2.668  -7.604
  619   2HG   ARG  83          1HG       ARG  83   4.757  -4.391  -7.969
  620   1HD   ARG  83          2HD       ARG  83   7.011  -3.291  -6.378
  621   2HD   ARG  83          1HD       ARG  83   5.451  -3.363  -5.567
  622    HE   ARG  83           HE       ARG  83   5.780  -5.853  -6.729
  623   1HH1  ARG  83          2HH1      ARG  83   7.514  -3.862  -4.447
  624   2HH1  ARG  83          1HH1      ARG  83   8.211  -5.205  -3.611
  625   1HH2  ARG  83          1HH2      ARG  83   6.704  -7.602  -5.620
  626   2HH2  ARG  83          2HH2      ARG  83   7.755  -7.319  -4.272
  627    H    CYS  84           H        CYS  84   4.581  -6.148  -9.384
  628    HA   CYS  84           HA       CYS  84   6.298  -7.809  -7.814
  629   1HB   CYS  84          2HB       CYS  84   3.666  -7.627  -7.881
  630   2HB   CYS  84          1HB       CYS  84   3.824  -8.881  -9.111
  631    HG   CYS  84           HG       CYS  84   3.834 -10.299  -7.020
  632    H    MET  85           H        MET  85   5.905  -7.406 -11.203
  633    HA   MET  85           HA       MET  85   6.676 -10.123 -11.904
  634   1HB   MET  85          2HB       MET  85   6.132  -7.618 -13.486
  635   2HB   MET  85          1HB       MET  85   6.800  -9.068 -14.240
  636   1HG   MET  85          2HG       MET  85   4.815 -10.279 -13.022
  637   2HG   MET  85          1HG       MET  85   4.110  -8.665 -12.965
  638   1HE   MET  85          1HE       MET  85   4.168 -11.770 -14.571
  639   2HE   MET  85          2HE       MET  85   5.691 -11.409 -15.382
  640   3HE   MET  85          3HE       MET  85   4.217 -11.587 -16.331
  641    H    LYS  86           H        LYS  86   8.419  -7.792 -10.503
  642    HA   LYS  86           HA       LYS  86  10.648  -7.329 -10.316
  643   1HB   LYS  86          2HB       LYS  86  10.630  -9.946 -11.733
  644   2HB   LYS  86          1HB       LYS  86  12.140  -9.037 -11.739
  645   1HG   LYS  86          2HG       LYS  86  12.379 -10.222  -9.759
  646   2HG   LYS  86          1HG       LYS  86  11.598  -8.759  -9.158
  647   1HD   LYS  86          2HD       LYS  86   9.412  -9.849  -9.233
  648   2HD   LYS  86          1HD       LYS  86  10.132 -11.296  -9.940
  649   1HE   LYS  86          2HE       LYS  86  10.052 -11.897  -7.693
  650   2HE   LYS  86          1HE       LYS  86  11.672 -11.210  -7.799
  651   1HZ   LYS  86          1HZ       LYS  86  10.822  -9.114  -6.995
  652   2HZ   LYS  86          2HZ       LYS  86  10.425 -10.351  -5.899
  653   3HZ   LYS  86          3HZ       LYS  86   9.241  -9.729  -6.948
  654    H    ASP  87           H        ASP  87  12.700  -6.905 -11.723
  655    HA   ASP  87           HA       ASP  87  11.874  -5.092 -13.829
  656   1HB   ASP  87          2HB       ASP  87  13.788  -4.784 -12.058
  657   2HB   ASP  87          1HB       ASP  87  14.748  -5.693 -13.226
  658    H    ASP  88           H        ASP  88  13.339  -8.270 -13.596
  659    HA   ASP  88           HA       ASP  88  13.886  -9.838 -15.176
  660   1HB   ASP  88          2HB       ASP  88  11.561  -8.905 -16.046
  661   2HB   ASP  88          1HB       ASP  88  12.562  -8.264 -17.349
  662    H    SER  89           HN       SER  89  15.861  -8.053 -14.620
  663    HA   SER  89           HA       SER  89  17.419  -8.103 -17.057
  664   1HB   SER  89          2HB       SER  89  16.275  -5.564 -16.024
  665   2HB   SER  89          1HB       SER  89  17.973  -5.527 -16.489
  666    HG   SER  89           HG       SER  89  17.430  -6.096 -18.529
  Start of MODEL   26
    1   1H    MET   1          1H        MET   1  16.043  -5.775 -14.269
    2   2H    MET   1          2H        MET   1  16.383  -4.724 -15.558
    3   3H    MET   1          3H        MET   1  17.493  -5.936 -15.134
    4    HA   MET   1           HA       MET   1  16.127  -6.399 -17.164
    5   1HB   MET   1          2HB       MET   1  15.563  -8.768 -16.366
    6   2HB   MET   1          1HB       MET   1  17.236  -8.258 -16.164
    7   1HG   MET   1          2HG       MET   1  17.000  -7.970 -13.840
    8   2HG   MET   1          1HG       MET   1  15.243  -7.868 -13.936
    9   1HE   MET   1          1HE       MET   1  17.980 -11.132 -13.122
   10   2HE   MET   1          2HE       MET   1  18.319  -9.564 -13.849
   11   3HE   MET   1          3HE       MET   1  18.084 -10.973 -14.880
   12    H    ASN   2           H        ASN   2  14.375  -4.820 -17.186
   13    HA   ASN   2           HA       ASN   2  11.943  -5.463 -15.719
   14   1HB   ASN   2          2HB       ASN   2  12.548  -3.330 -17.778
   15   2HB   ASN   2          1HB       ASN   2  10.987  -3.523 -16.980
   16   1HD2  ASN   2          1HD2      ASN   2  11.624  -4.018 -14.346
   17   2HD2  ASN   2          2HD2      ASN   2  12.544  -2.749 -13.698
   18    H    ASP   3           H        ASP   3  10.010  -6.129 -16.621
   19    HA   ASP   3           HA       ASP   3   9.680  -6.667 -19.420
   20   1HB   ASP   3          2HB       ASP   3  11.139  -8.611 -18.146
   21   2HB   ASP   3          1HB       ASP   3   9.497  -9.235 -18.000
   22    H    ILE   4           H        ILE   4   8.644  -7.436 -16.122
   23    HA   ILE   4           HA       ILE   4   5.997  -8.205 -16.732
   24    HB   ILE   4           HB       ILE   4   5.467  -7.887 -14.405
   25   1HG1  ILE   4          2HG1      ILE   4   6.632  -5.610 -14.261
   26   2HG1  ILE   4          1HG1      ILE   4   6.783  -6.651 -12.854
   27   1HG2  ILE   4          1HG2      ILE   4   6.857  -9.823 -14.933
   28   2HG2  ILE   4          2HG2      ILE   4   7.291  -9.184 -13.348
   29   3HG2  ILE   4          3HG2      ILE   4   8.318  -8.856 -14.743
   30   1HD1  ILE   4          1HD1      ILE   4   8.993  -7.453 -14.092
   31   2HD1  ILE   4          2HD1      ILE   4   8.986  -5.986 -13.114
   32   3HD1  ILE   4          3HD1      ILE   4   8.857  -5.875 -14.867
   33    H    TYR   5           H        TYR   5   7.487  -5.056 -16.400
   34    HA   TYR   5           HA       TYR   5   5.045  -3.560 -16.175
   35   1HB   TYR   5          2HB       TYR   5   7.779  -2.624 -17.089
   36   2HB   TYR   5          1HB       TYR   5   6.442  -1.601 -16.562
   37    HD1  TYR   5           HD1      TYR   5   5.516  -1.950 -14.189
   38    HD2  TYR   5           HD2      TYR   5   9.280  -3.533 -15.519
   39    HE1  TYR   5           HE1      TYR   5   6.228  -2.243 -11.834
   40    HE2  TYR   5           HE2      TYR   5   9.989  -3.830 -13.166
   41    HH   TYR   5           HH       TYR   5   8.326  -4.113 -10.766
   42    H    LYS   6           H        LYS   6   7.137  -4.618 -18.809
   43    HA   LYS   6           HA       LYS   6   5.843  -3.082 -20.865
   44   1HB   LYS   6          2HB       LYS   6   7.385  -5.643 -21.310
   45   2HB   LYS   6          1HB       LYS   6   7.181  -4.288 -22.418
   46   1HG   LYS   6          2HG       LYS   6   8.853  -4.406 -19.902
   47   2HG   LYS   6          1HG       LYS   6   9.383  -4.044 -21.545
   48   1HD   LYS   6          2HD       LYS   6   8.308  -1.909 -21.526
   49   2HD   LYS   6          1HD       LYS   6   7.410  -2.298 -20.058
   50   1HE   LYS   6          2HE       LYS   6   9.269  -2.028 -18.683
   51   2HE   LYS   6          1HE       LYS   6  10.410  -2.366 -19.983
   52   1HZ   LYS   6          1HZ       LYS   6   8.745   0.082 -19.732
   53   2HZ   LYS   6          2HZ       LYS   6   9.836  -0.246 -20.992
   54   3HZ   LYS   6          3HZ       LYS   6  10.406  -0.024 -19.408
   55    H    ALA   7           H        ALA   7   5.551  -6.359 -19.605
   56    HA   ALA   7           HA       ALA   7   3.586  -7.226 -21.511
   57   1HB   ALA   7          1HB       ALA   7   3.174  -8.999 -19.640
   58   2HB   ALA   7          2HB       ALA   7   4.611  -8.295 -18.895
   59   3HB   ALA   7          3HB       ALA   7   4.712  -9.010 -20.504
   60    H    ALA   8           H        ALA   8   3.517  -5.583 -18.406
   61    HA   ALA   8           HA       ALA   8   0.692  -5.950 -17.960
   62   1HB   ALA   8          1HB       ALA   8   2.707  -4.090 -16.677
   63   2HB   ALA   8          2HB       ALA   8   2.133  -5.634 -16.042
   64   3HB   ALA   8          3HB       ALA   8   1.031  -4.262 -16.154
   65    H    VAL   9           H        VAL   9   2.744  -3.473 -19.438
   66    HA   VAL   9           HA       VAL   9   0.890  -1.365 -19.494
   67    HB   VAL   9           HB       VAL   9   3.428  -1.444 -20.170
   68   1HG1  VAL   9          1HG1      VAL   9   3.953  -1.769 -22.407
   69   2HG1  VAL   9          2HG1      VAL   9   2.312  -1.421 -22.953
   70   3HG1  VAL   9          3HG1      VAL   9   2.681  -2.970 -22.200
   71   1HG2  VAL   9          1HG2      VAL   9   1.574   0.308 -21.796
   72   2HG2  VAL   9          2HG2      VAL   9   3.171   0.709 -21.165
   73   3HG2  VAL   9          3HG2      VAL   9   1.806   0.534 -20.062
   74    H    GLU  10           H        GLU  10   1.159  -4.210 -21.541
   75    HA   GLU  10           HA       GLU  10  -0.755  -3.206 -23.489
   76   1HB   GLU  10          2HB       GLU  10   0.647  -5.858 -23.144
   77   2HB   GLU  10          1HB       GLU  10  -0.579  -5.583 -24.382
   78   1HG   GLU  10          2HG       GLU  10   0.915  -3.437 -24.885
   79   2HG   GLU  10          1HG       GLU  10   2.172  -4.434 -24.151
   80    H    GLN  11           H        GLN  11  -0.894  -4.792 -20.456
   81    HA   GLN  11           HA       GLN  11  -3.473  -6.072 -20.974
   82   1HB   GLN  11          2HB       GLN  11  -1.894  -5.909 -18.397
   83   2HB   GLN  11          1HB       GLN  11  -3.286  -6.943 -18.713
   84   1HG   GLN  11          2HG       GLN  11  -0.930  -7.110 -20.551
   85   2HG   GLN  11          1HG       GLN  11  -0.822  -7.885 -18.971
   86   1HE2  GLN  11          1HE2      GLN  11  -2.544  -7.945 -22.075
   87   2HE2  GLN  11          2HE2      GLN  11  -3.291  -9.449 -21.826
   88    H    LEU  12           H        LEU  12  -2.174  -3.156 -19.618
   89    HA   LEU  12           HA       LEU  12  -3.971  -2.311 -17.744
   90   1HB   LEU  12          2HB       LEU  12  -2.984  -0.561 -19.990
   91   2HB   LEU  12          1HB       LEU  12  -3.521  -0.040 -18.409
   92    HG   LEU  12           HG       LEU  12  -0.975  -1.484 -19.132
   93   1HD1  LEU  12          1HD1      LEU  12  -1.338   1.106 -19.161
   94   2HD1  LEU  12          2HD1      LEU  12   0.096   0.454 -18.369
   95   3HD1  LEU  12          3HD1      LEU  12  -1.292   0.958 -17.405
   96   1HD2  LEU  12          1HD2      LEU  12  -1.892  -2.587 -17.146
   97   2HD2  LEU  12          2HD2      LEU  12  -2.175  -1.023 -16.381
   98   3HD2  LEU  12          3HD2      LEU  12  -0.526  -1.573 -16.682
   99    H    THR  13           H        THR  13  -6.100  -2.595 -17.781
  100    HA   THR  13           HA       THR  13  -7.596  -1.648 -20.161
  101    HB   THR  13           HB       THR  13  -9.372  -3.351 -19.106
  102    HG1  THR  13           HG1      THR  13  -8.454  -4.562 -17.682
  103   1HG2  THR  13          1HG2      THR  13  -7.063  -4.229 -20.855
  104   2HG2  THR  13          2HG2      THR  13  -8.476  -3.337 -21.420
  105   3HG2  THR  13          3HG2      THR  13  -8.662  -4.970 -20.778
  106    H    ASP  14           H        ASP  14  -9.862  -1.039 -19.659
  107    HA   ASP  14           HA       ASP  14  -9.986   0.947 -17.653
  108   1HB   ASP  14          2HB       ASP  14 -12.164  -0.445 -19.225
  109   2HB   ASP  14          1HB       ASP  14 -12.471   0.900 -18.126
  110    H    GLU  15           H        GLU  15 -10.869  -2.454 -17.694
  111    HA   GLU  15           HA       GLU  15 -12.439  -2.505 -15.331
  112   1HB   GLU  15          2HB       GLU  15 -10.902  -4.600 -16.852
  113   2HB   GLU  15          1HB       GLU  15 -11.692  -4.983 -15.322
  114   1HG   GLU  15          2HG       GLU  15 -13.845  -4.221 -16.210
  115   2HG   GLU  15          1HG       GLU  15 -13.076  -3.758 -17.728
  116    H    GLN  16           H        GLN  16  -8.958  -3.153 -15.890
  117    HA   GLN  16           HA       GLN  16  -8.394  -3.691 -13.144
  118   1HB   GLN  16          2HB       GLN  16  -6.257  -4.103 -13.825
  119   2HB   GLN  16          1HB       GLN  16  -6.998  -4.115 -15.421
  120   1HG   GLN  16          2HG       GLN  16  -6.285  -1.893 -15.884
  121   2HG   GLN  16          1HG       GLN  16  -5.874  -1.588 -14.199
  122   1HE2  GLN  16          1HE2      GLN  16  -5.024  -4.233 -16.529
  123   2HE2  GLN  16          2HE2      GLN  16  -3.357  -4.140 -16.229
  124    H    LYS  17           H        LYS  17  -8.144  -0.768 -15.155
  125    HA   LYS  17           HA       LYS  17  -6.988   0.909 -13.189
  126   1HB   LYS  17          2HB       LYS  17  -8.336   1.278 -15.781
  127   2HB   LYS  17          1HB       LYS  17  -8.544   2.622 -14.659
  128   1HG   LYS  17          2HG       LYS  17  -6.520   3.300 -15.444
  129   2HG   LYS  17          1HG       LYS  17  -5.882   2.084 -14.338
  130   1HD   LYS  17          2HD       LYS  17  -4.856   1.437 -16.321
  131   2HD   LYS  17          1HD       LYS  17  -6.319   0.454 -16.375
  132   1HE   LYS  17          2HE       LYS  17  -7.359   1.863 -17.949
  133   2HE   LYS  17          1HE       LYS  17  -6.285   3.214 -17.588
  134   1HZ   LYS  17          1HZ       LYS  17  -4.446   1.894 -18.526
  135   2HZ   LYS  17          2HZ       LYS  17  -5.657   2.238 -19.666
  136   3HZ   LYS  17          3HZ       LYS  17  -5.556   0.692 -18.973
  137    H    ASN  18           H        ASN  18 -10.296  -0.089 -13.841
  138    HA   ASN  18           HA       ASN  18 -11.609   1.781 -12.146
  139   1HB   ASN  18          2HB       ASN  18 -13.255   0.834 -13.374
  140   2HB   ASN  18          1HB       ASN  18 -12.313  -0.616 -13.686
  141   1HD2  ASN  18          1HD2      ASN  18 -12.673  -2.455 -12.335
  142   2HD2  ASN  18          2HD2      ASN  18 -13.870  -2.493 -11.134
  143    H    GLU  19           H        GLU  19 -10.322  -1.481 -11.671
  144    HA   GLU  19           HA       GLU  19 -11.232  -1.936  -9.045
  145   1HB   GLU  19          2HB       GLU  19  -8.695  -2.916 -10.389
  146   2HB   GLU  19          1HB       GLU  19  -9.341  -3.544  -8.873
  147   1HG   GLU  19          2HG       GLU  19 -11.074  -3.448 -11.329
  148   2HG   GLU  19          1HG       GLU  19  -9.940  -4.776 -11.094
  149    H    PHE  20           H        PHE  20  -8.065  -0.736 -10.166
  150    HA   PHE  20           HA       PHE  20  -7.075  -0.136  -7.571
  151   1HB   PHE  20          2HB       PHE  20  -6.256   0.977 -10.263
  152   2HB   PHE  20          1HB       PHE  20  -5.353   1.193  -8.764
  153    HD1  PHE  20           HD1      PHE  20  -5.758  -0.841 -11.624
  154    HD2  PHE  20           HD2      PHE  20  -4.813  -1.036  -7.440
  155    HE1  PHE  20           HE1      PHE  20  -4.676  -3.038 -11.974
  156    HE2  PHE  20           HE2      PHE  20  -3.717  -3.232  -7.792
  157    HZ   PHE  20           HZ       PHE  20  -3.653  -4.235 -10.061
  158    H    LYS  21           H        LYS  21  -8.789   1.811  -9.992
  159    HA   LYS  21           HA       LYS  21  -8.480   4.325  -8.740
  160   1HB   LYS  21          2HB       LYS  21  -9.277   4.040 -11.077
  161   2HB   LYS  21          1HB       LYS  21 -10.797   3.398 -10.458
  162   1HG   LYS  21          2HG       LYS  21 -11.033   5.790 -10.984
  163   2HG   LYS  21          1HG       LYS  21 -11.195   5.527  -9.250
  164   1HD   LYS  21          2HD       LYS  21  -9.754   7.448  -9.597
  165   2HD   LYS  21          1HD       LYS  21  -8.765   6.118  -8.994
  166   1HE   LYS  21          2HE       LYS  21  -7.852   5.678 -11.144
  167   2HE   LYS  21          1HE       LYS  21  -9.089   6.639 -11.954
  168   1HZ   LYS  21          1HZ       LYS  21  -8.182   8.625 -10.977
  169   2HZ   LYS  21          2HZ       LYS  21  -6.947   7.791 -11.793
  170   3HZ   LYS  21          3HZ       LYS  21  -7.043   7.728 -10.097
  171    H    ALA  22           H        ALA  22 -11.014   1.840  -8.443
  172    HA   ALA  22           HA       ALA  22 -12.655   3.318  -6.641
  173   1HB   ALA  22          1HB       ALA  22 -13.619   1.058  -6.082
  174   2HB   ALA  22          2HB       ALA  22 -12.413   0.345  -7.153
  175   3HB   ALA  22          3HB       ALA  22 -13.627   1.445  -7.802
  176    H    ALA  23           H        ALA  23 -10.102   0.886  -6.182
  177    HA   ALA  23           HA       ALA  23 -10.241   0.779  -3.342
  178   1HB   ALA  23          1HB       ALA  23  -7.974  -0.225  -3.487
  179   2HB   ALA  23          2HB       ALA  23  -7.923   0.181  -5.205
  180   3HB   ALA  23          3HB       ALA  23  -9.110  -0.979  -4.607
  181    H    PHE  24           H        PHE  24  -8.859   3.051  -5.564
  182    HA   PHE  24           HA       PHE  24  -7.091   4.275  -3.604
  183   1HB   PHE  24          2HB       PHE  24  -6.765   4.092  -6.204
  184   2HB   PHE  24          1HB       PHE  24  -7.815   5.504  -6.250
  185    HD1  PHE  24           HD1      PHE  24  -4.531   4.200  -5.229
  186    HD2  PHE  24           HD2      PHE  24  -7.097   7.644  -5.286
  187    HE1  PHE  24           HE1      PHE  24  -2.597   5.650  -4.673
  188    HE2  PHE  24           HE2      PHE  24  -5.165   9.093  -4.728
  189    HZ   PHE  24           HZ       PHE  24  -2.914   8.097  -4.424
  190    H    ASP  25           H        ASP  25  -9.909   5.298  -5.550
  191    HA   ASP  25           HA       ASP  25 -10.338   7.795  -4.418
  192   1HB   ASP  25          2HB       ASP  25 -11.554   6.424  -6.384
  193   2HB   ASP  25          1HB       ASP  25 -12.769   6.247  -5.120
  194    H    ILE  26           H        ILE  26 -11.535   4.641  -3.239
  195    HA   ILE  26           HA       ILE  26 -13.354   5.586  -1.331
  196    HB   ILE  26           HB       ILE  26 -12.906   3.462  -0.092
  197   1HG1  ILE  26          2HG1      ILE  26 -10.833   3.059  -2.274
  198   2HG1  ILE  26          1HG1      ILE  26 -10.479   3.337  -0.572
  199   1HG2  ILE  26          1HG2      ILE  26 -13.260   2.054  -2.378
  200   2HG2  ILE  26          2HG2      ILE  26 -13.585   3.682  -2.974
  201   3HG2  ILE  26          3HG2      ILE  26 -14.533   3.026  -1.640
  202   1HD1  ILE  26          1HD1      ILE  26 -11.941   1.283  -0.096
  203   2HD1  ILE  26          2HD1      ILE  26 -10.370   0.981  -0.839
  204   3HD1  ILE  26          3HD1      ILE  26 -11.833   0.949  -1.825
  205    H    PHE  27           H        PHE  27  -9.838   5.280  -1.149
  206    HA   PHE  27           HA       PHE  27  -9.773   6.115   1.640
  207   1HB   PHE  27          2HB       PHE  27  -7.686   5.341  -0.382
  208   2HB   PHE  27          1HB       PHE  27  -7.225   6.158   1.110
  209    HD1  PHE  27           HD1      PHE  27  -8.674   3.100  -0.340
  210    HD2  PHE  27           HD2      PHE  27  -7.516   5.083   3.288
  211    HE1  PHE  27           HE1      PHE  27  -8.877   0.959   0.891
  212    HE2  PHE  27           HE2      PHE  27  -7.717   2.940   4.521
  213    HZ   PHE  27           HZ       PHE  27  -8.399   0.879   3.322
  214    H    ILE  28           H        ILE  28  -9.428   7.545  -1.545
  215    HA   ILE  28           HA       ILE  28  -8.383  10.054  -0.448
  216    HB   ILE  28           HB       ILE  28  -9.117   9.491  -3.325
  217   1HG1  ILE  28          2HG1      ILE  28  -7.529   7.816  -2.968
  218   2HG1  ILE  28          1HG1      ILE  28  -6.524   9.170  -3.462
  219   1HG2  ILE  28          1HG2      ILE  28  -7.696  11.636  -1.837
  220   2HG2  ILE  28          2HG2      ILE  28  -8.677  11.740  -3.298
  221   3HG2  ILE  28          3HG2      ILE  28  -7.012  11.166  -3.393
  222   1HD1  ILE  28          1HD1      ILE  28  -6.925   8.036  -0.705
  223   2HD1  ILE  28          2HD1      ILE  28  -6.384   9.702  -0.916
  224   3HD1  ILE  28          3HD1      ILE  28  -5.415   8.371  -1.552
  225    H    GLN  29           H        GLN  29 -10.999   9.294   0.421
  226    HA   GLN  29           HA       GLN  29 -12.952  10.785  -1.092
  227   1HB   GLN  29          2HB       GLN  29 -14.447  10.353   0.863
  228   2HB   GLN  29          1HB       GLN  29 -13.742   8.888   0.184
  229   1HG   GLN  29          2HG       GLN  29 -12.295   8.583   1.991
  230   2HG   GLN  29          1HG       GLN  29 -12.338  10.287   2.445
  231   1HE2  GLN  29          1HE2      GLN  29 -13.326   7.383   3.599
  232   2HE2  GLN  29          2HE2      GLN  29 -14.758   7.840   4.386
  233    H    ASP  30           H        ASP  30 -10.742  11.453   1.535
  234    HA   ASP  30           HA       ASP  30 -11.592  14.263   1.483
  235   1HB   ASP  30          2HB       ASP  30 -11.562  12.490   3.914
  236   2HB   ASP  30          1HB       ASP  30 -11.277  14.223   4.064
  237    H    ALA  31           H        ALA  31  -9.250  12.846   0.407
  238    HA   ALA  31           HA       ALA  31  -7.002  13.337   2.126
  239   1HB   ALA  31          1HB       ALA  31  -5.642  12.732   0.255
  240   2HB   ALA  31          2HB       ALA  31  -6.948  13.064  -0.882
  241   3HB   ALA  31          3HB       ALA  31  -7.058  11.681   0.205
  242    H    GLU  32           H        GLU  32  -5.353  14.905   1.805
  243    HA   GLU  32           HA       GLU  32  -6.399  17.527   1.120
  244   1HB   GLU  32          2HB       GLU  32  -3.859  16.533   2.380
  245   2HB   GLU  32          1HB       GLU  32  -3.974  18.193   1.795
  246   1HG   GLU  32          2HG       GLU  32  -6.141  18.366   3.150
  247   2HG   GLU  32          1HG       GLU  32  -5.661  16.852   3.917
  248    H    ASP  33           H        ASP  33  -3.831  15.360  -0.037
  249    HA   ASP  33           HA       ASP  33  -3.330  17.163  -2.310
  250   1HB   ASP  33          2HB       ASP  33  -1.818  14.830  -1.151
  251   2HB   ASP  33          1HB       ASP  33  -1.454  15.457  -2.759
  252    H    GLY  34           H        GLY  34  -4.313  13.837  -1.566
  253   1HA   GLY  34          2HA       GLY  34  -6.122  12.921  -2.995
  254   2HA   GLY  34          1HA       GLY  34  -5.221  13.538  -4.375
  255    H    CYS  35           H        CYS  35  -4.143  11.773  -1.480
  256    HA   CYS  35           HA       CYS  35  -3.584   9.357  -2.983
  257   1HB   CYS  35          2HB       CYS  35  -1.108   9.601  -1.927
  258   2HB   CYS  35          1HB       CYS  35  -1.503  10.072  -3.576
  259    HG   CYS  35           HG       CYS  35  -0.367  12.143  -2.496
  260    H    ILE  36           H        ILE  36  -2.371   7.750  -1.478
  261    HA   ILE  36           HA       ILE  36  -3.634   7.977   1.185
  262    HB   ILE  36           HB       ILE  36  -3.327   5.530   1.344
  263   1HG1  ILE  36          2HG1      ILE  36  -2.836   4.786  -1.315
  264   2HG1  ILE  36          1HG1      ILE  36  -1.632   6.025  -0.967
  265   1HG2  ILE  36          1HG2      ILE  36  -4.626   6.166  -1.306
  266   2HG2  ILE  36          2HG2      ILE  36  -5.342   6.678   0.222
  267   3HG2  ILE  36          3HG2      ILE  36  -5.108   4.962  -0.111
  268   1HD1  ILE  36          1HD1      ILE  36  -0.477   4.638   0.381
  269   2HD1  ILE  36          2HD1      ILE  36  -1.509   3.334  -0.209
  270   3HD1  ILE  36          3HD1      ILE  36  -1.932   4.195   1.274
  271    H    SER  37           H        SER  37  -2.289   6.559   2.860
  272    HA   SER  37           HA       SER  37   0.329   7.858   2.994
  273   1HB   SER  37          2HB       SER  37  -1.286   7.827   4.957
  274   2HB   SER  37          1HB       SER  37  -0.957   6.103   5.092
  275    HG   SER  37           HG       SER  37   0.501   7.114   6.397
  276    H    THR  38           H        THR  38   2.229   6.829   2.828
  277    HA   THR  38           HA       THR  38   2.432   4.308   1.592
  278    HB   THR  38           HB       THR  38   4.856   4.409   2.246
  279    HG1  THR  38           HG1      THR  38   4.243   6.946   3.315
  280   1HG2  THR  38          1HG2      THR  38   5.191   6.722   1.079
  281   2HG2  THR  38          2HG2      THR  38   3.438   6.692   0.903
  282   3HG2  THR  38          3HG2      THR  38   4.417   5.416   0.183
  283    H    LYS  39           H        LYS  39   2.501   5.263   4.991
  284    HA   LYS  39           HA       LYS  39   3.263   2.691   6.006
  285   1HB   LYS  39          2HB       LYS  39   1.815   4.931   7.439
  286   2HB   LYS  39          1HB       LYS  39   2.691   3.598   8.189
  287   1HG   LYS  39          2HG       LYS  39   3.834   5.874   6.549
  288   2HG   LYS  39          1HG       LYS  39   4.162   5.495   8.238
  289   1HD   LYS  39          2HD       LYS  39   5.186   3.335   7.518
  290   2HD   LYS  39          1HD       LYS  39   4.938   3.813   5.838
  291   1HE   LYS  39          2HE       LYS  39   6.394   5.676   7.689
  292   2HE   LYS  39          1HE       LYS  39   7.251   4.295   7.007
  293   1HZ   LYS  39          1HZ       LYS  39   7.467   6.264   5.616
  294   2HZ   LYS  39          2HZ       LYS  39   5.779   6.351   5.446
  295   3HZ   LYS  39          3HZ       LYS  39   6.634   5.034   4.799
  296    H    GLU  40           H        GLU  40   0.263   4.175   5.026
  297    HA   GLU  40           HA       GLU  40  -1.383   2.145   6.340
  298   1HB   GLU  40          2HB       GLU  40  -1.990   4.605   4.714
  299   2HB   GLU  40          1HB       GLU  40  -3.237   3.414   5.074
  300   1HG   GLU  40          2HG       GLU  40  -2.725   3.654   7.502
  301   2HG   GLU  40          1HG       GLU  40  -1.559   4.918   7.104
  302    H    LEU  41           H        LEU  41   0.517   1.999   3.699
  303    HA   LEU  41           HA       LEU  41  -1.328   0.970   1.745
  304   1HB   LEU  41          2HB       LEU  41   0.840   2.025   1.144
  305   2HB   LEU  41          1HB       LEU  41   1.674   0.682   1.892
  306    HG   LEU  41           HG       LEU  41   0.982  -0.825   0.199
  307   1HD1  LEU  41          1HD1      LEU  41  -1.008   1.334  -0.533
  308   2HD1  LEU  41          2HD1      LEU  41  -1.342  -0.321  -0.023
  309   3HD1  LEU  41          3HD1      LEU  41  -0.636  -0.013  -1.610
  310   1HD2  LEU  41          1HD2      LEU  41   1.395   1.783  -1.283
  311   2HD2  LEU  41          2HD2      LEU  41   1.890   0.167  -1.785
  312   3HD2  LEU  41          3HD2      LEU  41   2.700   0.957  -0.432
  313    H    GLY  42           H        GLY  42  -2.416  -0.539   3.102
  314   1HA   GLY  42          2HA       GLY  42  -1.378  -3.220   2.886
  315   2HA   GLY  42          1HA       GLY  42  -1.481  -2.657   4.552
  316    H    LYS  43           H        LYS  43  -3.725  -1.149   4.588
  317    HA   LYS  43           HA       LYS  43  -5.817  -3.118   4.565
  318   1HB   LYS  43          2HB       LYS  43  -7.227  -1.346   5.444
  319   2HB   LYS  43          1HB       LYS  43  -5.664  -1.295   6.257
  320   1HG   LYS  43          2HG       LYS  43  -5.229   0.351   4.095
  321   2HG   LYS  43          1HG       LYS  43  -6.913   0.690   4.481
  322   1HD   LYS  43          2HD       LYS  43  -4.791   0.632   6.625
  323   2HD   LYS  43          1HD       LYS  43  -5.123   2.094   5.696
  324   1HE   LYS  43          2HE       LYS  43  -7.594   1.727   6.337
  325   2HE   LYS  43          1HE       LYS  43  -6.985   0.587   7.536
  326   1HZ   LYS  43          1HZ       LYS  43  -7.209   2.740   8.530
  327   2HZ   LYS  43          2HZ       LYS  43  -6.279   3.462   7.305
  328   3HZ   LYS  43          3HZ       LYS  43  -5.557   2.380   8.397
  329    H    VAL  44           H        VAL  44  -4.652  -0.728   2.324
  330    HA   VAL  44           HA       VAL  44  -7.055  -0.408   0.805
  331    HB   VAL  44           HB       VAL  44  -5.612   0.624  -0.888
  332   1HG1  VAL  44          1HG1      VAL  44  -5.163   1.325   2.008
  333   2HG1  VAL  44          2HG1      VAL  44  -6.146   2.162   0.808
  334   3HG1  VAL  44          3HG1      VAL  44  -4.390   2.261   0.729
  335   1HG2  VAL  44          1HG2      VAL  44  -3.384  -0.495   0.837
  336   2HG2  VAL  44          2HG2      VAL  44  -3.133   0.768  -0.369
  337   3HG2  VAL  44          3HG2      VAL  44  -3.691  -0.828  -0.869
  338    H    MET  45           H        MET  45  -4.255  -2.571   0.626
  339    HA   MET  45           HA       MET  45  -4.975  -3.785  -1.867
  340   1HB   MET  45          2HB       MET  45  -3.207  -4.846   0.353
  341   2HB   MET  45          1HB       MET  45  -3.295  -5.481  -1.290
  342   1HG   MET  45          2HG       MET  45  -2.572  -3.273  -2.163
  343   2HG   MET  45          1HG       MET  45  -2.429  -2.684  -0.507
  344   1HE   MET  45          1HE       MET  45   0.606  -3.192   0.667
  345   2HE   MET  45          2HE       MET  45  -0.275  -4.581   1.299
  346   3HE   MET  45          3HE       MET  45  -1.127  -3.069   0.999
  347    H    ARG  46           H        ARG  46  -5.872  -4.293   1.465
  348    HA   ARG  46           HA       ARG  46  -6.782  -6.942   1.397
  349   1HB   ARG  46          2HB       ARG  46  -7.684  -4.541   2.981
  350   2HB   ARG  46          1HB       ARG  46  -8.417  -6.131   3.198
  351   1HG   ARG  46          2HG       ARG  46  -6.061  -7.032   3.550
  352   2HG   ARG  46          1HG       ARG  46  -5.524  -5.355   3.630
  353   1HD   ARG  46          2HD       ARG  46  -7.346  -5.042   5.421
  354   2HD   ARG  46          1HD       ARG  46  -7.415  -6.800   5.485
  355    HE   ARG  46           HE       ARG  46  -4.721  -5.999   5.747
  356   1HH1  ARG  46          2HH1      ARG  46  -7.755  -5.858   7.471
  357   2HH1  ARG  46          1HH1      ARG  46  -7.010  -5.830   9.032
  358   1HH2  ARG  46          1HH2      ARG  46  -3.766  -5.963   7.805
  359   2HH2  ARG  46          2HH2      ARG  46  -4.758  -5.891   9.223
  360    H    MET  47           H        MET  47  -8.446  -3.916   0.556
  361    HA   MET  47           HA       MET  47 -10.954  -5.145  -0.064
  362   1HB   MET  47          2HB       MET  47  -9.737  -2.448  -0.521
  363   2HB   MET  47          1HB       MET  47 -11.179  -2.895  -1.433
  364   1HG   MET  47          2HG       MET  47 -12.521  -2.815   0.403
  365   2HG   MET  47          1HG       MET  47 -11.298  -3.538   1.447
  366   1HE   MET  47          1HE       MET  47 -12.338  -1.573   3.330
  367   2HE   MET  47          2HE       MET  47 -13.384  -1.334   1.933
  368   3HE   MET  47          3HE       MET  47 -12.624   0.056   2.703
  369    H    LEU  48           H        LEU  48  -8.025  -4.447  -1.896
  370    HA   LEU  48           HA       LEU  48  -9.025  -4.755  -4.505
  371   1HB   LEU  48          2HB       LEU  48  -6.637  -4.096  -3.517
  372   2HB   LEU  48          1HB       LEU  48  -6.313  -5.781  -3.857
  373    HG   LEU  48           HG       LEU  48  -7.035  -5.351  -6.232
  374   1HD1  LEU  48          1HD1      LEU  48  -8.369  -3.303  -5.726
  375   2HD1  LEU  48          2HD1      LEU  48  -7.164  -3.026  -6.983
  376   3HD1  LEU  48          3HD1      LEU  48  -6.872  -2.454  -5.340
  377   1HD2  LEU  48          1HD2      LEU  48  -4.805  -3.478  -5.479
  378   2HD2  LEU  48          2HD2      LEU  48  -4.896  -4.606  -6.831
  379   3HD2  LEU  48          3HD2      LEU  48  -4.635  -5.210  -5.195
  380    H    GLY  49           H        GLY  49  -7.631  -7.169  -2.261
  381   1HA   GLY  49          2HA       GLY  49  -9.238  -9.297  -2.763
  382   2HA   GLY  49          1HA       GLY  49  -8.117  -9.347  -4.117
  383    H    GLN  50           H        GLN  50  -5.805  -8.395  -2.670
  384    HA   GLN  50           HA       GLN  50  -5.040 -10.902  -1.413
  385   1HB   GLN  50          2HB       GLN  50  -2.789 -10.024  -1.413
  386   2HB   GLN  50          1HB       GLN  50  -3.518  -9.676  -2.979
  387   1HG   GLN  50          2HG       GLN  50  -4.215  -7.454  -1.484
  388   2HG   GLN  50          1HG       GLN  50  -2.594  -7.824  -0.896
  389   1HE2  GLN  50          1HE2      GLN  50  -4.420  -7.308  -3.956
  390   2HE2  GLN  50          2HE2      GLN  50  -3.084  -6.726  -4.826
  391    H    ASN  51           H        ASN  51  -3.643 -10.753   0.616
  392    HA   ASN  51           HA       ASN  51  -4.438  -8.678   2.509
  393   1HB   ASN  51          2HB       ASN  51  -6.240 -10.449   2.584
  394   2HB   ASN  51          1HB       ASN  51  -5.010 -11.583   3.139
  395   1HD2  ASN  51          1HD2      ASN  51  -4.373 -11.474   5.346
  396   2HD2  ASN  51          2HD2      ASN  51  -5.003 -10.342   6.444
  397    HA   PRO  52           HA       PRO  52  -0.181 -10.260   3.226
  398   1HB   PRO  52          2HB       PRO  52   1.028  -7.814   3.145
  399   2HB   PRO  52          1HB       PRO  52   0.700  -8.790   1.708
  400   1HG   PRO  52          2HG       PRO  52  -0.631  -6.333   2.653
  401   2HG   PRO  52          1HG       PRO  52  -0.518  -6.990   1.015
  402   1HD   PRO  52          2HD       PRO  52  -2.760  -7.155   2.777
  403   2HD   PRO  52          1HD       PRO  52  -2.573  -7.969   1.206
  404    H    THR  53           H        THR  53   1.566  -8.950   4.744
  405    HA   THR  53           HA       THR  53   0.169  -8.432   7.305
  406    HB   THR  53           HB       THR  53   1.974  -9.408   8.451
  407    HG1  THR  53           HG1      THR  53   3.980  -9.815   7.294
  408   1HG2  THR  53          1HG2      THR  53   1.762 -10.859   5.806
  409   2HG2  THR  53          2HG2      THR  53   0.794 -11.154   7.252
  410   3HG2  THR  53          3HG2      THR  53   2.518 -11.526   7.252
  411    HA   PRO  54           HA       PRO  54   1.990  -4.412   7.491
  412   1HB   PRO  54          2HB       PRO  54   3.076  -4.241  10.000
  413   2HB   PRO  54          1HB       PRO  54   1.339  -4.171   9.662
  414   1HG   PRO  54          2HG       PRO  54   2.958  -6.404  10.771
  415   2HG   PRO  54          1HG       PRO  54   1.265  -5.981  11.071
  416   1HD   PRO  54          2HD       PRO  54   2.132  -8.037   9.390
  417   2HD   PRO  54          1HD       PRO  54   0.517  -7.294   9.341
  418    H    GLU  55           H        GLU  55   4.177  -7.010   8.410
  419    HA   GLU  55           HA       GLU  55   6.571  -5.407   7.985
  420   1HB   GLU  55          2HB       GLU  55   7.779  -7.555   8.345
  421   2HB   GLU  55          1HB       GLU  55   6.695  -7.151   9.672
  422   1HG   GLU  55          2HG       GLU  55   5.033  -8.718   8.880
  423   2HG   GLU  55          1HG       GLU  55   5.941  -9.004   7.396
  424    H    GLU  56           H        GLU  56   4.579  -7.693   6.230
  425    HA   GLU  56           HA       GLU  56   6.441  -8.141   4.089
  426   1HB   GLU  56          2HB       GLU  56   4.410  -9.606   4.837
  427   2HB   GLU  56          1HB       GLU  56   3.477  -8.529   3.799
  428   1HG   GLU  56          2HG       GLU  56   4.147 -10.372   2.421
  429   2HG   GLU  56          1HG       GLU  56   5.178  -9.017   1.967
  430    H    LEU  57           H        LEU  57   3.415  -6.225   4.378
  431    HA   LEU  57           HA       LEU  57   3.476  -5.096   1.808
  432   1HB   LEU  57          2HB       LEU  57   2.010  -3.368   2.696
  433   2HB   LEU  57          1HB       LEU  57   1.512  -4.960   3.219
  434    HG   LEU  57           HG       LEU  57   2.931  -4.329   5.372
  435   1HD1  LEU  57          1HD1      LEU  57   3.788  -2.227   5.102
  436   2HD1  LEU  57          2HD1      LEU  57   2.174  -1.728   5.607
  437   3HD1  LEU  57          3HD1      LEU  57   2.583  -1.784   3.893
  438   1HD2  LEU  57          1HD2      LEU  57   0.537  -4.847   5.342
  439   2HD2  LEU  57          2HD2      LEU  57   0.178  -3.235   4.724
  440   3HD2  LEU  57          3HD2      LEU  57   0.827  -3.430   6.351
  441    H    GLN  58           H        GLN  58   5.258  -4.270   4.713
  442    HA   GLN  58           HA       GLN  58   6.003  -1.644   4.195
  443   1HB   GLN  58          2HB       GLN  58   6.562  -3.082   6.247
  444   2HB   GLN  58          1HB       GLN  58   7.934  -3.672   5.311
  445   1HG   GLN  58          2HG       GLN  58   8.647  -1.779   6.682
  446   2HG   GLN  58          1HG       GLN  58   8.683  -1.314   4.982
  447   1HE2  GLN  58          1HE2      GLN  58   7.031   0.198   4.214
  448   2HE2  GLN  58          2HE2      GLN  58   6.075   1.082   5.305
  449    H    GLU  59           H        GLU  59   7.472  -4.653   2.996
  450    HA   GLU  59           HA       GLU  59   9.607  -3.405   1.582
  451   1HB   GLU  59          2HB       GLU  59   8.292  -6.112   1.318
  452   2HB   GLU  59          1HB       GLU  59   9.635  -5.608   0.292
  453   1HG   GLU  59          2HG       GLU  59  10.827  -5.011   2.528
  454   2HG   GLU  59          1HG       GLU  59   9.609  -6.046   3.274
  455    H    MET  60           H        MET  60   6.294  -4.297   0.703
  456    HA   MET  60           HA       MET  60   6.496  -3.827  -2.083
  457   1HB   MET  60          2HB       MET  60   4.103  -3.622  -0.234
  458   2HB   MET  60          1HB       MET  60   4.012  -3.564  -1.995
  459   1HG   MET  60          2HG       MET  60   4.843  -5.802  -2.201
  460   2HG   MET  60          1HG       MET  60   5.303  -5.858  -0.500
  461   1HE   MET  60          1HE       MET  60   4.096  -7.833  -1.975
  462   2HE   MET  60          2HE       MET  60   2.352  -7.946  -2.205
  463   3HE   MET  60          3HE       MET  60   3.073  -8.498  -0.695
  464    H    ILE  61           H        ILE  61   5.585  -1.712   0.635
  465    HA   ILE  61           HA       ILE  61   4.833   0.573  -0.770
  466    HB   ILE  61           HB       ILE  61   6.214   0.267   1.901
  467   1HG1  ILE  61          2HG1      ILE  61   3.409   1.175   1.587
  468   2HG1  ILE  61          1HG1      ILE  61   3.732  -0.504   1.161
  469   1HG2  ILE  61          1HG2      ILE  61   6.688   2.504   1.188
  470   2HG2  ILE  61          2HG2      ILE  61   5.317   2.611   2.293
  471   3HG2  ILE  61          3HG2      ILE  61   5.055   2.717   0.552
  472   1HD1  ILE  61          1HD1      ILE  61   4.753   0.670   3.741
  473   2HD1  ILE  61          2HD1      ILE  61   4.523  -1.026   3.315
  474   3HD1  ILE  61          3HD1      ILE  61   3.125   0.005   3.620
  475    H    ASP  62           H        ASP  62   8.001   0.223   0.844
  476    HA   ASP  62           HA       ASP  62   9.317   2.315  -0.388
  477   1HB   ASP  62          2HB       ASP  62  10.105   0.598   1.456
  478   2HB   ASP  62          1HB       ASP  62  10.846  -0.214   0.077
  479    H    GLU  63           H        GLU  63   8.794  -0.957  -1.638
  480    HA   GLU  63           HA       GLU  63  10.552  -0.850  -3.845
  481   1HB   GLU  63          2HB       GLU  63   8.172  -2.487  -3.102
  482   2HB   GLU  63          1HB       GLU  63   8.686  -2.509  -4.788
  483   1HG   GLU  63          2HG       GLU  63  10.974  -3.116  -4.075
  484   2HG   GLU  63          1HG       GLU  63  10.445  -3.124  -2.396
  485    H    VAL  64           H        VAL  64   7.023  -0.264  -3.713
  486    HA   VAL  64           HA       VAL  64   6.899   0.668  -6.427
  487    HB   VAL  64           HB       VAL  64   4.580   1.193  -5.979
  488   1HG1  VAL  64          1HG1      VAL  64   3.892  -0.980  -5.745
  489   2HG1  VAL  64          2HG1      VAL  64   4.867  -1.245  -4.301
  490   3HG1  VAL  64          3HG1      VAL  64   5.620  -1.295  -5.895
  491   1HG2  VAL  64          1HG2      VAL  64   3.636   1.091  -3.727
  492   2HG2  VAL  64          2HG2      VAL  64   4.961   2.256  -3.754
  493   3HG2  VAL  64          3HG2      VAL  64   5.210   0.653  -3.061
  494    H    ASP  65           H        ASP  65   7.684   2.194  -3.421
  495    HA   ASP  65           HA       ASP  65   6.859   4.844  -4.112
  496   1HB   ASP  65          2HB       ASP  65   7.712   3.664  -1.791
  497   2HB   ASP  65          1HB       ASP  65   9.133   4.595  -2.253
  498    H    GLU  66           H        GLU  66   7.631   5.139  -6.222
  499    HA   GLU  66           HA       GLU  66  10.424   4.939  -6.887
  500   1HB   GLU  66          2HB       GLU  66   8.056   6.177  -8.293
  501   2HB   GLU  66          1HB       GLU  66   9.688   6.228  -8.959
  502   1HG   GLU  66          2HG       GLU  66   9.655   4.029  -9.530
  503   2HG   GLU  66          1HG       GLU  66   8.856   3.556  -8.031
  504    H    ASP  67           H        ASP  67   8.301   7.529  -5.812
  505    HA   ASP  67           HA       ASP  67  10.334   9.573  -6.250
  506   1HB   ASP  67          2HB       ASP  67   8.575  11.067  -5.129
  507   2HB   ASP  67          1HB       ASP  67   8.157  10.375  -6.693
  508    H    GLY  68           H        GLY  68   8.675   8.065  -3.479
  509   1HA   GLY  68          2HA       GLY  68   9.443   7.701  -1.321
  510   2HA   GLY  68          1HA       GLY  68  10.990   8.401  -1.789
  511    H    SER  69           H        SER  69   7.656   9.675  -1.788
  512    HA   SER  69           HA       SER  69   8.617  12.134  -0.519
  513   1HB   SER  69          2HB       SER  69   6.349  13.004  -1.053
  514   2HB   SER  69          1HB       SER  69   7.209  12.426  -2.476
  515    HG   SER  69           HG       SER  69   4.847  11.702  -1.717
  516    H    GLY  70           H        GLY  70   5.935   9.814  -0.082
  517   1HA   GLY  70          2HA       GLY  70   6.095   9.164   2.521
  518   2HA   GLY  70          1HA       GLY  70   5.419  10.786   2.613
  519    H    THR  71           H        THR  71   3.989  10.394   0.007
  520    HA   THR  71           HA       THR  71   1.775   8.714   1.021
  521    HB   THR  71           HB       THR  71   0.271  10.118  -0.303
  522    HG1  THR  71           HG1      THR  71   1.412  10.822  -1.990
  523   1HG2  THR  71          1HG2      THR  71   0.629  12.280   0.909
  524   2HG2  THR  71          2HG2      THR  71   2.197  11.672   1.443
  525   3HG2  THR  71          3HG2      THR  71   0.715  10.867   1.961
  526    H    VAL  72           H        VAL  72   0.625   7.412  -0.476
  527    HA   VAL  72           HA       VAL  72   2.279   6.555  -2.757
  528    HB   VAL  72           HB       VAL  72  -0.151   5.194  -1.570
  529   1HG1  VAL  72          1HG1      VAL  72   0.579   3.276  -2.864
  530   2HG1  VAL  72          2HG1      VAL  72   2.024   4.136  -3.397
  531   3HG1  VAL  72          3HG1      VAL  72   0.432   4.657  -3.951
  532   1HG2  VAL  72          1HG2      VAL  72   1.543   3.648  -0.566
  533   2HG2  VAL  72          2HG2      VAL  72   1.629   5.283   0.091
  534   3HG2  VAL  72          3HG2      VAL  72   2.813   4.748  -1.103
  535    H    ASP  73           H        ASP  73   1.819   7.382  -4.661
  536    HA   ASP  73           HA       ASP  73  -0.791   8.557  -5.208
  537   1HB   ASP  73          2HB       ASP  73   1.719   8.348  -6.892
  538   2HB   ASP  73          1HB       ASP  73   0.251   9.180  -7.396
  539    H    PHE  74           H        PHE  74  -1.552   8.091  -7.601
  540    HA   PHE  74           HA       PHE  74  -2.506   5.425  -7.651
  541   1HB   PHE  74          2HB       PHE  74  -3.507   7.546  -8.751
  542   2HB   PHE  74          1HB       PHE  74  -2.415   7.193 -10.089
  543    HD1  PHE  74           HD1      PHE  74  -3.909   6.508 -11.784
  544    HD2  PHE  74           HD2      PHE  74  -4.163   4.736  -7.880
  545    HE1  PHE  74           HE1      PHE  74  -5.509   4.825 -12.652
  546    HE2  PHE  74           HE2      PHE  74  -5.756   3.053  -8.749
  547    HZ   PHE  74           HZ       PHE  74  -6.434   3.095 -11.135
  548    H    ASP  75           H        ASP  75   0.255   6.981  -9.215
  549    HA   ASP  75           HA       ASP  75   0.835   4.920 -11.086
  550   1HB   ASP  75          2HB       ASP  75   2.279   7.265  -9.968
  551   2HB   ASP  75          1HB       ASP  75   3.272   5.981 -10.660
  552    H    GLU  76           H        GLU  76   1.820   5.509  -7.742
  553    HA   GLU  76           HA       GLU  76   3.572   3.196  -7.637
  554   1HB   GLU  76          2HB       GLU  76   2.526   4.674  -5.228
  555   2HB   GLU  76          1HB       GLU  76   4.063   3.834  -5.423
  556   1HG   GLU  76          2HG       GLU  76   4.905   5.542  -6.894
  557   2HG   GLU  76          1HG       GLU  76   3.315   6.297  -7.018
  558    H    PHE  77           H        PHE  77   0.240   3.897  -7.136
  559    HA   PHE  77           HA       PHE  77  -0.365   1.696  -5.380
  560   1HB   PHE  77          2HB       PHE  77  -1.704   3.800  -5.478
  561   2HB   PHE  77          1HB       PHE  77  -2.219   3.364  -7.104
  562    HD1  PHE  77           HD1      PHE  77  -2.297   2.265  -3.531
  563    HD2  PHE  77           HD2      PHE  77  -3.972   1.825  -7.470
  564    HE1  PHE  77           HE1      PHE  77  -4.136   0.884  -2.601
  565    HE2  PHE  77           HE2      PHE  77  -5.809   0.444  -6.534
  566    HZ   PHE  77           HZ       PHE  77  -5.889  -0.027  -4.099
  567    H    LEU  78           H        LEU  78  -0.368   2.252  -8.867
  568    HA   LEU  78           HA       LEU  78  -1.746  -0.220  -9.487
  569   1HB   LEU  78          2HB       LEU  78  -0.223   1.708 -11.228
  570   2HB   LEU  78          1HB       LEU  78  -1.165   0.358 -11.822
  571    HG   LEU  78           HG       LEU  78  -2.590   2.314 -10.091
  572   1HD1  LEU  78          1HD1      LEU  78  -1.907   2.942 -12.976
  573   2HD1  LEU  78          2HD1      LEU  78  -1.083   3.673 -11.597
  574   3HD1  LEU  78          3HD1      LEU  78  -2.806   3.952 -11.844
  575   1HD2  LEU  78          1HD2      LEU  78  -3.936   1.829 -12.506
  576   2HD2  LEU  78          2HD2      LEU  78  -4.242   1.045 -10.956
  577   3HD2  LEU  78          3HD2      LEU  78  -3.146   0.300 -12.120
  578    H    VAL  79           H        VAL  79   1.622   0.924  -9.529
  579    HA   VAL  79           HA       VAL  79   2.787  -1.265 -10.850
  580    HB   VAL  79           HB       VAL  79   4.874  -0.675  -9.533
  581   1HG1  VAL  79          1HG1      VAL  79   4.548   0.257 -11.721
  582   2HG1  VAL  79          2HG1      VAL  79   5.050   1.584 -10.673
  583   3HG1  VAL  79          3HG1      VAL  79   3.353   1.405 -11.119
  584   1HG2  VAL  79          1HG2      VAL  79   3.612   0.254  -7.563
  585   2HG2  VAL  79          2HG2      VAL  79   3.147   1.621  -8.573
  586   3HG2  VAL  79          3HG2      VAL  79   4.845   1.344  -8.196
  587    H    MET  80           H        MET  80   1.569  -0.973  -7.621
  588    HA   MET  80           HA       MET  80   2.904  -2.847  -6.141
  589   1HB   MET  80          2HB       MET  80   0.071  -1.944  -6.253
  590   2HB   MET  80          1HB       MET  80   0.416  -3.404  -5.325
  591   1HG   MET  80          2HG       MET  80   2.378  -1.941  -4.331
  592   2HG   MET  80          1HG       MET  80   1.368  -0.597  -4.866
  593   1HE   MET  80          1HE       MET  80  -1.540  -1.663  -4.632
  594   2HE   MET  80          2HE       MET  80  -0.946  -0.082  -4.135
  595   3HE   MET  80          3HE       MET  80  -1.939  -1.029  -3.030
  596    H    MET  81           H        MET  81   0.601  -3.473  -8.757
  597    HA   MET  81           HA       MET  81   0.437  -6.305  -8.212
  598   1HB   MET  81          2HB       MET  81  -0.597  -4.480 -10.337
  599   2HB   MET  81          1HB       MET  81  -0.517  -6.208 -10.680
  600   1HG   MET  81          2HG       MET  81  -1.584  -6.193  -8.148
  601   2HG   MET  81          1HG       MET  81  -2.298  -4.739  -8.850
  602   1HE   MET  81          1HE       MET  81  -4.868  -7.806  -8.986
  603   2HE   MET  81          2HE       MET  81  -4.365  -6.386  -8.073
  604   3HE   MET  81          3HE       MET  81  -3.429  -7.873  -7.960
  605    H    VAL  82           H        VAL  82   1.972  -4.361 -10.799
  606    HA   VAL  82           HA       VAL  82   3.205  -6.548 -12.098
  607    HB   VAL  82           HB       VAL  82   4.777  -4.775 -13.050
  608   1HG1  VAL  82          1HG1      VAL  82   2.839  -3.687 -14.309
  609   2HG1  VAL  82          2HG1      VAL  82   1.767  -4.616 -13.261
  610   3HG1  VAL  82          3HG1      VAL  82   2.892  -5.448 -14.335
  611   1HG2  VAL  82          1HG2      VAL  82   4.241  -2.461 -12.650
  612   2HG2  VAL  82          2HG2      VAL  82   4.468  -3.216 -11.073
  613   3HG2  VAL  82          3HG2      VAL  82   2.841  -2.896 -11.672
  614    H    ARG  83           H        ARG  83   4.348  -4.493  -9.423
  615    HA   ARG  83           HA       ARG  83   7.043  -5.342  -9.466
  616   1HB   ARG  83          2HB       ARG  83   7.161  -4.613  -7.119
  617   2HB   ARG  83          1HB       ARG  83   6.342  -3.419  -8.123
  618   1HG   ARG  83          2HG       ARG  83   4.361  -3.689  -7.044
  619   2HG   ARG  83          1HG       ARG  83   4.551  -5.437  -6.927
  620   1HD   ARG  83          2HD       ARG  83   6.163  -3.518  -5.241
  621   2HD   ARG  83          1HD       ARG  83   4.603  -4.142  -4.719
  622    HE   ARG  83           HE       ARG  83   7.105  -5.586  -4.786
  623   1HH1  ARG  83          2HH1      ARG  83   3.622  -5.864  -4.913
  624   2HH1  ARG  83          1HH1      ARG  83   3.607  -7.495  -4.337
  625   1HH2  ARG  83          1HH2      ARG  83   7.057  -7.724  -4.031
  626   2HH2  ARG  83          2HH2      ARG  83   5.544  -8.544  -3.839
  627    H    CYS  84           H        CYS  84   4.145  -6.922  -8.346
  628    HA   CYS  84           HA       CYS  84   5.553  -8.937  -6.795
  629   1HB   CYS  84          2HB       CYS  84   3.082  -8.033  -6.516
  630   2HB   CYS  84          1HB       CYS  84   2.723  -9.286  -7.703
  631    HG   CYS  84           HG       CYS  84   3.971  -9.847  -4.892
  632    H    MET  85           H        MET  85   4.316  -8.529 -10.052
  633    HA   MET  85           HA       MET  85   4.201 -11.214 -10.889
  634   1HB   MET  85          2HB       MET  85   4.859  -8.734 -12.497
  635   2HB   MET  85          1HB       MET  85   4.475 -10.310 -13.187
  636   1HG   MET  85          2HG       MET  85   2.608  -8.922 -11.260
  637   2HG   MET  85          1HG       MET  85   2.538  -8.629 -12.996
  638   1HE   MET  85          1HE       MET  85  -0.108 -10.981 -11.082
  639   2HE   MET  85          2HE       MET  85  -0.407 -10.080 -12.566
  640   3HE   MET  85          3HE       MET  85   0.474  -9.318 -11.243
  641    H    LYS  86           H        LYS  86   6.940  -9.075 -10.414
  642    HA   LYS  86           HA       LYS  86   8.901 -10.150 -12.027
  643   1HB   LYS  86          2HB       LYS  86   9.055  -9.087  -9.209
  644   2HB   LYS  86          1HB       LYS  86  10.491  -9.625 -10.082
  645   1HG   LYS  86          2HG       LYS  86  10.165  -7.989 -11.804
  646   2HG   LYS  86          1HG       LYS  86   8.550  -7.596 -11.216
  647   1HD   LYS  86          2HD       LYS  86   9.830  -5.844 -10.337
  648   2HD   LYS  86          1HD       LYS  86   9.789  -6.983  -8.991
  649   1HE   LYS  86          2HE       LYS  86  11.967  -7.945 -10.126
  650   2HE   LYS  86          1HE       LYS  86  12.048  -6.345 -10.864
  651   1HZ   LYS  86          1HZ       LYS  86  11.958  -5.356  -8.670
  652   2HZ   LYS  86          2HZ       LYS  86  13.261  -6.441  -8.770
  653   3HZ   LYS  86          3HZ       LYS  86  11.842  -6.888  -7.949
  654    H    ASP  87           H        ASP  87   9.617 -12.146 -12.313
  655    HA   ASP  87           HA       ASP  87  10.169 -13.871 -10.038
  656   1HB   ASP  87          2HB       ASP  87   7.702 -14.215 -10.846
  657   2HB   ASP  87          1HB       ASP  87   8.454 -15.068 -12.194
  658    H    ASP  88           H        ASP  88  12.309 -13.876 -10.628
  659    HA   ASP  88           HA       ASP  88  13.262 -14.275 -13.277
  660   1HB   ASP  88          2HB       ASP  88  14.554 -13.353 -11.245
  661   2HB   ASP  88          1HB       ASP  88  14.806 -15.042 -10.801
  662    H    SER  89           HN       SER  89  12.417 -16.028 -14.299
  663    HA   SER  89           HA       SER  89  13.239 -18.665 -13.275
  664   1HB   SER  89          2HB       SER  89  11.027 -19.602 -13.972
  665   2HB   SER  89          1HB       SER  89  10.918 -18.490 -12.612
  666    HG   SER  89           HG       SER  89   9.841 -17.128 -13.816
  Start of MODEL   27
    1   1H    MET   1          1H        MET   1  13.072   3.256 -18.635
    2   2H    MET   1          2H        MET   1  12.919   4.839 -18.041
    3   3H    MET   1          3H        MET   1  11.547   3.851 -18.197
    4    HA   MET   1           HA       MET   1  13.793   3.530 -16.284
    5   1HB   MET   1          2HB       MET   1  10.973   4.472 -16.153
    6   2HB   MET   1          1HB       MET   1  11.519   3.447 -14.826
    7   1HG   MET   1          2HG       MET   1  13.540   4.967 -14.622
    8   2HG   MET   1          1HG       MET   1  12.738   6.058 -15.753
    9   1HE   MET   1          1HE       MET   1  13.906   6.353 -13.058
   10   2HE   MET   1          2HE       MET   1  13.045   5.493 -11.784
   11   3HE   MET   1          3HE       MET   1  12.815   7.228 -11.976
   12    H    ASN   2           H        ASN   2  10.589   2.190 -17.181
   13    HA   ASN   2           HA       ASN   2  11.679  -0.517 -16.704
   14   1HB   ASN   2          2HB       ASN   2   9.182   0.726 -15.607
   15   2HB   ASN   2          1HB       ASN   2   9.222  -1.009 -15.934
   16   1HD2  ASN   2          1HD2      ASN   2  11.313  -2.132 -15.000
   17   2HD2  ASN   2          2HD2      ASN   2  11.806  -1.616 -13.462
   18    H    ASP   3           H        ASP   3  11.202  -2.007 -18.204
   19    HA   ASP   3           HA       ASP   3   9.476  -1.168 -20.452
   20   1HB   ASP   3          2HB       ASP   3  10.726  -2.749 -21.827
   21   2HB   ASP   3          1HB       ASP   3  11.830  -1.628 -21.036
   22    H    ILE   4           H        ILE   4   9.559  -3.356 -17.815
   23    HA   ILE   4           HA       ILE   4   7.966  -5.389 -19.151
   24    HB   ILE   4           HB       ILE   4   8.037  -6.632 -17.150
   25   1HG1  ILE   4          2HG1      ILE   4   9.046  -5.370 -15.038
   26   2HG1  ILE   4          1HG1      ILE   4   8.385  -3.950 -15.852
   27   1HG2  ILE   4          1HG2      ILE   4  10.613  -5.329 -16.588
   28   2HG2  ILE   4          2HG2      ILE   4  10.353  -5.690 -18.295
   29   3HG2  ILE   4          3HG2      ILE   4  10.271  -6.982 -17.099
   30   1HD1  ILE   4          1HD1      ILE   4   6.855  -5.217 -14.186
   31   2HD1  ILE   4          2HD1      ILE   4   6.714  -6.430 -15.457
   32   3HD1  ILE   4          3HD1      ILE   4   6.176  -4.776 -15.751
   33    H    TYR   5           H        TYR   5   7.442  -2.487 -17.308
   34    HA   TYR   5           HA       TYR   5   4.832  -2.971 -16.337
   35   1HB   TYR   5          2HB       TYR   5   6.070  -0.343 -17.225
   36   2HB   TYR   5          1HB       TYR   5   4.599  -0.506 -16.275
   37    HD1  TYR   5           HD1      TYR   5   6.629  -3.134 -15.226
   38    HD2  TYR   5           HD2      TYR   5   6.322   1.135 -14.938
   39    HE1  TYR   5           HE1      TYR   5   7.992  -3.182 -13.170
   40    HE2  TYR   5           HE2      TYR   5   7.678   1.089 -12.868
   41    HH   TYR   5           HH       TYR   5   9.597  -0.941 -11.967
   42    H    LYS   6           H        LYS   6   6.092  -1.976 -19.445
   43    HA   LYS   6           HA       LYS   6   3.499  -1.359 -20.589
   44   1HB   LYS   6          2HB       LYS   6   6.043  -1.882 -22.137
   45   2HB   LYS   6          1HB       LYS   6   4.656  -0.908 -22.618
   46   1HG   LYS   6          2HG       LYS   6   6.755  -0.270 -20.538
   47   2HG   LYS   6          1HG       LYS   6   6.310   0.670 -21.962
   48   1HD   LYS   6          2HD       LYS   6   4.181   1.264 -20.998
   49   2HD   LYS   6          1HD       LYS   6   4.411   0.137 -19.663
   50   1HE   LYS   6          2HE       LYS   6   5.946   1.497 -18.588
   51   2HE   LYS   6          1HE       LYS   6   6.476   2.262 -20.087
   52   1HZ   LYS   6          1HZ       LYS   6   3.852   2.694 -18.762
   53   2HZ   LYS   6          2HZ       LYS   6   4.370   3.434 -20.202
   54   3HZ   LYS   6          3HZ       LYS   6   5.160   3.774 -18.738
   55    H    ALA   7           H        ALA   7   5.822  -4.008 -20.628
   56    HA   ALA   7           HA       ALA   7   4.449  -5.632 -22.535
   57   1HB   ALA   7          1HB       ALA   7   6.573  -6.144 -20.474
   58   2HB   ALA   7          2HB       ALA   7   6.674  -6.266 -22.230
   59   3HB   ALA   7          3HB       ALA   7   5.808  -7.496 -21.310
   60    H    ALA   8           H        ALA   8   4.118  -5.151 -19.068
   61    HA   ALA   8           HA       ALA   8   2.451  -7.488 -18.672
   62   1HB   ALA   8          1HB       ALA   8   4.007  -6.102 -16.969
   63   2HB   ALA   8          2HB       ALA   8   2.620  -7.057 -16.440
   64   3HB   ALA   8          3HB       ALA   8   2.460  -5.314 -16.653
   65    H    VAL   9           H        VAL   9   1.961  -4.041 -19.272
   66    HA   VAL   9           HA       VAL   9  -0.689  -3.779 -18.418
   67    HB   VAL   9           HB       VAL   9   0.967  -1.988 -19.356
   68   1HG1  VAL   9          1HG1      VAL   9   0.933  -1.516 -21.619
   69   2HG1  VAL   9          2HG1      VAL   9  -0.663  -2.229 -21.853
   70   3HG1  VAL   9          3HG1      VAL   9   0.750  -3.268 -21.686
   71   1HG2  VAL   9          1HG2      VAL   9  -1.476  -1.787 -18.493
   72   2HG2  VAL   9          2HG2      VAL   9  -1.910  -1.674 -20.199
   73   3HG2  VAL   9          3HG2      VAL   9  -0.833  -0.475 -19.482
   74    H    GLU  10           H        GLU  10   0.592  -5.267 -21.330
   75    HA   GLU  10           HA       GLU  10  -1.850  -5.395 -22.790
   76   1HB   GLU  10          2HB       GLU  10   0.644  -7.107 -22.929
   77   2HB   GLU  10          1HB       GLU  10  -0.699  -7.223 -24.066
   78   1HG   GLU  10          2HG       GLU  10   0.841  -4.666 -23.528
   79   2HG   GLU  10          1HG       GLU  10   1.190  -5.762 -24.864
   80    H    GLN  11           H        GLN  11  -0.457  -7.325 -20.217
   81    HA   GLN  11           HA       GLN  11  -2.275  -9.552 -20.592
   82   1HB   GLN  11          2HB       GLN  11  -0.408  -8.898 -18.298
   83   2HB   GLN  11          1HB       GLN  11  -1.290 -10.414 -18.498
   84   1HG   GLN  11          2HG       GLN  11   0.597  -9.343 -20.608
   85   2HG   GLN  11          1HG       GLN  11   1.132 -10.417 -19.315
   86   1HE2  GLN  11          1HE2      GLN  11  -0.708 -10.254 -22.313
   87   2HE2  GLN  11          2HE2      GLN  11  -1.011 -11.920 -22.432
   88    H    LEU  12           H        LEU  12  -1.953  -6.783 -18.427
   89    HA   LEU  12           HA       LEU  12  -4.230  -7.476 -16.806
   90   1HB   LEU  12          2HB       LEU  12  -2.811  -4.831 -17.116
   91   2HB   LEU  12          1HB       LEU  12  -3.964  -5.234 -15.866
   92    HG   LEU  12           HG       LEU  12  -1.833  -7.170 -15.855
   93   1HD1  LEU  12          1HD1      LEU  12  -0.826  -4.399 -15.274
   94   2HD1  LEU  12          2HD1      LEU  12  -0.747  -5.026 -16.921
   95   3HD1  LEU  12          3HD1      LEU  12   0.089  -5.868 -15.616
   96   1HD2  LEU  12          1HD2      LEU  12  -2.853  -6.962 -13.807
   97   2HD2  LEU  12          2HD2      LEU  12  -3.179  -5.244 -14.026
   98   3HD2  LEU  12          3HD2      LEU  12  -1.569  -5.781 -13.551
   99    H    THR  13           H        THR  13  -6.047  -5.817 -16.564
  100    HA   THR  13           HA       THR  13  -6.908  -4.831 -19.224
  101    HB   THR  13           HB       THR  13  -9.288  -5.376 -18.118
  102    HG1  THR  13           HG1      THR  13  -9.076  -6.629 -16.471
  103   1HG2  THR  13          1HG2      THR  13  -9.142  -7.606 -19.331
  104   2HG2  THR  13          2HG2      THR  13  -7.445  -7.230 -19.625
  105   3HG2  THR  13          3HG2      THR  13  -8.707  -6.184 -20.276
  106    H    ASP  14           H        ASP  14  -8.881  -3.341 -18.944
  107    HA   ASP  14           HA       ASP  14  -8.110  -1.083 -17.424
  108   1HB   ASP  14          2HB       ASP  14  -9.703  -1.262 -19.487
  109   2HB   ASP  14          1HB       ASP  14 -10.952  -1.542 -18.273
  110    H    GLU  15           H        GLU  15 -10.148  -3.841 -16.740
  111    HA   GLU  15           HA       GLU  15 -11.642  -2.916 -14.566
  112   1HB   GLU  15          2HB       GLU  15 -10.569  -5.650 -15.255
  113   2HB   GLU  15          1HB       GLU  15 -11.563  -5.367 -13.827
  114   1HG   GLU  15          2HG       GLU  15 -13.322  -5.708 -15.222
  115   2HG   GLU  15          1HG       GLU  15 -13.000  -4.066 -15.778
  116    H    GLN  16           H        GLN  16  -8.323  -4.224 -14.658
  117    HA   GLN  16           HA       GLN  16  -7.936  -4.355 -11.860
  118   1HB   GLN  16          2HB       GLN  16  -5.645  -4.677 -12.290
  119   2HB   GLN  16          1HB       GLN  16  -6.434  -5.328 -13.723
  120   1HG   GLN  16          2HG       GLN  16  -5.043  -3.990 -14.902
  121   2HG   GLN  16          1HG       GLN  16  -6.069  -2.659 -14.385
  122   1HE2  GLN  16          1HE2      GLN  16  -2.949  -3.108 -14.723
  123   2HE2  GLN  16          2HE2      GLN  16  -2.329  -2.414 -13.304
  124    H    LYS  17           H        LYS  17  -7.658  -1.695 -14.155
  125    HA   LYS  17           HA       LYS  17  -6.522   0.123 -12.201
  126   1HB   LYS  17          2HB       LYS  17  -7.236   0.238 -15.068
  127   2HB   LYS  17          1HB       LYS  17  -7.427   1.749 -14.179
  128   1HG   LYS  17          2HG       LYS  17  -5.200   2.002 -14.589
  129   2HG   LYS  17          1HG       LYS  17  -5.011   0.897 -13.227
  130   1HD   LYS  17          2HD       LYS  17  -3.782  -0.275 -14.776
  131   2HD   LYS  17          1HD       LYS  17  -5.374  -0.917 -15.177
  132   1HE   LYS  17          2HE       LYS  17  -4.604   1.626 -16.513
  133   2HE   LYS  17          1HE       LYS  17  -3.737   0.180 -17.025
  134   1HZ   LYS  17          1HZ       LYS  17  -6.670   0.627 -17.044
  135   2HZ   LYS  17          2HZ       LYS  17  -5.958  -0.895 -17.296
  136   3HZ   LYS  17          3HZ       LYS  17  -5.655   0.379 -18.378
  137    H    ASN  18           H        ASN  18  -9.693  -0.782 -13.381
  138    HA   ASN  18           HA       ASN  18 -11.164   1.454 -12.433
  139   1HB   ASN  18          2HB       ASN  18 -11.814  -1.343 -13.261
  140   2HB   ASN  18          1HB       ASN  18 -13.017  -0.463 -12.319
  141   1HD2  ASN  18          1HD2      ASN  18 -12.294  -1.137 -15.448
  142   2HD2  ASN  18          2HD2      ASN  18 -12.838   0.286 -16.196
  143    H    GLU  19           H        GLU  19 -10.391  -1.723 -11.015
  144    HA   GLU  19           HA       GLU  19 -11.732  -1.301  -8.534
  145   1HB   GLU  19          2HB       GLU  19  -9.378  -3.112  -9.153
  146   2HB   GLU  19          1HB       GLU  19 -10.386  -3.193  -7.709
  147   1HG   GLU  19          2HG       GLU  19 -12.341  -3.348  -9.506
  148   2HG   GLU  19          1HG       GLU  19 -11.038  -3.962 -10.522
  149    H    PHE  20           H        PHE  20  -8.383  -0.885  -9.619
  150    HA   PHE  20           HA       PHE  20  -7.259  -0.064  -7.164
  151   1HB   PHE  20          2HB       PHE  20  -6.501   0.291 -10.045
  152   2HB   PHE  20          1HB       PHE  20  -5.633   1.196  -8.810
  153    HD1  PHE  20           HD1      PHE  20  -3.582  -0.068  -9.484
  154    HD2  PHE  20           HD2      PHE  20  -7.021  -2.030  -7.821
  155    HE1  PHE  20           HE1      PHE  20  -2.203  -2.060  -8.983
  156    HE2  PHE  20           HE2      PHE  20  -5.639  -4.024  -7.322
  157    HZ   PHE  20           HZ       PHE  20  -3.230  -4.040  -7.900
  158    H    LYS  21           H        LYS  21  -8.836   1.763  -9.769
  159    HA   LYS  21           HA       LYS  21  -8.306   4.358  -8.755
  160   1HB   LYS  21          2HB       LYS  21  -9.087   3.866 -11.088
  161   2HB   LYS  21          1HB       LYS  21 -10.682   3.507 -10.430
  162   1HG   LYS  21          2HG       LYS  21 -10.572   5.834 -11.243
  163   2HG   LYS  21          1HG       LYS  21 -10.815   5.792  -9.497
  164   1HD   LYS  21          2HD       LYS  21  -8.590   6.420  -9.046
  165   2HD   LYS  21          1HD       LYS  21  -8.037   5.958 -10.657
  166   1HE   LYS  21          2HE       LYS  21  -9.602   7.804 -11.537
  167   2HE   LYS  21          1HE       LYS  21  -9.681   8.368  -9.869
  168   1HZ   LYS  21          1HZ       LYS  21  -7.942   9.513 -11.047
  169   2HZ   LYS  21          2HZ       LYS  21  -7.220   8.045 -11.503
  170   3HZ   LYS  21          3HZ       LYS  21  -7.249   8.510  -9.869
  171    H    ALA  22           H        ALA  22 -11.061   2.137  -8.332
  172    HA   ALA  22           HA       ALA  22 -12.616   3.896  -6.719
  173   1HB   ALA  22          1HB       ALA  22 -12.635   0.867  -6.777
  174   2HB   ALA  22          2HB       ALA  22 -13.587   1.915  -7.830
  175   3HB   ALA  22          3HB       ALA  22 -13.891   1.899  -6.092
  176    H    ALA  23           H        ALA  23 -10.291   1.318  -5.964
  177    HA   ALA  23           HA       ALA  23 -10.511   1.436  -3.141
  178   1HB   ALA  23          1HB       ALA  23  -8.334   0.274  -3.124
  179   2HB   ALA  23          2HB       ALA  23  -8.149   0.603  -4.848
  180   3HB   ALA  23          3HB       ALA  23  -9.442  -0.456  -4.285
  181    H    PHE  24           H        PHE  24  -8.857   3.427  -5.474
  182    HA   PHE  24           HA       PHE  24  -7.108   4.692  -3.533
  183   1HB   PHE  24          2HB       PHE  24  -6.752   4.340  -6.125
  184   2HB   PHE  24          1HB       PHE  24  -7.687   5.828  -6.252
  185    HD1  PHE  24           HD1      PHE  24  -4.552   4.315  -4.999
  186    HD2  PHE  24           HD2      PHE  24  -6.799   7.947  -5.470
  187    HE1  PHE  24           HE1      PHE  24  -2.524   5.641  -4.466
  188    HE2  PHE  24           HE2      PHE  24  -4.776   9.273  -4.928
  189    HZ   PHE  24           HZ       PHE  24  -2.637   8.118  -4.429
  190    H    ASP  25           H        ASP  25  -9.819   5.747  -5.611
  191    HA   ASP  25           HA       ASP  25 -10.182   8.317  -4.662
  192   1HB   ASP  25          2HB       ASP  25 -11.993   6.309  -5.915
  193   2HB   ASP  25          1HB       ASP  25 -12.720   7.750  -5.205
  194    H    ILE  26           H        ILE  26 -11.578   5.314  -3.297
  195    HA   ILE  26           HA       ILE  26 -13.279   6.500  -1.414
  196    HB   ILE  26           HB       ILE  26 -13.032   4.400  -0.098
  197   1HG1  ILE  26          2HG1      ILE  26 -10.978   3.729  -2.233
  198   2HG1  ILE  26          1HG1      ILE  26 -10.628   4.024  -0.532
  199   1HG2  ILE  26          1HG2      ILE  26 -13.484   2.929  -2.338
  200   2HG2  ILE  26          2HG2      ILE  26 -13.683   4.556  -2.988
  201   3HG2  ILE  26          3HG2      ILE  26 -14.678   4.020  -1.635
  202   1HD1  ILE  26          1HD1      ILE  26 -10.728   1.652  -0.767
  203   2HD1  ILE  26          2HD1      ILE  26 -12.203   1.742  -1.730
  204   3HD1  ILE  26          3HD1      ILE  26 -12.249   2.122  -0.008
  205    H    PHE  27           H        PHE  27  -9.805   5.905  -1.273
  206    HA   PHE  27           HA       PHE  27  -9.601   6.807   1.487
  207   1HB   PHE  27          2HB       PHE  27  -7.704   5.732  -0.556
  208   2HB   PHE  27          1HB       PHE  27  -7.051   6.708   0.759
  209    HD1  PHE  27           HD1      PHE  27  -7.103   5.933   3.057
  210    HD2  PHE  27           HD2      PHE  27  -8.876   3.608  -0.089
  211    HE1  PHE  27           HE1      PHE  27  -7.273   3.989   4.588
  212    HE2  PHE  27           HE2      PHE  27  -9.046   1.665   1.442
  213    HZ   PHE  27           HZ       PHE  27  -8.245   1.856   3.780
  214    H    ILE  28           H        ILE  28  -9.232   8.140  -1.742
  215    HA   ILE  28           HA       ILE  28  -7.968  10.578  -0.717
  216    HB   ILE  28           HB       ILE  28  -8.807  10.071  -3.572
  217   1HG1  ILE  28          2HG1      ILE  28  -7.390   8.234  -3.256
  218   2HG1  ILE  28          1HG1      ILE  28  -6.273   9.480  -3.784
  219   1HG2  ILE  28          1HG2      ILE  28  -6.562  11.512  -3.730
  220   2HG2  ILE  28          2HG2      ILE  28  -7.084  12.025  -2.122
  221   3HG2  ILE  28          3HG2      ILE  28  -8.141  12.272  -3.513
  222   1HD1  ILE  28          1HD1      ILE  28  -6.008   9.991  -1.238
  223   2HD1  ILE  28          2HD1      ILE  28  -5.179   8.590  -1.916
  224   3HD1  ILE  28          3HD1      ILE  28  -6.681   8.375  -1.018
  225    H    GLN  29           H        GLN  29 -10.741   9.895   0.053
  226    HA   GLN  29           HA       GLN  29 -12.573  11.525  -1.398
  227   1HB   GLN  29          2HB       GLN  29 -13.998  11.370   0.656
  228   2HB   GLN  29          1HB       GLN  29 -13.460   9.805   0.056
  229   1HG   GLN  29          2HG       GLN  29 -11.955   9.497   1.815
  230   2HG   GLN  29          1HG       GLN  29 -11.822  11.225   2.139
  231   1HE2  GLN  29          1HE2      GLN  29 -13.292   8.375   3.247
  232   2HE2  GLN  29          2HE2      GLN  29 -14.515   9.083   4.188
  233    H    ASP  30           H        ASP  30 -10.321  12.116   1.228
  234    HA   ASP  30           HA       ASP  30 -10.492  14.976   0.820
  235   1HB   ASP  30          2HB       ASP  30 -12.301  14.136   2.597
  236   2HB   ASP  30          1HB       ASP  30 -10.901  14.174   3.667
  237    H    ALA  31           H        ALA  31  -8.412  13.285   0.298
  238    HA   ALA  31           HA       ALA  31  -6.578  13.047   2.499
  239   1HB   ALA  31          1HB       ALA  31  -6.388  11.492   0.663
  240   2HB   ALA  31          2HB       ALA  31  -4.925  12.477   0.710
  241   3HB   ALA  31          3HB       ALA  31  -6.175  12.811  -0.489
  242    H    GLU  32           H        GLU  32  -4.652  14.176   2.831
  243    HA   GLU  32           HA       GLU  32  -4.809  16.999   2.421
  244   1HB   GLU  32          2HB       GLU  32  -2.633  17.096   3.552
  245   2HB   GLU  32          1HB       GLU  32  -3.756  16.057   4.427
  246   1HG   GLU  32          2HG       GLU  32  -2.660  14.161   2.926
  247   2HG   GLU  32          1HG       GLU  32  -1.325  15.309   2.842
  248    H    ASP  33           H        ASP  33  -2.907  14.415   0.924
  249    HA   ASP  33           HA       ASP  33  -1.848  16.396  -1.005
  250   1HB   ASP  33          2HB       ASP  33  -0.281  14.960   0.557
  251   2HB   ASP  33          1HB       ASP  33  -0.598  13.700  -0.634
  252    H    GLY  34           H        GLY  34  -4.401  14.577  -0.929
  253   1HA   GLY  34          2HA       GLY  34  -5.693  13.494  -2.494
  254   2HA   GLY  34          1HA       GLY  34  -4.587  14.122  -3.711
  255    H    CYS  35           H        CYS  35  -3.566  12.072  -1.041
  256    HA   CYS  35           HA       CYS  35  -3.370   9.715  -2.786
  257   1HB   CYS  35          2HB       CYS  35  -1.014  10.864  -1.270
  258   2HB   CYS  35          1HB       CYS  35  -1.018   9.369  -2.197
  259    HG   CYS  35           HG       CYS  35  -1.430  10.815  -4.373
  260    H    ILE  36           H        ILE  36  -2.281   7.875  -1.368
  261    HA   ILE  36           HA       ILE  36  -3.772   7.860   1.181
  262    HB   ILE  36           HB       ILE  36  -3.535   5.400   1.088
  263   1HG1  ILE  36          2HG1      ILE  36  -2.807   4.981  -1.606
  264   2HG1  ILE  36          1HG1      ILE  36  -1.599   6.087  -0.953
  265   1HG2  ILE  36          1HG2      ILE  36  -5.258   5.095  -0.451
  266   2HG2  ILE  36          2HG2      ILE  36  -4.559   6.225  -1.611
  267   3HG2  ILE  36          3HG2      ILE  36  -5.360   6.832  -0.162
  268   1HD1  ILE  36          1HD1      ILE  36  -2.162   4.062   1.005
  269   2HD1  ILE  36          2HD1      ILE  36  -0.639   4.415   0.192
  270   3HD1  ILE  36          3HD1      ILE  36  -1.785   3.288  -0.536
  271    H    SER  37           H        SER  37  -2.592   6.243   2.807
  272    HA   SER  37           HA       SER  37   0.055   7.425   3.236
  273   1HB   SER  37          2HB       SER  37  -1.833   7.219   5.032
  274   2HB   SER  37          1HB       SER  37  -1.290   5.550   5.159
  275    HG   SER  37           HG       SER  37   0.573   6.206   5.973
  276    H    THR  38           H        THR  38   1.919   6.276   3.324
  277    HA   THR  38           HA       THR  38   2.217   3.943   1.808
  278    HB   THR  38           HB       THR  38   4.453   3.738   3.058
  279    HG1  THR  38           HG1      THR  38   4.286   4.796   4.890
  280   1HG2  THR  38          1HG2      THR  38   3.568   6.203   1.559
  281   2HG2  THR  38          2HG2      THR  38   4.456   4.810   0.941
  282   3HG2  THR  38          3HG2      THR  38   5.251   5.952   2.025
  283    H    LYS  39           H        LYS  39   1.799   4.360   5.301
  284    HA   LYS  39           HA       LYS  39   2.120   1.570   5.930
  285   1HB   LYS  39          2HB       LYS  39   0.861   3.793   7.559
  286   2HB   LYS  39          1HB       LYS  39   1.302   2.197   8.165
  287   1HG   LYS  39          2HG       LYS  39   3.342   3.042   8.630
  288   2HG   LYS  39          1HG       LYS  39   3.619   3.135   6.891
  289   1HD   LYS  39          2HD       LYS  39   2.482   5.396   6.925
  290   2HD   LYS  39          1HD       LYS  39   2.496   5.302   8.686
  291   1HE   LYS  39          2HE       LYS  39   4.913   5.186   8.723
  292   2HE   LYS  39          1HE       LYS  39   4.980   5.054   6.966
  293   1HZ   LYS  39          1HZ       LYS  39   5.440   7.309   7.720
  294   2HZ   LYS  39          2HZ       LYS  39   3.922   7.382   8.479
  295   3HZ   LYS  39          3HZ       LYS  39   4.024   7.256   6.787
  296    H    GLU  40           H        GLU  40  -0.534   3.591   4.903
  297    HA   GLU  40           HA       GLU  40  -2.606   1.779   5.790
  298   1HB   GLU  40          2HB       GLU  40  -2.673   4.398   5.328
  299   2HB   GLU  40          1HB       GLU  40  -3.139   3.854   3.717
  300   1HG   GLU  40          2HG       GLU  40  -5.224   3.895   4.694
  301   2HG   GLU  40          1HG       GLU  40  -4.747   2.259   5.144
  302    H    LEU  41           H        LEU  41  -0.385   1.341   3.429
  303    HA   LEU  41           HA       LEU  41  -1.818   0.732   1.096
  304   1HB   LEU  41          2HB       LEU  41   0.811   0.572   1.878
  305   2HB   LEU  41          1HB       LEU  41   0.376  -1.112   1.691
  306    HG   LEU  41           HG       LEU  41   1.324  -0.354  -0.373
  307   1HD1  LEU  41          1HD1      LEU  41  -0.689  -0.551  -1.920
  308   2HD1  LEU  41          2HD1      LEU  41  -1.692  -0.580  -0.470
  309   3HD1  LEU  41          3HD1      LEU  41  -0.505  -1.854  -0.747
  310   1HD2  LEU  41          1HD2      LEU  41  -0.747   1.678  -0.949
  311   2HD2  LEU  41          2HD2      LEU  41   0.984   1.709  -1.286
  312   3HD2  LEU  41          3HD2      LEU  41   0.392   2.120   0.324
  313    H    GLY  42           H        GLY  42  -1.096  -1.261   3.950
  314   1HA   GLY  42          2HA       GLY  42  -2.115  -3.715   3.027
  315   2HA   GLY  42          1HA       GLY  42  -2.008  -3.233   4.715
  316    H    LYS  43           H        LYS  43  -3.765  -0.821   4.054
  317    HA   LYS  43           HA       LYS  43  -6.290  -2.135   4.592
  318   1HB   LYS  43          2HB       LYS  43  -5.344   0.103   5.590
  319   2HB   LYS  43          1HB       LYS  43  -6.029   0.815   4.130
  320   1HG   LYS  43          2HG       LYS  43  -7.841   0.950   5.569
  321   2HG   LYS  43          1HG       LYS  43  -8.153  -0.605   4.801
  322   1HD   LYS  43          2HD       LYS  43  -6.378  -0.851   7.113
  323   2HD   LYS  43          1HD       LYS  43  -7.939  -0.151   7.542
  324   1HE   LYS  43          2HE       LYS  43  -9.134  -2.027   6.743
  325   2HE   LYS  43          1HE       LYS  43  -7.761  -2.612   5.805
  326   1HZ   LYS  43          1HZ       LYS  43  -8.105  -3.883   7.853
  327   2HZ   LYS  43          2HZ       LYS  43  -7.863  -2.475   8.772
  328   3HZ   LYS  43          3HZ       LYS  43  -6.595  -3.113   7.836
  329    H    VAL  44           H        VAL  44  -4.948  -0.051   2.015
  330    HA   VAL  44           HA       VAL  44  -7.313   0.047   0.458
  331    HB   VAL  44           HB       VAL  44  -5.774   0.681  -1.436
  332   1HG1  VAL  44          1HG1      VAL  44  -5.819   2.047   1.234
  333   2HG1  VAL  44          2HG1      VAL  44  -6.586   2.528  -0.279
  334   3HG1  VAL  44          3HG1      VAL  44  -4.849   2.731  -0.069
  335   1HG2  VAL  44          1HG2      VAL  44  -3.657   0.412   0.721
  336   2HG2  VAL  44          2HG2      VAL  44  -3.410   1.076  -0.893
  337   3HG2  VAL  44          3HG2      VAL  44  -3.805  -0.629  -0.695
  338    H    MET  45           H        MET  45  -4.575  -2.226   0.467
  339    HA   MET  45           HA       MET  45  -5.370  -3.667  -1.864
  340   1HB   MET  45          2HB       MET  45  -3.696  -4.556   0.497
  341   2HB   MET  45          1HB       MET  45  -3.858  -5.441  -1.022
  342   1HG   MET  45          2HG       MET  45  -2.990  -3.436  -2.231
  343   2HG   MET  45          1HG       MET  45  -2.727  -2.651  -0.676
  344   1HE   MET  45          1HE       MET  45  -0.149  -3.399   0.865
  345   2HE   MET  45          2HE       MET  45  -0.659  -5.045   1.232
  346   3HE   MET  45          3HE       MET  45  -1.856  -3.755   1.162
  347    H    ARG  46           H        ARG  46  -6.168  -3.904   1.546
  348    HA   ARG  46           HA       ARG  46  -7.407  -6.436   1.559
  349   1HB   ARG  46          2HB       ARG  46  -7.443  -4.040   3.301
  350   2HB   ARG  46          1HB       ARG  46  -8.851  -5.095   3.424
  351   1HG   ARG  46          2HG       ARG  46  -7.404  -7.026   3.847
  352   2HG   ARG  46          1HG       ARG  46  -5.970  -6.018   3.653
  353   1HD   ARG  46          2HD       ARG  46  -6.412  -6.260   6.024
  354   2HD   ARG  46          1HD       ARG  46  -6.770  -4.603   5.556
  355    HE   ARG  46           HE       ARG  46  -9.016  -4.993   6.033
  356   1HH1  ARG  46          2HH1      ARG  46  -7.260  -8.014   5.919
  357   2HH1  ARG  46          1HH1      ARG  46  -8.578  -8.945   6.544
  358   1HH2  ARG  46          1HH2      ARG  46 -10.725  -6.239   6.853
  359   2HH2  ARG  46          2HH2      ARG  46 -10.531  -7.947   7.071
  360    H    MET  47           H        MET  47  -8.649  -3.199   0.825
  361    HA   MET  47           HA       MET  47 -11.377  -3.942   0.505
  362   1HB   MET  47          2HB       MET  47 -10.017  -1.558   0.531
  363   2HB   MET  47          1HB       MET  47 -10.430  -1.719  -1.176
  364   1HG   MET  47          2HG       MET  47 -12.618  -2.417   0.677
  365   2HG   MET  47          1HG       MET  47 -12.123  -0.726   0.733
  366   1HE   MET  47          1HE       MET  47 -15.085  -2.452  -1.781
  367   2HE   MET  47          2HE       MET  47 -15.227  -1.246  -0.505
  368   3HE   MET  47          3HE       MET  47 -14.435  -2.784  -0.171
  369    H    LEU  48           H        LEU  48  -8.609  -3.798  -1.697
  370    HA   LEU  48           HA       LEU  48 -10.005  -4.237  -4.121
  371   1HB   LEU  48          2HB       LEU  48  -7.359  -3.839  -3.376
  372   2HB   LEU  48          1HB       LEU  48  -7.365  -5.469  -4.013
  373    HG   LEU  48           HG       LEU  48  -6.784  -3.930  -5.779
  374   1HD1  LEU  48          1HD1      LEU  48  -8.519  -4.479  -7.412
  375   2HD1  LEU  48          2HD1      LEU  48  -9.666  -4.811  -6.115
  376   3HD1  LEU  48          3HD1      LEU  48  -8.264  -5.855  -6.341
  377   1HD2  LEU  48          1HD2      LEU  48  -9.405  -2.552  -5.107
  378   2HD2  LEU  48          2HD2      LEU  48  -8.371  -2.150  -6.478
  379   3HD2  LEU  48          3HD2      LEU  48  -7.790  -1.898  -4.832
  380    H    GLY  49           H        GLY  49  -8.372  -6.490  -1.894
  381   1HA   GLY  49          2HA       GLY  49  -9.884  -8.576  -1.586
  382   2HA   GLY  49          1HA       GLY  49  -9.589  -8.774  -3.312
  383    H    GLN  50           H        GLN  50  -7.568  -7.915  -0.491
  384    HA   GLN  50           HA       GLN  50  -5.883 -10.273  -0.953
  385   1HB   GLN  50          2HB       GLN  50  -5.049  -7.456  -1.424
  386   2HB   GLN  50          1HB       GLN  50  -3.910  -8.487  -0.558
  387   1HG   GLN  50          2HG       GLN  50  -3.556  -9.860  -2.366
  388   2HG   GLN  50          1HG       GLN  50  -5.192  -9.640  -2.988
  389   1HE2  GLN  50          1HE2      GLN  50  -2.028  -8.888  -3.704
  390   2HE2  GLN  50          2HE2      GLN  50  -2.278  -7.471  -4.604
  391    H    ASN  51           H        ASN  51  -4.452 -10.733   0.839
  392    HA   ASN  51           HA       ASN  51  -4.879  -9.190   3.290
  393   1HB   ASN  51          2HB       ASN  51  -6.653 -11.083   3.024
  394   2HB   ASN  51          1HB       ASN  51  -5.319 -12.161   3.435
  395   1HD2  ASN  51          1HD2      ASN  51  -6.024 -12.706   5.577
  396   2HD2  ASN  51          2HD2      ASN  51  -6.137 -11.560   6.823
  397    HA   PRO  52           HA       PRO  52  -0.613 -10.994   2.930
  398   1HB   PRO  52          2HB       PRO  52   0.714  -8.615   2.689
  399   2HB   PRO  52          1HB       PRO  52   0.077  -9.515   1.309
  400   1HG   PRO  52          2HG       PRO  52  -0.914  -7.027   2.548
  401   2HG   PRO  52          1HG       PRO  52  -1.128  -7.623   0.897
  402   1HD   PRO  52          2HD       PRO  52  -3.039  -7.729   3.011
  403   2HD   PRO  52          1HD       PRO  52  -3.168  -8.506   1.415
  404    H    THR  53           H        THR  53   1.462  -9.782   4.160
  405    HA   THR  53           HA       THR  53   0.520  -9.388   6.933
  406    HB   THR  53           HB       THR  53   2.586 -10.226   7.697
  407    HG1  THR  53           HG1      THR  53   4.398  -9.958   6.650
  408   1HG2  THR  53          1HG2      THR  53   1.261 -12.010   6.674
  409   2HG2  THR  53          2HG2      THR  53   2.982 -12.313   6.434
  410   3HG2  THR  53          3HG2      THR  53   2.004 -11.682   5.108
  411    HA   PRO  54           HA       PRO  54   1.924  -5.220   6.967
  412   1HB   PRO  54          2HB       PRO  54   3.274  -5.026   9.348
  413   2HB   PRO  54          1HB       PRO  54   1.509  -5.077   9.208
  414   1HG   PRO  54          2HG       PRO  54   3.410  -7.229  10.013
  415   2HG   PRO  54          1HG       PRO  54   1.759  -6.913  10.576
  416   1HD   PRO  54          2HD       PRO  54   2.426  -8.885   8.748
  417   2HD   PRO  54          1HD       PRO  54   0.812  -8.147   8.874
  418    H    GLU  55           H        GLU  55   4.355  -7.678   7.481
  419    HA   GLU  55           HA       GLU  55   6.600  -5.916   6.920
  420   1HB   GLU  55          2HB       GLU  55   6.699  -8.932   6.943
  421   2HB   GLU  55          1HB       GLU  55   7.993  -7.787   7.295
  422   1HG   GLU  55          2HG       GLU  55   6.703  -7.031   9.308
  423   2HG   GLU  55          1HG       GLU  55   5.534  -8.313   8.987
  424    H    GLU  56           H        GLU  56   4.602  -8.295   5.243
  425    HA   GLU  56           HA       GLU  56   6.228  -8.496   2.902
  426   1HB   GLU  56          2HB       GLU  56   3.383  -9.227   3.544
  427   2HB   GLU  56          1HB       GLU  56   3.980  -9.315   1.887
  428   1HG   GLU  56          2HG       GLU  56   5.516 -10.594   4.145
  429   2HG   GLU  56          1HG       GLU  56   4.176 -11.440   3.372
  430    H    LEU  57           H        LEU  57   3.113  -6.791   3.486
  431    HA   LEU  57           HA       LEU  57   3.073  -5.445   1.010
  432   1HB   LEU  57          2HB       LEU  57   1.416  -3.985   1.977
  433   2HB   LEU  57          1HB       LEU  57   1.099  -5.641   2.430
  434    HG   LEU  57           HG       LEU  57   2.499  -4.844   4.602
  435   1HD1  LEU  57          1HD1      LEU  57   2.864  -2.585   4.256
  436   2HD1  LEU  57          2HD1      LEU  57   1.276  -2.506   5.020
  437   3HD1  LEU  57          3HD1      LEU  57   1.417  -2.397   3.266
  438   1HD2  LEU  57          1HD2      LEU  57   0.281  -5.888   4.625
  439   2HD2  LEU  57          2HD2      LEU  57  -0.451  -4.393   4.046
  440   3HD2  LEU  57          3HD2      LEU  57   0.269  -4.456   5.654
  441    H    GLN  58           H        GLN  58   4.711  -4.696   4.026
  442    HA   GLN  58           HA       GLN  58   5.262  -1.982   3.689
  443   1HB   GLN  58          2HB       GLN  58   6.140  -4.035   5.420
  444   2HB   GLN  58          1HB       GLN  58   7.592  -3.307   4.735
  445   1HG   GLN  58          2HG       GLN  58   5.318  -1.740   5.991
  446   2HG   GLN  58          1HG       GLN  58   6.825  -2.149   6.811
  447   1HE2  GLN  58          1HE2      GLN  58   5.379  -0.059   4.372
  448   2HE2  GLN  58          2HE2      GLN  58   6.763   0.884   4.094
  449    H    GLU  59           H        GLU  59   7.141  -4.788   2.554
  450    HA   GLU  59           HA       GLU  59   9.234  -3.352   1.330
  451   1HB   GLU  59          2HB       GLU  59   8.093  -6.091   0.751
  452   2HB   GLU  59          1HB       GLU  59   9.534  -5.456  -0.046
  453   1HG   GLU  59          2HG       GLU  59  10.745  -5.340   1.993
  454   2HG   GLU  59          1HG       GLU  59   9.284  -5.513   2.964
  455    H    MET  60           H        MET  60   6.103  -4.450   0.057
  456    HA   MET  60           HA       MET  60   6.527  -3.759  -2.649
  457   1HB   MET  60          2HB       MET  60   4.050  -4.083  -0.968
  458   2HB   MET  60          1HB       MET  60   3.946  -3.548  -2.646
  459   1HG   MET  60          2HG       MET  60   5.347  -5.579  -3.261
  460   2HG   MET  60          1HG       MET  60   5.105  -6.145  -1.609
  461   1HE   MET  60          1HE       MET  60   3.675  -8.493  -2.528
  462   2HE   MET  60          2HE       MET  60   2.164  -8.096  -1.713
  463   3HE   MET  60          3HE       MET  60   3.696  -7.579  -1.013
  464    H    ILE  61           H        ILE  61   5.197  -1.888   0.074
  465    HA   ILE  61           HA       ILE  61   4.359   0.397  -1.285
  466    HB   ILE  61           HB       ILE  61   5.529   0.088   1.485
  467   1HG1  ILE  61          2HG1      ILE  61   2.672   0.699   0.971
  468   2HG1  ILE  61          1HG1      ILE  61   3.216  -0.912   0.505
  469   1HG2  ILE  61          1HG2      ILE  61   5.803   2.389   0.975
  470   2HG2  ILE  61          2HG2      ILE  61   4.282   2.297   1.864
  471   3HG2  ILE  61          3HG2      ILE  61   4.268   2.463   0.108
  472   1HD1  ILE  61          1HD1      ILE  61   2.361  -0.644   2.909
  473   2HD1  ILE  61          2HD1      ILE  61   3.846   0.259   3.213
  474   3HD1  ILE  61          3HD1      ILE  61   3.927  -1.426   2.704
  475    H    ASP  62           H        ASP  62   7.382   0.279   0.613
  476    HA   ASP  62           HA       ASP  62   8.577   2.541  -0.463
  477   1HB   ASP  62          2HB       ASP  62   9.348   1.065   1.513
  478   2HB   ASP  62          1HB       ASP  62  10.217   0.132   0.294
  479    H    GLU  63           H        GLU  63   8.513  -0.745  -1.766
  480    HA   GLU  63           HA       GLU  63  10.539  -0.527  -3.705
  481   1HB   GLU  63          2HB       GLU  63   8.149  -2.252  -3.328
  482   2HB   GLU  63          1HB       GLU  63   8.815  -2.172  -4.959
  483   1HG   GLU  63          2HG       GLU  63  10.854  -2.464  -2.852
  484   2HG   GLU  63          1HG       GLU  63   9.744  -3.830  -2.970
  485    H    VAL  64           H        VAL  64   7.073   0.262  -3.901
  486    HA   VAL  64           HA       VAL  64   7.388   1.254  -6.632
  487    HB   VAL  64           HB       VAL  64   4.974   1.571  -6.610
  488   1HG1  VAL  64          1HG1      VAL  64   5.828  -0.663  -7.124
  489   2HG1  VAL  64          2HG1      VAL  64   4.319  -0.792  -6.225
  490   3HG1  VAL  64          3HG1      VAL  64   5.855  -1.069  -5.407
  491   1HG2  VAL  64          1HG2      VAL  64   5.062   0.597  -3.739
  492   2HG2  VAL  64          2HG2      VAL  64   3.632   1.084  -4.646
  493   3HG2  VAL  64          3HG2      VAL  64   4.846   2.285  -4.202
  494    H    ASP  65           H        ASP  65   7.460   2.558  -3.437
  495    HA   ASP  65           HA       ASP  65   6.457   5.164  -4.053
  496   1HB   ASP  65          2HB       ASP  65   6.832   3.984  -1.720
  497   2HB   ASP  65          1HB       ASP  65   8.421   4.740  -1.833
  498    H    GLU  66           H        GLU  66   7.524   5.648  -6.005
  499    HA   GLU  66           HA       GLU  66  10.396   5.886  -6.138
  500   1HB   GLU  66          2HB       GLU  66   8.170   6.750  -7.983
  501   2HB   GLU  66          1HB       GLU  66   9.870   7.074  -8.322
  502   1HG   GLU  66          2HG       GLU  66  10.266   4.566  -7.969
  503   2HG   GLU  66          1HG       GLU  66   8.512   4.388  -8.038
  504    H    ASP  67           H        ASP  67   7.852   7.972  -5.042
  505    HA   ASP  67           HA       ASP  67   9.298  10.438  -5.516
  506   1HB   ASP  67          2HB       ASP  67   6.924  10.007  -3.692
  507   2HB   ASP  67          1HB       ASP  67   7.499  11.538  -4.344
  508    H    GLY  68           H        GLY  68   8.454   8.491  -2.641
  509   1HA   GLY  68          2HA       GLY  68   9.621   8.213  -0.649
  510   2HA   GLY  68          1HA       GLY  68  10.913   9.214  -1.306
  511    H    SER  69           H        SER  69   7.514  10.112  -1.138
  512    HA   SER  69           HA       SER  69   8.202  12.493   0.403
  513   1HB   SER  69          2HB       SER  69   5.752  13.049  -0.102
  514   2HB   SER  69          1HB       SER  69   6.848  12.974  -1.476
  515    HG   SER  69           HG       SER  69   4.637  11.614  -1.134
  516    H    GLY  70           H        GLY  70   5.784   9.876   0.518
  517   1HA   GLY  70          2HA       GLY  70   5.865   8.960   3.016
  518   2HA   GLY  70          1HA       GLY  70   5.105  10.527   3.285
  519    H    THR  71           H        THR  71   3.754  10.491   0.670
  520    HA   THR  71           HA       THR  71   1.557   8.647   1.360
  521    HB   THR  71           HB       THR  71   0.117  10.134   0.070
  522    HG1  THR  71           HG1      THR  71   1.221  11.040  -1.502
  523   1HG2  THR  71          1HG2      THR  71   1.954  11.603   1.980
  524   2HG2  THR  71          2HG2      THR  71   0.481  10.730   2.404
  525   3HG2  THR  71          3HG2      THR  71   0.385  12.203   1.439
  526    H    VAL  72           H        VAL  72   0.527   7.433  -0.288
  527    HA   VAL  72           HA       VAL  72   2.325   6.776  -2.524
  528    HB   VAL  72           HB       VAL  72  -0.105   5.261  -1.551
  529   1HG1  VAL  72          1HG1      VAL  72   0.749   3.463  -2.944
  530   2HG1  VAL  72          2HG1      VAL  72   2.184   4.406  -3.345
  531   3HG1  VAL  72          3HG1      VAL  72   0.603   4.913  -3.937
  532   1HG2  VAL  72          1HG2      VAL  72   2.850   4.936  -0.957
  533   2HG2  VAL  72          2HG2      VAL  72   1.645   3.693  -0.619
  534   3HG2  VAL  72          3HG2      VAL  72   1.560   5.252   0.203
  535    H    ASP  73           H        ASP  73   1.925   7.609  -4.434
  536    HA   ASP  73           HA       ASP  73  -0.646   8.834  -5.045
  537   1HB   ASP  73          2HB       ASP  73   1.838   8.557  -6.765
  538   2HB   ASP  73          1HB       ASP  73   0.439   9.567  -7.121
  539    H    PHE  74           H        PHE  74  -1.460   8.405  -7.381
  540    HA   PHE  74           HA       PHE  74  -2.265   5.676  -7.526
  541   1HB   PHE  74          2HB       PHE  74  -3.439   7.811  -8.479
  542   2HB   PHE  74          1HB       PHE  74  -2.430   7.515  -9.895
  543    HD1  PHE  74           HD1      PHE  74  -3.643   6.455 -11.570
  544    HD2  PHE  74           HD2      PHE  74  -4.231   5.270  -7.488
  545    HE1  PHE  74           HE1      PHE  74  -5.210   4.681 -12.311
  546    HE2  PHE  74           HE2      PHE  74  -5.806   3.500  -8.225
  547    HZ   PHE  74           HZ       PHE  74  -6.296   3.205 -10.638
  548    H    ASP  75           H        ASP  75   0.302   7.539  -9.055
  549    HA   ASP  75           HA       ASP  75   0.997   5.685 -11.091
  550   1HB   ASP  75          2HB       ASP  75   2.301   8.018  -9.787
  551   2HB   ASP  75          1HB       ASP  75   3.370   6.858 -10.576
  552    H    GLU  76           H        GLU  76   1.848   5.999  -7.689
  553    HA   GLU  76           HA       GLU  76   3.778   3.820  -7.772
  554   1HB   GLU  76          2HB       GLU  76   2.645   5.041  -5.261
  555   2HB   GLU  76          1HB       GLU  76   4.233   4.313  -5.516
  556   1HG   GLU  76          2HG       GLU  76   4.817   6.182  -7.051
  557   2HG   GLU  76          1HG       GLU  76   3.248   6.917  -6.726
  558    H    PHE  77           H        PHE  77   0.398   4.302  -7.190
  559    HA   PHE  77           HA       PHE  77  -0.078   1.890  -5.693
  560   1HB   PHE  77          2HB       PHE  77  -1.526   3.971  -5.660
  561   2HB   PHE  77          1HB       PHE  77  -2.074   3.529  -7.274
  562    HD1  PHE  77           HD1      PHE  77  -1.700   2.060  -3.832
  563    HD2  PHE  77           HD2      PHE  77  -3.930   2.158  -7.504
  564    HE1  PHE  77           HE1      PHE  77  -3.380   0.520  -2.855
  565    HE2  PHE  77           HE2      PHE  77  -5.610   0.616  -6.526
  566    HZ   PHE  77           HZ       PHE  77  -5.333  -0.202  -4.200
  567    H    LEU  78           H        LEU  78  -0.266   2.863  -9.102
  568    HA   LEU  78           HA       LEU  78  -1.450   0.418 -10.026
  569   1HB   LEU  78          2HB       LEU  78  -0.042   2.666 -11.452
  570   2HB   LEU  78          1HB       LEU  78  -0.694   1.275 -12.287
  571    HG   LEU  78           HG       LEU  78  -2.115   3.579 -11.019
  572   1HD1  LEU  78          1HD1      LEU  78  -3.540   3.207 -13.063
  573   2HD1  LEU  78          2HD1      LEU  78  -2.445   1.904 -13.523
  574   3HD1  LEU  78          3HD1      LEU  78  -1.849   3.561 -13.420
  575   1HD2  LEU  78          1HD2      LEU  78  -4.226   2.091 -11.182
  576   2HD2  LEU  78          2HD2      LEU  78  -3.179   1.866  -9.780
  577   3HD2  LEU  78          3HD2      LEU  78  -3.108   0.728 -11.127
  578    H    VAL  79           H        VAL  79   1.875   1.719 -10.063
  579    HA   VAL  79           HA       VAL  79   3.110  -0.323 -11.514
  580    HB   VAL  79           HB       VAL  79   5.199   0.278 -10.254
  581   1HG1  VAL  79          1HG1      VAL  79   3.446   2.321 -11.600
  582   2HG1  VAL  79          2HG1      VAL  79   4.873   1.500 -12.232
  583   3HG1  VAL  79          3HG1      VAL  79   5.048   2.766 -11.017
  584   1HG2  VAL  79          1HG2      VAL  79   3.333   2.234  -8.882
  585   2HG2  VAL  79          2HG2      VAL  79   5.087   2.197  -8.718
  586   3HG2  VAL  79          3HG2      VAL  79   4.117   0.858  -8.109
  587    H    MET  80           H        MET  80   2.021  -0.326  -8.198
  588    HA   MET  80           HA       MET  80   3.514  -2.294  -6.991
  589   1HB   MET  80          2HB       MET  80   0.919  -1.127  -6.582
  590   2HB   MET  80          1HB       MET  80   0.849  -2.860  -6.262
  591   1HG   MET  80          2HG       MET  80   2.781  -2.677  -4.757
  592   2HG   MET  80          1HG       MET  80   2.894  -0.950  -5.098
  593   1HE   MET  80          1HE       MET  80   1.567   0.688  -4.631
  594   2HE   MET  80          2HE       MET  80   1.916   0.611  -2.906
  595   3HE   MET  80          3HE       MET  80   0.253   0.807  -3.456
  596    H    MET  81           H        MET  81   1.023  -2.727  -9.453
  597    HA   MET  81           HA       MET  81   0.862  -5.588  -9.142
  598   1HB   MET  81          2HB       MET  81  -0.198  -3.619 -11.149
  599   2HB   MET  81          1HB       MET  81  -0.262  -5.349 -11.483
  600   1HG   MET  81          2HG       MET  81  -1.276  -4.222  -8.875
  601   2HG   MET  81          1HG       MET  81  -2.305  -4.292 -10.304
  602   1HE   MET  81          1HE       MET  81  -2.502  -6.183  -7.217
  603   2HE   MET  81          2HE       MET  81  -0.824  -5.693  -7.437
  604   3HE   MET  81          3HE       MET  81  -1.229  -7.404  -7.342
  605    H    VAL  82           H        VAL  82   2.306  -3.441 -11.610
  606    HA   VAL  82           HA       VAL  82   3.458  -5.569 -13.117
  607    HB   VAL  82           HB       VAL  82   4.819  -3.746 -14.202
  608   1HG1  VAL  82          1HG1      VAL  82   2.409  -2.475 -14.691
  609   2HG1  VAL  82          2HG1      VAL  82   1.906  -4.066 -14.121
  610   3HG1  VAL  82          3HG1      VAL  82   2.986  -3.926 -15.511
  611   1HG2  VAL  82          1HG2      VAL  82   4.815  -2.283 -12.120
  612   2HG2  VAL  82          2HG2      VAL  82   3.131  -1.905 -12.486
  613   3HG2  VAL  82          3HG2      VAL  82   4.403  -1.450 -13.619
  614    H    ARG  83           H        ARG  83   4.702  -3.592 -10.450
  615    HA   ARG  83           HA       ARG  83   7.434  -4.174 -10.717
  616   1HB   ARG  83          2HB       ARG  83   7.655  -3.634  -8.342
  617   2HB   ARG  83          1HB       ARG  83   6.591  -2.482  -9.144
  618   1HG   ARG  83          2HG       ARG  83   4.783  -3.125  -7.936
  619   2HG   ARG  83          1HG       ARG  83   5.199  -4.834  -8.040
  620   1HD   ARG  83          2HD       ARG  83   6.730  -2.916  -6.281
  621   2HD   ARG  83          1HD       ARG  83   5.299  -3.762  -5.708
  622    HE   ARG  83           HE       ARG  83   7.922  -4.892  -6.112
  623   1HH1  ARG  83          2HH1      ARG  83   4.494  -5.571  -6.064
  624   2HH1  ARG  83          1HH1      ARG  83   4.705  -7.246  -5.690
  625   1HH2  ARG  83          1HH2      ARG  83   8.171  -7.090  -5.616
  626   2HH2  ARG  83          2HH2      ARG  83   6.778  -8.105  -5.437
  627    H    CYS  84           H        CYS  84   4.830  -6.235  -9.709
  628    HA   CYS  84           HA       CYS  84   6.269  -8.110  -8.146
  629   1HB   CYS  84          2HB       CYS  84   3.691  -7.860  -8.558
  630   2HB   CYS  84          1HB       CYS  84   3.992  -8.954  -9.907
  631    HG   CYS  84           HG       CYS  84   4.527 -10.822  -8.313
  632    H    MET  85           H        MET  85   6.010  -7.632 -11.617
  633    HA   MET  85           HA       MET  85   6.915 -10.200 -12.445
  634   1HB   MET  85          2HB       MET  85   6.642  -7.519 -13.722
  635   2HB   MET  85          1HB       MET  85   7.694  -8.695 -14.504
  636   1HG   MET  85          2HG       MET  85   4.946  -9.517 -13.608
  637   2HG   MET  85          1HG       MET  85   5.150  -8.646 -15.127
  638   1HE   MET  85          1HE       MET  85   4.691 -12.703 -15.440
  639   2HE   MET  85          2HE       MET  85   3.845 -11.187 -15.735
  640   3HE   MET  85          3HE       MET  85   4.223 -11.670 -14.083
  641    H    LYS  86           H        LYS  86   8.572  -7.164 -11.681
  642    HA   LYS  86           HA       LYS  86  10.742  -6.679 -11.169
  643   1HB   LYS  86          2HB       LYS  86  10.594  -9.588 -10.648
  644   2HB   LYS  86          1HB       LYS  86  12.213  -8.936 -10.891
  645   1HG   LYS  86          2HG       LYS  86  10.406  -7.363  -9.128
  646   2HG   LYS  86          1HG       LYS  86  10.973  -8.908  -8.492
  647   1HD   LYS  86          2HD       LYS  86  13.292  -7.923  -9.516
  648   2HD   LYS  86          1HD       LYS  86  12.491  -6.424  -9.047
  649   1HE   LYS  86          2HE       LYS  86  13.451  -6.914  -7.022
  650   2HE   LYS  86          1HE       LYS  86  11.989  -7.882  -6.838
  651   1HZ   LYS  86          1HZ       LYS  86  14.597  -8.867  -7.871
  652   2HZ   LYS  86          2HZ       LYS  86  13.189  -9.800  -7.683
  653   3HZ   LYS  86          3HZ       LYS  86  13.975  -9.160  -6.320
  654    H    ASP  87           H        ASP  87  11.514  -9.708 -12.859
  655    HA   ASP  87           HA       ASP  87  12.596 -10.160 -14.821
  656   1HB   ASP  87          2HB       ASP  87  11.420  -7.477 -15.506
  657   2HB   ASP  87          1HB       ASP  87  12.518  -8.292 -16.618
  658    H    ASP  88           H        ASP  88  13.250  -6.653 -14.593
  659    HA   ASP  88           HA       ASP  88  15.202  -5.466 -14.430
  660   1HB   ASP  88          2HB       ASP  88  16.415  -7.904 -13.114
  661   2HB   ASP  88          1HB       ASP  88  16.867  -6.214 -12.892
  662    H    SER  89           HN       SER  89  14.717  -6.821 -16.838
  663    HA   SER  89           HA       SER  89  17.429  -6.990 -17.885
  664   1HB   SER  89          2HB       SER  89  15.580  -9.348 -17.754
  665   2HB   SER  89          1HB       SER  89  16.662  -9.172 -19.133
  666    HG   SER  89           HG       SER  89  18.354  -9.465 -17.858
  Start of MODEL   28
    1   1H    MET   1          1H        MET   1  13.347   5.533 -16.951
    2   2H    MET   1          2H        MET   1  12.257   5.087 -15.726
    3   3H    MET   1          3H        MET   1  12.052   6.554 -16.555
    4    HA   MET   1           HA       MET   1  10.464   4.925 -17.347
    5   1HB   MET   1          2HB       MET   1  11.745   6.622 -18.879
    6   2HB   MET   1          1HB       MET   1  12.547   5.181 -19.507
    7   1HG   MET   1          2HG       MET   1  10.156   4.216 -19.775
    8   2HG   MET   1          1HG       MET   1   9.614   5.884 -19.591
    9   1HE   MET   1          1HE       MET   1   9.418   7.501 -21.750
   10   2HE   MET   1          2HE       MET   1   8.484   6.020 -21.549
   11   3HE   MET   1          3HE       MET   1   9.166   6.416 -23.124
   12    H    ASN   2           H        ASN   2  10.009   2.819 -17.597
   13    HA   ASN   2           HA       ASN   2  12.232   0.930 -18.099
   14   1HB   ASN   2          2HB       ASN   2  10.037   0.694 -16.038
   15   2HB   ASN   2          1HB       ASN   2  11.035  -0.665 -16.552
   16   1HD2  ASN   2          1HD2      ASN   2  13.567   0.117 -16.599
   17   2HD2  ASN   2          2HD2      ASN   2  14.058   0.880 -15.167
   18    H    ASP   3           H        ASP   3  11.318  -1.303 -18.684
   19    HA   ASP   3           HA       ASP   3   9.135  -0.898 -20.632
   20   1HB   ASP   3          2HB       ASP   3  11.566  -1.736 -21.248
   21   2HB   ASP   3          1HB       ASP   3  10.917  -3.293 -20.732
   22    H    ILE   4           H        ILE   4   9.547  -2.207 -17.583
   23    HA   ILE   4           HA       ILE   4   8.104  -4.670 -17.942
   24    HB   ILE   4           HB       ILE   4   8.092  -4.915 -15.599
   25   1HG1  ILE   4          2HG1      ILE   4   7.175  -2.537 -15.233
   26   2HG1  ILE   4          1HG1      ILE   4   8.245  -3.182 -13.994
   27   1HG2  ILE   4          1HG2      ILE   4  10.331  -5.061 -16.595
   28   2HG2  ILE   4          2HG2      ILE   4  10.414  -4.452 -14.943
   29   3HG2  ILE   4          3HG2      ILE   4  10.585  -3.341 -16.301
   30   1HD1  ILE   4          1HD1      ILE   4   9.051  -0.996 -14.358
   31   2HD1  ILE   4          2HD1      ILE   4   8.840  -1.113 -16.104
   32   3HD1  ILE   4          3HD1      ILE   4  10.141  -2.000 -15.311
   33    H    TYR   5           H        TYR   5   7.246  -1.337 -17.484
   34    HA   TYR   5           HA       TYR   5   4.550  -1.737 -16.606
   35   1HB   TYR   5          2HB       TYR   5   5.699   0.652 -18.075
   36   2HB   TYR   5          1HB       TYR   5   4.244   0.617 -17.079
   37    HD1  TYR   5           HD1      TYR   5   7.619   1.506 -17.077
   38    HD2  TYR   5           HD2      TYR   5   4.687  -0.461 -14.636
   39    HE1  TYR   5           HE1      TYR   5   8.984   1.974 -15.064
   40    HE2  TYR   5           HE2      TYR   5   6.050   0.013 -12.616
   41    HH   TYR   5           HH       TYR   5   8.871   0.503 -12.377
   42    H    LYS   6           H        LYS   6   6.170  -1.435 -19.710
   43    HA   LYS   6           HA       LYS   6   3.751  -1.294 -21.279
   44   1HB   LYS   6          2HB       LYS   6   6.464  -2.146 -22.305
   45   2HB   LYS   6          1HB       LYS   6   5.157  -1.365 -23.194
   46   1HG   LYS   6          2HG       LYS   6   6.984  -0.151 -21.112
   47   2HG   LYS   6          1HG       LYS   6   6.743   0.362 -22.782
   48   1HD   LYS   6          2HD       LYS   6   4.521   1.157 -22.300
   49   2HD   LYS   6          1HD       LYS   6   4.548   0.426 -20.693
   50   1HE   LYS   6          2HE       LYS   6   6.038   2.021 -19.849
   51   2HE   LYS   6          1HE       LYS   6   6.643   2.449 -21.450
   52   1HZ   LYS   6          1HZ       LYS   6   3.908   3.033 -20.447
   53   2HZ   LYS   6          2HZ       LYS   6   4.544   3.491 -21.955
   54   3HZ   LYS   6          3HZ       LYS   6   5.178   4.155 -20.525
   55    H    ALA   7           H        ALA   7   6.026  -3.790 -20.285
   56    HA   ALA   7           HA       ALA   7   4.843  -5.899 -21.829
   57   1HB   ALA   7          1HB       ALA   7   6.822  -5.789 -19.571
   58   2HB   ALA   7          2HB       ALA   7   7.060  -6.339 -21.229
   59   3HB   ALA   7          3HB       ALA   7   6.149  -7.334 -20.093
   60    H    ALA   8           H        ALA   8   4.296  -4.532 -18.631
   61    HA   ALA   8           HA       ALA   8   2.622  -6.723 -17.749
   62   1HB   ALA   8          1HB       ALA   8   3.309  -4.027 -16.582
   63   2HB   ALA   8          2HB       ALA   8   3.792  -5.624 -16.007
   64   3HB   ALA   8          3HB       ALA   8   2.116  -5.098 -15.846
   65    H    VAL   9           H        VAL   9   2.167  -3.587 -19.302
   66    HA   VAL   9           HA       VAL   9  -0.524  -3.130 -18.702
   67    HB   VAL   9           HB       VAL   9   1.165  -1.654 -20.021
   68   1HG1  VAL   9          1HG1      VAL   9  -0.272  -2.691 -22.434
   69   2HG1  VAL   9          2HG1      VAL   9   1.153  -3.561 -21.870
   70   3HG1  VAL   9          3HG1      VAL   9   1.282  -1.864 -22.325
   71   1HG2  VAL   9          1HG2      VAL   9  -1.680  -1.736 -21.043
   72   2HG2  VAL   9          2HG2      VAL   9  -0.651  -0.324 -20.811
   73   3HG2  VAL   9          3HG2      VAL   9  -1.280  -1.194 -19.413
   74    H    GLU  10           H        GLU  10   0.904  -5.396 -20.972
   75    HA   GLU  10           HA       GLU  10  -1.516  -5.979 -22.401
   76   1HB   GLU  10          2HB       GLU  10   1.097  -7.480 -22.133
   77   2HB   GLU  10          1HB       GLU  10  -0.235  -8.021 -23.155
   78   1HG   GLU  10          2HG       GLU  10   0.067  -6.331 -24.687
   79   2HG   GLU  10          1HG       GLU  10   0.641  -5.189 -23.471
   80    H    GLN  11           H        GLN  11  -0.147  -7.032 -19.373
   81    HA   GLN  11           HA       GLN  11  -1.802  -9.423 -19.212
   82   1HB   GLN  11          2HB       GLN  11  -0.048  -8.153 -17.097
   83   2HB   GLN  11          1HB       GLN  11  -0.769  -9.761 -17.030
   84   1HG   GLN  11          2HG       GLN  11   0.499 -10.366 -19.103
   85   2HG   GLN  11          1HG       GLN  11   1.296  -8.794 -19.029
   86   1HE2  GLN  11          1HE2      GLN  11   2.300  -8.361 -16.679
   87   2HE2  GLN  11          2HE2      GLN  11   3.138  -9.677 -16.010
   88    H    LEU  12           H        LEU  12  -1.521  -6.310 -17.521
   89    HA   LEU  12           HA       LEU  12  -3.850  -6.718 -15.907
   90   1HB   LEU  12          2HB       LEU  12  -3.632  -4.303 -15.401
   91   2HB   LEU  12          1HB       LEU  12  -2.180  -5.224 -15.092
   92    HG   LEU  12           HG       LEU  12  -1.932  -4.244 -17.730
   93   1HD1  LEU  12          1HD1      LEU  12  -3.802  -2.672 -16.991
   94   2HD1  LEU  12          2HD1      LEU  12  -2.323  -1.893 -17.552
   95   3HD1  LEU  12          3HD1      LEU  12  -2.659  -2.010 -15.824
   96   1HD2  LEU  12          1HD2      LEU  12  -0.729  -3.178 -15.156
   97   2HD2  LEU  12          2HD2      LEU  12  -0.041  -3.043 -16.774
   98   3HD2  LEU  12          3HD2      LEU  12  -0.163  -4.622 -15.997
   99    H    THR  13           H        THR  13  -5.899  -5.913 -16.132
  100    HA   THR  13           HA       THR  13  -6.624  -4.981 -18.845
  101    HB   THR  13           HB       THR  13  -9.002  -5.681 -17.839
  102    HG1  THR  13           HG1      THR  13  -8.465  -6.429 -15.892
  103   1HG2  THR  13          1HG2      THR  13  -8.329  -6.672 -19.842
  104   2HG2  THR  13          2HG2      THR  13  -8.422  -8.053 -18.749
  105   3HG2  THR  13          3HG2      THR  13  -6.856  -7.337 -19.135
  106    H    ASP  14           H        ASP  14  -8.726  -3.674 -18.829
  107    HA   ASP  14           HA       ASP  14  -8.301  -1.235 -17.441
  108   1HB   ASP  14          2HB       ASP  14 -10.730  -2.318 -18.886
  109   2HB   ASP  14          1HB       ASP  14 -10.631  -0.680 -18.239
  110    H    GLU  15           H        GLU  15 -10.164  -4.119 -16.747
  111    HA   GLU  15           HA       GLU  15 -11.866  -3.121 -14.724
  112   1HB   GLU  15          2HB       GLU  15 -10.725  -5.864 -15.263
  113   2HB   GLU  15          1HB       GLU  15 -11.807  -5.550 -13.909
  114   1HG   GLU  15          2HG       GLU  15 -13.358  -6.138 -15.528
  115   2HG   GLU  15          1HG       GLU  15 -13.285  -4.396 -15.792
  116    H    GLN  16           H        GLN  16  -8.574  -4.457 -14.612
  117    HA   GLN  16           HA       GLN  16  -8.248  -4.498 -11.811
  118   1HB   GLN  16          2HB       GLN  16  -6.363  -4.359 -14.137
  119   2HB   GLN  16          1HB       GLN  16  -5.739  -4.082 -12.511
  120   1HG   GLN  16          2HG       GLN  16  -6.415  -6.237 -11.768
  121   2HG   GLN  16          1HG       GLN  16  -7.449  -6.483 -13.176
  122   1HE2  GLN  16          1HE2      GLN  16  -3.965  -5.719 -12.540
  123   2HE2  GLN  16          2HE2      GLN  16  -3.376  -6.773 -13.734
  124    H    LYS  17           H        LYS  17  -7.540  -1.966 -14.214
  125    HA   LYS  17           HA       LYS  17  -6.533  -0.065 -12.346
  126   1HB   LYS  17          2HB       LYS  17  -7.350  -0.036 -15.194
  127   2HB   LYS  17          1HB       LYS  17  -7.421   1.511 -14.350
  128   1HG   LYS  17          2HG       LYS  17  -5.198   1.689 -14.659
  129   2HG   LYS  17          1HG       LYS  17  -5.001   0.355 -13.524
  130   1HD   LYS  17          2HD       LYS  17  -4.023  -0.718 -15.271
  131   2HD   LYS  17          1HD       LYS  17  -5.676  -0.979 -15.826
  132   1HE   LYS  17          2HE       LYS  17  -4.169   1.540 -16.532
  133   2HE   LYS  17          1HE       LYS  17  -4.009   0.076 -17.501
  134   1HZ   LYS  17          1HZ       LYS  17  -6.473   0.061 -17.682
  135   2HZ   LYS  17          2HZ       LYS  17  -5.735   1.396 -18.432
  136   3HZ   LYS  17          3HZ       LYS  17  -6.503   1.581 -16.928
  137    H    ASN  18           H        ASN  18  -9.762  -0.903 -13.452
  138    HA   ASN  18           HA       ASN  18 -11.101   1.427 -12.517
  139   1HB   ASN  18          2HB       ASN  18 -12.644   0.379 -13.784
  140   2HB   ASN  18          1HB       ASN  18 -11.832  -1.171 -13.636
  141   1HD2  ASN  18          1HD2      ASN  18 -12.722  -2.695 -12.188
  142   2HD2  ASN  18          2HD2      ASN  18 -14.056  -2.375 -11.186
  143    H    GLU  19           H        GLU  19 -10.479  -1.765 -11.078
  144    HA   GLU  19           HA       GLU  19 -11.784  -1.258  -8.591
  145   1HB   GLU  19          2HB       GLU  19  -9.496  -3.170  -9.143
  146   2HB   GLU  19          1HB       GLU  19 -10.592  -3.218  -7.761
  147   1HG   GLU  19          2HG       GLU  19 -12.446  -3.821  -9.109
  148   2HG   GLU  19          1HG       GLU  19 -11.617  -3.359 -10.593
  149    H    PHE  20           H        PHE  20  -8.467  -0.918  -9.749
  150    HA   PHE  20           HA       PHE  20  -7.251  -0.185  -7.302
  151   1HB   PHE  20          2HB       PHE  20  -6.552   0.147 -10.196
  152   2HB   PHE  20          1HB       PHE  20  -5.628   1.037  -8.991
  153    HD1  PHE  20           HD1      PHE  20  -3.626  -0.274  -9.686
  154    HD2  PHE  20           HD2      PHE  20  -7.081  -2.156  -7.965
  155    HE1  PHE  20           HE1      PHE  20  -2.285  -2.297  -9.212
  156    HE2  PHE  20           HE2      PHE  20  -5.739  -4.183  -7.491
  157    HZ   PHE  20           HZ       PHE  20  -3.339  -4.256  -8.113
  158    H    LYS  21           H        LYS  21  -8.720   1.748  -9.902
  159    HA   LYS  21           HA       LYS  21  -8.099   4.292  -8.806
  160   1HB   LYS  21          2HB       LYS  21  -8.814   3.887 -11.179
  161   2HB   LYS  21          1HB       LYS  21 -10.452   3.609 -10.585
  162   1HG   LYS  21          2HG       LYS  21 -10.168   5.945 -11.341
  163   2HG   LYS  21          1HG       LYS  21 -10.489   5.875  -9.608
  164   1HD   LYS  21          2HD       LYS  21  -8.257   6.360  -9.044
  165   2HD   LYS  21          1HD       LYS  21  -7.656   5.894 -10.636
  166   1HE   LYS  21          2HE       LYS  21  -9.610   8.148 -10.506
  167   2HE   LYS  21          1HE       LYS  21  -7.966   8.462  -9.954
  168   1HZ   LYS  21          1HZ       LYS  21  -8.713   7.320 -12.595
  169   2HZ   LYS  21          2HZ       LYS  21  -7.131   7.637 -12.061
  170   3HZ   LYS  21          3HZ       LYS  21  -8.218   8.918 -12.315
  171    H    ALA  22           H        ALA  22 -10.941   2.172  -8.514
  172    HA   ALA  22           HA       ALA  22 -12.496   3.964  -6.936
  173   1HB   ALA  22          1HB       ALA  22 -13.677   2.179  -7.974
  174   2HB   ALA  22          2HB       ALA  22 -13.701   1.819  -6.248
  175   3HB   ALA  22          3HB       ALA  22 -12.579   0.968  -7.311
  176    H    ALA  23           H        ALA  23 -10.301   1.285  -6.130
  177    HA   ALA  23           HA       ALA  23 -10.628   1.389  -3.315
  178   1HB   ALA  23          1HB       ALA  23  -9.614  -0.573  -4.140
  179   2HB   ALA  23          2HB       ALA  23  -8.294   0.289  -3.349
  180   3HB   ALA  23          3HB       ALA  23  -8.446   0.329  -5.106
  181    H    PHE  24           H        PHE  24  -8.838   3.353  -5.548
  182    HA   PHE  24           HA       PHE  24  -7.097   4.507  -3.524
  183   1HB   PHE  24          2HB       PHE  24  -6.596   4.146  -6.068
  184   2HB   PHE  24          1HB       PHE  24  -7.507   5.637  -6.282
  185    HD1  PHE  24           HD1      PHE  24  -6.677   7.773  -5.367
  186    HD2  PHE  24           HD2      PHE  24  -4.440   4.127  -4.934
  187    HE1  PHE  24           HE1      PHE  24  -4.666   9.078  -4.736
  188    HE2  PHE  24           HE2      PHE  24  -2.433   5.436  -4.301
  189    HZ   PHE  24           HZ       PHE  24  -2.548   7.910  -4.201
  190    H    ASP  25           H        ASP  25  -9.660   5.695  -5.713
  191    HA   ASP  25           HA       ASP  25  -9.890   8.280  -4.715
  192   1HB   ASP  25          2HB       ASP  25 -11.020   7.146  -6.779
  193   2HB   ASP  25          1HB       ASP  25 -12.333   6.812  -5.650
  194    H    ILE  26           H        ILE  26 -11.468   5.312  -3.508
  195    HA   ILE  26           HA       ILE  26 -13.345   6.494  -1.805
  196    HB   ILE  26           HB       ILE  26 -13.147   4.423  -0.410
  197   1HG1  ILE  26          2HG1      ILE  26 -10.974   3.740  -2.419
  198   2HG1  ILE  26          1HG1      ILE  26 -10.718   4.068  -0.708
  199   1HG2  ILE  26          1HG2      ILE  26 -13.425   2.936  -2.690
  200   2HG2  ILE  26          2HG2      ILE  26 -13.683   4.566  -3.310
  201   3HG2  ILE  26          3HG2      ILE  26 -14.695   3.947  -2.004
  202   1HD1  ILE  26          1HD1      ILE  26 -10.785   1.694  -0.896
  203   2HD1  ILE  26          2HD1      ILE  26 -12.197   1.746  -1.951
  204   3HD1  ILE  26          3HD1      ILE  26 -12.356   2.160  -0.244
  205    H    PHE  27           H        PHE  27  -9.894   5.928  -1.326
  206    HA   PHE  27           HA       PHE  27  -9.951   6.928   1.407
  207   1HB   PHE  27          2HB       PHE  27  -7.857   5.812  -0.415
  208   2HB   PHE  27          1HB       PHE  27  -7.345   6.825   0.936
  209    HD1  PHE  27           HD1      PHE  27  -7.690   6.123   3.249
  210    HD2  PHE  27           HD2      PHE  27  -8.991   3.669  -0.029
  211    HE1  PHE  27           HE1      PHE  27  -8.005   4.215   4.801
  212    HE2  PHE  27           HE2      PHE  27  -9.306   1.763   1.524
  213    HZ   PHE  27           HZ       PHE  27  -8.813   2.035   3.939
  214    H    ILE  28           H        ILE  28  -9.211   8.096  -1.828
  215    HA   ILE  28           HA       ILE  28  -8.168  10.633  -0.789
  216    HB   ILE  28           HB       ILE  28  -8.548   9.929  -3.698
  217   1HG1  ILE  28          2HG1      ILE  28  -7.199   8.128  -3.033
  218   2HG1  ILE  28          1HG1      ILE  28  -6.021   9.343  -3.501
  219   1HG2  ILE  28          1HG2      ILE  28  -6.390  11.410  -3.712
  220   2HG2  ILE  28          2HG2      ILE  28  -6.957  11.928  -2.123
  221   3HG2  ILE  28          3HG2      ILE  28  -7.967  12.183  -3.545
  222   1HD1  ILE  28          1HD1      ILE  28  -6.118  10.051  -0.984
  223   2HD1  ILE  28          2HD1      ILE  28  -5.187   8.624  -1.437
  224   3HD1  ILE  28          3HD1      ILE  28  -6.797   8.441  -0.741
  225    H    GLN  29           H        GLN  29 -10.914  10.062  -0.237
  226    HA   GLN  29           HA       GLN  29 -12.616  11.411  -2.109
  227   1HB   GLN  29          2HB       GLN  29 -14.278  11.409  -0.233
  228   2HB   GLN  29          1HB       GLN  29 -13.633   9.814  -0.612
  229   1HG   GLN  29          2HG       GLN  29 -12.431   9.678   1.357
  230   2HG   GLN  29          1HG       GLN  29 -12.216  11.424   1.473
  231   1HE2  GLN  29          1HE2      GLN  29 -14.476   8.770   2.131
  232   2HE2  GLN  29          2HE2      GLN  29 -15.529   9.682   3.102
  233    H    ASP  30           H        ASP  30 -10.694  12.375   0.657
  234    HA   ASP  30           HA       ASP  30 -10.953  15.164  -0.067
  235   1HB   ASP  30          2HB       ASP  30 -12.867  14.347   1.652
  236   2HB   ASP  30          1HB       ASP  30 -11.578  14.700   2.801
  237    H    ALA  31           H        ALA  31  -8.757  13.510  -0.176
  238    HA   ALA  31           HA       ALA  31  -7.140  13.585   2.177
  239   1HB   ALA  31          1HB       ALA  31  -6.835  12.015   0.211
  240   2HB   ALA  31          2HB       ALA  31  -5.361  12.794   0.787
  241   3HB   ALA  31          3HB       ALA  31  -6.157  13.382  -0.673
  242    H    GLU  32           H        GLU  32  -5.153  14.787   2.431
  243    HA   GLU  32           HA       GLU  32  -5.505  17.590   2.053
  244   1HB   GLU  32          2HB       GLU  32  -3.154  15.947   2.997
  245   2HB   GLU  32          1HB       GLU  32  -3.106  17.708   2.893
  246   1HG   GLU  32          2HG       GLU  32  -5.326  17.596   4.278
  247   2HG   GLU  32          1HG       GLU  32  -4.786  15.968   4.685
  248    H    ASP  33           H        ASP  33  -3.229  15.252   0.634
  249    HA   ASP  33           HA       ASP  33  -2.534  17.239  -1.436
  250   1HB   ASP  33          2HB       ASP  33  -1.127  14.702  -0.570
  251   2HB   ASP  33          1HB       ASP  33  -0.612  15.715  -1.917
  252    H    GLY  34           H        GLY  34  -3.756  13.956  -0.951
  253   1HA   GLY  34          2HA       GLY  34  -5.481  13.204  -2.547
  254   2HA   GLY  34          1HA       GLY  34  -4.467  13.857  -3.829
  255    H    CYS  35           H        CYS  35  -3.690  11.840  -0.993
  256    HA   CYS  35           HA       CYS  35  -3.128   9.515  -2.639
  257   1HB   CYS  35          2HB       CYS  35  -0.738   9.563  -1.348
  258   2HB   CYS  35          1HB       CYS  35  -0.968  10.126  -2.999
  259    HG   CYS  35           HG       CYS  35  -0.762  11.993  -0.505
  260    H    ILE  36           H        ILE  36  -2.178   7.713  -1.214
  261    HA   ILE  36           HA       ILE  36  -3.570   7.820   1.393
  262    HB   ILE  36           HB       ILE  36  -3.474   5.336   1.320
  263   1HG1  ILE  36          2HG1      ILE  36  -3.005   4.920  -1.449
  264   2HG1  ILE  36          1HG1      ILE  36  -1.657   5.885  -0.848
  265   1HG2  ILE  36          1HG2      ILE  36  -4.685   6.392  -1.239
  266   2HG2  ILE  36          2HG2      ILE  36  -5.370   6.767   0.343
  267   3HG2  ILE  36          3HG2      ILE  36  -5.280   5.093  -0.205
  268   1HD1  ILE  36          1HD1      ILE  36  -0.784   4.053   0.108
  269   2HD1  ILE  36          2HD1      ILE  36  -2.152   3.093  -0.452
  270   3HD1  ILE  36          3HD1      ILE  36  -2.223   3.903   1.116
  271    H    SER  37           H        SER  37  -2.449   6.075   2.951
  272    HA   SER  37           HA       SER  37   0.285   7.067   3.309
  273   1HB   SER  37          2HB       SER  37  -1.452   7.056   5.191
  274   2HB   SER  37          1HB       SER  37  -1.253   5.306   5.219
  275    HG   SER  37           HG       SER  37   0.146   6.524   6.667
  276    H    THR  38           H        THR  38   2.055   5.718   3.548
  277    HA   THR  38           HA       THR  38   2.174   3.428   1.910
  278    HB   THR  38           HB       THR  38   4.369   2.989   3.142
  279    HG1  THR  38           HG1      THR  38   4.304   3.936   5.034
  280   1HG2  THR  38          1HG2      THR  38   5.359   5.196   2.270
  281   2HG2  THR  38          2HG2      THR  38   3.709   5.611   1.805
  282   3HG2  THR  38          3HG2      THR  38   4.493   4.195   1.106
  283    H    LYS  39           H        LYS  39   1.848   3.774   5.433
  284    HA   LYS  39           HA       LYS  39   1.834   0.957   5.968
  285   1HB   LYS  39          2HB       LYS  39   1.217   1.560   8.221
  286   2HB   LYS  39          1HB       LYS  39   2.429   2.709   7.655
  287   1HG   LYS  39          2HG       LYS  39   0.251   4.052   6.875
  288   2HG   LYS  39          1HG       LYS  39  -0.479   3.133   8.191
  289   1HD   LYS  39          2HD       LYS  39   1.611   3.918   9.558
  290   2HD   LYS  39          1HD       LYS  39   1.744   5.156   8.309
  291   1HE   LYS  39          2HE       LYS  39   0.369   6.231   9.852
  292   2HE   LYS  39          1HE       LYS  39  -0.828   5.494   8.788
  293   1HZ   LYS  39          1HZ       LYS  39  -1.307   5.095  11.137
  294   2HZ   LYS  39          2HZ       LYS  39   0.182   4.295  11.313
  295   3HZ   LYS  39          3HZ       LYS  39  -1.023   3.645  10.305
  296    H    GLU  40           H        GLU  40  -0.539   3.174   4.801
  297    HA   GLU  40           HA       GLU  40  -2.855   1.717   5.727
  298   1HB   GLU  40          2HB       GLU  40  -2.380   4.087   3.972
  299   2HB   GLU  40          1HB       GLU  40  -3.916   3.235   3.832
  300   1HG   GLU  40          2HG       GLU  40  -4.137   3.425   6.352
  301   2HG   GLU  40          1HG       GLU  40  -2.738   4.500   6.319
  302    H    LEU  41           H        LEU  41  -0.578   1.005   3.375
  303    HA   LEU  41           HA       LEU  41  -2.077   0.193   1.150
  304   1HB   LEU  41          2HB       LEU  41   0.548   0.161   1.736
  305   2HB   LEU  41          1HB       LEU  41   0.185  -1.533   1.983
  306    HG   LEU  41           HG       LEU  41  -0.171   0.064  -0.559
  307   1HD1  LEU  41          1HD1      LEU  41   1.841  -1.804   0.525
  308   2HD1  LEU  41          2HD1      LEU  41   2.001  -0.585  -0.739
  309   3HD1  LEU  41          3HD1      LEU  41   1.320  -2.167  -1.119
  310   1HD2  LEU  41          1HD2      LEU  41  -0.975  -2.049  -1.555
  311   2HD2  LEU  41          2HD2      LEU  41  -2.046  -1.524  -0.254
  312   3HD2  LEU  41          3HD2      LEU  41  -0.892  -2.828   0.026
  313    H    GLY  42           H        GLY  42  -1.157  -1.633   4.072
  314   1HA   GLY  42          2HA       GLY  42  -2.371  -4.080   3.364
  315   2HA   GLY  42          1HA       GLY  42  -2.014  -3.559   5.005
  316    H    LYS  43           H        LYS  43  -3.777  -1.076   4.346
  317    HA   LYS  43           HA       LYS  43  -6.245  -2.241   5.348
  318   1HB   LYS  43          2HB       LYS  43  -5.588   0.650   4.728
  319   2HB   LYS  43          1HB       LYS  43  -6.985   0.068   5.632
  320   1HG   LYS  43          2HG       LYS  43  -4.311  -0.821   6.599
  321   2HG   LYS  43          1HG       LYS  43  -4.713   0.878   6.838
  322   1HD   LYS  43          2HD       LYS  43  -6.859  -1.051   7.522
  323   2HD   LYS  43          1HD       LYS  43  -5.441  -1.080   8.571
  324   1HE   LYS  43          2HE       LYS  43  -5.649   1.421   8.797
  325   2HE   LYS  43          1HE       LYS  43  -7.176   1.317   7.922
  326   1HZ   LYS  43          1HZ       LYS  43  -7.991  -0.209   9.624
  327   2HZ   LYS  43          2HZ       LYS  43  -7.552   1.289  10.294
  328   3HZ   LYS  43          3HZ       LYS  43  -6.532  -0.058  10.475
  329    H    VAL  44           H        VAL  44  -5.048  -0.752   2.369
  330    HA   VAL  44           HA       VAL  44  -7.667  -0.546   1.180
  331    HB   VAL  44           HB       VAL  44  -6.437   0.004  -0.906
  332   1HG1  VAL  44          1HG1      VAL  44  -6.994   1.805   0.600
  333   2HG1  VAL  44          2HG1      VAL  44  -5.355   2.084   0.013
  334   3HG1  VAL  44          3HG1      VAL  44  -5.614   1.434   1.633
  335   1HG2  VAL  44          1HG2      VAL  44  -3.924  -0.170   0.767
  336   2HG2  VAL  44          2HG2      VAL  44  -4.053   0.102  -0.971
  337   3HG2  VAL  44          3HG2      VAL  44  -4.439  -1.480  -0.296
  338    H    MET  45           H        MET  45  -5.084  -2.934   1.218
  339    HA   MET  45           HA       MET  45  -5.908  -4.497  -0.981
  340   1HB   MET  45          2HB       MET  45  -4.634  -5.555   1.554
  341   2HB   MET  45          1HB       MET  45  -4.602  -6.294  -0.044
  342   1HG   MET  45          2HG       MET  45  -3.564  -3.517   0.119
  343   2HG   MET  45          1HG       MET  45  -2.587  -4.757   0.903
  344   1HE   MET  45          1HE       MET  45  -3.692  -4.091  -3.407
  345   2HE   MET  45          2HE       MET  45  -4.482  -3.549  -1.926
  346   3HE   MET  45          3HE       MET  45  -4.838  -5.150  -2.572
  347    H    ARG  46           H        ARG  46  -6.944  -4.417   2.383
  348    HA   ARG  46           HA       ARG  46  -8.491  -6.778   2.419
  349   1HB   ARG  46          2HB       ARG  46  -8.378  -4.294   4.048
  350   2HB   ARG  46          1HB       ARG  46  -9.855  -5.252   4.160
  351   1HG   ARG  46          2HG       ARG  46  -8.383  -7.281   4.558
  352   2HG   ARG  46          1HG       ARG  46  -7.022  -6.169   4.712
  353   1HD   ARG  46          2HD       ARG  46  -7.644  -5.527   6.784
  354   2HD   ARG  46          1HD       ARG  46  -9.328  -5.342   6.312
  355    HE   ARG  46           HE       ARG  46  -8.104  -7.690   7.516
  356   1HH1  ARG  46          2HH1      ARG  46 -10.802  -6.406   5.699
  357   2HH1  ARG  46          1HH1      ARG  46 -11.874  -7.686   6.151
  358   1HH2  ARG  46          1HH2      ARG  46  -9.531  -9.356   8.092
  359   2HH2  ARG  46          2HH2      ARG  46 -11.159  -9.350   7.501
  360    H    MET  47           H        MET  47  -9.287  -3.466   1.438
  361    HA   MET  47           HA       MET  47 -12.073  -4.056   0.952
  362   1HB   MET  47          2HB       MET  47 -10.289  -1.687   0.491
  363   2HB   MET  47          1HB       MET  47 -11.859  -1.767  -0.310
  364   1HG   MET  47          2HG       MET  47 -11.643  -2.307   2.643
  365   2HG   MET  47          1HG       MET  47 -11.709  -0.649   2.046
  366   1HE   MET  47          1HE       MET  47 -13.296  -1.536   3.974
  367   2HE   MET  47          2HE       MET  47 -14.778  -2.452   3.714
  368   3HE   MET  47          3HE       MET  47 -14.785  -0.704   3.501
  369    H    LEU  48           H        LEU  48  -9.119  -3.875  -0.979
  370    HA   LEU  48           HA       LEU  48 -10.353  -3.977  -3.541
  371   1HB   LEU  48          2HB       LEU  48  -8.005  -3.277  -3.092
  372   2HB   LEU  48          1HB       LEU  48  -7.612  -4.942  -2.728
  373    HG   LEU  48           HG       LEU  48  -8.627  -5.279  -5.196
  374   1HD1  LEU  48          1HD1      LEU  48  -9.026  -2.756  -5.301
  375   2HD1  LEU  48          2HD1      LEU  48  -8.109  -3.445  -6.641
  376   3HD1  LEU  48          3HD1      LEU  48  -7.272  -2.577  -5.354
  377   1HD2  LEU  48          1HD2      LEU  48  -5.822  -4.219  -4.916
  378   2HD2  LEU  48          2HD2      LEU  48  -6.398  -5.585  -5.873
  379   3HD2  LEU  48          3HD2      LEU  48  -6.284  -5.721  -4.118
  380    H    GLY  49           H        GLY  49  -8.881  -6.500  -1.495
  381   1HA   GLY  49          2HA       GLY  49 -10.418  -8.588  -1.505
  382   2HA   GLY  49          1HA       GLY  49 -10.053  -8.584  -3.228
  383    H    GLN  50           H        GLN  50  -8.046  -7.966  -0.346
  384    HA   GLN  50           HA       GLN  50  -6.497 -10.394  -0.736
  385   1HB   GLN  50          2HB       GLN  50  -5.515  -7.719  -1.594
  386   2HB   GLN  50          1HB       GLN  50  -4.383  -8.724  -0.689
  387   1HG   GLN  50          2HG       GLN  50  -5.122 -10.615  -2.330
  388   2HG   GLN  50          1HG       GLN  50  -5.705  -9.288  -3.335
  389   1HE2  GLN  50          1HE2      GLN  50  -3.138 -11.244  -3.218
  390   2HE2  GLN  50          2HE2      GLN  50  -1.891 -10.174  -3.648
  391    H    ASN  51           H        ASN  51  -4.821 -10.629   0.964
  392    HA   ASN  51           HA       ASN  51  -5.111  -8.855   3.274
  393   1HB   ASN  51          2HB       ASN  51  -6.746 -11.011   3.208
  394   2HB   ASN  51          1HB       ASN  51  -5.322 -11.729   3.961
  395   1HD2  ASN  51          1HD2      ASN  51  -4.510 -10.657   5.986
  396   2HD2  ASN  51          2HD2      ASN  51  -5.591  -9.761   6.939
  397    HA   PRO  52           HA       PRO  52  -0.821 -10.477   2.734
  398   1HB   PRO  52          2HB       PRO  52   0.376  -8.025   2.541
  399   2HB   PRO  52          1HB       PRO  52  -0.284  -8.902   1.156
  400   1HG   PRO  52          2HG       PRO  52  -1.340  -6.524   2.552
  401   2HG   PRO  52          1HG       PRO  52  -1.597  -7.057   0.885
  402   1HD   PRO  52          2HD       PRO  52  -3.412  -7.351   3.056
  403   2HD   PRO  52          1HD       PRO  52  -3.557  -8.089   1.443
  404    H    THR  53           H        THR  53   1.257  -9.251   3.889
  405    HA   THR  53           HA       THR  53   0.472  -8.890   6.723
  406    HB   THR  53           HB       THR  53   2.390 -10.030   7.405
  407    HG1  THR  53           HG1      THR  53   4.241  -9.823   6.424
  408   1HG2  THR  53          1HG2      THR  53   0.940 -11.616   6.251
  409   2HG2  THR  53          2HG2      THR  53   2.629 -12.051   5.989
  410   3HG2  THR  53          3HG2      THR  53   1.718 -11.239   4.713
  411    HA   PRO  54           HA       PRO  54   2.431  -4.938   6.756
  412   1HB   PRO  54          2HB       PRO  54   4.027  -4.979   8.986
  413   2HB   PRO  54          1HB       PRO  54   2.263  -4.833   9.032
  414   1HG   PRO  54          2HG       PRO  54   3.981  -7.202   9.593
  415   2HG   PRO  54          1HG       PRO  54   2.433  -6.734  10.317
  416   1HD   PRO  54          2HD       PRO  54   2.728  -8.698   8.375
  417   2HD   PRO  54          1HD       PRO  54   1.210  -7.828   8.703
  418    H    GLU  55           H        GLU  55   4.617  -7.671   7.017
  419    HA   GLU  55           HA       GLU  55   6.982  -6.177   6.239
  420   1HB   GLU  55          2HB       GLU  55   6.682  -9.181   6.176
  421   2HB   GLU  55          1HB       GLU  55   8.155  -8.234   6.373
  422   1HG   GLU  55          2HG       GLU  55   6.538  -7.378   8.473
  423   2HG   GLU  55          1HG       GLU  55   6.235  -9.112   8.390
  424    H    GLU  56           H        GLU  56   4.599  -8.325   4.761
  425    HA   GLU  56           HA       GLU  56   5.855  -8.633   2.243
  426   1HB   GLU  56          2HB       GLU  56   3.710  -9.796   3.336
  427   2HB   GLU  56          1HB       GLU  56   2.877  -8.570   2.380
  428   1HG   GLU  56          2HG       GLU  56   5.034 -10.306   1.170
  429   2HG   GLU  56          1HG       GLU  56   3.356 -10.844   1.243
  430    H    LEU  57           H        LEU  57   3.112  -6.495   3.164
  431    HA   LEU  57           HA       LEU  57   3.070  -5.038   0.753
  432   1HB   LEU  57          2HB       LEU  57   1.747  -3.399   1.928
  433   2HB   LEU  57          1HB       LEU  57   1.232  -5.010   2.364
  434    HG   LEU  57           HG       LEU  57   2.928  -4.553   4.401
  435   1HD1  LEU  57          1HD1      LEU  57   2.777  -2.044   3.104
  436   2HD1  LEU  57          2HD1      LEU  57   3.489  -2.389   4.680
  437   3HD1  LEU  57          3HD1      LEU  57   1.798  -1.900   4.564
  438   1HD2  LEU  57          1HD2      LEU  57   0.478  -5.140   4.446
  439   2HD2  LEU  57          2HD2      LEU  57   0.117  -3.421   4.291
  440   3HD2  LEU  57          3HD2      LEU  57   0.963  -4.019   5.718
  441    H    GLN  58           H        GLN  58   5.221  -4.818   3.487
  442    HA   GLN  58           HA       GLN  58   6.070  -2.152   3.283
  443   1HB   GLN  58          2HB       GLN  58   6.660  -3.904   5.082
  444   2HB   GLN  58          1HB       GLN  58   7.954  -4.389   3.988
  445   1HG   GLN  58          2HG       GLN  58   8.844  -2.741   5.531
  446   2HG   GLN  58          1HG       GLN  58   8.722  -1.996   3.937
  447   1HE2  GLN  58          1HE2      GLN  58   7.127  -0.310   3.629
  448   2HE2  GLN  58          2HE2      GLN  58   6.263   0.358   4.929
  449    H    GLU  59           H        GLU  59   7.522  -5.072   1.789
  450    HA   GLU  59           HA       GLU  59   9.577  -3.759   0.404
  451   1HB   GLU  59          2HB       GLU  59   9.809  -5.733  -0.930
  452   2HB   GLU  59          1HB       GLU  59   9.347  -6.255   0.688
  453   1HG   GLU  59          2HG       GLU  59   6.890  -5.976  -0.422
  454   2HG   GLU  59          1HG       GLU  59   7.820  -6.395  -1.858
  455    H    MET  60           H        MET  60   6.167  -4.076  -0.382
  456    HA   MET  60           HA       MET  60   6.384  -3.301  -3.123
  457   1HB   MET  60          2HB       MET  60   4.081  -3.269  -1.166
  458   2HB   MET  60          1HB       MET  60   3.919  -2.718  -2.833
  459   1HG   MET  60          2HG       MET  60   5.019  -5.019  -3.426
  460   2HG   MET  60          1HG       MET  60   4.498  -5.483  -1.807
  461   1HE   MET  60          1HE       MET  60   1.332  -6.923  -2.452
  462   2HE   MET  60          2HE       MET  60   2.867  -6.791  -1.598
  463   3HE   MET  60          3HE       MET  60   2.829  -7.463  -3.227
  464    H    ILE  61           H        ILE  61   5.633  -1.539  -0.117
  465    HA   ILE  61           HA       ILE  61   5.152   0.995  -1.153
  466    HB   ILE  61           HB       ILE  61   6.423   0.107   1.439
  467   1HG1  ILE  61          2HG1      ILE  61   3.769   1.423   1.238
  468   2HG1  ILE  61          1HG1      ILE  61   3.889  -0.206   0.579
  469   1HG2  ILE  61          1HG2      ILE  61   5.656   2.876   0.492
  470   2HG2  ILE  61          2HG2      ILE  61   7.214   2.340   1.124
  471   3HG2  ILE  61          3HG2      ILE  61   5.821   2.462   2.198
  472   1HD1  ILE  61          1HD1      ILE  61   3.248  -0.240   2.968
  473   2HD1  ILE  61          2HD1      ILE  61   4.741   0.607   3.369
  474   3HD1  ILE  61          3HD1      ILE  61   4.804  -1.021   2.693
  475    H    ASP  62           H        ASP  62   8.239   0.038   0.354
  476    HA   ASP  62           HA       ASP  62   9.793   2.166  -0.437
  477   1HB   ASP  62          2HB       ASP  62  10.621  -0.726  -0.125
  478   2HB   ASP  62          1HB       ASP  62  11.743   0.628  -0.232
  479    H    GLU  63           H        GLU  63   9.007  -0.732  -2.343
  480    HA   GLU  63           HA       GLU  63  10.834  -0.114  -4.474
  481   1HB   GLU  63          2HB       GLU  63   8.608  -2.089  -4.111
  482   2HB   GLU  63          1HB       GLU  63   9.286  -1.817  -5.716
  483   1HG   GLU  63          2HG       GLU  63  11.391  -2.082  -3.724
  484   2HG   GLU  63          1HG       GLU  63  10.335  -3.494  -3.728
  485    H    VAL  64           H        VAL  64   7.283   0.195  -4.140
  486    HA   VAL  64           HA       VAL  64   6.959   1.358  -6.741
  487    HB   VAL  64           HB       VAL  64   4.652   1.695  -6.164
  488   1HG1  VAL  64          1HG1      VAL  64   4.434  -0.517  -6.472
  489   2HG1  VAL  64          2HG1      VAL  64   4.626  -0.746  -4.735
  490   3HG1  VAL  64          3HG1      VAL  64   6.035  -0.807  -5.793
  491   1HG2  VAL  64          1HG2      VAL  64   4.700   2.655  -4.002
  492   2HG2  VAL  64          2HG2      VAL  64   5.642   1.323  -3.337
  493   3HG2  VAL  64          3HG2      VAL  64   3.948   1.079  -3.757
  494    H    ASP  65           H        ASP  65   7.563   2.709  -3.555
  495    HA   ASP  65           HA       ASP  65   6.700   5.365  -4.197
  496   1HB   ASP  65          2HB       ASP  65   7.372   4.108  -1.857
  497   2HB   ASP  65          1HB       ASP  65   8.801   5.098  -2.141
  498    H    GLU  66           H        GLU  66   7.692   5.562  -6.281
  499    HA   GLU  66           HA       GLU  66  10.467   5.472  -6.776
  500   1HB   GLU  66          2HB       GLU  66   8.236   6.990  -8.131
  501   2HB   GLU  66          1HB       GLU  66   9.895   6.993  -8.728
  502   1HG   GLU  66          2HG       GLU  66   9.863   4.592  -9.027
  503   2HG   GLU  66          1HG       GLU  66   8.298   4.466  -8.224
  504    H    ASP  67           H        ASP  67   8.384   8.096  -5.639
  505    HA   ASP  67           HA       ASP  67  10.529  10.047  -5.710
  506   1HB   ASP  67          2HB       ASP  67   8.829  11.510  -4.520
  507   2HB   ASP  67          1HB       ASP  67   8.362  10.945  -6.121
  508    H    GLY  68           H        GLY  68   8.837   8.144  -3.233
  509   1HA   GLY  68          2HA       GLY  68   9.540   7.495  -1.130
  510   2HA   GLY  68          1HA       GLY  68  11.101   8.236  -1.472
  511    H    SER  69           H        SER  69   7.762   9.464  -1.225
  512    HA   SER  69           HA       SER  69   8.737  11.730   0.353
  513   1HB   SER  69          2HB       SER  69   6.465  12.653   0.008
  514   2HB   SER  69          1HB       SER  69   7.255  12.255  -1.513
  515    HG   SER  69           HG       SER  69   5.828  10.726  -1.849
  516    H    GLY  70           H        GLY  70   6.144   9.296   0.505
  517   1HA   GLY  70          2HA       GLY  70   6.338   8.237   2.945
  518   2HA   GLY  70          1HA       GLY  70   5.688   9.826   3.341
  519    H    THR  71           H        THR  71   4.166  10.015   0.835
  520    HA   THR  71           HA       THR  71   1.897   8.299   1.595
  521    HB   THR  71           HB       THR  71   0.512   9.869   0.334
  522    HG1  THR  71           HG1      THR  71   1.701  10.595  -1.301
  523   1HG2  THR  71          1HG2      THR  71   0.965  11.930   1.662
  524   2HG2  THR  71          2HG2      THR  71   2.512  11.240   2.155
  525   3HG2  THR  71          3HG2      THR  71   1.003  10.468   2.647
  526    H    VAL  72           H        VAL  72   0.622   7.300  -0.111
  527    HA   VAL  72           HA       VAL  72   2.311   6.506  -2.405
  528    HB   VAL  72           HB       VAL  72  -0.074   5.030  -1.279
  529   1HG1  VAL  72          1HG1      VAL  72   0.579   4.666  -3.698
  530   2HG1  VAL  72          2HG1      VAL  72   0.663   3.220  -2.692
  531   3HG1  VAL  72          3HG1      VAL  72   2.139   4.083  -3.118
  532   1HG2  VAL  72          1HG2      VAL  72   1.738   3.448  -0.433
  533   2HG2  VAL  72          2HG2      VAL  72   1.619   4.986   0.422
  534   3HG2  VAL  72          3HG2      VAL  72   2.897   4.736  -0.767
  535    H    ASP  73           H        ASP  73   1.805   7.528  -4.202
  536    HA   ASP  73           HA       ASP  73  -0.866   8.608  -4.637
  537   1HB   ASP  73          2HB       ASP  73   1.656   8.705  -6.316
  538   2HB   ASP  73          1HB       ASP  73   0.137   9.483  -6.760
  539    H    PHE  74           H        PHE  74  -1.584   8.321  -7.094
  540    HA   PHE  74           HA       PHE  74  -2.347   5.591  -7.370
  541   1HB   PHE  74          2HB       PHE  74  -3.534   7.724  -8.261
  542   2HB   PHE  74          1HB       PHE  74  -2.455   7.553  -9.648
  543    HD1  PHE  74           HD1      PHE  74  -3.563   6.577 -11.439
  544    HD2  PHE  74           HD2      PHE  74  -4.280   5.097  -7.476
  545    HE1  PHE  74           HE1      PHE  74  -5.035   4.808 -12.367
  546    HE2  PHE  74           HE2      PHE  74  -5.757   3.331  -8.398
  547    HZ   PHE  74           HZ       PHE  74  -6.135   3.186 -10.846
  548    H    ASP  75           H        ASP  75   0.307   7.485  -8.672
  549    HA   ASP  75           HA       ASP  75   1.050   5.757 -10.800
  550   1HB   ASP  75          2HB       ASP  75   2.680   7.697  -9.135
  551   2HB   ASP  75          1HB       ASP  75   3.284   6.869 -10.565
  552    H    GLU  76           H        GLU  76   1.853   5.929  -7.366
  553    HA   GLU  76           HA       GLU  76   3.724   3.717  -7.450
  554   1HB   GLU  76          2HB       GLU  76   2.414   4.829  -4.968
  555   2HB   GLU  76          1HB       GLU  76   3.985   4.042  -5.119
  556   1HG   GLU  76          2HG       GLU  76   4.901   5.930  -6.306
  557   2HG   GLU  76          1HG       GLU  76   3.310   6.676  -6.455
  558    H    PHE  77           H        PHE  77   0.324   4.226  -6.963
  559    HA   PHE  77           HA       PHE  77  -0.286   1.762  -5.640
  560   1HB   PHE  77          2HB       PHE  77  -1.690   3.906  -5.713
  561   2HB   PHE  77          1HB       PHE  77  -2.179   3.404  -7.328
  562    HD1  PHE  77           HD1      PHE  77  -1.929   2.061  -3.824
  563    HD2  PHE  77           HD2      PHE  77  -4.029   2.030  -7.571
  564    HE1  PHE  77           HE1      PHE  77  -3.644   0.557  -2.850
  565    HE2  PHE  77           HE2      PHE  77  -5.743   0.523  -6.597
  566    HZ   PHE  77           HZ       PHE  77  -5.551  -0.211  -4.236
  567    H    LEU  78           H        LEU  78  -0.158   2.825  -9.013
  568    HA   LEU  78           HA       LEU  78  -1.270   0.372 -10.067
  569   1HB   LEU  78          2HB       LEU  78   0.077   2.744 -11.347
  570   2HB   LEU  78          1HB       LEU  78  -0.473   1.358 -12.263
  571    HG   LEU  78           HG       LEU  78  -2.037   3.560 -11.003
  572   1HD1  LEU  78          1HD1      LEU  78  -2.638   1.850 -13.423
  573   2HD1  LEU  78          2HD1      LEU  78  -1.527   3.220 -13.488
  574   3HD1  LEU  78          3HD1      LEU  78  -3.220   3.477 -13.066
  575   1HD2  LEU  78          1HD2      LEU  78  -2.959   0.681 -11.188
  576   2HD2  LEU  78          2HD2      LEU  78  -4.085   2.037 -11.136
  577   3HD2  LEU  78          3HD2      LEU  78  -2.997   1.742  -9.779
  578    H    VAL  79           H        VAL  79   2.006   1.792  -9.819
  579    HA   VAL  79           HA       VAL  79   3.355  -0.158 -11.323
  580    HB   VAL  79           HB       VAL  79   5.374   0.429  -9.959
  581   1HG1  VAL  79          1HG1      VAL  79   5.036   1.715 -11.920
  582   2HG1  VAL  79          2HG1      VAL  79   5.279   2.910 -10.646
  583   3HG1  VAL  79          3HG1      VAL  79   3.651   2.559 -11.226
  584   1HG2  VAL  79          1HG2      VAL  79   4.229   0.896  -7.833
  585   2HG2  VAL  79          2HG2      VAL  79   3.416   2.274  -8.570
  586   3HG2  VAL  79          3HG2      VAL  79   5.165   2.295  -8.359
  587    H    MET  80           H        MET  80   2.125  -0.258  -8.057
  588    HA   MET  80           HA       MET  80   3.554  -2.289  -6.864
  589   1HB   MET  80          2HB       MET  80   0.769  -1.301  -6.665
  590   2HB   MET  80          1HB       MET  80   1.056  -2.918  -6.026
  591   1HG   MET  80          2HG       MET  80   2.966  -1.997  -4.694
  592   2HG   MET  80          1HG       MET  80   2.524  -0.383  -5.253
  593   1HE   MET  80          1HE       MET  80  -0.030   0.890  -3.221
  594   2HE   MET  80          2HE       MET  80   1.238   1.004  -4.438
  595   3HE   MET  80          3HE       MET  80   1.670   0.791  -2.744
  596    H    MET  81           H        MET  81   0.961  -2.622  -9.285
  597    HA   MET  81           HA       MET  81   0.948  -5.503  -9.080
  598   1HB   MET  81          2HB       MET  81  -0.672  -5.451 -10.909
  599   2HB   MET  81          1HB       MET  81  -1.109  -4.304  -9.647
  600   1HG   MET  81          2HG       MET  81  -0.638  -2.466 -10.957
  601   2HG   MET  81          1HG       MET  81   0.557  -3.321 -11.928
  602   1HE   MET  81          1HE       MET  81  -1.655  -1.639 -13.871
  603   2HE   MET  81          2HE       MET  81  -1.910  -1.415 -12.143
  604   3HE   MET  81          3HE       MET  81  -3.236  -1.977 -13.156
  605    H    VAL  82           H        VAL  82   2.345  -3.153 -11.348
  606    HA   VAL  82           HA       VAL  82   3.256  -5.214 -13.166
  607    HB   VAL  82           HB       VAL  82   4.477  -3.374 -14.304
  608   1HG1  VAL  82          1HG1      VAL  82   2.572  -2.855 -15.396
  609   2HG1  VAL  82          2HG1      VAL  82   1.857  -2.113 -13.963
  610   3HG1  VAL  82          3HG1      VAL  82   1.751  -3.858 -14.199
  611   1HG2  VAL  82          1HG2      VAL  82   3.613  -1.035 -13.353
  612   2HG2  VAL  82          2HG2      VAL  82   5.102  -1.776 -12.764
  613   3HG2  VAL  82          3HG2      VAL  82   3.613  -1.932 -11.840
  614    H    ARG  83           H        ARG  83   4.631  -3.464 -10.439
  615    HA   ARG  83           HA       ARG  83   7.369  -3.925 -10.900
  616   1HB   ARG  83          2HB       ARG  83   5.754  -3.540  -8.390
  617   2HB   ARG  83          1HB       ARG  83   7.485  -3.872  -8.316
  618   1HG   ARG  83          2HG       ARG  83   7.631  -1.949 -10.109
  619   2HG   ARG  83          1HG       ARG  83   6.064  -1.489  -9.453
  620   1HD   ARG  83          2HD       ARG  83   7.112  -0.474  -7.744
  621   2HD   ARG  83          1HD       ARG  83   7.714  -2.044  -7.224
  622    HE   ARG  83           HE       ARG  83   9.790  -1.505  -8.128
  623   1HH1  ARG  83          2HH1      ARG  83   7.367   0.767  -9.221
  624   2HH1  ARG  83          1HH1      ARG  83   8.521   1.847  -9.925
  625   1HH2  ARG  83          1HH2      ARG  83  11.279  -0.070  -9.059
  626   2HH2  ARG  83          2HH2      ARG  83  10.727   1.377  -9.834
  627    H    CYS  84           H        CYS  84   4.839  -6.062  -9.849
  628    HA   CYS  84           HA       CYS  84   6.346  -8.051  -8.539
  629   1HB   CYS  84          2HB       CYS  84   3.773  -8.207 -10.115
  630   2HB   CYS  84          1HB       CYS  84   4.466  -9.594  -9.275
  631    HG   CYS  84           HG       CYS  84   3.556  -6.986  -7.800
  632    H    MET  85           H        MET  85   5.968  -7.295 -11.937
  633    HA   MET  85           HA       MET  85   6.677  -9.722 -13.134
  634   1HB   MET  85          2HB       MET  85   6.909  -6.849 -13.918
  635   2HB   MET  85          1HB       MET  85   7.783  -8.046 -14.874
  636   1HG   MET  85          2HG       MET  85   5.487  -9.335 -14.832
  637   2HG   MET  85          1HG       MET  85   4.823  -7.742 -14.468
  638   1HE   MET  85          1HE       MET  85   6.525  -9.362 -18.341
  639   2HE   MET  85          2HE       MET  85   5.816 -10.199 -16.962
  640   3HE   MET  85          3HE       MET  85   7.440  -9.527 -16.836
  641    H    LYS  86           H        LYS  86   8.830  -6.984 -12.293
  642    HA   LYS  86           HA       LYS  86  11.135  -8.817 -12.452
  643   1HB   LYS  86          2HB       LYS  86  10.798  -5.863 -12.751
  644   2HB   LYS  86          1HB       LYS  86  12.329  -6.458 -12.108
  645   1HG   LYS  86          2HG       LYS  86  11.167  -7.742 -14.564
  646   2HG   LYS  86          1HG       LYS  86  12.020  -6.205 -14.712
  647   1HD   LYS  86          2HD       LYS  86  14.029  -7.132 -13.778
  648   2HD   LYS  86          1HD       LYS  86  13.194  -8.610 -13.299
  649   1HE   LYS  86          2HE       LYS  86  14.142  -9.360 -15.261
  650   2HE   LYS  86          1HE       LYS  86  12.646  -8.696 -15.917
  651   1HZ   LYS  86          1HZ       LYS  86  15.248  -7.272 -15.745
  652   2HZ   LYS  86          2HZ       LYS  86  13.805  -6.623 -16.368
  653   3HZ   LYS  86          3HZ       LYS  86  14.565  -7.923 -17.154
  654    H    ASP  87           H        ASP  87  10.459  -5.930 -10.470
  655    HA   ASP  87           HA       ASP  87  10.616  -5.525  -8.224
  656   1HB   ASP  87          2HB       ASP  87   9.166  -7.802  -8.356
  657   2HB   ASP  87          1HB       ASP  87  10.553  -8.380  -7.435
  658    H    ASP  88           H        ASP  88  12.565  -4.797  -7.689
  659    HA   ASP  88           HA       ASP  88  14.947  -6.428  -7.872
  660   1HB   ASP  88          2HB       ASP  88  14.597  -3.693  -6.610
  661   2HB   ASP  88          1HB       ASP  88  16.125  -4.463  -7.032
  662    H    SER  89           HN       SER  89  14.915  -8.106  -6.449
  663    HA   SER  89           HA       SER  89  14.185  -7.643  -3.654
  664   1HB   SER  89          2HB       SER  89  13.599  -9.748  -5.106
  665   2HB   SER  89          1HB       SER  89  15.232 -10.259  -4.687
  666    HG   SER  89           HG       SER  89  14.572 -10.644  -2.729
  Start of MODEL   29
    1   1H    MET   1          1H        MET   1  16.603   4.088 -15.568
    2   2H    MET   1          2H        MET   1  16.307   2.442 -15.265
    3   3H    MET   1          3H        MET   1  15.521   3.634 -14.344
    4    HA   MET   1           HA       MET   1  14.216   4.345 -16.169
    5   1HB   MET   1          2HB       MET   1  14.487   3.278 -18.402
    6   2HB   MET   1          1HB       MET   1  15.924   4.174 -17.913
    7   1HG   MET   1          2HG       MET   1  17.151   2.224 -17.482
    8   2HG   MET   1          1HG       MET   1  15.703   1.237 -17.293
    9   1HE   MET   1          1HE       MET   1  18.042   3.151 -19.457
   10   2HE   MET   1          2HE       MET   1  18.075   2.270 -20.982
   11   3HE   MET   1          3HE       MET   1  18.633   1.484 -19.507
   12    H    ASN   2           H        ASN   2  12.301   3.243 -16.886
   13    HA   ASN   2           HA       ASN   2  12.034   0.429 -16.053
   14   1HB   ASN   2          2HB       ASN   2  10.426   2.758 -15.028
   15   2HB   ASN   2          1HB       ASN   2   9.740   1.135 -15.084
   16   1HD2  ASN   2          1HD2      ASN   2  11.447  -0.602 -14.140
   17   2HD2  ASN   2          2HD2      ASN   2  12.172  -0.142 -12.679
   18    H    ASP   3           H        ASP   3  11.276  -0.650 -17.745
   19    HA   ASP   3           HA       ASP   3   9.219   0.636 -19.443
   20   1HB   ASP   3          2HB       ASP   3  11.691  -0.865 -20.276
   21   2HB   ASP   3          1HB       ASP   3  10.282  -0.772 -21.333
   22    H    ILE   4           H        ILE   4   9.532  -1.679 -17.227
   23    HA   ILE   4           HA       ILE   4   8.294  -3.880 -18.685
   24    HB   ILE   4           HB       ILE   4   8.433  -5.165 -16.694
   25   1HG1  ILE   4          2HG1      ILE   4   7.572  -3.248 -15.215
   26   2HG1  ILE   4          1HG1      ILE   4   8.766  -4.323 -14.498
   27   1HG2  ILE   4          1HG2      ILE   4  10.883  -4.490 -15.908
   28   2HG2  ILE   4          2HG2      ILE   4  10.789  -3.441 -17.321
   29   3HG2  ILE   4          3HG2      ILE   4  10.587  -5.183 -17.500
   30   1HD1  ILE   4          1HD1      ILE   4   9.711  -2.300 -13.925
   31   2HD1  ILE   4          2HD1      ILE   4   9.032  -1.466 -15.323
   32   3HD1  ILE   4          3HD1      ILE   4  10.451  -2.497 -15.512
   33    H    TYR   5           H        TYR   5   7.354  -1.189 -16.696
   34    HA   TYR   5           HA       TYR   5   4.751  -2.141 -15.970
   35   1HB   TYR   5          2HB       TYR   5   5.550   0.763 -16.232
   36   2HB   TYR   5          1HB       TYR   5   4.322   0.064 -15.183
   37    HD1  TYR   5           HD1      TYR   5   5.789  -2.294 -14.090
   38    HD2  TYR   5           HD2      TYR   5   7.077   1.750 -14.731
   39    HE1  TYR   5           HE1      TYR   5   7.476  -2.550 -12.302
   40    HE2  TYR   5           HE2      TYR   5   8.766   1.491 -12.940
   41    HH   TYR   5           HH       TYR   5   9.927  -1.156 -11.869
   42    H    LYS   6           H        LYS   6   6.135  -0.459 -18.713
   43    HA   LYS   6           HA       LYS   6   3.618   0.322 -19.892
   44   1HB   LYS   6          2HB       LYS   6   6.223   0.021 -21.385
   45   2HB   LYS   6          1HB       LYS   6   4.882   1.106 -21.739
   46   1HG   LYS   6          2HG       LYS   6   6.888   1.294 -19.483
   47   2HG   LYS   6          1HG       LYS   6   6.552   2.481 -20.743
   48   1HD   LYS   6          2HD       LYS   6   4.483   3.098 -19.775
   49   2HD   LYS   6          1HD       LYS   6   4.414   1.638 -18.787
   50   1HE   LYS   6          2HE       LYS   6   5.020   3.482 -17.341
   51   2HE   LYS   6          1HE       LYS   6   6.445   2.465 -17.550
   52   1HZ   LYS   6          1HZ       LYS   6   5.945   4.793 -19.303
   53   2HZ   LYS   6          2HZ       LYS   6   7.408   3.979 -19.010
   54   3HZ   LYS   6          3HZ       LYS   6   6.726   4.969 -17.809
   55    H    ALA   7           H        ALA   7   5.893  -2.339 -20.241
   56    HA   ALA   7           HA       ALA   7   4.549  -3.571 -22.464
   57   1HB   ALA   7          1HB       ALA   7   5.943  -5.610 -21.626
   58   2HB   ALA   7          2HB       ALA   7   6.698  -4.434 -20.550
   59   3HB   ALA   7          3HB       ALA   7   6.789  -4.215 -22.297
   60    H    ALA   8           H        ALA   8   4.305  -3.752 -18.965
   61    HA   ALA   8           HA       ALA   8   2.602  -6.102 -18.997
   62   1HB   ALA   8          1HB       ALA   8   2.388  -5.593 -16.531
   63   2HB   ALA   8          2HB       ALA   8   3.488  -4.239 -16.791
   64   3HB   ALA   8          3HB       ALA   8   4.033  -5.888 -17.095
   65    H    VAL   9           H        VAL   9   2.173  -2.622 -19.051
   66    HA   VAL   9           HA       VAL   9  -0.396  -2.409 -17.949
   67    HB   VAL   9           HB       VAL   9   1.233  -0.542 -18.766
   68   1HG1  VAL   9          1HG1      VAL   9   0.945  -1.472 -21.200
   69   2HG1  VAL   9          2HG1      VAL   9   0.984   0.271 -20.943
   70   3HG1  VAL   9          3HG1      VAL   9  -0.557  -0.551 -21.181
   71   1HG2  VAL   9          1HG2      VAL   9  -1.780  -0.526 -18.893
   72   2HG2  VAL   9          2HG2      VAL   9  -0.852   0.946 -19.176
   73   3HG2  VAL   9          3HG2      VAL   9  -0.728   0.110 -17.628
   74    H    GLU  10           H        GLU  10   0.626  -3.489 -21.139
   75    HA   GLU  10           HA       GLU  10  -1.934  -3.404 -22.391
   76   1HB   GLU  10          2HB       GLU  10   0.575  -4.976 -22.992
   77   2HB   GLU  10          1HB       GLU  10  -0.877  -5.073 -23.988
   78   1HG   GLU  10          2HG       GLU  10  -0.624  -2.940 -24.812
   79   2HG   GLU  10          1HG       GLU  10   0.120  -2.342 -23.330
   80    H    GLN  11           H        GLN  11  -0.405  -5.653 -20.204
   81    HA   GLN  11           HA       GLN  11  -2.163  -7.866 -20.806
   82   1HB   GLN  11          2HB       GLN  11  -0.364  -7.450 -18.407
   83   2HB   GLN  11          1HB       GLN  11  -1.116  -8.967 -18.897
   84   1HG   GLN  11          2HG       GLN  11   0.120  -8.807 -21.077
   85   2HG   GLN  11          1HG       GLN  11   0.963  -7.394 -20.445
   86   1HE2  GLN  11          1HE2      GLN  11   2.002  -7.861 -18.131
   87   2HE2  GLN  11          2HE2      GLN  11   2.789  -9.358 -17.985
   88    H    LEU  12           H        LEU  12  -1.934  -5.344 -18.337
   89    HA   LEU  12           HA       LEU  12  -3.973  -6.270 -16.623
   90   1HB   LEU  12          2HB       LEU  12  -2.983  -3.479 -17.176
   91   2HB   LEU  12          1HB       LEU  12  -4.132  -3.869 -15.916
   92    HG   LEU  12           HG       LEU  12  -1.791  -5.550 -15.687
   93   1HD1  LEU  12          1HD1      LEU  12  -1.381  -2.555 -15.852
   94   2HD1  LEU  12          2HD1      LEU  12  -0.526  -3.813 -16.744
   95   3HD1  LEU  12          3HD1      LEU  12  -0.264  -3.631 -15.010
   96   1HD2  LEU  12          1HD2      LEU  12  -1.773  -4.473 -13.414
   97   2HD2  LEU  12          2HD2      LEU  12  -3.345  -5.139 -13.858
   98   3HD2  LEU  12          3HD2      LEU  12  -3.063  -3.401 -13.960
   99    H    THR  13           H        THR  13  -6.135  -5.819 -16.473
  100    HA   THR  13           HA       THR  13  -7.421  -4.881 -18.960
  101    HB   THR  13           HB       THR  13  -9.466  -5.930 -17.519
  102    HG1  THR  13           HG1      THR  13  -8.110  -6.601 -15.840
  103   1HG2  THR  13          1HG2      THR  13  -8.800  -8.124 -18.791
  104   2HG2  THR  13          2HG2      THR  13  -7.512  -7.123 -19.461
  105   3HG2  THR  13          3HG2      THR  13  -9.199  -6.674 -19.711
  106    H    ASP  14           H        ASP  14  -9.605  -3.820 -18.587
  107    HA   ASP  14           HA       ASP  14  -9.234  -1.407 -17.122
  108   1HB   ASP  14          2HB       ASP  14 -11.610  -2.646 -18.504
  109   2HB   ASP  14          1HB       ASP  14 -11.748  -1.131 -17.611
  110    H    GLU  15           H        GLU  15 -10.806  -4.462 -16.438
  111    HA   GLU  15           HA       GLU  15 -12.365  -3.717 -14.217
  112   1HB   GLU  15          2HB       GLU  15 -12.459  -6.061 -13.689
  113   2HB   GLU  15          1HB       GLU  15 -12.490  -5.899 -15.442
  114   1HG   GLU  15          2HG       GLU  15  -9.917  -6.193 -15.303
  115   2HG   GLU  15          1HG       GLU  15 -10.223  -6.819 -13.682
  116    H    GLN  16           H        GLN  16  -8.983  -4.732 -14.463
  117    HA   GLN  16           HA       GLN  16  -8.438  -4.865 -11.675
  118   1HB   GLN  16          2HB       GLN  16  -6.582  -4.345 -14.015
  119   2HB   GLN  16          1HB       GLN  16  -6.044  -4.658 -12.366
  120   1HG   GLN  16          2HG       GLN  16  -7.967  -6.599 -13.570
  121   2HG   GLN  16          1HG       GLN  16  -6.307  -6.629 -14.163
  122   1HE2  GLN  16          1HE2      GLN  16  -5.108  -8.160 -13.035
  123   2HE2  GLN  16          2HE2      GLN  16  -5.262  -8.489 -11.377
  124    H    LYS  17           H        LYS  17  -8.010  -2.274 -14.081
  125    HA   LYS  17           HA       LYS  17  -6.956  -0.385 -12.207
  126   1HB   LYS  17          2HB       LYS  17  -7.852  -0.318 -15.034
  127   2HB   LYS  17          1HB       LYS  17  -7.917   1.210 -14.155
  128   1HG   LYS  17          2HG       LYS  17  -5.720   1.339 -14.790
  129   2HG   LYS  17          1HG       LYS  17  -5.483   0.339 -13.355
  130   1HD   LYS  17          2HD       LYS  17  -4.356  -0.923 -14.950
  131   2HD   LYS  17          1HD       LYS  17  -5.963  -1.643 -15.039
  132   1HE   LYS  17          2HE       LYS  17  -5.593  -1.239 -17.288
  133   2HE   LYS  17          1HE       LYS  17  -6.350   0.285 -16.831
  134   1HZ   LYS  17          1HZ       LYS  17  -4.134   1.222 -16.489
  135   2HZ   LYS  17          2HZ       LYS  17  -4.343   0.683 -18.085
  136   3HZ   LYS  17          3HZ       LYS  17  -3.430  -0.239 -16.988
  137    H    ASN  18           H        ASN  18 -10.173  -1.409 -13.083
  138    HA   ASN  18           HA       ASN  18 -11.602   0.886 -12.174
  139   1HB   ASN  18          2HB       ASN  18 -12.251  -1.801 -13.104
  140   2HB   ASN  18          1HB       ASN  18 -13.273  -1.312 -11.753
  141   1HD2  ASN  18          1HD2      ASN  18 -12.100  -0.124 -14.947
  142   2HD2  ASN  18          2HD2      ASN  18 -13.481   0.809 -15.267
  143    H    GLU  19           H        GLU  19 -10.694  -2.204 -10.651
  144    HA   GLU  19           HA       GLU  19 -11.855  -1.640  -8.102
  145   1HB   GLU  19          2HB       GLU  19  -9.551  -3.493  -8.784
  146   2HB   GLU  19          1HB       GLU  19 -10.463  -3.493  -7.274
  147   1HG   GLU  19          2HG       GLU  19 -12.551  -3.887  -8.675
  148   2HG   GLU  19          1HG       GLU  19 -11.473  -4.178 -10.040
  149    H    PHE  20           H        PHE  20  -8.606  -1.303  -9.471
  150    HA   PHE  20           HA       PHE  20  -7.291  -0.363  -7.155
  151   1HB   PHE  20          2HB       PHE  20  -6.752  -0.232 -10.095
  152   2HB   PHE  20          1HB       PHE  20  -5.797   0.780  -9.016
  153    HD1  PHE  20           HD1      PHE  20  -7.112  -2.352  -7.668
  154    HD2  PHE  20           HD2      PHE  20  -3.787  -0.534  -9.689
  155    HE1  PHE  20           HE1      PHE  20  -5.696  -4.295  -7.083
  156    HE2  PHE  20           HE2      PHE  20  -2.369  -2.474  -9.099
  157    HZ   PHE  20           HZ       PHE  20  -3.321  -4.358  -7.795
  158    H    LYS  21           H        LYS  21  -8.971   1.367  -9.768
  159    HA   LYS  21           HA       LYS  21  -8.339   3.986  -8.858
  160   1HB   LYS  21          2HB       LYS  21  -9.123   3.488 -11.167
  161   2HB   LYS  21          1HB       LYS  21 -10.717   3.110 -10.518
  162   1HG   LYS  21          2HG       LYS  21 -10.647   5.426 -11.359
  163   2HG   LYS  21          1HG       LYS  21 -10.896   5.405  -9.616
  164   1HD   LYS  21          2HD       LYS  21  -9.229   7.071 -10.015
  165   2HD   LYS  21          1HD       LYS  21  -8.364   5.669  -9.384
  166   1HE   LYS  21          2HE       LYS  21  -7.633   5.029 -11.583
  167   2HE   LYS  21          1HE       LYS  21  -8.704   6.202 -12.347
  168   1HZ   LYS  21          1HZ       LYS  21  -6.512   6.951 -10.493
  169   2HZ   LYS  21          2HZ       LYS  21  -7.436   7.986 -11.473
  170   3HZ   LYS  21          3HZ       LYS  21  -6.335   6.903 -12.179
  171    H    ALA  22           H        ALA  22 -11.134   1.846  -8.334
  172    HA   ALA  22           HA       ALA  22 -12.651   3.700  -6.794
  173   1HB   ALA  22          1HB       ALA  22 -13.607   1.647  -7.848
  174   2HB   ALA  22          2HB       ALA  22 -13.999   1.796  -6.135
  175   3HB   ALA  22          3HB       ALA  22 -12.741   0.677  -6.658
  176    H    ALA  23           H        ALA  23 -10.412   1.077  -5.918
  177    HA   ALA  23           HA       ALA  23 -10.633   1.334  -3.107
  178   1HB   ALA  23          1HB       ALA  23  -8.457   0.237  -4.890
  179   2HB   ALA  23          2HB       ALA  23  -9.627  -0.658  -3.919
  180   3HB   ALA  23          3HB       ALA  23  -8.325   0.232  -3.131
  181    H    PHE  24           H        PHE  24  -8.905   3.180  -5.504
  182    HA   PHE  24           HA       PHE  24  -7.130   4.454  -3.587
  183   1HB   PHE  24          2HB       PHE  24  -6.701   3.971  -6.128
  184   2HB   PHE  24          1HB       PHE  24  -7.619   5.452  -6.382
  185    HD1  PHE  24           HD1      PHE  24  -4.528   4.000  -5.001
  186    HD2  PHE  24           HD2      PHE  24  -6.751   7.620  -5.647
  187    HE1  PHE  24           HE1      PHE  24  -2.504   5.336  -4.488
  188    HE2  PHE  24           HE2      PHE  24  -4.728   8.954  -5.130
  189    HZ   PHE  24           HZ       PHE  24  -2.604   7.812  -4.551
  190    H    ASP  25           H        ASP  25  -9.775   5.506  -5.747
  191    HA   ASP  25           HA       ASP  25  -9.992   8.141  -4.879
  192   1HB   ASP  25          2HB       ASP  25 -11.817   6.235  -6.248
  193   2HB   ASP  25          1HB       ASP  25 -12.538   7.691  -5.560
  194    H    ILE  26           H        ILE  26 -11.546   5.238  -3.484
  195    HA   ILE  26           HA       ILE  26 -13.359   6.512  -1.779
  196    HB   ILE  26           HB       ILE  26 -13.136   4.508  -0.298
  197   1HG1  ILE  26          2HG1      ILE  26 -11.011   3.723  -2.321
  198   2HG1  ILE  26          1HG1      ILE  26 -10.718   4.125  -0.632
  199   1HG2  ILE  26          1HG2      ILE  26 -14.720   3.950  -1.827
  200   2HG2  ILE  26          2HG2      ILE  26 -13.463   2.920  -2.512
  201   3HG2  ILE  26          3HG2      ILE  26 -13.748   4.526  -3.182
  202   1HD1  ILE  26          1HD1      ILE  26 -12.215   1.754  -1.746
  203   2HD1  ILE  26          2HD1      ILE  26 -12.365   2.245  -0.059
  204   3HD1  ILE  26          3HD1      ILE  26 -10.797   1.750  -0.697
  205    H    PHE  27           H        PHE  27  -9.895   5.974  -1.394
  206    HA   PHE  27           HA       PHE  27  -9.869   7.108   1.290
  207   1HB   PHE  27          2HB       PHE  27  -7.802   5.923  -0.533
  208   2HB   PHE  27          1HB       PHE  27  -7.292   6.939   0.815
  209    HD1  PHE  27           HD1      PHE  27  -8.946   3.786  -0.141
  210    HD2  PHE  27           HD2      PHE  27  -7.658   6.252   3.132
  211    HE1  PHE  27           HE1      PHE  27  -9.285   1.890   1.420
  212    HE2  PHE  27           HE2      PHE  27  -7.996   4.355   4.693
  213    HZ   PHE  27           HZ       PHE  27  -8.810   2.175   3.837
  214    H    ILE  28           H        ILE  28  -9.220   8.097  -2.022
  215    HA   ILE  28           HA       ILE  28  -8.134  10.683  -1.158
  216    HB   ILE  28           HB       ILE  28  -8.627   9.809  -4.008
  217   1HG1  ILE  28          2HG1      ILE  28  -7.224   8.075  -3.314
  218   2HG1  ILE  28          1HG1      ILE  28  -6.075   9.282  -3.867
  219   1HG2  ILE  28          1HG2      ILE  28  -8.043  12.040  -4.104
  220   2HG2  ILE  28          2HG2      ILE  28  -6.437  11.309  -4.122
  221   3HG2  ILE  28          3HG2      ILE  28  -7.092  11.966  -2.621
  222   1HD1  ILE  28          1HD1      ILE  28  -6.123  10.098  -1.377
  223   2HD1  ILE  28          2HD1      ILE  28  -5.174   8.670  -1.797
  224   3HD1  ILE  28          3HD1      ILE  28  -6.760   8.486  -1.052
  225    H    GLN  29           H        GLN  29 -10.866  10.127  -0.484
  226    HA   GLN  29           HA       GLN  29 -12.655  11.351  -2.342
  227   1HB   GLN  29          2HB       GLN  29 -14.227  11.474  -0.400
  228   2HB   GLN  29          1HB       GLN  29 -13.567   9.863  -0.670
  229   1HG   GLN  29          2HG       GLN  29 -12.794   9.839   1.441
  230   2HG   GLN  29          1HG       GLN  29 -11.768  11.224   1.072
  231   1HE2  GLN  29          1HE2      GLN  29 -13.563  10.491   3.513
  232   2HE2  GLN  29          2HE2      GLN  29 -14.468  11.904   3.768
  233    H    ASP  30           H        ASP  30 -10.553  12.559   0.185
  234    HA   ASP  30           HA       ASP  30 -10.974  15.280  -0.721
  235   1HB   ASP  30          2HB       ASP  30 -12.698  14.613   1.190
  236   2HB   ASP  30          1HB       ASP  30 -11.310  14.929   2.229
  237    H    ALA  31           H        ALA  31  -8.729  13.655  -0.917
  238    HA   ALA  31           HA       ALA  31  -6.894  14.074   1.250
  239   1HB   ALA  31          1HB       ALA  31  -6.260  13.388  -1.626
  240   2HB   ALA  31          2HB       ALA  31  -6.707  12.201  -0.403
  241   3HB   ALA  31          3HB       ALA  31  -5.222  13.137  -0.223
  242    H    GLU  32           H        GLU  32  -5.045  15.408   1.255
  243    HA   GLU  32           HA       GLU  32  -5.489  18.051   0.229
  244   1HB   GLU  32          2HB       GLU  32  -3.312  16.743   1.830
  245   2HB   GLU  32          1HB       GLU  32  -3.051  18.343   1.134
  246   1HG   GLU  32          2HG       GLU  32  -5.620  17.906   2.581
  247   2HG   GLU  32          1HG       GLU  32  -4.158  18.004   3.560
  248    H    ASP  33           H        ASP  33  -3.096  15.507  -0.439
  249    HA   ASP  33           HA       ASP  33  -2.129  16.999  -2.780
  250   1HB   ASP  33          2HB       ASP  33  -0.514  15.956  -1.143
  251   2HB   ASP  33          1HB       ASP  33  -1.088  14.380  -1.681
  252    H    GLY  34           H        GLY  34  -3.632  13.908  -1.902
  253   1HA   GLY  34          2HA       GLY  34  -5.356  13.016  -3.400
  254   2HA   GLY  34          1HA       GLY  34  -4.341  13.506  -4.752
  255    H    CYS  35           H        CYS  35  -3.615  11.777  -1.720
  256    HA   CYS  35           HA       CYS  35  -3.075   9.292  -3.122
  257   1HB   CYS  35          2HB       CYS  35  -0.705   9.419  -1.813
  258   2HB   CYS  35          1HB       CYS  35  -0.902   9.842  -3.509
  259    HG   CYS  35           HG       CYS  35   0.090  11.997  -2.684
  260    H    ILE  36           H        ILE  36  -2.179   7.627  -1.525
  261    HA   ILE  36           HA       ILE  36  -3.620   7.971   1.030
  262    HB   ILE  36           HB       ILE  36  -3.443   5.472   1.187
  263   1HG1  ILE  36          2HG1      ILE  36  -2.967   4.960  -1.602
  264   2HG1  ILE  36          1HG1      ILE  36  -1.604   5.873  -0.955
  265   1HG2  ILE  36          1HG2      ILE  36  -5.271   5.087  -0.259
  266   2HG2  ILE  36          2HG2      ILE  36  -4.698   6.264  -1.441
  267   3HG2  ILE  36          3HG2      ILE  36  -5.367   6.811   0.096
  268   1HD1  ILE  36          1HD1      ILE  36  -1.632   4.224   1.009
  269   2HD1  ILE  36          2HD1      ILE  36  -1.064   3.599  -0.542
  270   3HD1  ILE  36          3HD1      ILE  36  -2.696   3.231   0.012
  271    H    SER  37           H        SER  37  -2.455   6.298   2.729
  272    HA   SER  37           HA       SER  37   0.199   7.482   3.102
  273   1HB   SER  37          2HB       SER  37  -1.750   7.210   4.904
  274   2HB   SER  37          1HB       SER  37  -0.988   5.638   5.122
  275    HG   SER  37           HG       SER  37  -0.077   8.170   5.731
  276    H    THR  38           H        THR  38   2.065   6.338   3.177
  277    HA   THR  38           HA       THR  38   2.323   3.941   1.743
  278    HB   THR  38           HB       THR  38   4.605   3.803   2.904
  279    HG1  THR  38           HG1      THR  38   5.033   5.214   4.406
  280   1HG2  THR  38          1HG2      THR  38   4.542   4.801   0.764
  281   2HG2  THR  38          2HG2      THR  38   5.333   6.006   1.780
  282   3HG2  THR  38          3HG2      THR  38   3.633   6.195   1.348
  283    H    LYS  39           H        LYS  39   2.143   4.519   5.243
  284    HA   LYS  39           HA       LYS  39   2.435   1.759   5.962
  285   1HB   LYS  39          2HB       LYS  39   1.874   2.474   8.210
  286   2HB   LYS  39          1HB       LYS  39   2.985   3.638   7.493
  287   1HG   LYS  39          2HG       LYS  39   0.349   4.477   6.814
  288   2HG   LYS  39          1HG       LYS  39   0.349   4.103   8.538
  289   1HD   LYS  39          2HD       LYS  39   2.537   5.770   7.290
  290   2HD   LYS  39          1HD       LYS  39   1.030   6.497   7.847
  291   1HE   LYS  39          2HE       LYS  39   1.412   5.494  10.097
  292   2HE   LYS  39          1HE       LYS  39   2.961   4.870   9.529
  293   1HZ   LYS  39          1HZ       LYS  39   3.273   6.948  10.679
  294   2HZ   LYS  39          2HZ       LYS  39   2.162   7.729   9.659
  295   3HZ   LYS  39          3HZ       LYS  39   3.635   7.156   9.034
  296    H    GLU  40           H        GLU  40  -0.224   3.679   4.847
  297    HA   GLU  40           HA       GLU  40  -2.229   1.838   5.929
  298   1HB   GLU  40          2HB       GLU  40  -2.310   4.524   4.631
  299   2HB   GLU  40          1HB       GLU  40  -3.728   3.490   4.492
  300   1HG   GLU  40          2HG       GLU  40  -2.402   3.945   7.162
  301   2HG   GLU  40          1HG       GLU  40  -3.593   5.084   6.533
  302    H    LEU  41           H        LEU  41  -0.178   1.483   3.477
  303    HA   LEU  41           HA       LEU  41  -1.821   1.031   1.205
  304   1HB   LEU  41          2HB       LEU  41   0.918   0.841   1.798
  305   2HB   LEU  41          1HB       LEU  41   0.435  -0.764   1.295
  306    HG   LEU  41           HG       LEU  41   0.072   1.790  -0.279
  307   1HD1  LEU  41          1HD1      LEU  41   1.641   0.526  -1.856
  308   2HD1  LEU  41          2HD1      LEU  41   1.945  -0.574  -0.511
  309   3HD1  LEU  41          3HD1      LEU  41   2.366   1.132  -0.367
  310   1HD2  LEU  41          1HD2      LEU  41  -0.456  -1.036  -1.216
  311   2HD2  LEU  41          2HD2      LEU  41  -0.932   0.474  -1.990
  312   3HD2  LEU  41          3HD2      LEU  41  -1.724  -0.041  -0.502
  313    H    GLY  42           H        GLY  42  -0.773  -1.011   3.885
  314   1HA   GLY  42          2HA       GLY  42  -1.750  -3.488   2.942
  315   2HA   GLY  42          1HA       GLY  42  -1.489  -3.070   4.630
  316    H    LYS  43           H        LYS  43  -3.430  -0.684   4.055
  317    HA   LYS  43           HA       LYS  43  -5.817  -2.072   4.929
  318   1HB   LYS  43          2HB       LYS  43  -4.925   0.220   5.756
  319   2HB   LYS  43          1HB       LYS  43  -5.647   0.863   4.281
  320   1HG   LYS  43          2HG       LYS  43  -7.421   1.074   5.757
  321   2HG   LYS  43          1HG       LYS  43  -7.752  -0.519   5.078
  322   1HD   LYS  43          2HD       LYS  43  -7.149  -1.623   7.009
  323   2HD   LYS  43          1HD       LYS  43  -5.963  -0.398   7.463
  324   1HE   LYS  43          2HE       LYS  43  -8.815   0.456   7.422
  325   2HE   LYS  43          1HE       LYS  43  -8.334  -0.640   8.717
  326   1HZ   LYS  43          1HZ       LYS  43  -6.548   0.876   9.297
  327   2HZ   LYS  43          2HZ       LYS  43  -8.047   1.671   9.359
  328   3HZ   LYS  43          3HZ       LYS  43  -7.001   1.930   8.046
  329    H    VAL  44           H        VAL  44  -4.779  -0.154   2.106
  330    HA   VAL  44           HA       VAL  44  -7.316  -0.319   0.781
  331    HB   VAL  44           HB       VAL  44  -6.068   0.516  -1.214
  332   1HG1  VAL  44          1HG1      VAL  44  -6.878   1.885   0.918
  333   2HG1  VAL  44          2HG1      VAL  44  -5.977   2.670  -0.379
  334   3HG1  VAL  44          3HG1      VAL  44  -5.149   2.175   1.097
  335   1HG2  VAL  44          1HG2      VAL  44  -3.706   1.113  -0.972
  336   2HG2  VAL  44          2HG2      VAL  44  -3.906  -0.619  -0.710
  337   3HG2  VAL  44          3HG2      VAL  44  -3.687   0.462   0.667
  338    H    MET  45           H        MET  45  -4.326  -2.225   0.661
  339    HA   MET  45           HA       MET  45  -5.118  -3.814  -1.589
  340   1HB   MET  45          2HB       MET  45  -3.076  -4.400   0.567
  341   2HB   MET  45          1HB       MET  45  -3.248  -5.281  -0.951
  342   1HG   MET  45          2HG       MET  45  -2.840  -3.153  -2.187
  343   2HG   MET  45          1HG       MET  45  -2.557  -2.347  -0.646
  344   1HE   MET  45          1HE       MET  45  -0.028  -4.465   1.005
  345   2HE   MET  45          2HE       MET  45  -1.342  -3.293   1.072
  346   3HE   MET  45          3HE       MET  45   0.286  -2.760   0.658
  347    H    ARG  46           H        ARG  46  -5.582  -4.016   1.877
  348    HA   ARG  46           HA       ARG  46  -6.384  -6.731   2.029
  349   1HB   ARG  46          2HB       ARG  46  -6.263  -6.163   4.204
  350   2HB   ARG  46          1HB       ARG  46  -6.213  -4.454   3.784
  351   1HG   ARG  46          2HG       ARG  46  -8.624  -4.329   3.738
  352   2HG   ARG  46          1HG       ARG  46  -8.764  -6.070   3.982
  353   1HD   ARG  46          2HD       ARG  46  -7.779  -5.896   6.190
  354   2HD   ARG  46          1HD       ARG  46  -7.424  -4.190   5.945
  355    HE   ARG  46           HE       ARG  46  -9.971  -5.336   6.691
  356   1HH1  ARG  46          2HH1      ARG  46  -8.366  -2.635   5.162
  357   2HH1  ARG  46          1HH1      ARG  46  -9.667  -1.535   5.459
  358   1HH2  ARG  46          1HH2      ARG  46 -11.664  -3.873   7.065
  359   2HH2  ARG  46          2HH2      ARG  46 -11.528  -2.231   6.533
  360    H    MET  47           H        MET  47  -8.114  -3.697   1.499
  361    HA   MET  47           HA       MET  47 -10.733  -4.861   1.391
  362   1HB   MET  47          2HB       MET  47  -9.607  -2.186   0.572
  363   2HB   MET  47          1HB       MET  47 -11.288  -2.619   0.257
  364   1HG   MET  47          2HG       MET  47 -11.714  -2.958   2.613
  365   2HG   MET  47          1HG       MET  47 -10.003  -2.772   2.997
  366   1HE   MET  47          1HE       MET  47 -12.648  -0.438   0.742
  367   2HE   MET  47          2HE       MET  47 -13.236   0.235   2.261
  368   3HE   MET  47          3HE       MET  47 -13.220  -1.510   2.027
  369    H    LEU  48           H        LEU  48  -8.200  -4.225  -0.968
  370    HA   LEU  48           HA       LEU  48  -9.633  -4.365  -3.355
  371   1HB   LEU  48          2HB       LEU  48  -7.004  -4.126  -2.698
  372   2HB   LEU  48          1HB       LEU  48  -7.033  -5.754  -3.334
  373    HG   LEU  48           HG       LEU  48  -6.428  -4.229  -5.103
  374   1HD1  LEU  48          1HD1      LEU  48  -8.074  -4.829  -6.744
  375   2HD1  LEU  48          2HD1      LEU  48  -9.338  -4.949  -5.519
  376   3HD1  LEU  48          3HD1      LEU  48  -8.038  -6.140  -5.564
  377   1HD2  LEU  48          1HD2      LEU  48  -7.610  -2.275  -5.650
  378   2HD2  LEU  48          2HD2      LEU  48  -7.699  -2.289  -3.889
  379   3HD2  LEU  48          3HD2      LEU  48  -9.080  -2.824  -4.845
  380    H    GLY  49           H        GLY  49  -8.214  -7.018  -1.428
  381   1HA   GLY  49          2HA       GLY  49 -10.137  -8.922  -1.778
  382   2HA   GLY  49          1HA       GLY  49  -9.172  -9.057  -3.242
  383    H    GLN  50           H        GLN  50  -6.641  -8.377  -1.965
  384    HA   GLN  50           HA       GLN  50  -6.006 -11.006  -0.903
  385   1HB   GLN  50          2HB       GLN  50  -4.435  -8.619  -1.787
  386   2HB   GLN  50          1HB       GLN  50  -3.668  -9.771  -0.695
  387   1HG   GLN  50          2HG       GLN  50  -3.132 -10.769  -2.702
  388   2HG   GLN  50          1HG       GLN  50  -4.700 -11.527  -2.425
  389   1HE2  GLN  50          1HE2      GLN  50  -3.160  -8.765  -4.132
  390   2HE2  GLN  50          2HE2      GLN  50  -4.358  -8.644  -5.328
  391    H    ASN  51           H        ASN  51  -4.446 -11.079   1.010
  392    HA   ASN  51           HA       ASN  51  -4.942  -9.064   3.068
  393   1HB   ASN  51          2HB       ASN  51  -6.787 -10.937   3.071
  394   2HB   ASN  51          1HB       ASN  51  -5.524 -11.911   3.821
  395   1HD2  ASN  51          1HD2      ASN  51  -7.781  -9.295   4.353
  396   2HD2  ASN  51          2HD2      ASN  51  -7.357  -8.998   5.969
  397    HA   PRO  52           HA       PRO  52  -0.757 -11.012   3.279
  398   1HB   PRO  52          2HB       PRO  52   0.647  -8.682   3.021
  399   2HB   PRO  52          1HB       PRO  52   0.093  -9.646   1.647
  400   1HG   PRO  52          2HG       PRO  52  -0.932  -7.074   2.674
  401   2HG   PRO  52          1HG       PRO  52  -1.019  -7.748   1.041
  402   1HD   PRO  52          2HD       PRO  52  -3.108  -7.704   2.972
  403   2HD   PRO  52          1HD       PRO  52  -3.110  -8.584   1.425
  404    H    THR  53           H        THR  53   1.249  -9.828   4.577
  405    HA   THR  53           HA       THR  53   0.172  -9.254   7.270
  406    HB   THR  53           HB       THR  53   2.133 -10.188   8.186
  407    HG1  THR  53           HG1      THR  53   4.014 -10.036   7.250
  408   1HG2  THR  53          1HG2      THR  53   0.758 -11.924   7.137
  409   2HG2  THR  53          2HG2      THR  53   2.468 -12.345   7.034
  410   3HG2  THR  53          3HG2      THR  53   1.630 -11.710   5.619
  411    HA   PRO  54           HA       PRO  54   1.863  -5.184   7.256
  412   1HB   PRO  54          2HB       PRO  54   3.220  -5.011   9.635
  413   2HB   PRO  54          1HB       PRO  54   1.456  -4.954   9.488
  414   1HG   PRO  54          2HG       PRO  54   3.212  -7.204  10.354
  415   2HG   PRO  54          1HG       PRO  54   1.588  -6.764  10.907
  416   1HD   PRO  54          2HD       PRO  54   2.111  -8.824   9.138
  417   2HD   PRO  54          1HD       PRO  54   0.554  -7.968   9.233
  418    H    GLU  55           H        GLU  55   4.143  -7.771   7.864
  419    HA   GLU  55           HA       GLU  55   6.506  -6.192   7.277
  420   1HB   GLU  55          2HB       GLU  55   6.305  -9.209   7.307
  421   2HB   GLU  55          1HB       GLU  55   7.741  -8.217   7.552
  422   1HG   GLU  55          2HG       GLU  55   6.690  -7.290   9.625
  423   2HG   GLU  55          1HG       GLU  55   5.346  -8.409   9.400
  424    H    GLU  56           H        GLU  56   4.440  -8.556   5.643
  425    HA   GLU  56           HA       GLU  56   5.940  -8.852   3.269
  426   1HB   GLU  56          2HB       GLU  56   3.840 -10.165   4.155
  427   2HB   GLU  56          1HB       GLU  56   2.942  -8.962   3.228
  428   1HG   GLU  56          2HG       GLU  56   3.271 -10.539   1.573
  429   2HG   GLU  56          1HG       GLU  56   4.745  -9.594   1.362
  430    H    LEU  57           H        LEU  57   3.013  -6.848   3.844
  431    HA   LEU  57           HA       LEU  57   3.101  -5.494   1.376
  432   1HB   LEU  57          2HB       LEU  57   1.554  -3.929   2.327
  433   2HB   LEU  57          1HB       LEU  57   1.129  -5.545   2.841
  434    HG   LEU  57           HG       LEU  57   2.635  -4.777   4.956
  435   1HD1  LEU  57          1HD1      LEU  57   1.691  -2.308   3.559
  436   2HD1  LEU  57          2HD1      LEU  57   3.136  -2.560   4.539
  437   3HD1  LEU  57          3HD1      LEU  57   1.567  -2.350   5.317
  438   1HD2  LEU  57          1HD2      LEU  57   0.246  -3.856   5.776
  439   2HD2  LEU  57          2HD2      LEU  57   0.546  -5.573   5.515
  440   3HD2  LEU  57          3HD2      LEU  57  -0.266  -4.624   4.273
  441    H    GLN  58           H        GLN  58   4.890  -4.975   4.339
  442    HA   GLN  58           HA       GLN  58   5.623  -2.292   4.083
  443   1HB   GLN  58          2HB       GLN  58   6.348  -4.405   5.759
  444   2HB   GLN  58          1HB       GLN  58   7.855  -3.927   4.980
  445   1HG   GLN  58          2HG       GLN  58   5.942  -2.062   6.418
  446   2HG   GLN  58          1HG       GLN  58   7.494  -2.624   7.038
  447   1HE2  GLN  58          1HE2      GLN  58   5.957  -0.399   4.782
  448   2HE2  GLN  58          2HE2      GLN  58   7.381   0.392   4.303
  449    H    GLU  59           H        GLU  59   7.213  -5.190   2.752
  450    HA   GLU  59           HA       GLU  59   9.338  -3.831   1.456
  451   1HB   GLU  59          2HB       GLU  59   8.046  -6.498   0.843
  452   2HB   GLU  59          1HB       GLU  59   9.534  -5.921   0.097
  453   1HG   GLU  59          2HG       GLU  59  10.769  -6.189   2.023
  454   2HG   GLU  59          1HG       GLU  59   9.395  -5.856   3.077
  455    H    MET  60           H        MET  60   6.059  -4.678   0.430
  456    HA   MET  60           HA       MET  60   6.335  -4.065  -2.318
  457   1HB   MET  60          2HB       MET  60   3.889  -3.944  -0.535
  458   2HB   MET  60          1HB       MET  60   3.856  -3.827  -2.294
  459   1HG   MET  60          2HG       MET  60   5.000  -6.058  -2.407
  460   2HG   MET  60          1HG       MET  60   4.839  -6.180  -0.656
  461   1HE   MET  60          1HE       MET  60   3.493  -7.174  -3.876
  462   2HE   MET  60          2HE       MET  60   2.922  -5.511  -3.978
  463   3HE   MET  60          3HE       MET  60   1.758  -6.833  -3.902
  464    H    ILE  61           H        ILE  61   5.368  -2.080   0.474
  465    HA   ILE  61           HA       ILE  61   4.628   0.264  -0.842
  466    HB   ILE  61           HB       ILE  61   5.954  -0.171   1.839
  467   1HG1  ILE  61          2HG1      ILE  61   3.150   0.748   1.495
  468   2HG1  ILE  61          1HG1      ILE  61   3.494  -0.917   1.030
  469   1HG2  ILE  61          1HG2      ILE  61   5.050   2.149   2.332
  470   2HG2  ILE  61          2HG2      ILE  61   4.818   2.345   0.594
  471   3HG2  ILE  61          3HG2      ILE  61   6.440   2.099   1.247
  472   1HD1  ILE  61          1HD1      ILE  61   4.347   0.253   3.683
  473   2HD1  ILE  61          2HD1      ILE  61   4.345  -1.442   3.198
  474   3HD1  ILE  61          3HD1      ILE  61   2.820  -0.596   3.455
  475    H    ASP  62           H        ASP  62   7.763  -0.163   0.808
  476    HA   ASP  62           HA       ASP  62   9.089   1.995  -0.323
  477   1HB   ASP  62          2HB       ASP  62  10.134  -0.649   0.688
  478   2HB   ASP  62          1HB       ASP  62  11.200   0.649   0.152
  479    H    GLU  63           H        GLU  63   8.607  -1.242  -1.661
  480    HA   GLU  63           HA       GLU  63  10.507  -1.117  -3.751
  481   1HB   GLU  63          2HB       GLU  63   8.074  -2.738  -3.195
  482   2HB   GLU  63          1HB       GLU  63   8.652  -2.699  -4.859
  483   1HG   GLU  63          2HG       GLU  63  10.684  -3.127  -2.716
  484   2HG   GLU  63          1HG       GLU  63   9.598  -4.466  -3.083
  485    H    VAL  64           H        VAL  64   7.030  -0.305  -3.719
  486    HA   VAL  64           HA       VAL  64   7.147   0.715  -6.439
  487    HB   VAL  64           HB       VAL  64   4.781   1.173  -6.196
  488   1HG1  VAL  64          1HG1      VAL  64   4.133  -1.025  -6.228
  489   2HG1  VAL  64          2HG1      VAL  64   4.986  -1.411  -4.734
  490   3HG1  VAL  64          3HG1      VAL  64   5.876  -1.281  -6.251
  491   1HG2  VAL  64          1HG2      VAL  64   5.164   0.415  -3.281
  492   2HG2  VAL  64          2HG2      VAL  64   3.621   0.773  -4.054
  493   3HG2  VAL  64          3HG2      VAL  64   4.836   2.041  -3.882
  494    H    ASP  65           H        ASP  65   7.749   2.015  -3.328
  495    HA   ASP  65           HA       ASP  65   6.819   4.675  -3.758
  496   1HB   ASP  65          2HB       ASP  65   7.804   3.323  -1.586
  497   2HB   ASP  65          1HB       ASP  65   9.163   4.364  -1.999
  498    H    GLU  66           H        GLU  66   7.496   5.297  -5.800
  499    HA   GLU  66           HA       GLU  66  10.234   5.183  -6.649
  500   1HB   GLU  66          2HB       GLU  66   7.841   6.682  -7.729
  501   2HB   GLU  66          1HB       GLU  66   9.427   6.683  -8.503
  502   1HG   GLU  66          2HG       GLU  66   9.341   4.345  -8.927
  503   2HG   GLU  66          1HG       GLU  66   7.995   4.112  -7.812
  504    H    ASP  67           H        ASP  67   8.211   7.675  -5.165
  505    HA   ASP  67           HA       ASP  67  10.331   9.669  -5.417
  506   1HB   ASP  67          2HB       ASP  67   8.605  11.038  -3.985
  507   2HB   ASP  67          1HB       ASP  67   8.315  10.764  -5.700
  508    H    GLY  68           H        GLY  68   8.689   7.868  -2.824
  509   1HA   GLY  68          2HA       GLY  68   9.476   7.264  -0.726
  510   2HA   GLY  68          1HA       GLY  68  11.026   7.992  -1.140
  511    H    SER  69           H        SER  69   7.776   9.420  -1.107
  512    HA   SER  69           HA       SER  69   8.773  11.651   0.493
  513   1HB   SER  69          2HB       SER  69   6.510  12.630  -0.021
  514   2HB   SER  69          1HB       SER  69   7.492  12.277  -1.439
  515    HG   SER  69           HG       SER  69   5.684  11.279  -1.979
  516    H    GLY  70           H        GLY  70   5.988   9.421   0.553
  517   1HA   GLY  70          2HA       GLY  70   5.977   8.498   3.079
  518   2HA   GLY  70          1HA       GLY  70   5.360  10.132   3.305
  519    H    THR  71           H        THR  71   4.077  10.062   0.589
  520    HA   THR  71           HA       THR  71   1.727   8.426   1.326
  521    HB   THR  71           HB       THR  71   0.390   9.974  -0.012
  522    HG1  THR  71           HG1      THR  71   2.764  11.484  -0.353
  523   1HG2  THR  71          1HG2      THR  71   0.747  12.039   1.366
  524   2HG2  THR  71          2HG2      THR  71   2.240  11.322   1.974
  525   3HG2  THR  71          3HG2      THR  71   0.689  10.559   2.323
  526    H    VAL  72           H        VAL  72   0.663   7.234  -0.271
  527    HA   VAL  72           HA       VAL  72   2.368   6.512  -2.567
  528    HB   VAL  72           HB       VAL  72  -0.009   5.003  -1.451
  529   1HG1  VAL  72          1HG1      VAL  72   0.651   4.603  -3.852
  530   2HG1  VAL  72          2HG1      VAL  72   0.798   3.178  -2.822
  531   3HG1  VAL  72          3HG1      VAL  72   2.236   4.092  -3.272
  532   1HG2  VAL  72          1HG2      VAL  72   1.701   5.045   0.253
  533   2HG2  VAL  72          2HG2      VAL  72   2.966   4.723  -0.934
  534   3HG2  VAL  72          3HG2      VAL  72   1.786   3.471  -0.538
  535    H    ASP  73           H        ASP  73   1.863   7.494  -4.395
  536    HA   ASP  73           HA       ASP  73  -0.821   8.524  -4.873
  537   1HB   ASP  73          2HB       ASP  73   1.707   8.625  -6.544
  538   2HB   ASP  73          1HB       ASP  73   0.183   9.387  -6.994
  539    H    PHE  74           H        PHE  74  -1.510   8.181  -7.342
  540    HA   PHE  74           HA       PHE  74  -2.250   5.446  -7.550
  541   1HB   PHE  74          2HB       PHE  74  -3.369   7.600  -8.564
  542   2HB   PHE  74          1HB       PHE  74  -2.329   7.243  -9.944
  543    HD1  PHE  74           HD1      PHE  74  -3.556   6.187 -11.609
  544    HD2  PHE  74           HD2      PHE  74  -4.185   5.065  -7.517
  545    HE1  PHE  74           HE1      PHE  74  -5.132   4.413 -12.338
  546    HE2  PHE  74           HE2      PHE  74  -5.766   3.295  -8.240
  547    HZ   PHE  74           HZ       PHE  74  -6.238   2.968 -10.653
  548    H    ASP  75           H        ASP  75   0.370   7.327  -8.970
  549    HA   ASP  75           HA       ASP  75   1.152   5.465 -10.967
  550   1HB   ASP  75          2HB       ASP  75   2.367   7.829  -9.655
  551   2HB   ASP  75          1HB       ASP  75   3.506   6.655 -10.314
  552    H    GLU  76           H        GLU  76   1.902   5.820  -7.544
  553    HA   GLU  76           HA       GLU  76   3.820   3.632  -7.532
  554   1HB   GLU  76          2HB       GLU  76   2.592   4.889  -5.079
  555   2HB   GLU  76          1HB       GLU  76   4.182   4.144  -5.258
  556   1HG   GLU  76          2HG       GLU  76   4.877   5.984  -6.754
  557   2HG   GLU  76          1HG       GLU  76   3.286   6.724  -6.583
  558    H    PHE  77           H        PHE  77   0.420   4.117  -7.092
  559    HA   PHE  77           HA       PHE  77  -0.102   1.716  -5.584
  560   1HB   PHE  77          2HB       PHE  77  -1.557   3.773  -5.568
  561   2HB   PHE  77          1HB       PHE  77  -2.034   3.381  -7.217
  562    HD1  PHE  77           HD1      PHE  77  -3.780   1.875  -7.627
  563    HD2  PHE  77           HD2      PHE  77  -1.927   1.962  -3.750
  564    HE1  PHE  77           HE1      PHE  77  -5.507   0.314  -6.767
  565    HE2  PHE  77           HE2      PHE  77  -3.653   0.398  -2.893
  566    HZ   PHE  77           HZ       PHE  77  -5.443  -0.424  -4.400
  567    H    LEU  78           H        LEU  78  -0.243   2.675  -9.003
  568    HA   LEU  78           HA       LEU  78  -1.384   0.203  -9.920
  569   1HB   LEU  78          2HB       LEU  78  -0.012   2.469 -11.352
  570   2HB   LEU  78          1HB       LEU  78  -0.635   1.061 -12.181
  571    HG   LEU  78           HG       LEU  78  -2.103   3.339 -10.923
  572   1HD1  LEU  78          1HD1      LEU  78  -2.303   1.681 -13.444
  573   2HD1  LEU  78          2HD1      LEU  78  -1.895   3.391 -13.299
  574   3HD1  LEU  78          3HD1      LEU  78  -3.541   2.848 -12.979
  575   1HD2  LEU  78          1HD2      LEU  78  -3.093   1.551  -9.687
  576   2HD2  LEU  78          2HD2      LEU  78  -3.081   0.480 -11.089
  577   3HD2  LEU  78          3HD2      LEU  78  -4.186   1.853 -11.038
  578    H    VAL  79           H        VAL  79   1.927   1.495  -9.736
  579    HA   VAL  79           HA       VAL  79   3.219  -0.456 -11.273
  580    HB   VAL  79           HB       VAL  79   5.250   0.035  -9.842
  581   1HG1  VAL  79          1HG1      VAL  79   5.217   1.330 -11.753
  582   2HG1  VAL  79          2HG1      VAL  79   5.090   2.598 -10.534
  583   3HG1  VAL  79          3HG1      VAL  79   3.646   2.037 -11.376
  584   1HG2  VAL  79          1HG2      VAL  79   5.100   1.870  -8.252
  585   2HG2  VAL  79          2HG2      VAL  79   3.955   0.613  -7.784
  586   3HG2  VAL  79          3HG2      VAL  79   3.382   2.069  -8.595
  587    H    MET  80           H        MET  80   1.979  -0.633  -8.017
  588    HA   MET  80           HA       MET  80   3.396  -2.710  -6.882
  589   1HB   MET  80          2HB       MET  80   0.652  -1.661  -6.621
  590   2HB   MET  80          1HB       MET  80   0.870  -3.323  -6.072
  591   1HG   MET  80          2HG       MET  80   2.966  -2.399  -4.836
  592   2HG   MET  80          1HG       MET  80   2.223  -0.820  -5.082
  593   1HE   MET  80          1HE       MET  80  -1.240  -1.184  -3.410
  594   2HE   MET  80          2HE       MET  80  -0.780  -1.441  -5.091
  595   3HE   MET  80          3HE       MET  80  -0.086  -0.094  -4.190
  596    H    MET  81           H        MET  81   0.887  -2.932  -9.375
  597    HA   MET  81           HA       MET  81   0.743  -5.821  -9.249
  598   1HB   MET  81          2HB       MET  81  -0.500  -3.687 -10.933
  599   2HB   MET  81          1HB       MET  81  -0.464  -5.335 -11.563
  600   1HG   MET  81          2HG       MET  81  -1.368  -4.894  -8.740
  601   2HG   MET  81          1HG       MET  81  -2.480  -4.521 -10.056
  602   1HE   MET  81          1HE       MET  81  -0.398  -7.248  -8.205
  603   2HE   MET  81          2HE       MET  81  -1.704  -8.430  -8.163
  604   3HE   MET  81          3HE       MET  81  -1.984  -6.799  -7.560
  605    H    VAL  82           H        VAL  82   1.986  -3.470 -11.629
  606    HA   VAL  82           HA       VAL  82   3.090  -5.434 -13.369
  607    HB   VAL  82           HB       VAL  82   4.355  -3.473 -14.350
  608   1HG1  VAL  82          1HG1      VAL  82   2.475  -2.822 -15.527
  609   2HG1  VAL  82          2HG1      VAL  82   1.479  -2.700 -14.076
  610   3HG1  VAL  82          3HG1      VAL  82   1.851  -4.282 -14.759
  611   1HG2  VAL  82          1HG2      VAL  82   2.655  -1.834 -12.460
  612   2HG2  VAL  82          2HG2      VAL  82   3.948  -1.278 -13.521
  613   3HG2  VAL  82          3HG2      VAL  82   4.332  -2.239 -12.092
  614    H    ARG  83           H        ARG  83   4.376  -3.854 -10.505
  615    HA   ARG  83           HA       ARG  83   7.134  -4.302 -11.038
  616   1HB   ARG  83          2HB       ARG  83   7.524  -3.874  -8.692
  617   2HB   ARG  83          1HB       ARG  83   6.301  -2.747  -9.270
  618   1HG   ARG  83          2HG       ARG  83   4.630  -3.705  -8.022
  619   2HG   ARG  83          1HG       ARG  83   5.306  -5.325  -8.158
  620   1HD   ARG  83          2HD       ARG  83   7.241  -4.011  -6.706
  621   2HD   ARG  83          1HD       ARG  83   5.764  -3.266  -6.110
  622    HE   ARG  83           HE       ARG  83   5.180  -5.294  -5.123
  623   1HH1  ARG  83          2HH1      ARG  83   7.844  -5.737  -7.340
  624   2HH1  ARG  83          1HH1      ARG  83   8.163  -7.357  -6.828
  625   1HH2  ARG  83          1HH2      ARG  83   5.620  -7.421  -4.469
  626   2HH2  ARG  83          2HH2      ARG  83   6.909  -8.309  -5.208
  627    H    CYS  84           H        CYS  84   4.575  -6.409 -10.035
  628    HA   CYS  84           HA       CYS  84   6.166  -8.422  -8.773
  629   1HB   CYS  84          2HB       CYS  84   3.408  -8.443  -9.995
  630   2HB   CYS  84          1HB       CYS  84   4.142  -9.891  -9.308
  631    HG   CYS  84           HG       CYS  84   3.862  -8.969  -7.002
  632    H    MET  85           H        MET  85   5.508  -7.603 -12.096
  633    HA   MET  85           HA       MET  85   5.880 -10.036 -13.403
  634   1HB   MET  85          2HB       MET  85   5.462  -7.481 -14.230
  635   2HB   MET  85          1HB       MET  85   7.157  -7.689 -14.673
  636   1HG   MET  85          2HG       MET  85   6.092 -10.065 -15.509
  637   2HG   MET  85          1HG       MET  85   4.745  -8.967 -15.798
  638   1HE   MET  85          1HE       MET  85   6.385 -10.213 -18.697
  639   2HE   MET  85          2HE       MET  85   5.477  -8.790 -19.202
  640   3HE   MET  85          3HE       MET  85   4.857  -9.807 -17.903
  641    H    LYS  86           H        LYS  86   8.293  -7.705 -12.229
  642    HA   LYS  86           HA       LYS  86  10.408  -9.682 -12.850
  643   1HB   LYS  86          2HB       LYS  86  11.981  -7.705 -12.722
  644   2HB   LYS  86          1HB       LYS  86  10.867  -7.684 -14.086
  645   1HG   LYS  86          2HG       LYS  86   9.367  -6.162 -12.830
  646   2HG   LYS  86          1HG       LYS  86  10.504  -6.167 -11.481
  647   1HD   LYS  86          2HD       LYS  86  12.203  -5.494 -13.455
  648   2HD   LYS  86          1HD       LYS  86  10.716  -4.834 -14.134
  649   1HE   LYS  86          2HE       LYS  86  10.385  -3.374 -12.312
  650   2HE   LYS  86          1HE       LYS  86  11.485  -4.280 -11.273
  651   1HZ   LYS  86          1HZ       LYS  86  12.276  -2.731 -13.682
  652   2HZ   LYS  86          2HZ       LYS  86  13.328  -3.588 -12.659
  653   3HZ   LYS  86          3HZ       LYS  86  12.491  -2.231 -12.077
  654    H    ASP  87           H        ASP  87  11.263 -10.683 -11.168
  655    HA   ASP  87           HA       ASP  87  11.809  -9.272  -8.685
  656   1HB   ASP  87          2HB       ASP  87   9.375 -10.659  -8.915
  657   2HB   ASP  87          1HB       ASP  87  10.430 -11.716  -7.977
  658    H    ASP  88           H        ASP  88  13.375 -10.655 -10.759
  659    HA   ASP  88           HA       ASP  88  15.137 -12.118 -10.940
  660   1HB   ASP  88          2HB       ASP  88  15.316 -10.951  -8.429
  661   2HB   ASP  88          1HB       ASP  88  15.438 -12.674  -8.079
  662    H    SER  89           HN       SER  89  15.853 -14.323  -9.239
  663    HA   SER  89           HA       SER  89  15.370 -16.532  -8.855
  664   1HB   SER  89          2HB       SER  89  12.779 -15.192  -8.392
  665   2HB   SER  89          1HB       SER  89  12.671 -16.907  -8.780
  666    HG   SER  89           HG       SER  89  13.810 -15.616  -6.592
  Start of MODEL   30
    1   1H    MET   1          1H        MET   1  15.036   0.637 -17.865
    2   2H    MET   1          2H        MET   1  14.500   2.168 -17.361
    3   3H    MET   1          3H        MET   1  13.379   1.001 -17.878
    4    HA   MET   1           HA       MET   1  15.059   0.892 -15.432
    5   1HB   MET   1          2HB       MET   1  12.537   2.065 -15.947
    6   2HB   MET   1          1HB       MET   1  12.207   0.573 -15.066
    7   1HG   MET   1          2HG       MET   1  14.377   2.448 -14.139
    8   2HG   MET   1          1HG       MET   1  12.693   2.735 -13.698
    9   1HE   MET   1          1HE       MET   1  12.416   1.573 -10.739
   10   2HE   MET   1          2HE       MET   1  13.219   2.866 -11.627
   11   3HE   MET   1          3HE       MET   1  14.168   1.779 -10.617
   12    H    ASN   2           H        ASN   2  12.215  -0.682 -16.950
   13    HA   ASN   2           HA       ASN   2  13.491  -3.290 -16.767
   14   1HB   ASN   2          2HB       ASN   2  12.084  -2.531 -14.558
   15   2HB   ASN   2          1HB       ASN   2  10.822  -3.313 -15.511
   16   1HD2  ASN   2          1HD2      ASN   2  14.233  -3.899 -14.472
   17   2HD2  ASN   2          2HD2      ASN   2  14.040  -5.576 -14.297
   18    H    ASP   3           H        ASP   3  12.319  -4.952 -17.871
   19    HA   ASP   3           HA       ASP   3  10.679  -3.871 -20.047
   20   1HB   ASP   3          2HB       ASP   3  12.209  -6.426 -19.649
   21   2HB   ASP   3          1HB       ASP   3  10.994  -6.290 -20.920
   22    H    ILE   4           H        ILE   4  10.099  -5.299 -17.046
   23    HA   ILE   4           HA       ILE   4   7.921  -7.023 -17.802
   24    HB   ILE   4           HB       ILE   4   7.434  -7.204 -15.432
   25   1HG1  ILE   4          2HG1      ILE   4   9.122  -5.843 -13.909
   26   2HG1  ILE   4          1HG1      ILE   4   9.132  -4.728 -15.278
   27   1HG2  ILE   4          1HG2      ILE   4   9.915  -7.650 -14.653
   28   2HG2  ILE   4          2HG2      ILE   4  10.290  -7.311 -16.341
   29   3HG2  ILE   4          3HG2      ILE   4   9.197  -8.631 -15.930
   30   1HD1  ILE   4          1HD1      ILE   4   6.970  -4.075 -14.927
   31   2HD1  ILE   4          2HD1      ILE   4   7.303  -4.611 -13.281
   32   3HD1  ILE   4          3HD1      ILE   4   6.461  -5.680 -14.403
   33    H    TYR   5           H        TYR   5   8.269  -3.628 -17.070
   34    HA   TYR   5           HA       TYR   5   5.524  -3.055 -16.530
   35   1HB   TYR   5          2HB       TYR   5   7.702  -1.239 -17.606
   36   2HB   TYR   5          1HB       TYR   5   6.147  -0.711 -16.964
   37    HD1  TYR   5           HD1      TYR   5   5.548  -1.409 -14.553
   38    HD2  TYR   5           HD2      TYR   5   9.526  -1.599 -16.162
   39    HE1  TYR   5           HE1      TYR   5   6.479  -1.466 -12.254
   40    HE2  TYR   5           HE2      TYR   5  10.455  -1.663 -13.868
   41    HH   TYR   5           HH       TYR   5   9.047  -0.704 -11.286
   42    H    LYS   6           H        LYS   6   7.499  -3.264 -19.427
   43    HA   LYS   6           HA       LYS   6   5.543  -2.153 -21.221
   44   1HB   LYS   6          2HB       LYS   6   7.756  -4.056 -22.007
   45   2HB   LYS   6          1HB       LYS   6   6.989  -2.814 -22.994
   46   1HG   LYS   6          2HG       LYS   6   8.930  -2.453 -20.707
   47   2HG   LYS   6          1HG       LYS   6   9.076  -1.874 -22.366
   48   1HD   LYS   6          2HD       LYS   6   7.403  -0.208 -22.041
   49   2HD   LYS   6          1HD       LYS   6   6.866  -0.937 -20.526
   50   1HE   LYS   6          2HE       LYS   6   8.648  -0.093 -19.323
   51   2HE   LYS   6          1HE       LYS   6   9.725  -0.082 -20.719
   52   1HZ   LYS   6          1HZ       LYS   6   8.522   1.799 -21.611
   53   2HZ   LYS   6          2HZ       LYS   6   9.079   2.157 -20.047
   54   3HZ   LYS   6          3HZ       LYS   6   7.444   1.776 -20.301
   55    H    ALA   7           H        ALA   7   6.501  -5.388 -20.200
   56    HA   ALA   7           HA       ALA   7   4.764  -6.835 -21.934
   57   1HB   ALA   7          1HB       ALA   7   5.452  -8.731 -20.802
   58   2HB   ALA   7          2HB       ALA   7   5.488  -7.913 -19.239
   59   3HB   ALA   7          3HB       ALA   7   6.779  -7.637 -20.408
   60    H    ALA   8           H        ALA   8   4.407  -5.455 -18.688
   61    HA   ALA   8           HA       ALA   8   1.848  -6.621 -18.157
   62   1HB   ALA   8          1HB       ALA   8   3.101  -5.927 -16.262
   63   2HB   ALA   8          2HB       ALA   8   1.753  -4.797 -16.384
   64   3HB   ALA   8          3HB       ALA   8   3.361  -4.314 -16.929
   65    H    VAL   9           H        VAL   9   2.945  -3.719 -19.805
   66    HA   VAL   9           HA       VAL   9   0.587  -2.191 -19.701
   67    HB   VAL   9           HB       VAL   9   2.949  -2.308 -21.539
   68   1HG1  VAL   9          1HG1      VAL   9   1.161  -1.961 -23.129
   69   2HG1  VAL   9          2HG1      VAL   9   1.942  -0.403 -22.844
   70   3HG1  VAL   9          3HG1      VAL   9   0.394  -0.767 -22.081
   71   1HG2  VAL   9          1HG2      VAL   9   3.512  -0.333 -20.509
   72   2HG2  VAL   9          2HG2      VAL   9   2.480  -0.984 -19.237
   73   3HG2  VAL   9          3HG2      VAL   9   1.838   0.199 -20.375
   74    H    GLU  10           H        GLU  10   1.608  -4.689 -22.020
   75    HA   GLU  10           HA       GLU  10  -0.823  -4.432 -23.578
   76   1HB   GLU  10          2HB       GLU  10   1.576  -6.235 -23.690
   77   2HB   GLU  10          1HB       GLU  10   0.129  -6.619 -24.621
   78   1HG   GLU  10          2HG       GLU  10   0.222  -4.263 -25.551
   79   2HG   GLU  10          1HG       GLU  10   1.806  -4.104 -24.793
   80    H    GLN  11           H        GLN  11  -0.260  -5.808 -20.591
   81    HA   GLN  11           HA       GLN  11  -2.212  -7.978 -21.041
   82   1HB   GLN  11          2HB       GLN  11  -0.260  -7.662 -18.754
   83   2HB   GLN  11          1HB       GLN  11  -1.303  -9.045 -19.069
   84   1HG   GLN  11          2HG       GLN  11   0.621  -8.105 -21.172
   85   2HG   GLN  11          1HG       GLN  11   1.186  -9.136 -19.859
   86   1HE2  GLN  11          1HE2      GLN  11  -0.822  -9.048 -22.761
   87   2HE2  GLN  11          2HE2      GLN  11  -1.139 -10.714 -22.808
   88    H    LEU  12           H        LEU  12  -1.625  -5.013 -19.284
   89    HA   LEU  12           HA       LEU  12  -3.429  -5.400 -17.148
   90   1HB   LEU  12          2HB       LEU  12  -3.581  -2.846 -17.185
   91   2HB   LEU  12          1HB       LEU  12  -2.036  -3.581 -16.841
   92    HG   LEU  12           HG       LEU  12  -1.291  -3.095 -19.135
   93   1HD1  LEU  12          1HD1      LEU  12  -3.221  -3.177 -20.470
   94   2HD1  LEU  12          2HD1      LEU  12  -2.847  -1.453 -20.415
   95   3HD1  LEU  12          3HD1      LEU  12  -4.126  -2.111 -19.394
   96   1HD2  LEU  12          1HD2      LEU  12  -1.013  -1.419 -17.301
   97   2HD2  LEU  12          2HD2      LEU  12  -2.529  -0.669 -17.801
   98   3HD2  LEU  12          3HD2      LEU  12  -1.144  -0.673 -18.893
   99    H    THR  13           H        THR  13  -5.521  -4.467 -16.809
  100    HA   THR  13           HA       THR  13  -7.112  -4.143 -19.289
  101    HB   THR  13           HB       THR  13  -8.975  -5.194 -17.691
  102    HG1  THR  13           HG1      THR  13  -7.898  -5.740 -15.932
  103   1HG2  THR  13          1HG2      THR  13  -8.229  -6.002 -19.931
  104   2HG2  THR  13          2HG2      THR  13  -8.608  -7.312 -18.814
  105   3HG2  THR  13          3HG2      THR  13  -6.927  -6.890 -19.138
  106    H    ASP  14           H        ASP  14  -9.296  -3.165 -18.807
  107    HA   ASP  14           HA       ASP  14  -8.944  -0.668 -17.453
  108   1HB   ASP  14          2HB       ASP  14 -11.429  -2.003 -18.557
  109   2HB   ASP  14          1HB       ASP  14 -11.373  -0.349 -17.946
  110    H    GLU  15           H        GLU  15 -10.346  -3.773 -16.626
  111    HA   GLU  15           HA       GLU  15 -11.842  -2.993 -14.351
  112   1HB   GLU  15          2HB       GLU  15 -10.633  -5.609 -15.229
  113   2HB   GLU  15          1HB       GLU  15 -11.486  -5.456 -13.694
  114   1HG   GLU  15          2HG       GLU  15 -13.508  -4.730 -14.817
  115   2HG   GLU  15          1HG       GLU  15 -12.673  -4.661 -16.369
  116    H    GLN  16           H        GLN  16  -8.431  -3.916 -14.760
  117    HA   GLN  16           HA       GLN  16  -7.825  -4.159 -12.001
  118   1HB   GLN  16          2HB       GLN  16  -5.560  -4.279 -12.612
  119   2HB   GLN  16          1HB       GLN  16  -6.396  -4.910 -14.027
  120   1HG   GLN  16          2HG       GLN  16  -5.197  -3.400 -15.207
  121   2HG   GLN  16          1HG       GLN  16  -6.291  -2.192 -14.548
  122   1HE2  GLN  16          1HE2      GLN  16  -3.008  -3.205 -14.643
  123   2HE2  GLN  16          2HE2      GLN  16  -2.424  -2.179 -13.423
  124    H    LYS  17           H        LYS  17  -7.978  -1.369 -14.143
  125    HA   LYS  17           HA       LYS  17  -6.842   0.406 -12.132
  126   1HB   LYS  17          2HB       LYS  17  -7.682   0.661 -14.967
  127   2HB   LYS  17          1HB       LYS  17  -7.825   2.108 -13.968
  128   1HG   LYS  17          2HG       LYS  17  -5.621   2.414 -14.403
  129   2HG   LYS  17          1HG       LYS  17  -5.354   1.129 -13.223
  130   1HD   LYS  17          2HD       LYS  17  -4.252   0.143 -14.968
  131   2HD   LYS  17          1HD       LYS  17  -5.879  -0.366 -15.421
  132   1HE   LYS  17          2HE       LYS  17  -4.998   2.329 -16.347
  133   2HE   LYS  17          1HE       LYS  17  -4.263   0.931 -17.132
  134   1HZ   LYS  17          1HZ       LYS  17  -6.544   0.071 -17.499
  135   2HZ   LYS  17          2HZ       LYS  17  -6.221   1.520 -18.325
  136   3HZ   LYS  17          3HZ       LYS  17  -7.160   1.538 -16.910
  137    H    ASN  18           H        ASN  18  -9.963  -0.757 -13.099
  138    HA   ASN  18           HA       ASN  18 -11.511   1.419 -12.058
  139   1HB   ASN  18          2HB       ASN  18 -12.903   0.258 -13.422
  140   2HB   ASN  18          1HB       ASN  18 -12.012  -1.243 -13.221
  141   1HD2  ASN  18          1HD2      ASN  18 -12.743  -2.731 -11.633
  142   2HD2  ASN  18          2HD2      ASN  18 -14.150  -2.486 -10.713
  143    H    GLU  19           H        GLU  19 -10.444  -1.745 -10.833
  144    HA   GLU  19           HA       GLU  19 -11.717  -1.503  -8.272
  145   1HB   GLU  19          2HB       GLU  19  -9.325  -3.186  -9.086
  146   2HB   GLU  19          1HB       GLU  19 -10.247  -3.367  -7.594
  147   1HG   GLU  19          2HG       GLU  19 -11.603  -3.499 -10.282
  148   2HG   GLU  19          1HG       GLU  19 -10.841  -4.923  -9.579
  149    H    PHE  20           H        PHE  20  -8.476  -0.876  -9.530
  150    HA   PHE  20           HA       PHE  20  -7.263  -0.101  -7.093
  151   1HB   PHE  20          2HB       PHE  20  -6.626   0.259  -9.993
  152   2HB   PHE  20          1HB       PHE  20  -5.736   1.212  -8.809
  153    HD1  PHE  20           HD1      PHE  20  -6.979  -1.982  -7.619
  154    HD2  PHE  20           HD2      PHE  20  -3.702  -0.063  -9.626
  155    HE1  PHE  20           HE1      PHE  20  -5.540  -3.929  -7.123
  156    HE2  PHE  20           HE2      PHE  20  -2.259  -2.013  -9.126
  157    HZ   PHE  20           HZ       PHE  20  -3.175  -3.948  -7.874
  158    H    LYS  21           H        LYS  21  -9.025   1.731  -9.567
  159    HA   LYS  21           HA       LYS  21  -8.472   4.317  -8.515
  160   1HB   LYS  21          2HB       LYS  21  -9.332   3.938 -10.820
  161   2HB   LYS  21          1HB       LYS  21 -10.877   3.439 -10.136
  162   1HG   LYS  21          2HG       LYS  21 -10.973   5.801 -10.803
  163   2HG   LYS  21          1HG       LYS  21 -11.099   5.660  -9.050
  164   1HD   LYS  21          2HD       LYS  21  -8.784   6.274  -8.758
  165   2HD   LYS  21          1HD       LYS  21  -8.487   6.185 -10.495
  166   1HE   LYS  21          2HE       LYS  21  -9.511   8.201 -10.916
  167   2HE   LYS  21          1HE       LYS  21 -10.666   8.010  -9.597
  168   1HZ   LYS  21          1HZ       LYS  21  -9.036   9.750  -9.145
  169   2HZ   LYS  21          2HZ       LYS  21  -7.775   8.617  -9.270
  170   3HZ   LYS  21          3HZ       LYS  21  -8.919   8.486  -8.019
  171    H    ALA  22           H        ALA  22 -11.077   1.969  -7.973
  172    HA   ALA  22           HA       ALA  22 -12.654   3.644  -6.286
  173   1HB   ALA  22          1HB       ALA  22 -12.528   0.618  -6.348
  174   2HB   ALA  22          2HB       ALA  22 -13.544   1.607  -7.395
  175   3HB   ALA  22          3HB       ALA  22 -13.819   1.597  -5.653
  176    H    ALA  23           H        ALA  23 -10.190   1.154  -5.654
  177    HA   ALA  23           HA       ALA  23 -10.296   1.291  -2.818
  178   1HB   ALA  23          1HB       ALA  23  -9.237  -0.577  -4.087
  179   2HB   ALA  23          2HB       ALA  23  -8.178   0.100  -2.850
  180   3HB   ALA  23          3HB       ALA  23  -7.933   0.517  -4.547
  181    H    PHE  24           H        PHE  24  -8.847   3.328  -5.223
  182    HA   PHE  24           HA       PHE  24  -7.010   4.631  -3.380
  183   1HB   PHE  24          2HB       PHE  24  -6.735   4.261  -5.966
  184   2HB   PHE  24          1HB       PHE  24  -7.744   5.698  -6.093
  185    HD1  PHE  24           HD1      PHE  24  -4.474   4.371  -5.074
  186    HD2  PHE  24           HD2      PHE  24  -6.954   7.876  -5.252
  187    HE1  PHE  24           HE1      PHE  24  -2.489   5.799  -4.656
  188    HE2  PHE  24           HE2      PHE  24  -4.970   9.302  -4.831
  189    HZ   PHE  24           HZ       PHE  24  -2.736   8.263  -4.535
  190    H    ASP  25           H        ASP  25  -9.840   5.593  -5.336
  191    HA   ASP  25           HA       ASP  25 -10.173   8.177  -4.367
  192   1HB   ASP  25          2HB       ASP  25 -11.407   6.883  -6.281
  193   2HB   ASP  25          1HB       ASP  25 -12.579   6.513  -5.016
  194    H    ILE  26           H        ILE  26 -11.389   5.131  -2.958
  195    HA   ILE  26           HA       ILE  26 -13.184   6.211  -1.104
  196    HB   ILE  26           HB       ILE  26 -12.702   4.187   0.294
  197   1HG1  ILE  26          2HG1      ILE  26 -10.700   3.612  -1.915
  198   2HG1  ILE  26          1HG1      ILE  26 -10.292   3.997  -0.245
  199   1HG2  ILE  26          1HG2      ILE  26 -14.374   3.625  -1.152
  200   2HG2  ILE  26          2HG2      ILE  26 -13.123   2.626  -1.892
  201   3HG2  ILE  26          3HG2      ILE  26 -13.492   4.215  -2.560
  202   1HD1  ILE  26          1HD1      ILE  26 -11.733   1.994   0.421
  203   2HD1  ILE  26          2HD1      ILE  26 -10.213   1.618  -0.389
  204   3HD1  ILE  26          3HD1      ILE  26 -11.729   1.553  -1.286
  205    H    PHE  27           H        PHE  27  -9.669   5.906  -0.937
  206    HA   PHE  27           HA       PHE  27  -9.577   6.964   1.777
  207   1HB   PHE  27          2HB       PHE  27  -7.509   5.999  -0.180
  208   2HB   PHE  27          1HB       PHE  27  -7.034   6.925   1.243
  209    HD1  PHE  27           HD1      PHE  27  -7.831   6.115   3.544
  210    HD2  PHE  27           HD2      PHE  27  -8.040   3.698  -0.001
  211    HE1  PHE  27           HE1      PHE  27  -8.061   4.080   4.943
  212    HE2  PHE  27           HE2      PHE  27  -8.267   1.664   1.399
  213    HZ   PHE  27           HZ       PHE  27  -8.278   1.856   3.871
  214    H    ILE  28           H        ILE  28  -9.197   8.115  -1.524
  215    HA   ILE  28           HA       ILE  28  -8.139  10.699  -0.629
  216    HB   ILE  28           HB       ILE  28  -8.875   9.946  -3.459
  217   1HG1  ILE  28          2HG1      ILE  28  -7.335   8.249  -2.981
  218   2HG1  ILE  28          1HG1      ILE  28  -6.301   9.535  -3.583
  219   1HG2  ILE  28          1HG2      ILE  28  -6.753  11.548  -3.682
  220   2HG2  ILE  28          2HG2      ILE  28  -7.331  12.118  -2.114
  221   3HG2  ILE  28          3HG2      ILE  28  -8.386  12.196  -3.525
  222   1HD1  ILE  28          1HD1      ILE  28  -5.188   8.870  -1.632
  223   2HD1  ILE  28          2HD1      ILE  28  -6.692   8.610  -0.749
  224   3HD1  ILE  28          3HD1      ILE  28  -6.136  10.251  -1.077
  225    H    GLN  29           H        GLN  29 -10.909   9.765   0.045
  226    HA   GLN  29           HA       GLN  29 -12.790  11.239  -1.504
  227   1HB   GLN  29          2HB       GLN  29 -14.297  10.949   0.485
  228   2HB   GLN  29          1HB       GLN  29 -13.609   9.442  -0.115
  229   1HG   GLN  29          2HG       GLN  29 -11.973   9.393   1.655
  230   2HG   GLN  29          1HG       GLN  29 -12.397  11.025   2.167
  231   1HE2  GLN  29          1HE2      GLN  29 -13.551  10.901   4.094
  232   2HE2  GLN  29          2HE2      GLN  29 -14.759   9.758   4.430
  233    H    ASP  30           H        ASP  30 -10.785  11.999   1.289
  234    HA   ASP  30           HA       ASP  30 -11.336  14.843   0.895
  235   1HB   ASP  30          2HB       ASP  30 -12.808  13.605   2.797
  236   2HB   ASP  30          1HB       ASP  30 -11.368  13.992   3.740
  237    H    ALA  31           H        ALA  31  -9.042  13.350   0.245
  238    HA   ALA  31           HA       ALA  31  -7.062  13.486   2.313
  239   1HB   ALA  31          1HB       ALA  31  -5.455  13.043   0.498
  240   2HB   ALA  31          2HB       ALA  31  -6.733  13.298  -0.692
  241   3HB   ALA  31          3HB       ALA  31  -6.827  11.936   0.424
  242    H    GLU  32           H        GLU  32  -5.330  14.929   2.505
  243    HA   GLU  32           HA       GLU  32  -5.983  17.677   1.962
  244   1HB   GLU  32          2HB       GLU  32  -3.453  16.431   3.066
  245   2HB   GLU  32          1HB       GLU  32  -3.770  18.164   2.989
  246   1HG   GLU  32          2HG       GLU  32  -5.799  17.836   4.389
  247   2HG   GLU  32          1HG       GLU  32  -5.413  16.119   4.512
  248    H    ASP  33           H        ASP  33  -3.461  15.448   0.817
  249    HA   ASP  33           HA       ASP  33  -2.663  17.369  -1.256
  250   1HB   ASP  33          2HB       ASP  33  -1.031  15.973   0.231
  251   2HB   ASP  33          1HB       ASP  33  -1.412  14.664  -0.888
  252    H    GLY  34           H        GLY  34  -4.151  14.193  -0.866
  253   1HA   GLY  34          2HA       GLY  34  -5.842  13.519  -2.492
  254   2HA   GLY  34          1HA       GLY  34  -4.821  14.205  -3.751
  255    H    CYS  35           H        CYS  35  -3.588  12.270  -1.076
  256    HA   CYS  35           HA       CYS  35  -3.279   9.909  -2.801
  257   1HB   CYS  35          2HB       CYS  35  -0.951  11.139  -1.308
  258   2HB   CYS  35          1HB       CYS  35  -0.914   9.708  -2.332
  259    HG   CYS  35           HG       CYS  35  -1.205  12.630  -3.371
  260    H    ILE  36           H        ILE  36  -2.102   8.131  -1.391
  261    HA   ILE  36           HA       ILE  36  -3.459   8.146   1.236
  262    HB   ILE  36           HB       ILE  36  -3.329   5.682   1.141
  263   1HG1  ILE  36          2HG1      ILE  36  -2.861   5.200  -1.590
  264   2HG1  ILE  36          1HG1      ILE  36  -1.562   6.281  -1.084
  265   1HG2  ILE  36          1HG2      ILE  36  -5.130   5.405  -0.383
  266   2HG2  ILE  36          2HG2      ILE  36  -4.556   6.709  -1.421
  267   3HG2  ILE  36          3HG2      ILE  36  -5.248   7.079   0.159
  268   1HD1  ILE  36          1HD1      ILE  36  -0.545   4.570  -0.052
  269   2HD1  ILE  36          2HD1      ILE  36  -1.853   3.489  -0.535
  270   3HD1  ILE  36          3HD1      ILE  36  -1.950   4.371   0.993
  271    H    SER  37           H        SER  37  -2.279   6.556   2.818
  272    HA   SER  37           HA       SER  37   0.461   7.563   3.054
  273   1HB   SER  37          2HB       SER  37  -1.255   7.669   4.953
  274   2HB   SER  37          1HB       SER  37  -1.033   5.929   5.103
  275    HG   SER  37           HG       SER  37   0.753   8.033   5.591
  276    H    THR  38           H        THR  38   2.196   6.172   3.640
  277    HA   THR  38           HA       THR  38   2.474   3.875   2.037
  278    HB   THR  38           HB       THR  38   4.511   3.415   3.462
  279    HG1  THR  38           HG1      THR  38   4.700   4.428   5.281
  280   1HG2  THR  38          1HG2      THR  38   4.517   6.323   2.776
  281   2HG2  THR  38          2HG2      THR  38   4.207   5.161   1.487
  282   3HG2  THR  38          3HG2      THR  38   5.713   5.084   2.402
  283    H    LYS  39           H        LYS  39   2.075   4.133   5.580
  284    HA   LYS  39           HA       LYS  39   1.843   1.357   6.065
  285   1HB   LYS  39          2HB       LYS  39   0.945   2.012   8.258
  286   2HB   LYS  39          1HB       LYS  39   2.367   2.965   7.838
  287   1HG   LYS  39          2HG       LYS  39   1.165   4.910   7.574
  288   2HG   LYS  39          1HG       LYS  39  -0.282   4.069   7.022
  289   1HD   LYS  39          2HD       LYS  39   0.401   3.383   9.778
  290   2HD   LYS  39          1HD       LYS  39   0.125   5.112   9.571
  291   1HE   LYS  39          2HE       LYS  39  -2.018   4.172  10.047
  292   2HE   LYS  39          1HE       LYS  39  -2.009   4.488   8.314
  293   1HZ   LYS  39          1HZ       LYS  39  -1.113   1.863   9.288
  294   2HZ   LYS  39          2HZ       LYS  39  -1.848   2.276   7.814
  295   3HZ   LYS  39          3HZ       LYS  39  -2.777   2.192   9.232
  296    H    GLU  40           H        GLU  40  -0.439   3.662   4.822
  297    HA   GLU  40           HA       GLU  40  -2.802   2.175   5.560
  298   1HB   GLU  40          2HB       GLU  40  -2.296   4.551   3.781
  299   2HB   GLU  40          1HB       GLU  40  -3.876   3.770   3.847
  300   1HG   GLU  40          2HG       GLU  40  -2.430   4.659   6.348
  301   2HG   GLU  40          1HG       GLU  40  -3.499   5.740   5.455
  302    H    LEU  41           H        LEU  41  -0.419   1.557   3.285
  303    HA   LEU  41           HA       LEU  41  -1.902   0.804   0.998
  304   1HB   LEU  41          2HB       LEU  41   0.711   0.968   1.500
  305   2HB   LEU  41          1HB       LEU  41   0.514  -0.750   1.765
  306    HG   LEU  41           HG       LEU  41   1.254  -0.231  -0.524
  307   1HD1  LEU  41          1HD1      LEU  41  -0.177  -1.763  -1.590
  308   2HD1  LEU  41          2HD1      LEU  41  -1.596  -1.185  -0.718
  309   3HD1  LEU  41          3HD1      LEU  41  -0.383  -2.153   0.117
  310   1HD2  LEU  41          1HD2      LEU  41  -0.059   1.051  -2.037
  311   2HD2  LEU  41          2HD2      LEU  41  -0.057   1.990  -0.544
  312   3HD2  LEU  41          3HD2      LEU  41  -1.463   1.015  -0.971
  313    H    GLY  42           H        GLY  42  -0.972  -0.966   3.931
  314   1HA   GLY  42          2HA       GLY  42  -1.903  -3.520   3.139
  315   2HA   GLY  42          1HA       GLY  42  -1.675  -2.981   4.798
  316    H    LYS  43           H        LYS  43  -3.654  -0.667   3.903
  317    HA   LYS  43           HA       LYS  43  -6.022  -2.002   4.919
  318   1HB   LYS  43          2HB       LYS  43  -5.712   0.861   3.989
  319   2HB   LYS  43          1HB       LYS  43  -7.004   0.208   4.993
  320   1HG   LYS  43          2HG       LYS  43  -4.085   0.152   5.804
  321   2HG   LYS  43          1HG       LYS  43  -5.189   1.449   6.258
  322   1HD   LYS  43          2HD       LYS  43  -6.650  -0.152   7.398
  323   2HD   LYS  43          1HD       LYS  43  -5.612  -1.486   6.893
  324   1HE   LYS  43          2HE       LYS  43  -3.748   0.040   8.073
  325   2HE   LYS  43          1HE       LYS  43  -5.152   0.585   8.989
  326   1HZ   LYS  43          1HZ       LYS  43  -4.314  -2.244   8.636
  327   2HZ   LYS  43          2HZ       LYS  43  -5.656  -1.710   9.532
  328   3HZ   LYS  43          3HZ       LYS  43  -4.083  -1.315  10.035
  329    H    VAL  44           H        VAL  44  -4.985  -0.436   1.897
  330    HA   VAL  44           HA       VAL  44  -7.483  -0.730   0.555
  331    HB   VAL  44           HB       VAL  44  -6.151  -0.313  -1.531
  332   1HG1  VAL  44          1HG1      VAL  44  -5.765   1.527   0.842
  333   2HG1  VAL  44          2HG1      VAL  44  -7.079   1.567  -0.335
  334   3HG1  VAL  44          3HG1      VAL  44  -5.441   1.996  -0.827
  335   1HG2  VAL  44          1HG2      VAL  44  -3.801   0.122  -1.406
  336   2HG2  VAL  44          2HG2      VAL  44  -4.049  -1.414  -0.579
  337   3HG2  VAL  44          3HG2      VAL  44  -3.815   0.063   0.355
  338    H    MET  45           H        MET  45  -4.670  -2.807   0.940
  339    HA   MET  45           HA       MET  45  -5.244  -4.658  -1.123
  340   1HB   MET  45          2HB       MET  45  -3.907  -5.329   1.508
  341   2HB   MET  45          1HB       MET  45  -3.728  -6.167  -0.033
  342   1HG   MET  45          2HG       MET  45  -3.065  -3.270  -0.049
  343   2HG   MET  45          1HG       MET  45  -1.962  -4.313   0.849
  344   1HE   MET  45          1HE       MET  45  -4.017  -5.257  -2.646
  345   2HE   MET  45          2HE       MET  45  -2.999  -4.120  -3.529
  346   3HE   MET  45          3HE       MET  45  -3.900  -3.572  -2.116
  347    H    ARG  46           H        ARG  46  -6.389  -4.319   2.177
  348    HA   ARG  46           HA       ARG  46  -7.707  -6.863   2.316
  349   1HB   ARG  46          2HB       ARG  46  -7.975  -4.321   3.927
  350   2HB   ARG  46          1HB       ARG  46  -8.936  -5.764   4.255
  351   1HG   ARG  46          2HG       ARG  46  -6.417  -6.829   4.072
  352   2HG   ARG  46          1HG       ARG  46  -6.076  -5.249   4.778
  353   1HD   ARG  46          2HD       ARG  46  -7.577  -5.655   6.610
  354   2HD   ARG  46          1HD       ARG  46  -8.207  -7.111   5.848
  355    HE   ARG  46           HE       ARG  46  -5.409  -7.382   6.236
  356   1HH1  ARG  46          2HH1      ARG  46  -8.420  -7.280   8.005
  357   2HH1  ARG  46          1HH1      ARG  46  -7.838  -8.271   9.298
  358   1HH2  ARG  46          1HH2      ARG  46  -4.669  -8.677   7.944
  359   2HH2  ARG  46          2HH2      ARG  46  -5.721  -9.059   9.265
  360    H    MET  47           H        MET  47  -8.638  -3.617   1.298
  361    HA   MET  47           HA       MET  47 -11.444  -4.187   1.059
  362   1HB   MET  47          2HB       MET  47  -9.648  -1.918   0.439
  363   2HB   MET  47          1HB       MET  47 -11.077  -2.057  -0.585
  364   1HG   MET  47          2HG       MET  47 -11.796  -0.737   1.243
  365   2HG   MET  47          1HG       MET  47 -12.399  -2.351   1.611
  366   1HE   MET  47          1HE       MET  47 -11.701   0.065   4.138
  367   2HE   MET  47          2HE       MET  47 -11.042   0.562   2.582
  368   3HE   MET  47          3HE       MET  47  -9.969   0.383   3.967
  369    H    LEU  48           H        LEU  48  -8.673  -4.161  -1.154
  370    HA   LEU  48           HA       LEU  48 -10.105  -4.564  -3.564
  371   1HB   LEU  48          2HB       LEU  48  -7.288  -4.989  -2.685
  372   2HB   LEU  48          1HB       LEU  48  -7.808  -5.731  -4.182
  373    HG   LEU  48           HG       LEU  48  -8.228  -2.788  -3.703
  374   1HD1  LEU  48          1HD1      LEU  48  -5.738  -4.127  -4.805
  375   2HD1  LEU  48          2HD1      LEU  48  -5.844  -3.252  -3.277
  376   3HD1  LEU  48          3HD1      LEU  48  -6.052  -2.391  -4.802
  377   1HD2  LEU  48          1HD2      LEU  48  -8.240  -2.710  -6.123
  378   2HD2  LEU  48          2HD2      LEU  48  -9.315  -4.016  -5.626
  379   3HD2  LEU  48          3HD2      LEU  48  -7.699  -4.385  -6.228
  380    H    GLY  49           H        GLY  49  -8.701  -6.833  -1.221
  381   1HA   GLY  49          2HA       GLY  49 -10.153  -8.882  -0.896
  382   2HA   GLY  49          1HA       GLY  49 -10.030  -9.070  -2.644
  383    H    GLN  50           H        GLN  50  -7.750  -8.375   0.016
  384    HA   GLN  50           HA       GLN  50  -6.240 -10.806  -0.548
  385   1HB   GLN  50          2HB       GLN  50  -5.345  -8.120  -1.393
  386   2HB   GLN  50          1HB       GLN  50  -4.153  -9.052  -0.488
  387   1HG   GLN  50          2HG       GLN  50  -4.819 -11.005  -2.084
  388   2HG   GLN  50          1HG       GLN  50  -5.481  -9.728  -3.103
  389   1HE2  GLN  50          1HE2      GLN  50  -3.994  -9.024  -4.633
  390   2HE2  GLN  50          2HE2      GLN  50  -2.313  -8.967  -4.405
  391    H    ASN  51           H        ASN  51  -4.727 -11.328   1.105
  392    HA   ASN  51           HA       ASN  51  -4.854  -9.643   3.525
  393   1HB   ASN  51          2HB       ASN  51  -6.427 -11.776   3.435
  394   2HB   ASN  51          1HB       ASN  51  -4.932 -12.615   3.849
  395   1HD2  ASN  51          1HD2      ASN  51  -7.575 -11.021   5.222
  396   2HD2  ASN  51          2HD2      ASN  51  -6.895 -10.662   6.735
  397    HA   PRO  52           HA       PRO  52  -0.514 -10.977   2.653
  398   1HB   PRO  52          2HB       PRO  52   0.545  -8.455   2.615
  399   2HB   PRO  52          1HB       PRO  52  -0.131  -9.248   1.190
  400   1HG   PRO  52          2HG       PRO  52  -1.244  -7.060   2.831
  401   2HG   PRO  52          1HG       PRO  52  -1.546  -7.458   1.134
  402   1HD   PRO  52          2HD       PRO  52  -3.250  -8.035   3.333
  403   2HD   PRO  52          1HD       PRO  52  -3.419  -8.649   1.671
  404    H    THR  53           H        THR  53   1.548  -9.729   3.828
  405    HA   THR  53           HA       THR  53   0.873  -9.730   6.709
  406    HB   THR  53           HB       THR  53   3.016 -10.571   7.173
  407    HG1  THR  53           HG1      THR  53   4.726 -10.076   6.034
  408   1HG2  THR  53          1HG2      THR  53   1.713 -12.283   6.028
  409   2HG2  THR  53          2HG2      THR  53   3.413 -12.433   5.582
  410   3HG2  THR  53          3HG2      THR  53   2.270 -11.691   4.462
  411    HA   PRO  54           HA       PRO  54   2.124  -5.526   7.093
  412   1HB   PRO  54          2HB       PRO  54   3.747  -5.531   9.307
  413   2HB   PRO  54          1HB       PRO  54   1.981  -5.656   9.368
  414   1HG   PRO  54          2HG       PRO  54   4.044  -7.788   9.685
  415   2HG   PRO  54          1HG       PRO  54   2.466  -7.620  10.471
  416   1HD   PRO  54          2HD       PRO  54   2.969  -9.339   8.361
  417   2HD   PRO  54          1HD       PRO  54   1.359  -8.695   8.757
  418    H    GLU  55           H        GLU  55   4.705  -7.891   7.044
  419    HA   GLU  55           HA       GLU  55   6.783  -5.951   6.419
  420   1HB   GLU  55          2HB       GLU  55   7.016  -8.945   6.116
  421   2HB   GLU  55          1HB       GLU  55   8.294  -7.772   6.425
  422   1HG   GLU  55          2HG       GLU  55   7.156  -7.266   8.637
  423   2HG   GLU  55          1HG       GLU  55   6.114  -8.656   8.331
  424    H    GLU  56           H        GLU  56   4.727  -8.280   4.746
  425    HA   GLU  56           HA       GLU  56   6.034  -8.187   2.222
  426   1HB   GLU  56          2HB       GLU  56   3.341  -9.082   3.179
  427   2HB   GLU  56          1HB       GLU  56   3.612  -8.889   1.446
  428   1HG   GLU  56          2HG       GLU  56   5.604 -10.410   3.111
  429   2HG   GLU  56          1HG       GLU  56   4.125 -11.203   2.573
  430    H    LEU  57           H        LEU  57   3.010  -6.593   3.341
  431    HA   LEU  57           HA       LEU  57   2.648  -5.024   1.032
  432   1HB   LEU  57          2HB       LEU  57   1.100  -3.729   2.296
  433   2HB   LEU  57          1HB       LEU  57   0.929  -5.400   2.776
  434    HG   LEU  57           HG       LEU  57   2.653  -4.557   4.685
  435   1HD1  LEU  57          1HD1      LEU  57   0.866  -2.207   4.710
  436   2HD1  LEU  57          2HD1      LEU  57   2.076  -2.183   3.427
  437   3HD1  LEU  57          3HD1      LEU  57   2.580  -2.321   5.111
  438   1HD2  LEU  57          1HD2      LEU  57   0.627  -5.696   5.231
  439   2HD2  LEU  57          2HD2      LEU  57  -0.366  -4.404   4.561
  440   3HD2  LEU  57          3HD2      LEU  57   0.527  -4.142   6.058
  441    H    GLN  58           H        GLN  58   4.616  -4.488   3.909
  442    HA   GLN  58           HA       GLN  58   5.138  -1.738   3.547
  443   1HB   GLN  58          2HB       GLN  58   5.653  -3.183   5.602
  444   2HB   GLN  58          1HB       GLN  58   7.123  -3.658   4.751
  445   1HG   GLN  58          2HG       GLN  58   7.663  -1.763   6.156
  446   2HG   GLN  58          1HG       GLN  58   7.664  -1.208   4.482
  447   1HE2  GLN  58          1HE2      GLN  58   5.916   0.219   3.790
  448   2HE2  GLN  58          2HE2      GLN  58   4.866   0.940   4.911
  449    H    GLU  59           H        GLU  59   7.199  -4.549   2.669
  450    HA   GLU  59           HA       GLU  59   9.199  -3.095   1.362
  451   1HB   GLU  59          2HB       GLU  59   9.830  -5.183   0.278
  452   2HB   GLU  59          1HB       GLU  59   9.409  -5.481   1.964
  453   1HG   GLU  59          2HG       GLU  59   7.329  -6.449   1.400
  454   2HG   GLU  59          1HG       GLU  59   7.361  -5.783  -0.231
  455    H    MET  60           H        MET  60   6.012  -4.031   0.237
  456    HA   MET  60           HA       MET  60   6.505  -3.594  -2.552
  457   1HB   MET  60          2HB       MET  60   4.016  -3.820  -0.870
  458   2HB   MET  60          1HB       MET  60   3.922  -3.347  -2.567
  459   1HG   MET  60          2HG       MET  60   5.454  -5.442  -2.956
  460   2HG   MET  60          1HG       MET  60   4.851  -5.947  -1.378
  461   1HE   MET  60          1HE       MET  60   3.401  -4.383  -4.848
  462   2HE   MET  60          2HE       MET  60   2.857  -5.965  -5.399
  463   3HE   MET  60          3HE       MET  60   4.539  -5.736  -4.928
  464    H    ILE  61           H        ILE  61   5.107  -1.624   0.066
  465    HA   ILE  61           HA       ILE  61   4.365   0.642  -1.370
  466    HB   ILE  61           HB       ILE  61   5.446   0.370   1.440
  467   1HG1  ILE  61          2HG1      ILE  61   2.629   1.066   0.845
  468   2HG1  ILE  61          1HG1      ILE  61   3.122  -0.569   0.412
  469   1HG2  ILE  61          1HG2      ILE  61   4.198   2.629   1.691
  470   2HG2  ILE  61          2HG2      ILE  61   4.372   2.752  -0.059
  471   3HG2  ILE  61          3HG2      ILE  61   5.805   2.640   0.966
  472   1HD1  ILE  61          1HD1      ILE  61   3.626   0.670   3.127
  473   2HD1  ILE  61          2HD1      ILE  61   3.875  -1.009   2.659
  474   3HD1  ILE  61          3HD1      ILE  61   2.241  -0.359   2.762
  475    H    ASP  62           H        ASP  62   7.336   0.474   0.607
  476    HA   ASP  62           HA       ASP  62   8.624   2.700  -0.399
  477   1HB   ASP  62          2HB       ASP  62   9.305   0.910   1.464
  478   2HB   ASP  62          1HB       ASP  62  10.339   0.330   0.158
  479    H    GLU  63           H        GLU  63   8.504  -0.547  -1.803
  480    HA   GLU  63           HA       GLU  63  10.518  -0.195  -3.763
  481   1HB   GLU  63          2HB       GLU  63   8.324  -2.117  -3.283
  482   2HB   GLU  63          1HB       GLU  63   8.836  -1.959  -4.963
  483   1HG   GLU  63          2HG       GLU  63  10.909  -2.239  -2.805
  484   2HG   GLU  63          1HG       GLU  63  10.066  -3.671  -3.395
  485    H    VAL  64           H        VAL  64   6.963   0.157  -3.992
  486    HA   VAL  64           HA       VAL  64   7.058   1.097  -6.705
  487    HB   VAL  64           HB       VAL  64   4.679   1.508  -6.480
  488   1HG1  VAL  64          1HG1      VAL  64   4.798  -0.942  -4.860
  489   2HG1  VAL  64          2HG1      VAL  64   5.918  -0.939  -6.221
  490   3HG1  VAL  64          3HG1      VAL  64   4.193  -0.705  -6.499
  491   1HG2  VAL  64          1HG2      VAL  64   4.878   2.489  -4.148
  492   2HG2  VAL  64          2HG2      VAL  64   4.974   0.834  -3.542
  493   3HG2  VAL  64          3HG2      VAL  64   3.520   1.385  -4.375
  494    H    ASP  65           H        ASP  65   7.311   2.663  -3.595
  495    HA   ASP  65           HA       ASP  65   6.484   5.264  -4.424
  496   1HB   ASP  65          2HB       ASP  65   7.086   4.139  -1.999
  497   2HB   ASP  65          1HB       ASP  65   8.505   5.144  -2.284
  498    H    GLU  66           H        GLU  66   7.477   5.629  -6.388
  499    HA   GLU  66           HA       GLU  66  10.228   5.393  -6.953
  500   1HB   GLU  66          2HB       GLU  66   8.070   7.094  -8.198
  501   2HB   GLU  66          1HB       GLU  66   9.712   7.005  -8.834
  502   1HG   GLU  66          2HG       GLU  66   9.276   4.392  -8.666
  503   2HG   GLU  66          1HG       GLU  66   7.589   4.895  -8.763
  504    H    ASP  67           H        ASP  67   8.358   8.204  -5.814
  505    HA   ASP  67           HA       ASP  67  10.734   9.880  -5.827
  506   1HB   ASP  67          2HB       ASP  67   9.123  11.523  -4.626
  507   2HB   ASP  67          1HB       ASP  67   8.845  11.157  -6.326
  508    H    GLY  68           H        GLY  68   8.761   8.177  -3.439
  509   1HA   GLY  68          2HA       GLY  68   9.267   7.527  -1.283
  510   2HA   GLY  68          1HA       GLY  68  10.912   8.099  -1.551
  511    H    SER  69           H        SER  69   7.742   9.721  -1.610
  512    HA   SER  69           HA       SER  69   8.840  11.926  -0.047
  513   1HB   SER  69          2HB       SER  69   6.597  12.972  -0.505
  514   2HB   SER  69          1HB       SER  69   7.523  12.572  -1.948
  515    HG   SER  69           HG       SER  69   6.044  11.172  -2.480
  516    H    GLY  70           H        GLY  70   6.041   9.724   0.126
  517   1HA   GLY  70          2HA       GLY  70   6.088   8.858   2.669
  518   2HA   GLY  70          1HA       GLY  70   5.473  10.495   2.876
  519    H    THR  71           H        THR  71   4.090  10.490   0.284
  520    HA   THR  71           HA       THR  71   1.767   8.844   1.052
  521    HB   THR  71           HB       THR  71   0.423  10.369  -0.284
  522    HG1  THR  71           HG1      THR  71   1.472  11.239  -1.879
  523   1HG2  THR  71          1HG2      THR  71   2.373  11.771   1.560
  524   2HG2  THR  71          2HG2      THR  71   0.817  11.067   2.002
  525   3HG2  THR  71          3HG2      THR  71   0.877  12.495   0.970
  526    H    VAL  72           H        VAL  72   0.668   7.618  -0.528
  527    HA   VAL  72           HA       VAL  72   2.410   6.777  -2.744
  528    HB   VAL  72           HB       VAL  72  -0.100   5.433  -1.729
  529   1HG1  VAL  72          1HG1      VAL  72   0.546   3.594  -3.088
  530   2HG1  VAL  72          2HG1      VAL  72   2.163   4.249  -3.345
  531   3HG1  VAL  72          3HG1      VAL  72   0.770   5.011  -4.116
  532   1HG2  VAL  72          1HG2      VAL  72   1.545   3.825  -0.689
  533   2HG2  VAL  72          2HG2      VAL  72   1.539   5.424   0.054
  534   3HG2  VAL  72          3HG2      VAL  72   2.825   4.977  -1.068
  535    H    ASP  73           H        ASP  73   2.057   7.601  -4.670
  536    HA   ASP  73           HA       ASP  73  -0.481   8.887  -5.314
  537   1HB   ASP  73          2HB       ASP  73   1.816   8.522  -7.235
  538   2HB   ASP  73          1HB       ASP  73   0.597   9.794  -7.206
  539    H    PHE  74           H        PHE  74  -1.450   8.412  -7.519
  540    HA   PHE  74           HA       PHE  74  -2.235   5.700  -7.666
  541   1HB   PHE  74          2HB       PHE  74  -3.386   7.829  -8.658
  542   2HB   PHE  74          1HB       PHE  74  -2.386   7.491 -10.072
  543    HD1  PHE  74           HD1      PHE  74  -3.577   6.366 -11.722
  544    HD2  PHE  74           HD2      PHE  74  -4.235   5.353  -7.603
  545    HE1  PHE  74           HE1      PHE  74  -5.150   4.578 -12.413
  546    HE2  PHE  74           HE2      PHE  74  -5.815   3.568  -8.290
  547    HZ   PHE  74           HZ       PHE  74  -6.271   3.180 -10.696
  548    H    ASP  75           H        ASP  75   0.351   7.492  -9.255
  549    HA   ASP  75           HA       ASP  75   1.007   5.590 -11.253
  550   1HB   ASP  75          2HB       ASP  75   2.355   7.911  -9.980
  551   2HB   ASP  75          1HB       ASP  75   3.414   6.705 -10.713
  552    H    GLU  76           H        GLU  76   1.910   5.977  -7.867
  553    HA   GLU  76           HA       GLU  76   3.754   3.734  -7.864
  554   1HB   GLU  76          2HB       GLU  76   2.597   4.997  -5.388
  555   2HB   GLU  76          1HB       GLU  76   4.190   4.280  -5.625
  556   1HG   GLU  76          2HG       GLU  76   4.688   6.165  -7.251
  557   2HG   GLU  76          1HG       GLU  76   3.182   6.917  -6.729
  558    H    PHE  77           H        PHE  77   0.380   4.307  -7.380
  559    HA   PHE  77           HA       PHE  77  -0.206   1.976  -5.805
  560   1HB   PHE  77          2HB       PHE  77  -1.572   4.134  -5.944
  561   2HB   PHE  77          1HB       PHE  77  -2.136   3.559  -7.511
  562    HD1  PHE  77           HD1      PHE  77  -1.832   2.485  -3.929
  563    HD2  PHE  77           HD2      PHE  77  -3.975   2.140  -7.634
  564    HE1  PHE  77           HE1      PHE  77  -3.542   1.085  -2.809
  565    HE2  PHE  77           HE2      PHE  77  -5.687   0.734  -6.514
  566    HZ   PHE  77           HZ       PHE  77  -5.471   0.209  -4.100
  567    H    LEU  78           H        LEU  78  -0.278   2.805  -9.254
  568    HA   LEU  78           HA       LEU  78  -1.524   0.360 -10.097
  569   1HB   LEU  78          2HB       LEU  78  -0.012   2.492 -11.594
  570   2HB   LEU  78          1HB       LEU  78  -0.718   1.095 -12.374
  571    HG   LEU  78           HG       LEU  78  -2.053   3.505 -11.203
  572   1HD1  LEU  78          1HD1      LEU  78  -3.431   3.198 -13.264
  573   2HD1  LEU  78          2HD1      LEU  78  -2.462   1.780 -13.664
  574   3HD1  LEU  78          3HD1      LEU  78  -1.712   3.375 -13.611
  575   1HD2  LEU  78          1HD2      LEU  78  -3.214   1.866  -9.950
  576   2HD2  LEU  78          2HD2      LEU  78  -3.173   0.700 -11.275
  577   3HD2  LEU  78          3HD2      LEU  78  -4.223   2.114 -11.377
  578    H    VAL  79           H        VAL  79   1.845   1.514  -9.958
  579    HA   VAL  79           HA       VAL  79   3.040  -0.595 -11.371
  580    HB   VAL  79           HB       VAL  79   5.103  -0.081  -9.987
  581   1HG1  VAL  79          1HG1      VAL  79   3.620   2.087 -11.486
  582   2HG1  VAL  79          2HG1      VAL  79   4.802   0.950 -12.138
  583   3HG1  VAL  79          3HG1      VAL  79   5.316   2.215 -11.020
  584   1HG2  VAL  79          1HG2      VAL  79   3.786   0.767  -8.007
  585   2HG2  VAL  79          2HG2      VAL  79   3.390   2.193  -8.962
  586   3HG2  VAL  79          3HG2      VAL  79   5.067   1.849  -8.548
  587    H    MET  80           H        MET  80   1.776  -0.510  -8.140
  588    HA   MET  80           HA       MET  80   3.116  -2.497  -6.794
  589   1HB   MET  80          2HB       MET  80   0.364  -1.457  -6.764
  590   2HB   MET  80          1HB       MET  80   0.518  -3.105  -6.159
  591   1HG   MET  80          2HG       MET  80   1.642  -2.446  -4.299
  592   2HG   MET  80          1HG       MET  80   2.612  -1.273  -5.189
  593   1HE   MET  80          1HE       MET  80  -1.457  -1.469  -5.006
  594   2HE   MET  80          2HE       MET  80  -1.555  -0.789  -3.384
  595   3HE   MET  80          3HE       MET  80  -0.623  -2.258  -3.662
  596    H    MET  81           H        MET  81   0.687  -2.889  -9.349
  597    HA   MET  81           HA       MET  81   0.474  -5.730  -9.161
  598   1HB   MET  81          2HB       MET  81  -0.390  -3.641 -11.098
  599   2HB   MET  81          1HB       MET  81  -0.289  -5.299 -11.690
  600   1HG   MET  81          2HG       MET  81  -1.573  -5.818  -9.416
  601   2HG   MET  81          1HG       MET  81  -2.081  -4.140  -9.596
  602   1HE   MET  81          1HE       MET  81  -3.164  -7.852 -11.834
  603   2HE   MET  81          2HE       MET  81  -1.834  -7.540 -10.722
  604   3HE   MET  81          3HE       MET  81  -1.632  -7.206 -12.440
  605    H    VAL  82           H        VAL  82   2.098  -3.674 -11.605
  606    HA   VAL  82           HA       VAL  82   3.389  -5.757 -12.985
  607    HB   VAL  82           HB       VAL  82   4.994  -3.961 -13.755
  608   1HG1  VAL  82          1HG1      VAL  82   3.463  -3.404 -15.322
  609   2HG1  VAL  82          2HG1      VAL  82   2.369  -2.701 -14.128
  610   3HG1  VAL  82          3HG1      VAL  82   2.360  -4.441 -14.416
  611   1HG2  VAL  82          1HG2      VAL  82   4.444  -1.640 -13.120
  612   2HG2  VAL  82          2HG2      VAL  82   4.923  -2.581 -11.708
  613   3HG2  VAL  82          3HG2      VAL  82   3.220  -2.236 -12.002
  614    H    ARG  83           H        ARG  83   4.311  -4.039 -10.056
  615    HA   ARG  83           HA       ARG  83   7.034  -4.762  -9.924
  616   1HB   ARG  83          2HB       ARG  83   4.997  -4.167  -7.774
  617   2HB   ARG  83          1HB       ARG  83   6.686  -4.520  -7.407
  618   1HG   ARG  83          2HG       ARG  83   6.311  -2.525  -9.545
  619   2HG   ARG  83          1HG       ARG  83   5.709  -2.016  -7.967
  620   1HD   ARG  83          2HD       ARG  83   7.880  -2.543  -6.948
  621   2HD   ARG  83          1HD       ARG  83   8.486  -3.105  -8.504
  622    HE   ARG  83           HE       ARG  83   7.517  -0.386  -8.585
  623   1HH1  ARG  83          2HH1      ARG  83  10.233  -2.441  -7.803
  624   2HH1  ARG  83          1HH1      ARG  83  11.405  -1.192  -8.046
  625   1HH2  ARG  83          1HH2      ARG  83   9.070   1.231  -8.895
  626   2HH2  ARG  83          2HH2      ARG  83  10.751   0.881  -8.662
  627    H    CYS  84           H        CYS  84   4.123  -6.584  -9.309
  628    HA   CYS  84           HA       CYS  84   5.270  -8.663  -7.735
  629   1HB   CYS  84          2HB       CYS  84   2.760  -8.087  -8.175
  630   2HB   CYS  84          1HB       CYS  84   2.950  -9.131  -9.584
  631    HG   CYS  84           HG       CYS  84   3.882 -10.350  -6.902
  632    H    MET  85           H        MET  85   5.449  -7.907 -11.111
  633    HA   MET  85           HA       MET  85   6.452 -10.618 -11.721
  634   1HB   MET  85          2HB       MET  85   5.111  -8.503 -13.369
  635   2HB   MET  85          1HB       MET  85   6.222  -9.628 -14.154
  636   1HG   MET  85          2HG       MET  85   4.902 -11.500 -13.007
  637   2HG   MET  85          1HG       MET  85   3.690 -10.274 -12.632
  638   1HE   MET  85          1HE       MET  85   3.050  -8.512 -15.572
  639   2HE   MET  85          2HE       MET  85   2.628  -8.919 -13.910
  640   3HE   MET  85          3HE       MET  85   1.694  -9.598 -15.239
  641    H    LYS  86           H        LYS  86   8.267  -9.326 -10.320
  642    HA   LYS  86           HA       LYS  86   9.963  -7.500 -11.651
  643   1HB   LYS  86          2HB       LYS  86  10.531  -9.510  -9.463
  644   2HB   LYS  86          1HB       LYS  86  11.724  -8.349 -10.043
  645   1HG   LYS  86          2HG       LYS  86   9.674  -6.659  -9.620
  646   2HG   LYS  86          1HG       LYS  86   9.265  -7.893  -8.429
  647   1HD   LYS  86          2HD       LYS  86  12.055  -6.757  -8.627
  648   2HD   LYS  86          1HD       LYS  86  10.809  -5.981  -7.650
  649   1HE   LYS  86          2HE       LYS  86  11.354  -8.924  -7.339
  650   2HE   LYS  86          1HE       LYS  86  12.373  -7.743  -6.518
  651   1HZ   LYS  86          1HZ       LYS  86  10.352  -6.777  -5.547
  652   2HZ   LYS  86          2HZ       LYS  86  10.569  -8.400  -5.092
  653   3HZ   LYS  86          3HZ       LYS  86   9.422  -7.994  -6.278
  654    H    ASP  87           H        ASP  87   9.861 -11.036 -11.599
  655    HA   ASP  87           HA       ASP  87  10.827 -12.632 -12.924
  656   1HB   ASP  87          2HB       ASP  87  11.110 -10.215 -14.693
  657   2HB   ASP  87          1HB       ASP  87  11.814 -11.761 -15.162
  658    H    ASP  88           H        ASP  88  12.420 -13.152 -11.427
  659    HA   ASP  88           HA       ASP  88  15.006 -11.780 -11.594
  660   1HB   ASP  88          2HB       ASP  88  13.878 -12.527  -9.388
  661   2HB   ASP  88          1HB       ASP  88  14.398 -14.152  -9.834
  662    H    SER  89           HN       SER  89  15.714 -12.421 -13.643
  663    HA   SER  89           HA       SER  89  16.175 -15.312 -14.040
  664   1HB   SER  89          2HB       SER  89  14.963 -13.876 -15.808
  665   2HB   SER  89          1HB       SER  89  16.549 -13.186 -16.144
  666    HG   SER  89           HG       SER  89  16.799 -14.900 -17.334
  Start of MODEL   31
    1   1H    MET   1          1H        MET   1  12.467   4.013 -15.111
    2   2H    MET   1          2H        MET   1  13.393   5.273 -15.773
    3   3H    MET   1          3H        MET   1  14.093   3.747 -15.512
    4    HA   MET   1           HA       MET   1  11.910   4.349 -17.438
    5   1HB   MET   1          2HB       MET   1  14.891   4.009 -17.688
    6   2HB   MET   1          1HB       MET   1  13.843   3.538 -19.027
    7   1HG   MET   1          2HG       MET   1  13.030   5.733 -19.322
    8   2HG   MET   1          1HG       MET   1  13.565   6.242 -17.720
    9   1HE   MET   1          1HE       MET   1  15.489   7.727 -17.445
   10   2HE   MET   1          2HE       MET   1  14.502   8.360 -18.758
   11   3HE   MET   1          3HE       MET   1  16.258   8.389 -18.893
   12    H    ASN   2           H        ASN   2  10.792   2.600 -16.244
   13    HA   ASN   2           HA       ASN   2  11.916  -0.086 -16.473
   14   1HB   ASN   2          2HB       ASN   2   9.501   1.105 -15.171
   15   2HB   ASN   2          1HB       ASN   2   9.485  -0.612 -15.573
   16   1HD2  ASN   2          1HD2      ASN   2  11.642  -1.794 -14.843
   17   2HD2  ASN   2          2HD2      ASN   2  12.229  -1.359 -13.312
   18    H    ASP   3           H        ASP   3  11.125  -1.715 -17.779
   19    HA   ASP   3           HA       ASP   3   9.265  -0.851 -19.917
   20   1HB   ASP   3          2HB       ASP   3  11.771  -2.506 -20.043
   21   2HB   ASP   3          1HB       ASP   3  10.528  -2.648 -21.285
   22    H    ILE   4           H        ILE   4   9.482  -2.905 -17.284
   23    HA   ILE   4           HA       ILE   4   8.112  -5.156 -18.526
   24    HB   ILE   4           HB       ILE   4   8.196  -6.267 -16.427
   25   1HG1  ILE   4          2HG1      ILE   4   7.485  -4.186 -15.112
   26   2HG1  ILE   4          1HG1      ILE   4   8.640  -5.252 -14.323
   27   1HG2  ILE   4          1HG2      ILE   4  10.655  -4.733 -17.186
   28   2HG2  ILE   4          2HG2      ILE   4  10.324  -6.460 -17.312
   29   3HG2  ILE   4          3HG2      ILE   4  10.685  -5.744 -15.742
   30   1HD1  ILE   4          1HD1      ILE   4   9.041  -2.509 -15.441
   31   2HD1  ILE   4          2HD1      ILE   4  10.398  -3.633 -15.517
   32   3HD1  ILE   4          3HD1      ILE   4   9.681  -3.220 -13.960
   33    H    TYR   5           H        TYR   5   7.314  -2.246 -16.789
   34    HA   TYR   5           HA       TYR   5   4.667  -3.001 -15.988
   35   1HB   TYR   5          2HB       TYR   5   5.615  -0.180 -16.547
   36   2HB   TYR   5          1HB       TYR   5   4.313  -0.690 -15.479
   37    HD1  TYR   5           HD1      TYR   5   6.061  -3.152 -14.429
   38    HD2  TYR   5           HD2      TYR   5   6.685   1.085 -14.726
   39    HE1  TYR   5           HE1      TYR   5   7.667  -3.257 -12.555
   40    HE2  TYR   5           HE2      TYR   5   8.290   0.977 -12.843
   41    HH   TYR   5           HH       TYR   5   9.804  -1.563 -11.858
   42    H    LYS   6           H        LYS   6   6.144  -1.675 -18.871
   43    HA   LYS   6           HA       LYS   6   3.675  -0.937 -20.173
   44   1HB   LYS   6          2HB       LYS   6   6.278  -1.497 -21.592
   45   2HB   LYS   6          1HB       LYS   6   4.992  -0.388 -22.061
   46   1HG   LYS   6          2HG       LYS   6   6.986  -0.078 -19.805
   47   2HG   LYS   6          1HG       LYS   6   6.744   0.985 -21.191
   48   1HD   LYS   6          2HD       LYS   6   4.605   1.714 -20.360
   49   2HD   LYS   6          1HD       LYS   6   4.619   0.486 -19.092
   50   1HE   LYS   6          2HE       LYS   6   6.088   1.661 -17.776
   51   2HE   LYS   6          1HE       LYS   6   6.936   2.354 -19.159
   52   1HZ   LYS   6          1HZ       LYS   6   4.274   3.171 -18.124
   53   2HZ   LYS   6          2HZ       LYS   6   4.985   3.781 -19.543
   54   3HZ   LYS   6          3HZ       LYS   6   5.713   4.064 -18.035
   55    H    ALA   7           H        ALA   7   5.822  -3.720 -20.124
   56    HA   ALA   7           HA       ALA   7   4.576  -5.153 -22.261
   57   1HB   ALA   7          1HB       ALA   7   5.685  -7.159 -21.005
   58   2HB   ALA   7          2HB       ALA   7   6.434  -5.903 -20.019
   59   3HB   ALA   7          3HB       ALA   7   6.718  -5.945 -21.759
   60    H    ALA   8           H        ALA   8   3.999  -4.865 -18.803
   61    HA   ALA   8           HA       ALA   8   2.094  -7.042 -18.698
   62   1HB   ALA   8          1HB       ALA   8   3.165  -5.039 -16.762
   63   2HB   ALA   8          2HB       ALA   8   3.056  -6.794 -16.623
   64   3HB   ALA   8          3HB       ALA   8   1.616  -5.801 -16.402
   65    H    VAL   9           H        VAL   9   1.980  -3.584 -19.291
   66    HA   VAL   9           HA       VAL   9  -0.723  -3.117 -18.615
   67    HB   VAL   9           HB       VAL   9   1.175  -1.425 -19.227
   68   1HG1  VAL   9          1HG1      VAL   9   1.527  -0.896 -21.419
   69   2HG1  VAL   9          2HG1      VAL   9  -0.152  -1.193 -21.866
   70   3HG1  VAL   9          3HG1      VAL   9   0.969  -2.543 -21.701
   71   1HG2  VAL   9          1HG2      VAL   9  -0.495   0.267 -19.557
   72   2HG2  VAL   9          2HG2      VAL   9  -1.228  -0.968 -18.535
   73   3HG2  VAL   9          3HG2      VAL   9  -1.624  -0.895 -20.251
   74    H    GLU  10           H        GLU  10   0.676  -4.775 -21.324
   75    HA   GLU  10           HA       GLU  10  -1.684  -4.504 -23.004
   76   1HB   GLU  10          2HB       GLU  10   0.928  -5.979 -23.269
   77   2HB   GLU  10          1HB       GLU  10  -0.408  -6.279 -24.382
   78   1HG   GLU  10          2HG       GLU  10   0.476  -3.457 -23.819
   79   2HG   GLU  10          1HG       GLU  10   1.357  -4.441 -24.987
   80    H    GLN  11           H        GLN  11  -0.721  -6.517 -20.413
   81    HA   GLN  11           HA       GLN  11  -2.404  -8.758 -21.286
   82   1HB   GLN  11          2HB       GLN  11  -0.651  -8.545 -18.831
   83   2HB   GLN  11          1HB       GLN  11  -1.426 -10.000 -19.452
   84   1HG   GLN  11          2HG       GLN  11   0.552  -8.380 -21.072
   85   2HG   GLN  11          1HG       GLN  11   1.032  -9.736 -20.053
   86   1HE2  GLN  11          1HE2      GLN  11  -0.415  -8.864 -23.107
   87   2HE2  GLN  11          2HE2      GLN  11  -0.703 -10.447 -23.647
   88    H    LEU  12           H        LEU  12  -2.258  -6.203 -18.868
   89    HA   LEU  12           HA       LEU  12  -4.356  -7.264 -17.226
   90   1HB   LEU  12          2HB       LEU  12  -4.416  -4.922 -16.288
   91   2HB   LEU  12          1HB       LEU  12  -2.909  -5.788 -16.123
   92    HG   LEU  12           HG       LEU  12  -1.939  -4.478 -17.956
   93   1HD1  LEU  12          1HD1      LEU  12  -3.799  -4.049 -19.378
   94   2HD1  LEU  12          2HD1      LEU  12  -3.320  -2.473 -18.748
   95   3HD1  LEU  12          3HD1      LEU  12  -4.723  -3.303 -18.073
   96   1HD2  LEU  12          1HD2      LEU  12  -3.320  -2.530 -16.112
   97   2HD2  LEU  12          2HD2      LEU  12  -1.671  -2.475 -16.735
   98   3HD2  LEU  12          3HD2      LEU  12  -2.110  -3.656 -15.501
   99    H    THR  13           H        THR  13  -6.260  -5.605 -16.753
  100    HA   THR  13           HA       THR  13  -7.504  -4.893 -19.348
  101    HB   THR  13           HB       THR  13  -9.679  -5.469 -17.885
  102    HG1  THR  13           HG1      THR  13  -9.258  -7.277 -16.625
  103   1HG2  THR  13          1HG2      THR  13  -9.526  -7.792 -18.935
  104   2HG2  THR  13          2HG2      THR  13  -7.925  -7.319 -19.504
  105   3HG2  THR  13          3HG2      THR  13  -9.350  -6.427 -20.038
  106    H    ASP  14           H        ASP  14  -9.442  -3.421 -19.010
  107    HA   ASP  14           HA       ASP  14  -8.594  -1.069 -17.623
  108   1HB   ASP  14          2HB       ASP  14 -10.076  -1.185 -19.710
  109   2HB   ASP  14          1HB       ASP  14 -11.396  -1.593 -18.613
  110    H    GLU  15           H        GLU  15 -10.733  -3.740 -16.879
  111    HA   GLU  15           HA       GLU  15 -12.197  -2.641 -14.753
  112   1HB   GLU  15          2HB       GLU  15 -12.669  -4.907 -14.094
  113   2HB   GLU  15          1HB       GLU  15 -12.656  -4.835 -15.851
  114   1HG   GLU  15          2HG       GLU  15 -10.193  -5.557 -15.692
  115   2HG   GLU  15          1HG       GLU  15 -10.551  -5.977 -14.017
  116    H    GLN  16           H        GLN  16  -9.005  -4.191 -14.808
  117    HA   GLN  16           HA       GLN  16  -8.593  -4.313 -12.021
  118   1HB   GLN  16          2HB       GLN  16  -6.396  -4.883 -12.472
  119   2HB   GLN  16          1HB       GLN  16  -7.166  -5.302 -13.999
  120   1HG   GLN  16          2HG       GLN  16  -5.447  -4.056 -14.856
  121   2HG   GLN  16          1HG       GLN  16  -6.543  -2.721 -14.517
  122   1HE2  GLN  16          1HE2      GLN  16  -4.039  -4.671 -12.769
  123   2HE2  GLN  16          2HE2      GLN  16  -3.404  -3.344 -11.921
  124    H    LYS  17           H        LYS  17  -8.172  -1.677 -14.329
  125    HA   LYS  17           HA       LYS  17  -6.903   0.083 -12.416
  126   1HB   LYS  17          2HB       LYS  17  -7.744   0.249 -15.250
  127   2HB   LYS  17          1HB       LYS  17  -7.800   1.762 -14.347
  128   1HG   LYS  17          2HG       LYS  17  -5.582   1.917 -14.773
  129   2HG   LYS  17          1HG       LYS  17  -5.389   0.670 -13.542
  130   1HD   LYS  17          2HD       LYS  17  -4.327  -0.409 -15.274
  131   2HD   LYS  17          1HD       LYS  17  -5.978  -0.912 -15.635
  132   1HE   LYS  17          2HE       LYS  17  -5.171   1.711 -16.759
  133   2HE   LYS  17          1HE       LYS  17  -4.357   0.307 -17.446
  134   1HZ   LYS  17          1HZ       LYS  17  -6.372   0.770 -18.655
  135   2HZ   LYS  17          2HZ       LYS  17  -7.294   0.705 -17.230
  136   3HZ   LYS  17          3HZ       LYS  17  -6.543  -0.699 -17.824
  137    H    ASN  18           H        ASN  18 -10.156  -0.641 -13.510
  138    HA   ASN  18           HA       ASN  18 -11.479   1.648 -12.474
  139   1HB   ASN  18          2HB       ASN  18 -12.244  -0.964 -13.557
  140   2HB   ASN  18          1HB       ASN  18 -13.310  -0.427 -12.258
  141   1HD2  ASN  18          1HD2      ASN  18 -11.671   1.080 -15.119
  142   2HD2  ASN  18          2HD2      ASN  18 -13.031   1.978 -15.592
  143    H    GLU  19           H        GLU  19 -10.688  -1.535 -11.111
  144    HA   GLU  19           HA       GLU  19 -11.951  -1.091  -8.573
  145   1HB   GLU  19          2HB       GLU  19  -9.725  -3.021  -9.293
  146   2HB   GLU  19          1HB       GLU  19 -10.713  -3.075  -7.833
  147   1HG   GLU  19          2HG       GLU  19 -12.726  -3.135  -9.503
  148   2HG   GLU  19          1HG       GLU  19 -11.512  -3.650 -10.673
  149    H    PHE  20           H        PHE  20  -8.650  -0.792  -9.829
  150    HA   PHE  20           HA       PHE  20  -7.367  -0.091  -7.405
  151   1HB   PHE  20          2HB       PHE  20  -6.723   0.254 -10.313
  152   2HB   PHE  20          1HB       PHE  20  -5.762   1.119  -9.119
  153    HD1  PHE  20           HD1      PHE  20  -3.785  -0.214  -9.837
  154    HD2  PHE  20           HD2      PHE  20  -7.257  -2.066  -8.116
  155    HE1  PHE  20           HE1      PHE  20  -2.472  -2.264  -9.397
  156    HE2  PHE  20           HE2      PHE  20  -5.942  -4.118  -7.679
  157    HZ   PHE  20           HZ       PHE  20  -3.548  -4.220  -8.317
  158    H    LYS  21           H        LYS  21  -8.900   1.865  -9.943
  159    HA   LYS  21           HA       LYS  21  -8.233   4.406  -8.862
  160   1HB   LYS  21          2HB       LYS  21  -9.008   4.034 -11.210
  161   2HB   LYS  21          1HB       LYS  21 -10.624   3.702 -10.586
  162   1HG   LYS  21          2HG       LYS  21 -10.441   6.049 -11.313
  163   2HG   LYS  21          1HG       LYS  21 -10.692   5.957  -9.570
  164   1HD   LYS  21          2HD       LYS  21  -8.440   6.488  -9.095
  165   2HD   LYS  21          1HD       LYS  21  -7.909   6.088 -10.729
  166   1HE   LYS  21          2HE       LYS  21  -7.933   8.470 -10.641
  167   2HE   LYS  21          1HE       LYS  21  -9.388   8.020 -11.527
  168   1HZ   LYS  21          1HZ       LYS  21  -9.331   8.553  -8.607
  169   2HZ   LYS  21          2HZ       LYS  21 -10.703   8.329  -9.585
  170   3HZ   LYS  21          3HZ       LYS  21  -9.741   9.717  -9.770
  171    H    ALA  22           H        ALA  22 -11.043   2.263  -8.467
  172    HA   ALA  22           HA       ALA  22 -12.565   4.055  -6.851
  173   1HB   ALA  22          1HB       ALA  22 -12.735   1.047  -6.695
  174   2HB   ALA  22          2HB       ALA  22 -13.399   1.945  -8.060
  175   3HB   ALA  22          3HB       ALA  22 -14.013   2.232  -6.432
  176    H    ALA  23           H        ALA  23 -10.325   1.393  -6.119
  177    HA   ALA  23           HA       ALA  23 -10.542   1.494  -3.295
  178   1HB   ALA  23          1HB       ALA  23  -9.500  -0.448  -4.010
  179   2HB   ALA  23          2HB       ALA  23  -8.103   0.508  -3.516
  180   3HB   ALA  23          3HB       ALA  23  -8.533   0.390  -5.223
  181    H    PHE  24           H        PHE  24  -8.845   3.473  -5.599
  182    HA   PHE  24           HA       PHE  24  -7.066   4.667  -3.631
  183   1HB   PHE  24          2HB       PHE  24  -6.650   4.298  -6.201
  184   2HB   PHE  24          1HB       PHE  24  -7.559   5.795  -6.374
  185    HD1  PHE  24           HD1      PHE  24  -4.486   4.256  -5.021
  186    HD2  PHE  24           HD2      PHE  24  -6.657   7.917  -5.599
  187    HE1  PHE  24           HE1      PHE  24  -2.451   5.555  -4.454
  188    HE2  PHE  24           HE2      PHE  24  -4.625   9.216  -5.024
  189    HZ   PHE  24           HZ       PHE  24  -2.521   8.034  -4.454
  190    H    ASP  25           H        ASP  25  -9.701   5.800  -5.761
  191    HA   ASP  25           HA       ASP  25  -9.972   8.389  -4.816
  192   1HB   ASP  25          2HB       ASP  25 -11.150   7.251  -6.797
  193   2HB   ASP  25          1HB       ASP  25 -12.361   6.741  -5.621
  194    H    ILE  26           H        ILE  26 -11.446   5.425  -3.468
  195    HA   ILE  26           HA       ILE  26 -13.231   6.625  -1.679
  196    HB   ILE  26           HB       ILE  26 -12.962   4.567  -0.280
  197   1HG1  ILE  26          2HG1      ILE  26 -10.889   3.873  -2.388
  198   2HG1  ILE  26          1HG1      ILE  26 -10.554   4.200  -0.690
  199   1HG2  ILE  26          1HG2      ILE  26 -13.612   4.658  -3.168
  200   2HG2  ILE  26          2HG2      ILE  26 -14.596   4.121  -1.806
  201   3HG2  ILE  26          3HG2      ILE  26 -13.383   3.043  -2.494
  202   1HD1  ILE  26          1HD1      ILE  26 -12.198   2.294  -0.170
  203   2HD1  ILE  26          2HD1      ILE  26 -10.634   1.834  -0.842
  204   3HD1  ILE  26          3HD1      ILE  26 -12.062   1.871  -1.876
  205    H    PHE  27           H        PHE  27  -9.760   6.048  -1.374
  206    HA   PHE  27           HA       PHE  27  -9.669   7.074   1.345
  207   1HB   PHE  27          2HB       PHE  27  -7.631   6.012  -0.588
  208   2HB   PHE  27          1HB       PHE  27  -7.113   6.928   0.827
  209    HD1  PHE  27           HD1      PHE  27  -8.381   3.758  -0.388
  210    HD2  PHE  27           HD2      PHE  27  -7.830   6.155   3.133
  211    HE1  PHE  27           HE1      PHE  27  -8.689   1.745   1.028
  212    HE2  PHE  27           HE2      PHE  27  -8.137   4.143   4.550
  213    HZ   PHE  27           HZ       PHE  27  -8.566   1.940   3.498
  214    H    ILE  28           H        ILE  28  -9.122   8.232  -1.931
  215    HA   ILE  28           HA       ILE  28  -7.990  10.760  -0.966
  216    HB   ILE  28           HB       ILE  28  -8.583  10.079  -3.844
  217   1HG1  ILE  28          2HG1      ILE  28  -7.210   8.259  -3.290
  218   2HG1  ILE  28          1HG1      ILE  28  -6.057   9.466  -3.834
  219   1HG2  ILE  28          1HG2      ILE  28  -7.945  12.302  -3.781
  220   2HG2  ILE  28          2HG2      ILE  28  -6.368  11.525  -3.938
  221   3HG2  ILE  28          3HG2      ILE  28  -6.927  12.078  -2.357
  222   1HD1  ILE  28          1HD1      ILE  28  -6.628   8.531  -1.040
  223   2HD1  ILE  28          2HD1      ILE  28  -5.985  10.153  -1.301
  224   3HD1  ILE  28          3HD1      ILE  28  -5.075   8.744  -1.847
  225    H    GLN  29           H        GLN  29 -10.726  10.149  -0.268
  226    HA   GLN  29           HA       GLN  29 -12.560  11.499  -1.978
  227   1HB   GLN  29          2HB       GLN  29 -14.025  11.598   0.077
  228   2HB   GLN  29          1HB       GLN  29 -13.483   9.984  -0.371
  229   1HG   GLN  29          2HG       GLN  29 -12.689   9.753   1.725
  230   2HG   GLN  29          1HG       GLN  29 -11.479  10.976   1.341
  231   1HE2  GLN  29          1HE2      GLN  29 -11.465  12.484   3.016
  232   2HE2  GLN  29          2HE2      GLN  29 -12.852  13.135   3.746
  233    H    ASP  30           H        ASP  30 -10.465  12.538   0.652
  234    HA   ASP  30           HA       ASP  30 -10.680  15.293  -0.191
  235   1HB   ASP  30          2HB       ASP  30 -12.557  14.575   1.647
  236   2HB   ASP  30          1HB       ASP  30 -11.231  15.053   2.706
  237    H    ALA  31           H        ALA  31  -8.528  13.613  -0.287
  238    HA   ALA  31           HA       ALA  31  -6.860  13.803   2.047
  239   1HB   ALA  31          1HB       ALA  31  -6.081  13.184  -0.812
  240   2HB   ALA  31          2HB       ALA  31  -6.623  11.989   0.366
  241   3HB   ALA  31          3HB       ALA  31  -5.116  12.868   0.631
  242    H    GLU  32           H        GLU  32  -4.977  15.041   2.301
  243    HA   GLU  32           HA       GLU  32  -5.183  17.731   1.308
  244   1HB   GLU  32          2HB       GLU  32  -3.198  18.179   2.679
  245   2HB   GLU  32          1HB       GLU  32  -4.413  17.289   3.594
  246   1HG   GLU  32          2HG       GLU  32  -3.205  15.214   3.315
  247   2HG   GLU  32          1HG       GLU  32  -2.075  15.968   2.193
  248    H    ASP  33           H        ASP  33  -3.090  14.962   0.636
  249    HA   ASP  33           HA       ASP  33  -1.662  16.561  -1.400
  250   1HB   ASP  33          2HB       ASP  33  -0.913  13.890  -0.184
  251   2HB   ASP  33          1HB       ASP  33   0.038  14.786  -1.368
  252    H    GLY  34           H        GLY  34  -4.286  14.550  -1.235
  253   1HA   GLY  34          2HA       GLY  34  -5.500  13.460  -2.862
  254   2HA   GLY  34          1HA       GLY  34  -4.345  14.063  -4.046
  255    H    CYS  35           H        CYS  35  -3.396  12.156  -1.248
  256    HA   CYS  35           HA       CYS  35  -3.066   9.740  -2.896
  257   1HB   CYS  35          2HB       CYS  35  -0.825  10.911  -1.235
  258   2HB   CYS  35          1HB       CYS  35  -0.755   9.464  -2.232
  259    HG   CYS  35           HG       CYS  35  -1.078  11.017  -4.353
  260    H    ILE  36           H        ILE  36  -2.091   7.944  -1.389
  261    HA   ILE  36           HA       ILE  36  -3.641   8.020   1.130
  262    HB   ILE  36           HB       ILE  36  -3.574   5.551   1.051
  263   1HG1  ILE  36          2HG1      ILE  36  -2.887   5.034  -1.626
  264   2HG1  ILE  36          1HG1      ILE  36  -1.614   6.094  -1.023
  265   1HG2  ILE  36          1HG2      ILE  36  -5.354   7.008  -0.116
  266   2HG2  ILE  36          2HG2      ILE  36  -5.256   5.313  -0.595
  267   3HG2  ILE  36          3HG2      ILE  36  -4.548   6.562  -1.621
  268   1HD1  ILE  36          1HD1      ILE  36  -1.963   3.318  -0.502
  269   2HD1  ILE  36          2HD1      ILE  36  -2.232   4.181   1.015
  270   3HD1  ILE  36          3HD1      ILE  36  -0.720   4.394   0.135
  271    H    SER  37           H        SER  37  -2.623   6.378   2.792
  272    HA   SER  37           HA       SER  37   0.125   7.299   3.224
  273   1HB   SER  37          2HB       SER  37  -1.801   7.370   4.988
  274   2HB   SER  37          1HB       SER  37  -1.438   5.659   5.195
  275    HG   SER  37           HG       SER  37  -0.248   7.314   6.515
  276    H    THR  38           H        THR  38   1.841   5.920   3.600
  277    HA   THR  38           HA       THR  38   1.963   3.521   2.126
  278    HB   THR  38           HB       THR  38   4.110   3.110   3.307
  279    HG1  THR  38           HG1      THR  38   3.530   5.492   4.723
  280   1HG2  THR  38          1HG2      THR  38   3.437   5.226   1.603
  281   2HG2  THR  38          2HG2      THR  38   5.057   4.604   1.914
  282   3HG2  THR  38          3HG2      THR  38   4.438   5.961   2.854
  283    H    LYS  39           H        LYS  39   1.406   4.131   5.574
  284    HA   LYS  39           HA       LYS  39   1.370   1.387   6.371
  285   1HB   LYS  39          2HB       LYS  39   0.447   2.211   8.472
  286   2HB   LYS  39          1HB       LYS  39   1.770   3.252   7.951
  287   1HG   LYS  39          2HG       LYS  39   0.256   4.938   7.163
  288   2HG   LYS  39          1HG       LYS  39  -1.133   3.865   7.341
  289   1HD   LYS  39          2HD       LYS  39  -1.263   4.180   9.603
  290   2HD   LYS  39          1HD       LYS  39   0.485   4.314   9.791
  291   1HE   LYS  39          2HE       LYS  39  -0.298   6.501  10.225
  292   2HE   LYS  39          1HE       LYS  39   0.250   6.574   8.551
  293   1HZ   LYS  39          1HZ       LYS  39  -1.922   7.591   8.806
  294   2HZ   LYS  39          2HZ       LYS  39  -2.553   6.149   9.446
  295   3HZ   LYS  39          3HZ       LYS  39  -2.031   6.208   7.830
  296    H    GLU  40           H        GLU  40  -0.978   3.520   4.924
  297    HA   GLU  40           HA       GLU  40  -3.288   1.957   5.672
  298   1HB   GLU  40          2HB       GLU  40  -2.868   4.261   3.770
  299   2HB   GLU  40          1HB       GLU  40  -4.416   3.433   3.919
  300   1HG   GLU  40          2HG       GLU  40  -2.914   4.696   6.231
  301   2HG   GLU  40          1HG       GLU  40  -4.263   5.450   5.383
  302    H    LEU  41           H        LEU  41  -0.815   1.372   3.496
  303    HA   LEU  41           HA       LEU  41  -2.136   0.486   1.176
  304   1HB   LEU  41          2HB       LEU  41   0.428   0.714   1.813
  305   2HB   LEU  41          1HB       LEU  41   0.251  -0.984   2.188
  306    HG   LEU  41           HG       LEU  41   1.128  -0.578  -0.087
  307   1HD1  LEU  41          1HD1      LEU  41  -0.089  -2.302  -1.061
  308   2HD1  LEU  41          2HD1      LEU  41  -1.631  -1.688  -0.465
  309   3HD1  LEU  41          3HD1      LEU  41  -0.523  -2.506   0.636
  310   1HD2  LEU  41          1HD2      LEU  41  -0.388   1.553  -0.289
  311   2HD2  LEU  41          2HD2      LEU  41  -1.599   0.416  -0.880
  312   3HD2  LEU  41          3HD2      LEU  41  -0.065   0.591  -1.731
  313    H    GLY  42           H        GLY  42  -1.391  -1.173   4.229
  314   1HA   GLY  42          2HA       GLY  42  -2.241  -3.764   3.480
  315   2HA   GLY  42          1HA       GLY  42  -2.162  -3.151   5.127
  316    H    LYS  43           H        LYS  43  -4.048  -0.888   4.124
  317    HA   LYS  43           HA       LYS  43  -6.507  -2.243   4.866
  318   1HB   LYS  43          2HB       LYS  43  -6.047   0.656   4.121
  319   2HB   LYS  43          1HB       LYS  43  -7.494  -0.010   4.878
  320   1HG   LYS  43          2HG       LYS  43  -4.971  -0.640   6.283
  321   2HG   LYS  43          1HG       LYS  43  -5.396   1.071   6.263
  322   1HD   LYS  43          2HD       LYS  43  -7.783   0.207   6.932
  323   2HD   LYS  43          1HD       LYS  43  -6.911  -1.239   7.444
  324   1HE   LYS  43          2HE       LYS  43  -5.824  -0.147   9.157
  325   2HE   LYS  43          1HE       LYS  43  -5.805   1.395   8.304
  326   1HZ   LYS  43          1HZ       LYS  43  -8.161   0.128   9.593
  327   2HZ   LYS  43          2HZ       LYS  43  -8.204   1.569   8.694
  328   3HZ   LYS  43          3HZ       LYS  43  -7.326   1.497  10.146
  329    H    VAL  44           H        VAL  44  -5.154  -0.637   2.001
  330    HA   VAL  44           HA       VAL  44  -7.537  -0.833   0.437
  331    HB   VAL  44           HB       VAL  44  -6.040  -0.348  -1.506
  332   1HG1  VAL  44          1HG1      VAL  44  -6.967   1.546  -0.428
  333   2HG1  VAL  44          2HG1      VAL  44  -5.243   1.897  -0.536
  334   3HG1  VAL  44          3HG1      VAL  44  -5.936   1.346   0.989
  335   1HG2  VAL  44          1HG2      VAL  44  -3.696   0.064  -1.168
  336   2HG2  VAL  44          2HG2      VAL  44  -4.033  -1.532  -0.500
  337   3HG2  VAL  44          3HG2      VAL  44  -3.852  -0.146   0.576
  338    H    MET  45           H        MET  45  -4.778  -2.956   0.990
  339    HA   MET  45           HA       MET  45  -5.164  -4.750  -1.151
  340   1HB   MET  45          2HB       MET  45  -4.186  -5.496   1.617
  341   2HB   MET  45          1HB       MET  45  -3.872  -6.354   0.109
  342   1HG   MET  45          2HG       MET  45  -3.078  -3.494   0.156
  343   2HG   MET  45          1HG       MET  45  -2.135  -4.574   1.181
  344   1HE   MET  45          1HE       MET  45  -3.698  -3.786  -1.968
  345   2HE   MET  45          2HE       MET  45  -3.809  -5.451  -2.535
  346   3HE   MET  45          3HE       MET  45  -2.648  -4.351  -3.277
  347    H    ARG  46           H        ARG  46  -6.665  -4.495   2.023
  348    HA   ARG  46           HA       ARG  46  -8.069  -6.974   1.962
  349   1HB   ARG  46          2HB       ARG  46  -8.152  -4.505   3.598
  350   2HB   ARG  46          1HB       ARG  46  -9.650  -5.435   3.539
  351   1HG   ARG  46          2HG       ARG  46  -7.461  -7.261   3.858
  352   2HG   ARG  46          1HG       ARG  46  -7.309  -5.988   5.068
  353   1HD   ARG  46          2HD       ARG  46  -9.927  -7.403   4.554
  354   2HD   ARG  46          1HD       ARG  46  -8.746  -8.019   5.704
  355    HE   ARG  46           HE       ARG  46  -9.095  -5.400   6.450
  356   1HH1  ARG  46          2HH1      ARG  46 -11.217  -8.124   5.916
  357   2HH1  ARG  46          1HH1      ARG  46 -12.392  -7.595   7.071
  358   1HH2  ARG  46          1HH2      ARG  46 -10.650  -4.727   7.960
  359   2HH2  ARG  46          2HH2      ARG  46 -12.072  -5.680   8.226
  360    H    MET  47           H        MET  47  -8.821  -3.717   0.819
  361    HA   MET  47           HA       MET  47 -11.555  -4.281   0.146
  362   1HB   MET  47          2HB       MET  47  -9.653  -2.029  -0.435
  363   2HB   MET  47          1HB       MET  47 -11.182  -2.138  -1.309
  364   1HG   MET  47          2HG       MET  47 -11.077  -2.329   1.702
  365   2HG   MET  47          1HG       MET  47 -11.167  -0.770   0.881
  366   1HE   MET  47          1HE       MET  47 -13.379   0.295   1.101
  367   2HE   MET  47          2HE       MET  47 -14.622  -0.227  -0.033
  368   3HE   MET  47          3HE       MET  47 -12.975   0.031  -0.600
  369    H    LEU  48           H        LEU  48  -8.473  -4.362  -1.590
  370    HA   LEU  48           HA       LEU  48  -9.617  -4.776  -4.185
  371   1HB   LEU  48          2HB       LEU  48  -7.055  -4.302  -3.147
  372   2HB   LEU  48          1HB       LEU  48  -6.962  -5.884  -3.888
  373    HG   LEU  48           HG       LEU  48  -6.279  -4.205  -5.489
  374   1HD1  LEU  48          1HD1      LEU  48  -7.532  -6.092  -6.399
  375   2HD1  LEU  48          2HD1      LEU  48  -7.964  -4.628  -7.282
  376   3HD1  LEU  48          3HD1      LEU  48  -9.058  -5.277  -6.061
  377   1HD2  LEU  48          1HD2      LEU  48  -7.517  -2.281  -6.017
  378   2HD2  LEU  48          2HD2      LEU  48  -7.768  -2.422  -4.277
  379   3HD2  LEU  48          3HD2      LEU  48  -9.021  -2.960  -5.394
  380    H    GLY  49           H        GLY  49  -7.940  -6.966  -1.909
  381   1HA   GLY  49          2HA       GLY  49  -9.375  -9.124  -1.640
  382   2HA   GLY  49          1HA       GLY  49  -9.036  -9.288  -3.361
  383    H    GLN  50           H        GLN  50  -7.121  -8.378  -0.484
  384    HA   GLN  50           HA       GLN  50  -5.381 -10.686  -0.785
  385   1HB   GLN  50          2HB       GLN  50  -4.619  -8.011  -1.765
  386   2HB   GLN  50          1HB       GLN  50  -3.444  -8.754  -0.680
  387   1HG   GLN  50          2HG       GLN  50  -3.842 -10.889  -2.159
  388   2HG   GLN  50          1HG       GLN  50  -4.437  -9.725  -3.343
  389   1HE2  GLN  50          1HE2      GLN  50  -2.741  -9.436  -4.816
  390   2HE2  GLN  50          2HE2      GLN  50  -1.132  -9.118  -4.379
  391    H    ASN  51           H        ASN  51  -3.879 -10.910   0.993
  392    HA   ASN  51           HA       ASN  51  -4.202  -9.065   3.242
  393   1HB   ASN  51          2HB       ASN  51  -5.994 -10.937   3.324
  394   2HB   ASN  51          1HB       ASN  51  -4.651 -11.999   3.747
  395   1HD2  ASN  51          1HD2      ASN  51  -6.260  -8.949   4.779
  396   2HD2  ASN  51          2HD2      ASN  51  -5.813  -9.093   6.410
  397    HA   PRO  52           HA       PRO  52   0.060 -10.801   2.958
  398   1HB   PRO  52          2HB       PRO  52   1.323  -8.379   2.819
  399   2HB   PRO  52          1HB       PRO  52   0.710  -9.242   1.404
  400   1HG   PRO  52          2HG       PRO  52  -0.350  -6.832   2.739
  401   2HG   PRO  52          1HG       PRO  52  -0.548  -7.370   1.066
  402   1HD   PRO  52          2HD       PRO  52  -2.456  -7.611   3.171
  403   2HD   PRO  52          1HD       PRO  52  -2.562  -8.331   1.548
  404    H    THR  53           H        THR  53   2.105  -9.574   4.242
  405    HA   THR  53           HA       THR  53   1.144  -9.329   7.029
  406    HB   THR  53           HB       THR  53   3.167 -10.254   7.770
  407    HG1  THR  53           HG1      THR  53   5.026  -9.995   6.765
  408   1HG2  THR  53          1HG2      THR  53   2.673 -11.511   5.062
  409   2HG2  THR  53          2HG2      THR  53   1.881 -11.955   6.575
  410   3HG2  THR  53          3HG2      THR  53   3.609 -12.241   6.367
  411    HA   PRO  54           HA       PRO  54   2.645  -5.199   7.289
  412   1HB   PRO  54          2HB       PRO  54   4.077  -5.147   9.629
  413   2HB   PRO  54          1HB       PRO  54   2.308  -5.185   9.549
  414   1HG   PRO  54          2HG       PRO  54   4.223  -7.377  10.181
  415   2HG   PRO  54          1HG       PRO  54   2.584  -7.100  10.793
  416   1HD   PRO  54          2HD       PRO  54   3.242  -8.954   8.828
  417   2HD   PRO  54          1HD       PRO  54   1.615  -8.272   9.067
  418    H    GLU  55           H        GLU  55   5.072  -7.700   7.605
  419    HA   GLU  55           HA       GLU  55   7.307  -5.928   7.040
  420   1HB   GLU  55          2HB       GLU  55   7.368  -8.946   6.969
  421   2HB   GLU  55          1HB       GLU  55   8.699  -7.834   7.277
  422   1HG   GLU  55          2HG       GLU  55   7.477  -7.088   9.363
  423   2HG   GLU  55          1HG       GLU  55   6.336  -8.405   9.086
  424    H    GLU  56           H        GLU  56   5.362  -8.380   5.364
  425    HA   GLU  56           HA       GLU  56   6.880  -8.395   2.951
  426   1HB   GLU  56          2HB       GLU  56   4.096  -9.302   3.655
  427   2HB   GLU  56          1HB       GLU  56   4.691  -9.367   1.996
  428   1HG   GLU  56          2HG       GLU  56   6.311 -10.536   4.254
  429   2HG   GLU  56          1HG       GLU  56   5.018 -11.467   3.497
  430    H    LEU  57           H        LEU  57   3.783  -6.805   3.815
  431    HA   LEU  57           HA       LEU  57   3.415  -5.475   1.364
  432   1HB   LEU  57          2HB       LEU  57   1.508  -4.973   2.379
  433   2HB   LEU  57          1HB       LEU  57   2.144  -5.538   3.902
  434    HG   LEU  57           HG       LEU  57   2.733  -2.740   2.975
  435   1HD1  LEU  57          1HD1      LEU  57   0.682  -2.038   4.236
  436   2HD1  LEU  57          2HD1      LEU  57   0.210  -3.735   4.330
  437   3HD1  LEU  57          3HD1      LEU  57   0.321  -2.936   2.762
  438   1HD2  LEU  57          1HD2      LEU  57   3.497  -2.482   5.096
  439   2HD2  LEU  57          2HD2      LEU  57   3.463  -4.243   5.187
  440   3HD2  LEU  57          3HD2      LEU  57   2.097  -3.304   5.786
  441    H    GLN  58           H        GLN  58   5.411  -4.690   4.149
  442    HA   GLN  58           HA       GLN  58   5.910  -1.975   3.633
  443   1HB   GLN  58          2HB       GLN  58   6.641  -3.484   5.651
  444   2HB   GLN  58          1HB       GLN  58   8.088  -3.752   4.680
  445   1HG   GLN  58          2HG       GLN  58   8.447  -1.844   6.170
  446   2HG   GLN  58          1HG       GLN  58   8.389  -1.284   4.499
  447   1HE2  GLN  58          1HE2      GLN  58   6.663   0.128   3.886
  448   2HE2  GLN  58          2HE2      GLN  58   5.488   0.677   4.983
  449    H    GLU  59           H        GLU  59   7.504  -4.901   2.389
  450    HA   GLU  59           HA       GLU  59   9.625  -3.681   1.002
  451   1HB   GLU  59          2HB       GLU  59   8.068  -6.214   0.452
  452   2HB   GLU  59          1HB       GLU  59   9.447  -5.717  -0.529
  453   1HG   GLU  59          2HG       GLU  59  10.964  -6.170   1.128
  454   2HG   GLU  59          1HG       GLU  59   9.860  -5.689   2.415
  455    H    MET  60           H        MET  60   6.272  -4.304   0.038
  456    HA   MET  60           HA       MET  60   6.507  -3.455  -2.656
  457   1HB   MET  60          2HB       MET  60   4.105  -3.461  -0.807
  458   2HB   MET  60          1HB       MET  60   4.029  -3.163  -2.544
  459   1HG   MET  60          2HG       MET  60   5.309  -5.656  -1.412
  460   2HG   MET  60          1HG       MET  60   3.584  -5.574  -1.762
  461   1HE   MET  60          1HE       MET  60   7.158  -6.143  -3.318
  462   2HE   MET  60          2HE       MET  60   6.372  -7.268  -4.422
  463   3HE   MET  60          3HE       MET  60   6.005  -7.334  -2.700
  464    H    ILE  61           H        ILE  61   5.747  -1.734   0.351
  465    HA   ILE  61           HA       ILE  61   4.967   0.736  -0.663
  466    HB   ILE  61           HB       ILE  61   6.520   0.074   1.851
  467   1HG1  ILE  61          2HG1      ILE  61   4.396  -0.971   1.970
  468   2HG1  ILE  61          1HG1      ILE  61   4.192   0.540   2.849
  469   1HG2  ILE  61          1HG2      ILE  61   5.174   2.642   0.986
  470   2HG2  ILE  61          2HG2      ILE  61   6.878   2.403   1.376
  471   3HG2  ILE  61          3HG2      ILE  61   5.659   2.300   2.647
  472   1HD1  ILE  61          1HD1      ILE  61   2.295   0.412   1.432
  473   2HD1  ILE  61          2HD1      ILE  61   3.258  -0.142   0.062
  474   3HD1  ILE  61          3HD1      ILE  61   3.385   1.529   0.610
  475    H    ASP  62           H        ASP  62   8.197   0.214   0.755
  476    HA   ASP  62           HA       ASP  62   9.429   2.441  -0.336
  477   1HB   ASP  62          2HB       ASP  62  11.546   1.389   0.156
  478   2HB   ASP  62          1HB       ASP  62  10.403   0.985   1.430
  479    H    GLU  63           H        GLU  63   8.921  -0.719  -1.826
  480    HA   GLU  63           HA       GLU  63  10.681  -0.390  -4.026
  481   1HB   GLU  63          2HB       GLU  63   8.387  -2.181  -3.394
  482   2HB   GLU  63          1HB       GLU  63   8.881  -2.052  -5.081
  483   1HG   GLU  63          2HG       GLU  63  11.239  -2.537  -4.362
  484   2HG   GLU  63          1HG       GLU  63  10.630  -2.835  -2.734
  485    H    VAL  64           H        VAL  64   7.148   0.141  -3.778
  486    HA   VAL  64           HA       VAL  64   7.053   1.258  -6.453
  487    HB   VAL  64           HB       VAL  64   4.679   1.507  -6.105
  488   1HG1  VAL  64          1HG1      VAL  64   6.001  -0.875  -6.139
  489   2HG1  VAL  64          2HG1      VAL  64   4.245  -0.728  -6.197
  490   3HG1  VAL  64          3HG1      VAL  64   5.052  -1.050  -4.664
  491   1HG2  VAL  64          1HG2      VAL  64   5.422   1.082  -3.213
  492   2HG2  VAL  64          2HG2      VAL  64   3.792   0.728  -3.786
  493   3HG2  VAL  64          3HG2      VAL  64   4.441   2.363  -3.922
  494    H    ASP  65           H        ASP  65   7.617   2.540  -3.297
  495    HA   ASP  65           HA       ASP  65   6.534   5.155  -3.791
  496   1HB   ASP  65          2HB       ASP  65   7.359   3.872  -1.522
  497   2HB   ASP  65          1HB       ASP  65   8.718   4.954  -1.816
  498    H    GLU  66           H        GLU  66   7.447   5.459  -5.911
  499    HA   GLU  66           HA       GLU  66  10.236   5.659  -6.411
  500   1HB   GLU  66          2HB       GLU  66   7.841   6.831  -7.835
  501   2HB   GLU  66          1HB       GLU  66   9.495   7.001  -8.425
  502   1HG   GLU  66          2HG       GLU  66   8.608   4.248  -7.703
  503   2HG   GLU  66          1HG       GLU  66   7.908   4.951  -9.161
  504    H    ASP  67           H        ASP  67   7.885   7.920  -5.105
  505    HA   ASP  67           HA       ASP  67   9.609  10.231  -5.431
  506   1HB   ASP  67          2HB       ASP  67   7.159  10.012  -3.672
  507   2HB   ASP  67          1HB       ASP  67   7.901  11.480  -4.301
  508    H    GLY  68           H        GLY  68   8.484   8.215  -2.711
  509   1HA   GLY  68          2HA       GLY  68   9.534   7.697  -0.709
  510   2HA   GLY  68          1HA       GLY  68  10.955   8.577  -1.269
  511    H    SER  69           H        SER  69   7.660   9.818  -1.079
  512    HA   SER  69           HA       SER  69   8.580  12.033   0.582
  513   1HB   SER  69          2HB       SER  69   6.214  12.873   0.117
  514   2HB   SER  69          1HB       SER  69   7.281  12.724  -1.277
  515    HG   SER  69           HG       SER  69   6.001  11.248  -2.053
  516    H    GLY  70           H        GLY  70   5.906   9.670   0.588
  517   1HA   GLY  70          2HA       GLY  70   5.942   8.678   3.085
  518   2HA   GLY  70          1HA       GLY  70   5.248  10.273   3.359
  519    H    THR  71           H        THR  71   3.916  10.341   0.741
  520    HA   THR  71           HA       THR  71   1.640   8.580   1.386
  521    HB   THR  71           HB       THR  71   0.282  10.118   0.067
  522    HG1  THR  71           HG1      THR  71   1.172  11.759  -1.044
  523   1HG2  THR  71          1HG2      THR  71   0.592  10.709   2.400
  524   2HG2  THR  71          2HG2      THR  71   0.619  12.187   1.438
  525   3HG2  THR  71          3HG2      THR  71   2.128  11.494   2.034
  526    H    VAL  72           H        VAL  72   0.595   7.397  -0.267
  527    HA   VAL  72           HA       VAL  72   2.388   6.677  -2.485
  528    HB   VAL  72           HB       VAL  72  -0.109   5.222  -1.598
  529   1HG1  VAL  72          1HG1      VAL  72   0.790   3.396  -2.903
  530   2HG1  VAL  72          2HG1      VAL  72   2.293   4.274  -3.185
  531   3HG1  VAL  72          3HG1      VAL  72   0.793   4.834  -3.923
  532   1HG2  VAL  72          1HG2      VAL  72   2.787   4.900  -0.764
  533   2HG2  VAL  72          2HG2      VAL  72   1.579   3.635  -0.544
  534   3HG2  VAL  72          3HG2      VAL  72   1.395   5.182   0.281
  535    H    ASP  73           H        ASP  73   2.026   7.506  -4.409
  536    HA   ASP  73           HA       ASP  73  -0.494   8.829  -5.040
  537   1HB   ASP  73          2HB       ASP  73   1.982   8.433  -6.749
  538   2HB   ASP  73          1HB       ASP  73   0.629   9.496  -7.118
  539    H    PHE  74           H        PHE  74  -1.288   8.409  -7.415
  540    HA   PHE  74           HA       PHE  74  -2.210   5.712  -7.522
  541   1HB   PHE  74          2HB       PHE  74  -3.289   7.864  -8.536
  542   2HB   PHE  74          1HB       PHE  74  -2.261   7.515  -9.927
  543    HD1  PHE  74           HD1      PHE  74  -3.471   6.465 -11.613
  544    HD2  PHE  74           HD2      PHE  74  -4.187   5.362  -7.527
  545    HE1  PHE  74           HE1      PHE  74  -5.072   4.727 -12.362
  546    HE2  PHE  74           HE2      PHE  74  -5.796   3.629  -8.275
  547    HZ   PHE  74           HZ       PHE  74  -6.239   3.311 -10.693
  548    H    ASP  75           H        ASP  75   0.449   7.447  -9.057
  549    HA   ASP  75           HA       ASP  75   1.110   5.492 -11.016
  550   1HB   ASP  75          2HB       ASP  75   2.475   7.832  -9.778
  551   2HB   ASP  75          1HB       ASP  75   3.507   6.614 -10.526
  552    H    GLU  76           H        GLU  76   1.927   5.948  -7.621
  553    HA   GLU  76           HA       GLU  76   3.794   3.724  -7.537
  554   1HB   GLU  76          2HB       GLU  76   2.564   5.036  -5.118
  555   2HB   GLU  76          1HB       GLU  76   4.152   4.288  -5.278
  556   1HG   GLU  76          2HG       GLU  76   4.745   6.121  -6.925
  557   2HG   GLU  76          1HG       GLU  76   3.228   6.907  -6.490
  558    H    PHE  77           H        PHE  77   0.395   4.281  -7.097
  559    HA   PHE  77           HA       PHE  77  -0.169   1.905  -5.565
  560   1HB   PHE  77          2HB       PHE  77  -1.604   3.955  -5.540
  561   2HB   PHE  77          1HB       PHE  77  -2.042   3.628  -7.213
  562    HD1  PHE  77           HD1      PHE  77  -2.060   2.092  -3.798
  563    HD2  PHE  77           HD2      PHE  77  -3.817   2.183  -7.718
  564    HE1  PHE  77           HE1      PHE  77  -3.844   0.548  -3.036
  565    HE2  PHE  77           HE2      PHE  77  -5.601   0.635  -6.955
  566    HZ   PHE  77           HZ       PHE  77  -5.613  -0.181  -4.614
  567    H    LEU  78           H        LEU  78  -0.325   2.856  -8.979
  568    HA   LEU  78           HA       LEU  78  -1.503   0.436  -9.932
  569   1HB   LEU  78          2HB       LEU  78   0.029   2.638 -11.303
  570   2HB   LEU  78          1HB       LEU  78  -0.625   1.264 -12.163
  571    HG   LEU  78           HG       LEU  78  -2.047   3.593 -10.929
  572   1HD1  LEU  78          1HD1      LEU  78  -1.491   3.397 -13.378
  573   2HD1  LEU  78          2HD1      LEU  78  -3.214   3.567 -13.045
  574   3HD1  LEU  78          3HD1      LEU  78  -2.546   1.986 -13.449
  575   1HD2  LEU  78          1HD2      LEU  78  -3.124   0.782 -11.224
  576   2HD2  LEU  78          2HD2      LEU  78  -4.180   2.194 -11.226
  577   3HD2  LEU  78          3HD2      LEU  78  -3.192   1.831  -9.809
  578    H    VAL  79           H        VAL  79   1.870   1.619  -9.825
  579    HA   VAL  79           HA       VAL  79   3.077  -0.458 -11.240
  580    HB   VAL  79           HB       VAL  79   5.136   0.029  -9.879
  581   1HG1  VAL  79          1HG1      VAL  79   5.062   2.570 -10.593
  582   2HG1  VAL  79          2HG1      VAL  79   3.539   2.098 -11.346
  583   3HG1  VAL  79          3HG1      VAL  79   5.040   1.303 -11.819
  584   1HG2  VAL  79          1HG2      VAL  79   4.011   0.641  -7.773
  585   2HG2  VAL  79          2HG2      VAL  79   3.294   2.044  -8.561
  586   3HG2  VAL  79          3HG2      VAL  79   5.040   1.956  -8.341
  587    H    MET  80           H        MET  80   1.903  -0.427  -7.941
  588    HA   MET  80           HA       MET  80   3.227  -2.519  -6.744
  589   1HB   MET  80          2HB       MET  80   0.665  -1.209  -6.409
  590   2HB   MET  80          1HB       MET  80   0.550  -2.927  -6.037
  591   1HG   MET  80          2HG       MET  80   2.083  -2.793  -4.293
  592   2HG   MET  80          1HG       MET  80   2.871  -1.364  -4.960
  593   1HE   MET  80          1HE       MET  80  -1.171  -1.598  -2.816
  594   2HE   MET  80          2HE       MET  80  -0.211  -2.908  -3.497
  595   3HE   MET  80          3HE       MET  80  -1.114  -1.839  -4.567
  596    H    MET  81           H        MET  81   0.602  -2.750  -9.134
  597    HA   MET  81           HA       MET  81   0.310  -5.592  -8.876
  598   1HB   MET  81          2HB       MET  81  -1.096  -5.448 -10.883
  599   2HB   MET  81          1HB       MET  81  -1.540  -4.223  -9.697
  600   1HG   MET  81          2HG       MET  81  -1.269  -2.657 -11.278
  601   2HG   MET  81          1HG       MET  81   0.446  -3.053 -11.330
  602   1HE   MET  81          1HE       MET  81   0.300  -2.015 -13.475
  603   2HE   MET  81          2HE       MET  81  -1.365  -2.019 -14.052
  604   3HE   MET  81          3HE       MET  81  -0.112  -2.823 -14.994
  605    H    VAL  82           H        VAL  82   2.181  -3.521 -11.063
  606    HA   VAL  82           HA       VAL  82   3.038  -5.777 -12.682
  607    HB   VAL  82           HB       VAL  82   4.571  -4.063 -13.747
  608   1HG1  VAL  82          1HG1      VAL  82   2.842  -4.021 -15.174
  609   2HG1  VAL  82          2HG1      VAL  82   2.148  -2.698 -14.239
  610   3HG1  VAL  82          3HG1      VAL  82   1.708  -4.366 -13.870
  611   1HG2  VAL  82          1HG2      VAL  82   4.219  -1.728 -13.239
  612   2HG2  VAL  82          2HG2      VAL  82   4.586  -2.553 -11.723
  613   3HG2  VAL  82          3HG2      VAL  82   2.922  -2.118 -12.111
  614    H    ARG  83           H        ARG  83   4.248  -4.011  -9.910
  615    HA   ARG  83           HA       ARG  83   6.982  -4.634 -10.068
  616   1HB   ARG  83          2HB       ARG  83   5.188  -4.257  -7.661
  617   2HB   ARG  83          1HB       ARG  83   6.945  -4.385  -7.568
  618   1HG   ARG  83          2HG       ARG  83   6.179  -2.470  -9.605
  619   2HG   ARG  83          1HG       ARG  83   5.443  -2.053  -8.059
  620   1HD   ARG  83          2HD       ARG  83   7.626  -1.004  -8.207
  621   2HD   ARG  83          1HD       ARG  83   7.668  -2.261  -6.978
  622    HE   ARG  83           HE       ARG  83   8.510  -3.339  -9.465
  623   1HH1  ARG  83          2HH1      ARG  83   9.541  -1.143  -6.956
  624   2HH1  ARG  83          1HH1      ARG  83  11.226  -1.441  -7.212
  625   1HH2  ARG  83          1HH2      ARG  83  10.724  -3.718  -9.785
  626   2HH2  ARG  83          2HH2      ARG  83  11.896  -2.895  -8.810
  627    H    CYS  84           H        CYS  84   4.246  -6.653  -9.392
  628    HA   CYS  84           HA       CYS  84   5.505  -8.689  -7.864
  629   1HB   CYS  84          2HB       CYS  84   3.102  -8.734  -9.697
  630   2HB   CYS  84          1HB       CYS  84   3.634 -10.142  -8.777
  631    HG   CYS  84           HG       CYS  84   1.877  -8.779  -7.344
  632    H    MET  85           H        MET  85   5.441  -7.979 -11.299
  633    HA   MET  85           HA       MET  85   6.281 -10.496 -12.294
  634   1HB   MET  85          2HB       MET  85   6.403  -7.681 -13.333
  635   2HB   MET  85          1HB       MET  85   7.233  -8.977 -14.196
  636   1HG   MET  85          2HG       MET  85   4.949 -10.240 -13.969
  637   2HG   MET  85          1HG       MET  85   4.288  -8.630 -13.687
  638   1HE   MET  85          1HE       MET  85   5.442 -11.231 -15.802
  639   2HE   MET  85          2HE       MET  85   5.322 -10.677 -17.469
  640   3HE   MET  85          3HE       MET  85   3.866 -10.813 -16.489
  641    H    LYS  86           H        LYS  86   8.008  -7.848 -10.787
  642    HA   LYS  86           HA       LYS  86  10.143  -7.678  -9.981
  643   1HB   LYS  86          2HB       LYS  86   9.925 -10.564 -10.523
  644   2HB   LYS  86          1HB       LYS  86  11.570  -9.932 -10.543
  645   1HG   LYS  86          2HG       LYS  86  11.419 -10.256  -8.282
  646   2HG   LYS  86          1HG       LYS  86  10.611  -8.689  -8.329
  647   1HD   LYS  86          2HD       LYS  86   8.579  -9.585  -7.841
  648   2HD   LYS  86          1HD       LYS  86   8.836 -10.973  -8.898
  649   1HE   LYS  86          2HE       LYS  86  10.412 -10.783  -6.351
  650   2HE   LYS  86          1HE       LYS  86   8.729 -11.301  -6.276
  651   1HZ   LYS  86          1HZ       LYS  86  10.847 -12.529  -7.961
  652   2HZ   LYS  86          2HZ       LYS  86   9.222 -13.024  -7.898
  653   3HZ   LYS  86          3HZ       LYS  86  10.216 -13.183  -6.529
  654    H    ASP  87           H        ASP  87  12.023  -6.863 -10.756
  655    HA   ASP  87           HA       ASP  87  12.873  -7.471 -13.480
  656   1HB   ASP  87          2HB       ASP  87  13.044  -4.901 -13.890
  657   2HB   ASP  87          1HB       ASP  87  11.498  -5.704 -14.137
  658    H    ASP  88           H        ASP  88  14.899  -8.043 -13.092
  659    HA   ASP  88           HA       ASP  88  16.517  -6.453 -11.202
  660   1HB   ASP  88          2HB       ASP  88  18.135  -8.388 -11.363
  661   2HB   ASP  88          1HB       ASP  88  16.578  -8.780 -10.637
  662    H    SER  89           HN       SER  89  15.981  -5.255 -13.655
  663    HA   SER  89           HA       SER  89  18.114  -5.703 -15.535
  664   1HB   SER  89          2HB       SER  89  15.812  -4.693 -16.050
  665   2HB   SER  89          1HB       SER  89  16.434  -3.201 -15.349
  666    HG   SER  89           HG       SER  89  16.745  -3.393 -17.650
  Start of MODEL   32
    1   1H    MET   1          1H        MET   1  17.190   0.985 -14.683
    2   2H    MET   1          2H        MET   1  17.538  -0.503 -15.425
    3   3H    MET   1          3H        MET   1  16.763  -0.465 -13.914
    4    HA   MET   1           HA       MET   1  14.781   0.424 -14.827
    5   1HB   MET   1          2HB       MET   1  14.625   0.963 -17.240
    6   2HB   MET   1          1HB       MET   1  15.835   1.962 -16.436
    7   1HG   MET   1          2HG       MET   1  17.635   0.723 -17.359
    8   2HG   MET   1          1HG       MET   1  16.589  -0.622 -17.808
    9   1HE   MET   1          1HE       MET   1  17.887  -0.136 -20.666
   10   2HE   MET   1          2HE       MET   1  16.221  -0.303 -21.212
   11   3HE   MET   1          3HE       MET   1  16.749  -1.136 -19.752
   12    H    ASN   2           H        ASN   2  13.218  -0.785 -16.181
   13    HA   ASN   2           HA       ASN   2  14.163  -3.452 -17.008
   14   1HB   ASN   2          2HB       ASN   2  12.904  -3.115 -14.597
   15   2HB   ASN   2          1HB       ASN   2  11.544  -3.469 -15.663
   16   1HD2  ASN   2          1HD2      ASN   2  14.921  -4.693 -15.177
   17   2HD2  ASN   2          2HD2      ASN   2  14.495  -6.328 -15.337
   18    H    ASP   3           H        ASP   3  12.757  -4.552 -18.472
   19    HA   ASP   3           HA       ASP   3  11.179  -2.690 -20.108
   20   1HB   ASP   3          2HB       ASP   3  13.059  -4.324 -20.965
   21   2HB   ASP   3          1HB       ASP   3  11.749  -5.506 -20.943
   22    H    ILE   4           H        ILE   4  10.563  -4.866 -17.643
   23    HA   ILE   4           HA       ILE   4   8.304  -6.268 -18.654
   24    HB   ILE   4           HB       ILE   4   7.716  -6.688 -16.300
   25   1HG1  ILE   4          2HG1      ILE   4   9.611  -5.734 -14.675
   26   2HG1  ILE   4          1HG1      ILE   4   9.654  -4.442 -15.877
   27   1HG2  ILE   4          1HG2      ILE   4   9.277  -8.253 -16.966
   28   2HG2  ILE   4          2HG2      ILE   4  10.166  -7.491 -15.649
   29   3HG2  ILE   4          3HG2      ILE   4  10.506  -7.038 -17.318
   30   1HD1  ILE   4          1HD1      ILE   4   7.966  -4.364 -13.810
   31   2HD1  ILE   4          2HD1      ILE   4   6.979  -5.338 -14.899
   32   3HD1  ILE   4          3HD1      ILE   4   7.512  -3.732 -15.393
   33    H    TYR   5           H        TYR   5   8.743  -3.026 -17.437
   34    HA   TYR   5           HA       TYR   5   6.014  -2.449 -16.841
   35   1HB   TYR   5          2HB       TYR   5   8.241  -0.552 -17.643
   36   2HB   TYR   5          1HB       TYR   5   6.708  -0.096 -16.896
   37    HD1  TYR   5           HD1      TYR   5  10.071  -1.208 -16.303
   38    HD2  TYR   5           HD2      TYR   5   6.117  -1.145 -14.620
   39    HE1  TYR   5           HE1      TYR   5  11.020  -1.678 -14.064
   40    HE2  TYR   5           HE2      TYR   5   7.071  -1.611 -12.377
   41    HH   TYR   5           HH       TYR   5   9.592  -2.887 -11.679
   42    H    LYS   6           H        LYS   6   7.965  -2.390 -19.750
   43    HA   LYS   6           HA       LYS   6   6.005  -0.970 -21.344
   44   1HB   LYS   6          2HB       LYS   6   8.264  -2.657 -22.428
   45   2HB   LYS   6          1HB       LYS   6   7.478  -1.272 -23.180
   46   1HG   LYS   6          2HG       LYS   6   9.366  -1.281 -20.817
   47   2HG   LYS   6          1HG       LYS   6   9.563  -0.449 -22.361
   48   1HD   LYS   6          2HD       LYS   6   7.792   1.095 -21.849
   49   2HD   LYS   6          1HD       LYS   6   7.313   0.163 -20.428
   50   1HE   LYS   6          2HE       LYS   6   9.186   0.839 -19.192
   51   2HE   LYS   6          1HE       LYS   6  10.112   1.253 -20.636
   52   1HZ   LYS   6          1HZ       LYS   6   7.707   2.713 -19.680
   53   2HZ   LYS   6          2HZ       LYS   6   8.671   3.128 -21.018
   54   3HZ   LYS   6          3HZ       LYS   6   9.310   3.218 -19.446
   55    H    ALA   7           H        ALA   7   6.979  -4.299 -20.773
   56    HA   ALA   7           HA       ALA   7   5.205  -5.437 -22.739
   57   1HB   ALA   7          1HB       ALA   7   6.104  -7.463 -22.145
   58   2HB   ALA   7          2HB       ALA   7   6.148  -7.060 -20.429
   59   3HB   ALA   7          3HB       ALA   7   7.377  -6.416 -21.517
   60    H    ALA   8           H        ALA   8   4.976  -4.476 -19.382
   61    HA   ALA   8           HA       ALA   8   2.563  -5.986 -18.858
   62   1HB   ALA   8          1HB       ALA   8   4.066  -3.890 -17.281
   63   2HB   ALA   8          2HB       ALA   8   4.004  -5.629 -16.984
   64   3HB   ALA   8          3HB       ALA   8   2.569  -4.638 -16.721
   65    H    VAL   9           H        VAL   9   3.411  -2.685 -19.817
   66    HA   VAL   9           HA       VAL   9   1.000  -1.401 -19.219
   67    HB   VAL   9           HB       VAL   9   3.208  -0.402 -20.125
   68   1HG1  VAL   9          1HG1      VAL   9   1.855  -0.479 -22.793
   69   2HG1  VAL   9          2HG1      VAL   9   2.813  -1.874 -22.303
   70   3HG1  VAL   9          3HG1      VAL   9   3.564  -0.282 -22.409
   71   1HG2  VAL   9          1HG2      VAL   9   0.680   0.688 -21.375
   72   2HG2  VAL   9          2HG2      VAL   9   2.062   1.586 -20.745
   73   3HG2  VAL   9          3HG2      VAL   9   0.966   0.764 -19.635
   74    H    GLU  10           H        GLU  10   1.807  -3.539 -21.889
   75    HA   GLU  10           HA       GLU  10  -0.616  -2.984 -23.370
   76   1HB   GLU  10          2HB       GLU  10   1.483  -5.147 -23.635
   77   2HB   GLU  10          1HB       GLU  10   0.098  -4.987 -24.716
   78   1HG   GLU  10          2HG       GLU  10   0.864  -2.971 -25.618
   79   2HG   GLU  10          1HG       GLU  10   1.872  -2.612 -24.215
   80    H    GLN  11           H        GLN  11   0.275  -5.041 -20.732
   81    HA   GLN  11           HA       GLN  11  -1.892  -6.938 -21.168
   82   1HB   GLN  11          2HB       GLN  11   0.013  -6.659 -18.833
   83   2HB   GLN  11          1HB       GLN  11  -1.113  -7.991 -19.091
   84   1HG   GLN  11          2HG       GLN  11   0.035  -8.395 -21.316
   85   2HG   GLN  11          1HG       GLN  11   1.261  -7.236 -20.808
   86   1HE2  GLN  11          1HE2      GLN  11   2.061  -7.785 -18.367
   87   2HE2  GLN  11          2HE2      GLN  11   2.423  -9.423 -18.114
   88    H    LEU  12           H        LEU  12  -1.083  -4.288 -18.949
   89    HA   LEU  12           HA       LEU  12  -3.255  -4.559 -17.184
   90   1HB   LEU  12          2HB       LEU  12  -1.818  -2.057 -18.062
   91   2HB   LEU  12          1HB       LEU  12  -2.916  -2.154 -16.705
   92    HG   LEU  12           HG       LEU  12  -0.821  -4.152 -16.487
   93   1HD1  LEU  12          1HD1      LEU  12   1.091  -2.736 -16.312
   94   2HD1  LEU  12          2HD1      LEU  12   0.112  -1.275 -16.447
   95   3HD1  LEU  12          3HD1      LEU  12   0.330  -2.325 -17.848
   96   1HD2  LEU  12          1HD2      LEU  12  -1.343  -1.727 -14.753
   97   2HD2  LEU  12          2HD2      LEU  12  -0.678  -3.287 -14.266
   98   3HD2  LEU  12          3HD2      LEU  12  -2.380  -3.153 -14.714
   99    H    THR  13           H        THR  13  -5.347  -4.018 -17.270
  100    HA   THR  13           HA       THR  13  -6.331  -2.671 -19.725
  101    HB   THR  13           HB       THR  13  -8.530  -3.968 -18.888
  102    HG1  THR  13           HG1      THR  13  -7.766  -5.115 -17.238
  103   1HG2  THR  13          1HG2      THR  13  -6.268  -4.801 -20.667
  104   2HG2  THR  13          2HG2      THR  13  -7.905  -4.301 -21.095
  105   3HG2  THR  13          3HG2      THR  13  -7.623  -5.903 -20.415
  106    H    ASP  14           H        ASP  14  -8.646  -1.817 -19.339
  107    HA   ASP  14           HA       ASP  14  -8.533   0.278 -17.440
  108   1HB   ASP  14          2HB       ASP  14  -9.946   0.125 -19.589
  109   2HB   ASP  14          1HB       ASP  14 -11.088  -0.802 -18.618
  110    H    GLU  15           H        GLU  15  -9.777  -2.990 -17.323
  111    HA   GLU  15           HA       GLU  15 -11.492  -2.804 -15.093
  112   1HB   GLU  15          2HB       GLU  15  -9.877  -5.085 -16.230
  113   2HB   GLU  15          1HB       GLU  15 -10.899  -5.282 -14.809
  114   1HG   GLU  15          2HG       GLU  15 -12.392  -5.856 -16.495
  115   2HG   GLU  15          1HG       GLU  15 -12.726  -4.132 -16.333
  116    H    GLN  16           H        GLN  16  -7.994  -3.516 -15.288
  117    HA   GLN  16           HA       GLN  16  -7.614  -4.009 -12.529
  118   1HB   GLN  16          2HB       GLN  16  -5.298  -3.946 -12.943
  119   2HB   GLN  16          1HB       GLN  16  -5.987  -4.487 -14.470
  120   1HG   GLN  16          2HG       GLN  16  -4.729  -2.825 -15.376
  121   2HG   GLN  16          1HG       GLN  16  -6.019  -1.770 -14.813
  122   1HE2  GLN  16          1HE2      GLN  16  -3.636  -0.503 -14.984
  123   2HE2  GLN  16          2HE2      GLN  16  -2.913  -0.312 -13.460
  124    H    LYS  17           H        LYS  17  -7.746  -1.021 -14.383
  125    HA   LYS  17           HA       LYS  17  -6.808   0.625 -12.191
  126   1HB   LYS  17          2HB       LYS  17  -7.991   1.217 -14.898
  127   2HB   LYS  17          1HB       LYS  17  -7.754   2.492 -13.702
  128   1HG   LYS  17          2HG       LYS  17  -5.604   2.631 -14.346
  129   2HG   LYS  17          1HG       LYS  17  -5.355   0.997 -13.729
  130   1HD   LYS  17          2HD       LYS  17  -5.576   0.024 -15.818
  131   2HD   LYS  17          1HD       LYS  17  -6.619   1.309 -16.423
  132   1HE   LYS  17          2HE       LYS  17  -4.138   2.525 -15.792
  133   2HE   LYS  17          1HE       LYS  17  -3.762   1.046 -16.676
  134   1HZ   LYS  17          1HZ       LYS  17  -5.677   3.142 -17.552
  135   2HZ   LYS  17          2HZ       LYS  17  -5.302   1.721 -18.404
  136   3HZ   LYS  17          3HZ       LYS  17  -4.115   2.913 -18.170
  137    H    ASN  18           H        ASN  18  -9.877  -0.529 -13.445
  138    HA   ASN  18           HA       ASN  18 -11.599   1.299 -12.134
  139   1HB   ASN  18          2HB       ASN  18 -11.875  -1.060 -13.733
  140   2HB   ASN  18          1HB       ASN  18 -12.872  -1.242 -12.288
  141   1HD2  ASN  18          1HD2      ASN  18 -12.318   0.840 -15.132
  142   2HD2  ASN  18          2HD2      ASN  18 -13.811   1.641 -15.034
  143    H    GLU  19           H        GLU  19 -10.357  -1.910 -11.175
  144    HA   GLU  19           HA       GLU  19 -11.721  -2.006  -8.667
  145   1HB   GLU  19          2HB       GLU  19  -9.161  -3.408  -9.489
  146   2HB   GLU  19          1HB       GLU  19 -10.165  -3.818  -8.099
  147   1HG   GLU  19          2HG       GLU  19 -12.082  -4.177  -9.724
  148   2HG   GLU  19          1HG       GLU  19 -10.903  -4.029 -11.028
  149    H    PHE  20           H        PHE  20  -8.361  -1.224  -9.551
  150    HA   PHE  20           HA       PHE  20  -7.442  -0.538  -6.980
  151   1HB   PHE  20          2HB       PHE  20  -6.543   0.309  -9.737
  152   2HB   PHE  20          1HB       PHE  20  -5.710   0.815  -8.274
  153    HD1  PHE  20           HD1      PHE  20  -4.120  -0.614 -10.142
  154    HD2  PHE  20           HD2      PHE  20  -6.850  -2.217  -7.238
  155    HE1  PHE  20           HE1      PHE  20  -2.859  -2.742 -10.129
  156    HE2  PHE  20           HE2      PHE  20  -5.586  -4.346  -7.230
  157    HZ   PHE  20           HZ       PHE  20  -3.589  -4.612  -8.675
  158    H    LYS  21           H        LYS  21  -9.140   1.356  -9.431
  159    HA   LYS  21           HA       LYS  21  -8.723   3.922  -8.301
  160   1HB   LYS  21          2HB       LYS  21  -9.549   3.595 -10.608
  161   2HB   LYS  21          1HB       LYS  21 -11.067   2.969  -9.967
  162   1HG   LYS  21          2HG       LYS  21 -11.334   5.333 -10.536
  163   2HG   LYS  21          1HG       LYS  21 -11.422   5.140  -8.785
  164   1HD   LYS  21          2HD       LYS  21  -9.220   5.972  -8.473
  165   2HD   LYS  21          1HD       LYS  21  -8.824   5.792 -10.183
  166   1HE   LYS  21          2HE       LYS  21 -10.763   7.477 -10.583
  167   2HE   LYS  21          1HE       LYS  21 -10.588   7.852  -8.868
  168   1HZ   LYS  21          1HZ       LYS  21  -8.260   8.355  -9.243
  169   2HZ   LYS  21          2HZ       LYS  21  -9.241   9.311 -10.250
  170   3HZ   LYS  21          3HZ       LYS  21  -8.413   7.971 -10.888
  171    H    ALA  22           H        ALA  22 -11.248   1.474  -7.798
  172    HA   ALA  22           HA       ALA  22 -12.874   3.098  -6.106
  173   1HB   ALA  22          1HB       ALA  22 -13.579   0.951  -7.290
  174   2HB   ALA  22          2HB       ALA  22 -14.097   1.120  -5.613
  175   3HB   ALA  22          3HB       ALA  22 -12.727   0.084  -6.013
  176    H    ALA  23           H        ALA  23 -10.307   0.719  -5.490
  177    HA   ALA  23           HA       ALA  23 -10.473   0.872  -2.631
  178   1HB   ALA  23          1HB       ALA  23  -9.438  -1.083  -3.479
  179   2HB   ALA  23          2HB       ALA  23  -8.118  -0.140  -2.788
  180   3HB   ALA  23          3HB       ALA  23  -8.368  -0.156  -4.533
  181    H    PHE  24           H        PHE  24  -9.026   2.846  -5.073
  182    HA   PHE  24           HA       PHE  24  -7.162   4.162  -3.262
  183   1HB   PHE  24          2HB       PHE  24  -6.880   3.716  -5.835
  184   2HB   PHE  24          1HB       PHE  24  -7.867   5.164  -6.008
  185    HD1  PHE  24           HD1      PHE  24  -4.628   3.814  -4.922
  186    HD2  PHE  24           HD2      PHE  24  -7.044   7.351  -5.237
  187    HE1  PHE  24           HE1      PHE  24  -2.623   5.219  -4.531
  188    HE2  PHE  24           HE2      PHE  24  -5.041   8.757  -4.839
  189    HZ   PHE  24           HZ       PHE  24  -2.829   7.690  -4.485
  190    H    ASP  25           H        ASP  25 -10.018   5.072  -5.213
  191    HA   ASP  25           HA       ASP  25 -10.287   7.705  -4.339
  192   1HB   ASP  25          2HB       ASP  25 -11.549   6.488  -6.219
  193   2HB   ASP  25          1HB       ASP  25 -12.670   5.973  -4.960
  194    H    ILE  26           H        ILE  26 -11.593   4.732  -2.849
  195    HA   ILE  26           HA       ILE  26 -13.321   5.901  -0.995
  196    HB   ILE  26           HB       ILE  26 -12.845   3.900   0.454
  197   1HG1  ILE  26          2HG1      ILE  26 -10.938   3.211  -1.809
  198   2HG1  ILE  26          1HG1      ILE  26 -10.453   3.649  -0.173
  199   1HG2  ILE  26          1HG2      ILE  26 -14.585   3.412  -0.958
  200   2HG2  ILE  26          2HG2      ILE  26 -13.405   2.289  -1.632
  201   3HG2  ILE  26          3HG2      ILE  26 -13.675   3.852  -2.402
  202   1HD1  ILE  26          1HD1      ILE  26 -11.958   1.703   0.599
  203   2HD1  ILE  26          2HD1      ILE  26 -10.430   1.283  -0.175
  204   3HD1  ILE  26          3HD1      ILE  26 -11.937   1.188  -1.088
  205    H    PHE  27           H        PHE  27  -9.813   5.551  -0.880
  206    HA   PHE  27           HA       PHE  27  -9.650   6.668   1.811
  207   1HB   PHE  27          2HB       PHE  27  -7.658   5.585  -0.155
  208   2HB   PHE  27          1HB       PHE  27  -7.110   6.595   1.184
  209    HD1  PHE  27           HD1      PHE  27  -8.615   3.389   0.233
  210    HD2  PHE  27           HD2      PHE  27  -7.412   5.877   3.520
  211    HE1  PHE  27           HE1      PHE  27  -8.818   1.455   1.770
  212    HE2  PHE  27           HE2      PHE  27  -7.614   3.942   5.057
  213    HZ   PHE  27           HZ       PHE  27  -8.320   1.732   4.181
  214    H    ILE  28           H        ILE  28  -9.306   7.736  -1.521
  215    HA   ILE  28           HA       ILE  28  -8.184  10.316  -0.696
  216    HB   ILE  28           HB       ILE  28  -8.948   9.496  -3.503
  217   1HG1  ILE  28          2HG1      ILE  28  -7.417   7.802  -3.010
  218   2HG1  ILE  28          1HG1      ILE  28  -6.365   9.071  -3.610
  219   1HG2  ILE  28          1HG2      ILE  28  -7.388  11.695  -2.233
  220   2HG2  ILE  28          2HG2      ILE  28  -8.428  11.732  -3.657
  221   3HG2  ILE  28          3HG2      ILE  28  -6.800  11.063  -3.773
  222   1HD1  ILE  28          1HD1      ILE  28  -6.209   9.807  -1.113
  223   2HD1  ILE  28          2HD1      ILE  28  -5.278   8.402  -1.640
  224   3HD1  ILE  28          3HD1      ILE  28  -6.797   8.179  -0.771
  225    H    GLN  29           H        GLN  29 -11.020   9.392  -0.069
  226    HA   GLN  29           HA       GLN  29 -12.827  10.943  -1.628
  227   1HB   GLN  29          2HB       GLN  29 -14.428  10.595   0.204
  228   2HB   GLN  29          1HB       GLN  29 -13.613   9.089  -0.210
  229   1HG   GLN  29          2HG       GLN  29 -12.119   9.305   1.692
  230   2HG   GLN  29          1HG       GLN  29 -12.753  10.911   2.058
  231   1HE2  GLN  29          1HE2      GLN  29 -13.183   7.554   2.677
  232   2HE2  GLN  29          2HE2      GLN  29 -14.681   7.668   3.468
  233    H    ASP  30           H        ASP  30 -10.798  11.632   1.147
  234    HA   ASP  30           HA       ASP  30 -11.321  14.486   0.824
  235   1HB   ASP  30          2HB       ASP  30 -12.840  13.297   2.675
  236   2HB   ASP  30          1HB       ASP  30 -11.379  13.503   3.641
  237    H    ALA  31           H        ALA  31  -9.064  12.979   0.123
  238    HA   ALA  31           HA       ALA  31  -7.057  13.027   2.168
  239   1HB   ALA  31          1HB       ALA  31  -6.817  11.507   0.290
  240   2HB   ALA  31          2HB       ALA  31  -5.480  12.659   0.268
  241   3HB   ALA  31          3HB       ALA  31  -6.834  12.856  -0.845
  242    H    GLU  32           H        GLU  32  -5.141  14.366   2.149
  243    HA   GLU  32           HA       GLU  32  -5.764  17.161   1.854
  244   1HB   GLU  32          2HB       GLU  32  -3.131  15.813   2.510
  245   2HB   GLU  32          1HB       GLU  32  -3.454  17.541   2.642
  246   1HG   GLU  32          2HG       GLU  32  -4.961  17.249   4.430
  247   2HG   GLU  32          1HG       GLU  32  -5.191  15.536   4.076
  248    H    ASP  33           H        ASP  33  -3.367  14.998   0.352
  249    HA   ASP  33           HA       ASP  33  -2.926  16.964  -1.795
  250   1HB   ASP  33          2HB       ASP  33  -1.038  15.712  -0.489
  251   2HB   ASP  33          1HB       ASP  33  -1.438  14.364  -1.553
  252    H    GLY  34           H        GLY  34  -4.121  13.699  -1.215
  253   1HA   GLY  34          2HA       GLY  34  -5.954  12.947  -2.690
  254   2HA   GLY  34          1HA       GLY  34  -5.005  13.557  -4.041
  255    H    CYS  35           H        CYS  35  -3.656  11.800  -1.293
  256    HA   CYS  35           HA       CYS  35  -3.344   9.361  -2.904
  257   1HB   CYS  35          2HB       CYS  35  -1.008  10.642  -1.475
  258   2HB   CYS  35          1HB       CYS  35  -0.977   9.237  -2.534
  259    HG   CYS  35           HG       CYS  35  -1.347  12.178  -3.493
  260    H    ILE  36           H        ILE  36  -2.172   7.649  -1.466
  261    HA   ILE  36           HA       ILE  36  -3.443   7.759   1.200
  262    HB   ILE  36           HB       ILE  36  -3.218   5.286   1.199
  263   1HG1  ILE  36          2HG1      ILE  36  -2.872   4.779  -1.566
  264   2HG1  ILE  36          1HG1      ILE  36  -1.558   5.855  -1.093
  265   1HG2  ILE  36          1HG2      ILE  36  -4.614   6.128  -1.338
  266   2HG2  ILE  36          2HG2      ILE  36  -5.219   6.627   0.242
  267   3HG2  ILE  36          3HG2      ILE  36  -5.108   4.913  -0.160
  268   1HD1  ILE  36          1HD1      ILE  36  -0.514   4.111  -0.145
  269   2HD1  ILE  36          2HD1      ILE  36  -1.883   3.058  -0.506
  270   3HD1  ILE  36          3HD1      ILE  36  -1.845   3.979   1.004
  271    H    SER  37           H        SER  37  -2.155   6.217   2.789
  272    HA   SER  37           HA       SER  37   0.556   7.324   2.898
  273   1HB   SER  37          2HB       SER  37  -1.308   7.160   4.845
  274   2HB   SER  37          1HB       SER  37  -0.455   5.644   5.121
  275    HG   SER  37           HG       SER  37   0.951   6.866   6.091
  276    H    THR  38           H        THR  38   2.355   5.995   3.436
  277    HA   THR  38           HA       THR  38   2.620   3.665   1.875
  278    HB   THR  38           HB       THR  38   4.725   3.279   3.241
  279    HG1  THR  38           HG1      THR  38   4.136   5.793   4.378
  280   1HG2  THR  38          1HG2      THR  38   5.588   5.719   2.553
  281   2HG2  THR  38          2HG2      THR  38   4.037   5.746   1.715
  282   3HG2  THR  38          3HG2      THR  38   5.216   4.488   1.345
  283    H    LYS  39           H        LYS  39   2.382   4.000   5.428
  284    HA   LYS  39           HA       LYS  39   2.144   1.202   5.937
  285   1HB   LYS  39          2HB       LYS  39   1.524   1.874   8.208
  286   2HB   LYS  39          1HB       LYS  39   2.907   2.813   7.643
  287   1HG   LYS  39          2HG       LYS  39   1.606   4.751   7.293
  288   2HG   LYS  39          1HG       LYS  39   0.092   3.847   7.309
  289   1HD   LYS  39          2HD       LYS  39  -0.064   3.928   9.565
  290   2HD   LYS  39          1HD       LYS  39   1.645   3.554   9.784
  291   1HE   LYS  39          2HE       LYS  39   0.896   6.258   8.731
  292   2HE   LYS  39          1HE       LYS  39   0.692   5.937  10.453
  293   1HZ   LYS  39          1HZ       LYS  39   3.007   5.256  10.567
  294   2HZ   LYS  39          2HZ       LYS  39   2.879   6.842   9.975
  295   3HZ   LYS  39          3HZ       LYS  39   3.203   5.559   8.910
  296    H    GLU  40           H        GLU  40  -0.094   3.536   4.772
  297    HA   GLU  40           HA       GLU  40  -2.490   2.305   5.806
  298   1HB   GLU  40          2HB       GLU  40  -2.025   4.774   4.927
  299   2HB   GLU  40          1HB       GLU  40  -2.563   4.068   3.405
  300   1HG   GLU  40          2HG       GLU  40  -4.666   3.404   4.362
  301   2HG   GLU  40          1HG       GLU  40  -4.118   3.808   5.989
  302    H    LEU  41           H        LEU  41  -0.334   1.273   3.466
  303    HA   LEU  41           HA       LEU  41  -1.983   0.484   1.324
  304   1HB   LEU  41          2HB       LEU  41   0.413   0.400   1.106
  305   2HB   LEU  41          1HB       LEU  41   0.545  -0.740   2.423
  306    HG   LEU  41           HG       LEU  41  -0.482  -2.483   1.078
  307   1HD1  LEU  41          1HD1      LEU  41  -1.013  -1.986  -1.339
  308   2HD1  LEU  41          2HD1      LEU  41  -0.817  -0.272  -0.969
  309   3HD1  LEU  41          3HD1      LEU  41  -2.095  -1.203  -0.187
  310   1HD2  LEU  41          1HD2      LEU  41   1.920  -2.206   0.798
  311   2HD2  LEU  41          2HD2      LEU  41   1.670  -0.931  -0.394
  312   3HD2  LEU  41          3HD2      LEU  41   1.213  -2.591  -0.771
  313    H    GLY  42           H        GLY  42  -1.391  -0.970   4.483
  314   1HA   GLY  42          2HA       GLY  42  -2.561  -3.509   3.936
  315   2HA   GLY  42          1HA       GLY  42  -2.298  -2.811   5.529
  316    H    LYS  43           H        LYS  43  -3.925  -0.375   4.447
  317    HA   LYS  43           HA       LYS  43  -6.485  -1.343   5.420
  318   1HB   LYS  43          2HB       LYS  43  -5.702   1.419   4.457
  319   2HB   LYS  43          1HB       LYS  43  -7.169   0.995   5.339
  320   1HG   LYS  43          2HG       LYS  43  -5.577   0.064   7.154
  321   2HG   LYS  43          1HG       LYS  43  -4.317   0.983   6.330
  322   1HD   LYS  43          2HD       LYS  43  -5.007   2.663   7.713
  323   2HD   LYS  43          1HD       LYS  43  -6.261   2.874   6.491
  324   1HE   LYS  43          2HE       LYS  43  -7.842   1.609   7.754
  325   2HE   LYS  43          1HE       LYS  43  -6.595   0.998   8.838
  326   1HZ   LYS  43          1HZ       LYS  43  -7.848   2.771   9.876
  327   2HZ   LYS  43          2HZ       LYS  43  -7.461   3.829   8.605
  328   3HZ   LYS  43          3HZ       LYS  43  -6.240   3.254   9.637
  329    H    VAL  44           H        VAL  44  -5.076  -0.242   2.354
  330    HA   VAL  44           HA       VAL  44  -7.591  -0.197   0.957
  331    HB   VAL  44           HB       VAL  44  -6.174  -0.057  -1.102
  332   1HG1  VAL  44          1HG1      VAL  44  -5.645   1.815   1.212
  333   2HG1  VAL  44          2HG1      VAL  44  -6.835   1.999  -0.076
  334   3HG1  VAL  44          3HG1      VAL  44  -5.116   2.157  -0.435
  335   1HG2  VAL  44          1HG2      VAL  44  -3.865   0.001   0.862
  336   2HG2  VAL  44          2HG2      VAL  44  -3.767   0.140  -0.892
  337   3HG2  VAL  44          3HG2      VAL  44  -4.255  -1.386  -0.157
  338    H    MET  45           H        MET  45  -5.020  -2.571   1.445
  339    HA   MET  45           HA       MET  45  -5.776  -4.461  -0.490
  340   1HB   MET  45          2HB       MET  45  -4.626  -5.089   2.240
  341   2HB   MET  45          1HB       MET  45  -4.557  -6.103   0.802
  342   1HG   MET  45          2HG       MET  45  -3.466  -3.359   0.501
  343   2HG   MET  45          1HG       MET  45  -2.542  -4.449   1.532
  344   1HE   MET  45          1HE       MET  45  -3.476  -4.508  -2.853
  345   2HE   MET  45          2HE       MET  45  -4.343  -3.764  -1.507
  346   3HE   MET  45          3HE       MET  45  -4.659  -5.446  -1.929
  347    H    ARG  46           H        ARG  46  -7.012  -3.822   2.742
  348    HA   ARG  46           HA       ARG  46  -8.553  -6.140   3.127
  349   1HB   ARG  46          2HB       ARG  46  -8.882  -3.306   4.109
  350   2HB   ARG  46          1HB       ARG  46  -9.998  -4.591   4.572
  351   1HG   ARG  46          2HG       ARG  46  -7.186  -5.375   4.849
  352   2HG   ARG  46          1HG       ARG  46  -7.612  -3.990   5.854
  353   1HD   ARG  46          2HD       ARG  46  -9.621  -5.305   6.649
  354   2HD   ARG  46          1HD       ARG  46  -8.960  -6.702   5.807
  355    HE   ARG  46           HE       ARG  46  -6.938  -5.716   7.471
  356   1HH1  ARG  46          2HH1      ARG  46 -10.140  -7.081   7.767
  357   2HH1  ARG  46          1HH1      ARG  46  -9.825  -7.804   9.307
  358   1HH2  ARG  46          1HH2      ARG  46  -6.548  -6.674   9.488
  359   2HH2  ARG  46          2HH2      ARG  46  -7.797  -7.575  10.279
  360    H    MET  47           H        MET  47  -9.305  -3.100   1.457
  361    HA   MET  47           HA       MET  47 -12.031  -3.854   0.873
  362   1HB   MET  47          2HB       MET  47 -10.260  -1.545   0.205
  363   2HB   MET  47          1HB       MET  47 -11.665  -1.838  -0.819
  364   1HG   MET  47          2HG       MET  47 -12.129  -1.971   2.114
  365   2HG   MET  47          1HG       MET  47 -11.790  -0.373   1.449
  366   1HE   MET  47          1HE       MET  47 -14.010  -1.690   2.939
  367   2HE   MET  47          2HE       MET  47 -14.974  -2.832   2.005
  368   3HE   MET  47          3HE       MET  47 -15.560  -1.189   2.250
  369    H    LEU  48           H        LEU  48  -8.929  -3.941  -0.828
  370    HA   LEU  48           HA       LEU  48  -9.995  -4.585  -3.399
  371   1HB   LEU  48          2HB       LEU  48  -7.629  -3.728  -2.679
  372   2HB   LEU  48          1HB       LEU  48  -7.269  -5.432  -2.503
  373    HG   LEU  48           HG       LEU  48  -7.914  -5.755  -4.900
  374   1HD1  LEU  48          1HD1      LEU  48  -7.978  -3.623  -6.275
  375   2HD1  LEU  48          2HD1      LEU  48  -8.147  -2.737  -4.760
  376   3HD1  LEU  48          3HD1      LEU  48  -9.391  -3.885  -5.254
  377   1HD2  LEU  48          1HD2      LEU  48  -5.564  -4.904  -3.820
  378   2HD2  LEU  48          2HD2      LEU  48  -5.858  -3.621  -4.994
  379   3HD2  LEU  48          3HD2      LEU  48  -5.762  -5.299  -5.527
  380    H    GLY  49           H        GLY  49  -8.433  -6.588  -0.887
  381   1HA   GLY  49          2HA       GLY  49  -9.861  -8.737  -0.543
  382   2HA   GLY  49          1HA       GLY  49  -9.420  -9.026  -2.225
  383    H    GLN  50           H        GLN  50  -7.633  -7.815   0.622
  384    HA   GLN  50           HA       GLN  50  -5.892 -10.143   0.658
  385   1HB   GLN  50          2HB       GLN  50  -5.091  -7.605  -0.605
  386   2HB   GLN  50          1HB       GLN  50  -3.960  -8.199   0.612
  387   1HG   GLN  50          2HG       GLN  50  -3.713 -10.301  -0.517
  388   2HG   GLN  50          1HG       GLN  50  -5.058  -9.945  -1.601
  389   1HE2  GLN  50          1HE2      GLN  50  -1.687  -9.052  -0.847
  390   2HE2  GLN  50          2HE2      GLN  50  -1.387  -8.294  -2.336
  391    H    ASN  51           H        ASN  51  -4.463 -10.160   2.499
  392    HA   ASN  51           HA       ASN  51  -4.845  -8.070   4.513
  393   1HB   ASN  51          2HB       ASN  51  -6.637  -9.977   4.702
  394   2HB   ASN  51          1HB       ASN  51  -5.304 -10.906   5.385
  395   1HD2  ASN  51          1HD2      ASN  51  -6.037 -10.892   7.589
  396   2HD2  ASN  51          2HD2      ASN  51  -6.162  -9.466   8.501
  397    HA   PRO  52           HA       PRO  52  -0.606  -9.916   4.532
  398   1HB   PRO  52          2HB       PRO  52   0.727  -7.600   3.965
  399   2HB   PRO  52          1HB       PRO  52   0.084  -8.685   2.726
  400   1HG   PRO  52          2HG       PRO  52  -0.895  -6.041   3.600
  401   2HG   PRO  52          1HG       PRO  52  -1.116  -6.868   2.051
  402   1HD   PRO  52          2HD       PRO  52  -3.017  -6.665   4.172
  403   2HD   PRO  52          1HD       PRO  52  -3.162  -7.650   2.696
  404    H    THR  53           H        THR  53   1.472  -8.567   5.586
  405    HA   THR  53           HA       THR  53   0.527  -7.699   8.257
  406    HB   THR  53           HB       THR  53   2.368  -8.735   9.242
  407    HG1  THR  53           HG1      THR  53   4.283  -8.719   8.368
  408   1HG2  THR  53          1HG2      THR  53   2.641 -10.968   8.220
  409   2HG2  THR  53          2HG2      THR  53   1.863 -10.376   6.751
  410   3HG2  THR  53          3HG2      THR  53   0.950 -10.467   8.257
  411    HA   PRO  54           HA       PRO  54   2.604  -3.843   7.749
  412   1HB   PRO  54          2HB       PRO  54   4.079  -3.527  10.037
  413   2HB   PRO  54          1HB       PRO  54   2.318  -3.362   9.964
  414   1HG   PRO  54          2HG       PRO  54   3.964  -5.595  11.033
  415   2HG   PRO  54          1HG       PRO  54   2.365  -5.028  11.541
  416   1HD   PRO  54          2HD       PRO  54   2.845  -7.283   9.960
  417   2HD   PRO  54          1HD       PRO  54   1.284  -6.440  10.090
  418    H    GLU  55           H        GLU  55   4.719  -6.518   8.565
  419    HA   GLU  55           HA       GLU  55   7.139  -5.177   7.661
  420   1HB   GLU  55          2HB       GLU  55   6.853  -8.131   8.212
  421   2HB   GLU  55          1HB       GLU  55   8.304  -7.137   8.308
  422   1HG   GLU  55          2HG       GLU  55   5.890  -6.906  10.134
  423   2HG   GLU  55          1HG       GLU  55   7.427  -7.652  10.563
  424    H    GLU  56           H        GLU  56   4.846  -7.611   6.505
  425    HA   GLU  56           HA       GLU  56   6.304  -8.320   4.149
  426   1HB   GLU  56          2HB       GLU  56   4.424  -9.650   5.297
  427   2HB   GLU  56          1HB       GLU  56   3.316  -8.570   4.453
  428   1HG   GLU  56          2HG       GLU  56   3.552 -10.410   2.985
  429   2HG   GLU  56          1HG       GLU  56   4.637  -9.189   2.319
  430    H    LEU  57           H        LEU  57   3.429  -6.248   4.677
  431    HA   LEU  57           HA       LEU  57   3.208  -5.383   1.994
  432   1HB   LEU  57          2HB       LEU  57   1.362  -4.424   2.759
  433   2HB   LEU  57          1HB       LEU  57   1.778  -5.010   4.348
  434    HG   LEU  57           HG       LEU  57   2.662  -2.315   3.295
  435   1HD1  LEU  57          1HD1      LEU  57   0.150  -2.618   3.402
  436   2HD1  LEU  57          2HD1      LEU  57   0.789  -1.345   4.444
  437   3HD1  LEU  57          3HD1      LEU  57   0.333  -2.903   5.133
  438   1HD2  LEU  57          1HD2      LEU  57   2.307  -2.529   6.143
  439   2HD2  LEU  57          2HD2      LEU  57   3.785  -2.180   5.246
  440   3HD2  LEU  57          3HD2      LEU  57   3.336  -3.850   5.593
  441    H    GLN  58           H        GLN  58   5.294  -4.343   4.602
  442    HA   GLN  58           HA       GLN  58   5.961  -1.755   3.788
  443   1HB   GLN  58          2HB       GLN  58   6.958  -3.632   5.664
  444   2HB   GLN  58          1HB       GLN  58   8.332  -3.099   4.696
  445   1HG   GLN  58          2HG       GLN  58   6.346  -1.253   6.056
  446   2HG   GLN  58          1HG       GLN  58   7.957  -1.630   6.666
  447   1HE2  GLN  58          1HE2      GLN  58   6.180   0.234   4.274
  448   2HE2  GLN  58          2HE2      GLN  58   7.524   1.055   3.640
  449    H    GLU  59           H        GLU  59   7.284  -4.879   2.736
  450    HA   GLU  59           HA       GLU  59   9.312  -3.845   1.044
  451   1HB   GLU  59          2HB       GLU  59   7.904  -6.483   1.271
  452   2HB   GLU  59          1HB       GLU  59   8.934  -6.169  -0.126
  453   1HG   GLU  59          2HG       GLU  59   9.988  -5.543   2.612
  454   2HG   GLU  59          1HG       GLU  59   9.960  -7.222   2.075
  455    H    MET  60           H        MET  60   5.911  -4.677   0.483
  456    HA   MET  60           HA       MET  60   5.921  -4.363  -2.333
  457   1HB   MET  60          2HB       MET  60   3.841  -4.475  -0.206
  458   2HB   MET  60          1HB       MET  60   3.375  -3.742  -1.741
  459   1HG   MET  60          2HG       MET  60   2.884  -6.027  -2.054
  460   2HG   MET  60          1HG       MET  60   4.453  -5.834  -2.832
  461   1HE   MET  60          1HE       MET  60   3.299  -8.295   0.784
  462   2HE   MET  60          2HE       MET  60   2.379  -7.861  -0.653
  463   3HE   MET  60          3HE       MET  60   2.697  -6.645   0.581
  464    H    ILE  61           H        ILE  61   5.190  -2.096   0.320
  465    HA   ILE  61           HA       ILE  61   4.382   0.118  -1.168
  466    HB   ILE  61           HB       ILE  61   5.913  -0.042   1.434
  467   1HG1  ILE  61          2HG1      ILE  61   3.086   0.844   1.247
  468   2HG1  ILE  61          1HG1      ILE  61   3.391  -0.858   0.904
  469   1HG2  ILE  61          1HG2      ILE  61   6.340   2.146   0.608
  470   2HG2  ILE  61          2HG2      ILE  61   4.984   2.324   1.723
  471   3HG2  ILE  61          3HG2      ILE  61   4.699   2.316  -0.017
  472   1HD1  ILE  61          1HD1      ILE  61   4.487  -1.159   3.034
  473   2HD1  ILE  61          2HD1      ILE  61   2.930  -0.387   3.329
  474   3HD1  ILE  61          3HD1      ILE  61   4.410   0.570   3.372
  475    H    ASP  62           H        ASP  62   7.623  -0.178   0.294
  476    HA   ASP  62           HA       ASP  62   8.885   1.840  -1.115
  477   1HB   ASP  62          2HB       ASP  62   9.755   0.348   0.832
  478   2HB   ASP  62          1HB       ASP  62  10.372  -0.686  -0.456
  479    H    GLU  63           H        GLU  63   8.278  -1.486  -2.151
  480    HA   GLU  63           HA       GLU  63  10.009  -1.559  -4.379
  481   1HB   GLU  63          2HB       GLU  63   7.615  -3.091  -3.506
  482   2HB   GLU  63          1HB       GLU  63   8.028  -3.173  -5.218
  483   1HG   GLU  63          2HG       GLU  63  10.192  -3.540  -3.167
  484   2HG   GLU  63          1HG       GLU  63   9.109  -4.882  -3.532
  485    H    VAL  64           H        VAL  64   6.592  -0.582  -4.115
  486    HA   VAL  64           HA       VAL  64   6.518   0.200  -6.924
  487    HB   VAL  64           HB       VAL  64   4.181   0.700  -6.556
  488   1HG1  VAL  64          1HG1      VAL  64   3.452  -1.485  -6.233
  489   2HG1  VAL  64          2HG1      VAL  64   4.594  -1.783  -4.924
  490   3HG1  VAL  64          3HG1      VAL  64   5.157  -1.749  -6.594
  491   1HG2  VAL  64          1HG2      VAL  64   4.486   1.731  -4.294
  492   2HG2  VAL  64          2HG2      VAL  64   4.693   0.112  -3.625
  493   3HG2  VAL  64          3HG2      VAL  64   3.154   0.576  -4.350
  494    H    ASP  65           H        ASP  65   7.257   1.717  -3.914
  495    HA   ASP  65           HA       ASP  65   6.356   4.345  -4.537
  496   1HB   ASP  65          2HB       ASP  65   7.358   3.167  -2.277
  497   2HB   ASP  65          1HB       ASP  65   8.720   4.154  -2.794
  498    H    GLU  66           H        GLU  66   6.986   4.869  -6.585
  499    HA   GLU  66           HA       GLU  66   9.663   4.623  -7.564
  500   1HB   GLU  66          2HB       GLU  66   7.283   6.201  -8.557
  501   2HB   GLU  66          1HB       GLU  66   8.816   6.096  -9.421
  502   1HG   GLU  66          2HG       GLU  66   8.401   3.979 -10.136
  503   2HG   GLU  66          1HG       GLU  66   7.763   3.481  -8.569
  504    H    ASP  67           H        ASP  67   7.817   7.309  -6.140
  505    HA   ASP  67           HA       ASP  67  10.028   9.157  -6.581
  506   1HB   ASP  67          2HB       ASP  67   8.494  10.718  -5.165
  507   2HB   ASP  67          1HB       ASP  67   8.028  10.316  -6.814
  508    H    GLY  68           H        GLY  68   8.466   7.574  -3.798
  509   1HA   GLY  68          2HA       GLY  68   9.348   7.042  -1.724
  510   2HA   GLY  68          1HA       GLY  68  10.906   7.659  -2.268
  511    H    SER  69           H        SER  69   7.728   9.241  -2.080
  512    HA   SER  69           HA       SER  69   8.930  11.521  -0.709
  513   1HB   SER  69          2HB       SER  69   6.636  12.525  -1.066
  514   2HB   SER  69          1HB       SER  69   7.493  12.087  -2.541
  515    HG   SER  69           HG       SER  69   5.222  11.389  -2.346
  516    H    GLY  70           H        GLY  70   6.096   9.401  -0.274
  517   1HA   GLY  70          2HA       GLY  70   6.320   8.632   2.311
  518   2HA   GLY  70          1HA       GLY  70   5.699  10.273   2.462
  519    H    THR  71           H        THR  71   4.153  10.178  -0.003
  520    HA   THR  71           HA       THR  71   1.914   8.492   0.931
  521    HB   THR  71           HB       THR  71   0.440   9.992  -0.274
  522    HG1  THR  71           HG1      THR  71   1.161  11.287  -1.765
  523   1HG2  THR  71          1HG2      THR  71   2.515  11.570   1.273
  524   2HG2  THR  71          2HG2      THR  71   1.174  10.673   1.990
  525   3HG2  THR  71          3HG2      THR  71   0.851  12.071   0.964
  526    H    VAL  72           H        VAL  72   0.730   7.251  -0.572
  527    HA   VAL  72           HA       VAL  72   2.324   6.467  -2.919
  528    HB   VAL  72           HB       VAL  72  -0.056   5.018  -1.753
  529   1HG1  VAL  72          1HG1      VAL  72   2.201   3.942  -3.450
  530   2HG1  VAL  72          2HG1      VAL  72   0.744   4.627  -4.169
  531   3HG1  VAL  72          3HG1      VAL  72   0.630   3.205  -3.130
  532   1HG2  VAL  72          1HG2      VAL  72   2.910   4.768  -1.183
  533   2HG2  VAL  72          2HG2      VAL  72   1.753   3.491  -0.808
  534   3HG2  VAL  72          3HG2      VAL  72   1.614   5.065  -0.024
  535    H    ASP  73           H        ASP  73   1.789   7.295  -4.792
  536    HA   ASP  73           HA       ASP  73  -0.843   8.469  -5.238
  537   1HB   ASP  73          2HB       ASP  73   1.532   8.230  -7.112
  538   2HB   ASP  73          1HB       ASP  73   0.087   9.198  -7.391
  539    H    PHE  74           H        PHE  74  -1.774   7.994  -7.540
  540    HA   PHE  74           HA       PHE  74  -2.539   5.244  -7.602
  541   1HB   PHE  74          2HB       PHE  74  -3.807   7.342  -8.506
  542   2HB   PHE  74          1HB       PHE  74  -2.867   7.064  -9.972
  543    HD1  PHE  74           HD1      PHE  74  -4.040   5.886 -11.589
  544    HD2  PHE  74           HD2      PHE  74  -4.580   4.868  -7.456
  545    HE1  PHE  74           HE1      PHE  74  -5.599   4.067 -12.240
  546    HE2  PHE  74           HE2      PHE  74  -6.146   3.056  -8.102
  547    HZ   PHE  74           HZ       PHE  74  -6.655   2.653 -10.496
  548    H    ASP  75           H        ASP  75  -0.060   7.127  -9.249
  549    HA   ASP  75           HA       ASP  75   0.562   5.270 -11.313
  550   1HB   ASP  75          2HB       ASP  75   1.948   7.580 -10.026
  551   2HB   ASP  75          1HB       ASP  75   2.940   6.439 -10.931
  552    H    GLU  76           H        GLU  76   1.569   5.662  -7.963
  553    HA   GLU  76           HA       GLU  76   3.473   3.475  -8.021
  554   1HB   GLU  76          2HB       GLU  76   2.324   4.693  -5.519
  555   2HB   GLU  76          1HB       GLU  76   3.923   3.997  -5.772
  556   1HG   GLU  76          2HG       GLU  76   4.346   5.894  -7.425
  557   2HG   GLU  76          1HG       GLU  76   2.863   6.632  -6.818
  558    H    PHE  77           H        PHE  77   0.099   3.943  -7.484
  559    HA   PHE  77           HA       PHE  77  -0.377   1.537  -5.973
  560   1HB   PHE  77          2HB       PHE  77  -1.782   3.716  -6.045
  561   2HB   PHE  77          1HB       PHE  77  -2.437   3.076  -7.549
  562    HD1  PHE  77           HD1      PHE  77  -1.864   2.161  -3.957
  563    HD2  PHE  77           HD2      PHE  77  -4.198   1.564  -7.510
  564    HE1  PHE  77           HE1      PHE  77  -3.441   0.733  -2.680
  565    HE2  PHE  77           HE2      PHE  77  -5.777   0.130  -6.235
  566    HZ   PHE  77           HZ       PHE  77  -5.397  -0.283  -3.818
  567    H    LEU  78           H        LEU  78  -0.520   2.518  -9.376
  568    HA   LEU  78           HA       LEU  78  -1.726   0.075 -10.307
  569   1HB   LEU  78          2HB       LEU  78  -0.327   2.320 -11.752
  570   2HB   LEU  78          1HB       LEU  78  -1.050   0.949 -12.565
  571    HG   LEU  78           HG       LEU  78  -2.373   3.256 -11.181
  572   1HD1  LEU  78          1HD1      LEU  78  -2.664   1.775 -13.801
  573   2HD1  LEU  78          2HD1      LEU  78  -2.203   3.458 -13.546
  574   3HD1  LEU  78          3HD1      LEU  78  -3.861   2.942 -13.242
  575   1HD2  LEU  78          1HD2      LEU  78  -3.438   1.470 -10.036
  576   2HD2  LEU  78          2HD2      LEU  78  -3.458   0.452 -11.478
  577   3HD2  LEU  78          3HD2      LEU  78  -4.519   1.855 -11.376
  578    H    VAL  79           H        VAL  79   1.601   1.249  -9.980
  579    HA   VAL  79           HA       VAL  79   2.855  -0.656 -11.637
  580    HB   VAL  79           HB       VAL  79   4.862  -0.324 -10.082
  581   1HG1  VAL  79          1HG1      VAL  79   3.467   1.903 -11.565
  582   2HG1  VAL  79          2HG1      VAL  79   4.770   0.861 -12.143
  583   3HG1  VAL  79          3HG1      VAL  79   5.095   2.084 -10.913
  584   1HG2  VAL  79          1HG2      VAL  79   3.196   1.960  -9.028
  585   2HG2  VAL  79          2HG2      VAL  79   4.771   1.407  -8.462
  586   3HG2  VAL  79          3HG2      VAL  79   3.334   0.429  -8.166
  587    H    MET  80           H        MET  80   1.398  -1.001  -8.539
  588    HA   MET  80           HA       MET  80   2.714  -3.122  -7.357
  589   1HB   MET  80          2HB       MET  80  -0.107  -2.198  -7.417
  590   2HB   MET  80          1HB       MET  80   0.174  -3.840  -6.835
  591   1HG   MET  80          2HG       MET  80   2.073  -2.714  -5.411
  592   2HG   MET  80          1HG       MET  80   1.153  -1.236  -5.700
  593   1HE   MET  80          1HE       MET  80  -0.981  -0.578  -4.533
  594   2HE   MET  80          2HE       MET  80  -2.225  -1.755  -4.121
  595   3HE   MET  80          3HE       MET  80  -1.629  -1.659  -5.775
  596    H    MET  81           H        MET  81   0.776  -3.155 -10.281
  597    HA   MET  81           HA       MET  81   0.493  -6.037 -10.363
  598   1HB   MET  81          2HB       MET  81  -0.216  -3.766 -12.178
  599   2HB   MET  81          1HB       MET  81  -0.122  -5.393 -12.852
  600   1HG   MET  81          2HG       MET  81  -1.597  -6.088 -10.833
  601   2HG   MET  81          1HG       MET  81  -1.935  -4.365 -10.674
  602   1HE   MET  81          1HE       MET  81  -3.411  -7.342 -13.752
  603   2HE   MET  81          2HE       MET  81  -2.939  -7.576 -12.071
  604   3HE   MET  81          3HE       MET  81  -1.705  -7.273 -13.292
  605    H    VAL  82           H        VAL  82   2.494  -3.613 -12.070
  606    HA   VAL  82           HA       VAL  82   3.868  -5.529 -13.686
  607    HB   VAL  82           HB       VAL  82   5.487  -3.660 -14.123
  608   1HG1  VAL  82          1HG1      VAL  82   2.990  -2.254 -14.572
  609   2HG1  VAL  82          2HG1      VAL  82   2.814  -3.974 -14.918
  610   3HG1  VAL  82          3HG1      VAL  82   4.058  -3.031 -15.741
  611   1HG2  VAL  82          1HG2      VAL  82   3.592  -2.073 -12.369
  612   2HG2  VAL  82          2HG2      VAL  82   4.996  -1.450 -13.230
  613   3HG2  VAL  82          3HG2      VAL  82   5.213  -2.568 -11.884
  614    H    ARG  83           H        ARG  83   4.466  -4.256 -10.454
  615    HA   ARG  83           HA       ARG  83   7.200  -5.013 -10.263
  616   1HB   ARG  83          2HB       ARG  83   6.907  -4.856  -7.828
  617   2HB   ARG  83          1HB       ARG  83   6.188  -3.470  -8.645
  618   1HG   ARG  83          2HG       ARG  83   4.013  -4.175  -8.224
  619   2HG   ARG  83          1HG       ARG  83   4.478  -5.869  -8.071
  620   1HD   ARG  83          2HD       ARG  83   5.675  -4.019  -6.087
  621   2HD   ARG  83          1HD       ARG  83   3.938  -4.265  -5.947
  622    HE   ARG  83           HE       ARG  83   6.011  -6.199  -5.374
  623   1HH1  ARG  83          2HH1      ARG  83   2.669  -5.746  -6.299
  624   2HH1  ARG  83          1HH1      ARG  83   2.165  -7.289  -5.700
  625   1HH2  ARG  83          1HH2      ARG  83   5.322  -8.214  -4.594
  626   2HH2  ARG  83          2HH2      ARG  83   3.661  -8.682  -4.737
  627    H    CYS  84           H        CYS  84   4.320  -6.882 -10.314
  628    HA   CYS  84           HA       CYS  84   5.234  -9.137  -8.796
  629   1HB   CYS  84          2HB       CYS  84   2.804  -8.472  -9.483
  630   2HB   CYS  84          1HB       CYS  84   3.181  -9.331 -10.976
  631    HG   CYS  84           HG       CYS  84   2.482 -10.667  -8.396
  632    H    MET  85           H        MET  85   6.029  -7.929 -11.885
  633    HA   MET  85           HA       MET  85   6.357 -10.083 -13.547
  634   1HB   MET  85          2HB       MET  85   8.149  -8.836 -14.625
  635   2HB   MET  85          1HB       MET  85   6.852  -7.739 -14.149
  636   1HG   MET  85          2HG       MET  85   8.562  -6.528 -13.245
  637   2HG   MET  85          1HG       MET  85   8.393  -7.664 -11.909
  638   1HE   MET  85          1HE       MET  85  12.026  -7.203 -11.881
  639   2HE   MET  85          2HE       MET  85  10.517  -6.303 -11.757
  640   3HE   MET  85          3HE       MET  85  11.539  -6.105 -13.179
  641    H    LYS  86           H        LYS  86   8.322  -9.283 -10.716
  642    HA   LYS  86           HA       LYS  86  10.604 -10.805 -11.189
  643   1HB   LYS  86          2HB       LYS  86   9.152  -9.944  -8.730
  644   2HB   LYS  86          1HB       LYS  86  10.367 -11.210  -8.558
  645   1HG   LYS  86          2HG       LYS  86  11.083  -8.791 -10.168
  646   2HG   LYS  86          1HG       LYS  86  11.033  -8.632  -8.413
  647   1HD   LYS  86          2HD       LYS  86  12.395 -11.003  -8.721
  648   2HD   LYS  86          1HD       LYS  86  12.960 -10.077 -10.112
  649   1HE   LYS  86          2HE       LYS  86  13.262  -8.137  -8.383
  650   2HE   LYS  86          1HE       LYS  86  13.219  -9.430  -7.184
  651   1HZ   LYS  86          1HZ       LYS  86  15.477  -8.979  -7.871
  652   2HZ   LYS  86          2HZ       LYS  86  15.074  -9.253  -9.499
  653   3HZ   LYS  86          3HZ       LYS  86  15.021 -10.532  -8.380
  654    H    ASP  87           H        ASP  87  11.192 -12.922 -10.833
  655    HA   ASP  87           HA       ASP  87   9.153 -14.863 -10.008
  656   1HB   ASP  87          2HB       ASP  87   9.184 -14.480 -12.595
  657   2HB   ASP  87          1HB       ASP  87  10.680 -15.410 -12.538
  658    H    ASP  88           H        ASP  88  12.497 -14.364 -11.143
  659    HA   ASP  88           HA       ASP  88  14.501 -15.197 -10.409
  660   1HB   ASP  88          2HB       ASP  88  13.273 -14.768  -8.110
  661   2HB   ASP  88          1HB       ASP  88  13.227 -16.529  -8.047
  662    H    SER  89           HN       SER  89  13.798 -16.560 -12.382
  663    HA   SER  89           HA       SER  89  13.578 -19.416 -11.646
  664   1HB   SER  89          2HB       SER  89  13.074 -19.690 -14.133
  665   2HB   SER  89          1HB       SER  89  11.849 -18.863 -13.175
  666    HG   SER  89           HG       SER  89  12.109 -17.436 -14.733
  Start of MODEL   33
    1   1H    MET   1          1H        MET   1  14.764   0.764 -15.580
    2   2H    MET   1          2H        MET   1  14.607   0.911 -17.266
    3   3H    MET   1          3H        MET   1  15.851   1.732 -16.453
    4    HA   MET   1           HA       MET   1  16.443  -0.399 -17.713
    5   1HB   MET   1          2HB       MET   1  18.062  -1.036 -15.896
    6   2HB   MET   1          1HB       MET   1  18.036   0.690 -16.249
    7   1HG   MET   1          2HG       MET   1  16.464   1.013 -14.327
    8   2HG   MET   1          1HG       MET   1  16.643  -0.698 -13.938
    9   1HE   MET   1          1HE       MET   1  18.310   0.783 -11.108
   10   2HE   MET   1          2HE       MET   1  16.813   1.023 -12.005
   11   3HE   MET   1          3HE       MET   1  18.026   2.300 -11.975
   12    H    ASN   2           H        ASN   2  13.823  -1.065 -17.264
   13    HA   ASN   2           HA       ASN   2  14.078  -3.711 -15.980
   14   1HB   ASN   2          2HB       ASN   2  11.933  -1.650 -15.485
   15   2HB   ASN   2          1HB       ASN   2  11.627  -3.372 -15.248
   16   1HD2  ASN   2          1HD2      ASN   2  13.604  -4.466 -13.927
   17   2HD2  ASN   2          2HD2      ASN   2  14.086  -3.594 -12.553
   18    H    ASP   3           H        ASP   3  11.823  -1.679 -17.874
   19    HA   ASP   3           HA       ASP   3  10.721  -2.053 -19.852
   20   1HB   ASP   3          2HB       ASP   3  13.062  -3.336 -20.284
   21   2HB   ASP   3          1HB       ASP   3  11.944  -4.694 -20.394
   22    H    ILE   4           H        ILE   4  10.324  -3.786 -17.112
   23    HA   ILE   4           HA       ILE   4   8.506  -5.809 -18.156
   24    HB   ILE   4           HB       ILE   4   8.212  -6.519 -15.868
   25   1HG1  ILE   4          2HG1      ILE   4   9.673  -5.155 -14.127
   26   2HG1  ILE   4          1HG1      ILE   4   9.409  -3.829 -15.262
   27   1HG2  ILE   4          1HG2      ILE   4  11.093  -5.890 -15.702
   28   2HG2  ILE   4          2HG2      ILE   4  10.583  -6.601 -17.235
   29   3HG2  ILE   4          3HG2      ILE   4  10.278  -7.455 -15.721
   30   1HD1  ILE   4          1HD1      ILE   4   7.684  -4.435 -13.264
   31   2HD1  ILE   4          2HD1      ILE   4   7.011  -5.429 -14.557
   32   3HD1  ILE   4          3HD1      ILE   4   7.178  -3.688 -14.780
   33    H    TYR   5           H        TYR   5   8.386  -2.586 -16.837
   34    HA   TYR   5           HA       TYR   5   5.647  -2.542 -16.064
   35   1HB   TYR   5          2HB       TYR   5   7.470  -0.280 -16.931
   36   2HB   TYR   5          1HB       TYR   5   5.891  -0.078 -16.169
   37    HD1  TYR   5           HD1      TYR   5   5.522  -1.302 -13.903
   38    HD2  TYR   5           HD2      TYR   5   9.389  -0.499 -15.587
   39    HE1  TYR   5           HE1      TYR   5   6.551  -1.567 -11.661
   40    HE2  TYR   5           HE2      TYR   5  10.421  -0.770 -13.351
   41    HH   TYR   5           HH       TYR   5   9.211  -0.464 -10.718
   42    H    LYS   6           H        LYS   6   7.335  -2.080 -19.100
   43    HA   LYS   6           HA       LYS   6   5.033  -1.024 -20.512
   44   1HB   LYS   6          2HB       LYS   6   7.462  -2.270 -21.804
   45   2HB   LYS   6          1HB       LYS   6   6.390  -1.036 -22.458
   46   1HG   LYS   6          2HG       LYS   6   8.442  -0.743 -20.258
   47   2HG   LYS   6          1HG       LYS   6   8.356   0.131 -21.787
   48   1HD   LYS   6          2HD       LYS   6   6.426   1.361 -21.082
   49   2HD   LYS   6          1HD       LYS   6   6.197   0.321 -19.675
   50   1HE   LYS   6          2HE       LYS   6   8.034   1.234 -18.537
   51   2HE   LYS   6          1HE       LYS   6   8.764   1.854 -20.018
   52   1HZ   LYS   6          1HZ       LYS   6   7.760   3.616 -18.686
   53   2HZ   LYS   6          2HZ       LYS   6   6.245   2.856 -18.800
   54   3HZ   LYS   6          3HZ       LYS   6   6.997   3.472 -20.194
   55    H    ALA   7           H        ALA   7   6.628  -4.122 -20.076
   56    HA   ALA   7           HA       ALA   7   4.976  -5.553 -21.950
   57   1HB   ALA   7          1HB       ALA   7   7.046  -6.584 -21.572
   58   2HB   ALA   7          2HB       ALA   7   5.935  -7.565 -20.614
   59   3HB   ALA   7          3HB       ALA   7   6.947  -6.355 -19.826
   60    H    ALA   8           H        ALA   8   4.750  -4.688 -18.559
   61    HA   ALA   8           HA       ALA   8   2.629  -6.604 -18.008
   62   1HB   ALA   8          1HB       ALA   8   3.870  -4.407 -16.338
   63   2HB   ALA   8          2HB       ALA   8   4.162  -6.143 -16.207
   64   3HB   ALA   8          3HB       ALA   8   2.587  -5.479 -15.773
   65    H    VAL   9           H        VAL   9   2.968  -3.137 -18.676
   66    HA   VAL   9           HA       VAL   9   0.356  -2.358 -17.928
   67    HB   VAL   9           HB       VAL   9   2.379  -0.864 -18.507
   68   1HG1  VAL   9          1HG1      VAL   9   2.782  -0.271 -20.715
   69   2HG1  VAL   9          2HG1      VAL   9   1.166  -0.738 -21.245
   70   3HG1  VAL   9          3HG1      VAL   9   2.375  -1.975 -20.907
   71   1HG2  VAL   9          1HG2      VAL   9  -0.343  -0.136 -19.628
   72   2HG2  VAL   9          2HG2      VAL   9   0.893   0.986 -19.059
   73   3HG2  VAL   9          3HG2      VAL   9   0.078  -0.083 -17.917
   74    H    GLU  10           H        GLU  10   1.549  -4.028 -20.748
   75    HA   GLU  10           HA       GLU  10  -0.868  -3.547 -22.298
   76   1HB   GLU  10          2HB       GLU  10   1.523  -5.326 -22.826
   77   2HB   GLU  10          1HB       GLU  10   0.201  -5.045 -23.960
   78   1HG   GLU  10          2HG       GLU  10   1.974  -2.869 -22.807
   79   2HG   GLU  10          1HG       GLU  10   2.180  -3.583 -24.405
   80    H    GLN  11           H        GLN  11   0.056  -5.690 -19.823
   81    HA   GLN  11           HA       GLN  11  -1.705  -7.845 -20.767
   82   1HB   GLN  11          2HB       GLN  11   0.103  -7.815 -18.346
   83   2HB   GLN  11          1HB       GLN  11  -0.713  -9.212 -19.045
   84   1HG   GLN  11          2HG       GLN  11   1.166  -7.545 -20.703
   85   2HG   GLN  11          1HG       GLN  11   1.786  -8.817 -19.650
   86   1HE2  GLN  11          1HE2      GLN  11   0.086  -8.182 -22.648
   87   2HE2  GLN  11          2HE2      GLN  11  -0.082  -9.805 -23.120
   88    H    LEU  12           H        LEU  12  -1.533  -5.326 -18.337
   89    HA   LEU  12           HA       LEU  12  -3.370  -6.380 -16.476
   90   1HB   LEU  12          2HB       LEU  12  -3.839  -3.898 -15.982
   91   2HB   LEU  12          1HB       LEU  12  -2.246  -4.537 -15.656
   92    HG   LEU  12           HG       LEU  12  -1.431  -3.513 -17.760
   93   1HD1  LEU  12          1HD1      LEU  12  -3.287  -3.422 -19.187
   94   2HD1  LEU  12          2HD1      LEU  12  -3.076  -1.735 -18.714
   95   3HD1  LEU  12          3HD1      LEU  12  -4.328  -2.715 -17.950
   96   1HD2  LEU  12          1HD2      LEU  12  -2.916  -1.454 -16.117
   97   2HD2  LEU  12          2HD2      LEU  12  -1.357  -1.282 -16.920
   98   3HD2  LEU  12          3HD2      LEU  12  -1.505  -2.312 -15.497
   99    H    THR  13           H        THR  13  -5.579  -5.730 -16.089
  100    HA   THR  13           HA       THR  13  -7.081  -5.402 -18.618
  101    HB   THR  13           HB       THR  13  -8.979  -6.284 -16.940
  102    HG1  THR  13           HG1      THR  13  -8.055  -7.808 -15.548
  103   1HG2  THR  13          1HG2      THR  13  -8.587  -7.430 -18.963
  104   2HG2  THR  13          2HG2      THR  13  -8.253  -8.639 -17.721
  105   3HG2  THR  13          3HG2      THR  13  -6.920  -7.810 -18.526
  106    H    ASP  14           H        ASP  14  -9.272  -4.376 -18.324
  107    HA   ASP  14           HA       ASP  14  -8.959  -1.745 -17.253
  108   1HB   ASP  14          2HB       ASP  14 -11.396  -3.211 -18.294
  109   2HB   ASP  14          1HB       ASP  14 -11.398  -1.511 -17.822
  110    H    GLU  15           H        GLU  15 -10.403  -4.726 -16.115
  111    HA   GLU  15           HA       GLU  15 -11.944  -3.693 -13.983
  112   1HB   GLU  15          2HB       GLU  15 -12.030  -5.958 -13.168
  113   2HB   GLU  15          1HB       GLU  15 -12.122  -6.005 -14.924
  114   1HG   GLU  15          2HG       GLU  15  -9.540  -6.292 -14.829
  115   2HG   GLU  15          1HG       GLU  15  -9.810  -6.742 -13.146
  116    H    GLN  16           H        GLN  16  -8.565  -4.767 -14.168
  117    HA   GLN  16           HA       GLN  16  -7.993  -4.610 -11.407
  118   1HB   GLN  16          2HB       GLN  16  -5.744  -4.900 -11.956
  119   2HB   GLN  16          1HB       GLN  16  -6.559  -5.629 -13.335
  120   1HG   GLN  16          2HG       GLN  16  -5.236  -4.283 -14.590
  121   2HG   GLN  16          1HG       GLN  16  -6.341  -2.996 -14.124
  122   1HE2  GLN  16          1HE2      GLN  16  -3.189  -4.468 -13.364
  123   2HE2  GLN  16          2HE2      GLN  16  -2.609  -3.157 -12.455
  124    H    LYS  17           H        LYS  17  -8.085  -2.156 -13.924
  125    HA   LYS  17           HA       LYS  17  -6.914  -0.107 -12.233
  126   1HB   LYS  17          2HB       LYS  17  -7.942  -0.248 -15.027
  127   2HB   LYS  17          1HB       LYS  17  -7.978   1.325 -14.230
  128   1HG   LYS  17          2HG       LYS  17  -5.805   1.514 -14.838
  129   2HG   LYS  17          1HG       LYS  17  -5.473   0.353 -13.552
  130   1HD   LYS  17          2HD       LYS  17  -4.558  -0.876 -15.241
  131   2HD   LYS  17          1HD       LYS  17  -6.231  -1.330 -15.556
  132   1HE   LYS  17          2HE       LYS  17  -5.137   1.182 -16.785
  133   2HE   LYS  17          1HE       LYS  17  -4.747  -0.376 -17.511
  134   1HZ   LYS  17          1HZ       LYS  17  -6.709   0.406 -18.543
  135   2HZ   LYS  17          2HZ       LYS  17  -7.438   0.784 -17.056
  136   3HZ   LYS  17          3HZ       LYS  17  -7.188  -0.838 -17.496
  137    H    ASN  18           H        ASN  18 -10.111  -1.215 -13.203
  138    HA   ASN  18           HA       ASN  18 -11.629   0.994 -12.288
  139   1HB   ASN  18          2HB       ASN  18 -12.171  -1.821 -13.038
  140   2HB   ASN  18          1HB       ASN  18 -13.330  -1.098 -11.922
  141   1HD2  ASN  18          1HD2      ASN  18 -12.551  -1.376 -15.219
  142   2HD2  ASN  18          2HD2      ASN  18 -13.478  -0.076 -15.795
  143    H    GLU  19           H        GLU  19 -10.545  -1.998 -10.694
  144    HA   GLU  19           HA       GLU  19 -11.849  -1.460  -8.196
  145   1HB   GLU  19          2HB       GLU  19  -9.474  -3.254  -8.773
  146   2HB   GLU  19          1HB       GLU  19 -10.448  -3.269  -7.303
  147   1HG   GLU  19          2HG       GLU  19 -11.743  -3.633  -9.997
  148   2HG   GLU  19          1HG       GLU  19 -10.995  -4.999  -9.173
  149    H    PHE  20           H        PHE  20  -8.571  -1.008  -9.459
  150    HA   PHE  20           HA       PHE  20  -7.355  -0.035  -7.108
  151   1HB   PHE  20          2HB       PHE  20  -6.756   0.243 -10.039
  152   2HB   PHE  20          1HB       PHE  20  -5.838   1.179  -8.866
  153    HD1  PHE  20           HD1      PHE  20  -3.869  -0.141  -9.796
  154    HD2  PHE  20           HD2      PHE  20  -7.062  -1.976  -7.586
  155    HE1  PHE  20           HE1      PHE  20  -2.433  -2.102  -9.351
  156    HE2  PHE  20           HE2      PHE  20  -5.621  -3.939  -7.136
  157    HZ   PHE  20           HZ       PHE  20  -3.305  -4.005  -8.017
  158    H    LYS  21           H        LYS  21  -9.035   1.654  -9.752
  159    HA   LYS  21           HA       LYS  21  -8.530   4.292  -8.877
  160   1HB   LYS  21          2HB       LYS  21  -9.380   3.720 -11.145
  161   2HB   LYS  21          1HB       LYS  21 -10.934   3.294 -10.428
  162   1HG   LYS  21          2HG       LYS  21 -10.938   5.610 -11.327
  163   2HG   LYS  21          1HG       LYS  21 -11.200   5.584  -9.583
  164   1HD   LYS  21          2HD       LYS  21  -8.996   6.311  -9.122
  165   2HD   LYS  21          1HD       LYS  21  -8.431   5.906 -10.743
  166   1HE   LYS  21          2HE       LYS  21 -10.622   7.933 -10.446
  167   2HE   LYS  21          1HE       LYS  21  -8.962   8.420 -10.104
  168   1HZ   LYS  21          1HZ       LYS  21  -8.313   7.625 -12.290
  169   2HZ   LYS  21          2HZ       LYS  21  -9.535   8.798 -12.419
  170   3HZ   LYS  21          3HZ       LYS  21  -9.909   7.153 -12.620
  171    H    ALA  22           H        ALA  22 -11.321   2.140  -8.309
  172    HA   ALA  22           HA       ALA  22 -12.770   3.974  -6.695
  173   1HB   ALA  22          1HB       ALA  22 -12.889   0.951  -6.577
  174   2HB   ALA  22          2HB       ALA  22 -13.759   1.933  -7.755
  175   3HB   ALA  22          3HB       ALA  22 -14.128   2.084  -6.037
  176    H    ALA  23           H        ALA  23 -10.509   1.342  -5.909
  177    HA   ALA  23           HA       ALA  23 -10.680   1.542  -3.090
  178   1HB   ALA  23          1HB       ALA  23  -8.383   0.589  -4.817
  179   2HB   ALA  23          2HB       ALA  23  -9.684  -0.410  -4.165
  180   3HB   ALA  23          3HB       ALA  23  -8.516   0.340  -3.076
  181    H    PHE  24           H        PHE  24  -8.958   3.430  -5.473
  182    HA   PHE  24           HA       PHE  24  -7.189   4.674  -3.529
  183   1HB   PHE  24          2HB       PHE  24  -6.758   4.244  -6.086
  184   2HB   PHE  24          1HB       PHE  24  -7.657   5.743  -6.299
  185    HD1  PHE  24           HD1      PHE  24  -4.644   4.218  -4.765
  186    HD2  PHE  24           HD2      PHE  24  -6.711   7.876  -5.669
  187    HE1  PHE  24           HE1      PHE  24  -2.610   5.512  -4.189
  188    HE2  PHE  24           HE2      PHE  24  -4.677   9.169  -5.090
  189    HZ   PHE  24           HZ       PHE  24  -2.626   7.986  -4.351
  190    H    ASP  25           H        ASP  25  -9.857   5.740  -5.659
  191    HA   ASP  25           HA       ASP  25 -10.088   8.368  -4.800
  192   1HB   ASP  25          2HB       ASP  25 -11.327   7.165  -6.709
  193   2HB   ASP  25          1HB       ASP  25 -12.511   6.714  -5.481
  194    H    ILE  26           H        ILE  26 -11.594   5.462  -3.354
  195    HA   ILE  26           HA       ILE  26 -13.278   6.770  -1.528
  196    HB   ILE  26           HB       ILE  26 -13.154   4.693  -0.170
  197   1HG1  ILE  26          2HG1      ILE  26 -11.077   3.879  -2.230
  198   2HG1  ILE  26          1HG1      ILE  26 -10.750   4.221  -0.534
  199   1HG2  ILE  26          1HG2      ILE  26 -13.603   3.183  -2.383
  200   2HG2  ILE  26          2HG2      ILE  26 -13.720   4.798  -3.079
  201   3HG2  ILE  26          3HG2      ILE  26 -14.772   4.337  -1.741
  202   1HD1  ILE  26          1HD1      ILE  26 -12.484   2.403  -0.002
  203   2HD1  ILE  26          2HD1      ILE  26 -10.939   1.858  -0.653
  204   3HD1  ILE  26          3HD1      ILE  26 -12.354   1.946  -1.701
  205    H    PHE  27           H        PHE  27  -9.826   6.097  -1.369
  206    HA   PHE  27           HA       PHE  27  -9.625   7.026   1.389
  207   1HB   PHE  27          2HB       PHE  27  -7.739   5.817  -0.592
  208   2HB   PHE  27          1HB       PHE  27  -7.074   6.764   0.740
  209    HD1  PHE  27           HD1      PHE  27  -7.417   6.072   3.080
  210    HD2  PHE  27           HD2      PHE  27  -8.886   3.710  -0.192
  211    HE1  PHE  27           HE1      PHE  27  -7.765   4.158   4.617
  212    HE2  PHE  27           HE2      PHE  27  -9.232   1.795   1.344
  213    HZ   PHE  27           HZ       PHE  27  -8.673   2.019   3.749
  214    H    ILE  28           H        ILE  28  -9.168   8.273  -1.856
  215    HA   ILE  28           HA       ILE  28  -7.768  10.657  -0.888
  216    HB   ILE  28           HB       ILE  28  -8.669  10.093  -3.717
  217   1HG1  ILE  28          2HG1      ILE  28  -7.277   8.256  -3.381
  218   2HG1  ILE  28          1HG1      ILE  28  -6.124   9.471  -3.905
  219   1HG2  ILE  28          1HG2      ILE  28  -6.879  12.068  -2.376
  220   2HG2  ILE  28          2HG2      ILE  28  -7.962  12.285  -3.751
  221   3HG2  ILE  28          3HG2      ILE  28  -6.406  11.481  -3.972
  222   1HD1  ILE  28          1HD1      ILE  28  -5.907  10.007  -1.351
  223   2HD1  ILE  28          2HD1      ILE  28  -5.075   8.596  -2.005
  224   3HD1  ILE  28          3HD1      ILE  28  -6.598   8.398  -1.139
  225    H    GLN  29           H        GLN  29 -10.696   9.978  -0.286
  226    HA   GLN  29           HA       GLN  29 -12.366  11.793  -1.675
  227   1HB   GLN  29          2HB       GLN  29 -13.860  11.617   0.341
  228   2HB   GLN  29          1HB       GLN  29 -13.402  10.066  -0.359
  229   1HG   GLN  29          2HG       GLN  29 -12.055   9.496   1.428
  230   2HG   GLN  29          1HG       GLN  29 -11.656  11.172   1.800
  231   1HE2  GLN  29          1HE2      GLN  29 -12.746  12.058   3.569
  232   2HE2  GLN  29          2HE2      GLN  29 -14.180  11.434   4.229
  233    H    ASP  30           H        ASP  30 -10.169  12.174   1.030
  234    HA   ASP  30           HA       ASP  30 -10.294  15.061   0.778
  235   1HB   ASP  30          2HB       ASP  30 -12.052  14.085   2.563
  236   2HB   ASP  30          1HB       ASP  30 -10.617  14.122   3.587
  237    H    ALA  31           H        ALA  31  -8.261  13.309   0.127
  238    HA   ALA  31           HA       ALA  31  -6.369  12.923   2.232
  239   1HB   ALA  31          1HB       ALA  31  -6.033  12.965  -0.773
  240   2HB   ALA  31          2HB       ALA  31  -6.237  11.543   0.250
  241   3HB   ALA  31          3HB       ALA  31  -4.764  12.507   0.362
  242    H    GLU  32           H        GLU  32  -4.274  13.949   2.383
  243    HA   GLU  32           HA       GLU  32  -4.464  16.808   2.420
  244   1HB   GLU  32          2HB       GLU  32  -2.135  14.944   2.924
  245   2HB   GLU  32          1HB       GLU  32  -2.061  16.693   3.142
  246   1HG   GLU  32          2HG       GLU  32  -3.247  16.622   5.078
  247   2HG   GLU  32          1HG       GLU  32  -4.377  15.424   4.449
  248    H    ASP  33           H        ASP  33  -2.479  14.511   0.555
  249    HA   ASP  33           HA       ASP  33  -1.957  16.672  -1.406
  250   1HB   ASP  33          2HB       ASP  33  -0.046  15.377  -0.021
  251   2HB   ASP  33          1HB       ASP  33  -0.219  14.259  -1.374
  252    H    GLY  34           H        GLY  34  -4.271  14.771  -1.274
  253   1HA   GLY  34          2HA       GLY  34  -5.557  13.566  -2.755
  254   2HA   GLY  34          1HA       GLY  34  -4.481  14.147  -4.021
  255    H    CYS  35           H        CYS  35  -3.327  12.294  -1.268
  256    HA   CYS  35           HA       CYS  35  -3.132   9.838  -2.877
  257   1HB   CYS  35          2HB       CYS  35  -0.760  11.096  -1.477
  258   2HB   CYS  35          1HB       CYS  35  -0.764   9.578  -2.365
  259    HG   CYS  35           HG       CYS  35  -0.034  11.906  -3.755
  260    H    ILE  36           H        ILE  36  -1.970   8.099  -1.384
  261    HA   ILE  36           HA       ILE  36  -3.355   8.239   1.227
  262    HB   ILE  36           HB       ILE  36  -3.237   5.787   1.254
  263   1HG1  ILE  36          2HG1      ILE  36  -2.617   5.088  -1.377
  264   2HG1  ILE  36          1HG1      ILE  36  -1.382   6.270  -0.945
  265   1HG2  ILE  36          1HG2      ILE  36  -4.310   6.534  -1.457
  266   2HG2  ILE  36          2HG2      ILE  36  -5.064   7.172   0.005
  267   3HG2  ILE  36          3HG2      ILE  36  -4.990   5.430  -0.262
  268   1HD1  ILE  36          1HD1      ILE  36  -1.748   4.549   1.303
  269   2HD1  ILE  36          2HD1      ILE  36  -0.324   4.714   0.276
  270   3HD1  ILE  36          3HD1      ILE  36  -1.570   3.535  -0.132
  271    H    SER  37           H        SER  37  -2.202   6.827   2.933
  272    HA   SER  37           HA       SER  37   0.566   7.773   3.087
  273   1HB   SER  37          2HB       SER  37  -1.305   7.888   4.976
  274   2HB   SER  37          1HB       SER  37  -0.725   6.260   5.316
  275    HG   SER  37           HG       SER  37   0.627   8.724   5.432
  276    H    THR  38           H        THR  38   2.310   6.447   3.207
  277    HA   THR  38           HA       THR  38   2.285   3.937   1.984
  278    HB   THR  38           HB       THR  38   4.544   3.624   3.164
  279    HG1  THR  38           HG1      THR  38   4.849   4.923   4.766
  280   1HG2  THR  38          1HG2      THR  38   4.097   6.193   1.621
  281   2HG2  THR  38          2HG2      THR  38   4.240   4.596   0.889
  282   3HG2  THR  38          3HG2      THR  38   5.611   5.297   1.748
  283    H    LYS  39           H        LYS  39   1.929   4.823   5.373
  284    HA   LYS  39           HA       LYS  39   2.165   2.232   6.497
  285   1HB   LYS  39          2HB       LYS  39   1.246   4.897   7.389
  286   2HB   LYS  39          1HB       LYS  39   0.548   3.526   8.254
  287   1HG   LYS  39          2HG       LYS  39   3.514   3.924   7.782
  288   2HG   LYS  39          1HG       LYS  39   2.678   4.332   9.282
  289   1HD   LYS  39          2HD       LYS  39   1.804   1.780   8.885
  290   2HD   LYS  39          1HD       LYS  39   3.428   1.683   8.204
  291   1HE   LYS  39          2HE       LYS  39   4.233   2.838  10.351
  292   2HE   LYS  39          1HE       LYS  39   2.635   2.488  11.009
  293   1HZ   LYS  39          1HZ       LYS  39   2.992   0.148  10.580
  294   2HZ   LYS  39          2HZ       LYS  39   4.244   0.759  11.554
  295   3HZ   LYS  39          3HZ       LYS  39   4.513   0.470   9.901
  296    H    GLU  40           H        GLU  40  -0.638   4.086   5.345
  297    HA   GLU  40           HA       GLU  40  -2.468   1.941   6.067
  298   1HB   GLU  40          2HB       GLU  40  -4.229   3.439   5.387
  299   2HB   GLU  40          1HB       GLU  40  -3.088   4.333   6.382
  300   1HG   GLU  40          2HG       GLU  40  -2.625   5.759   4.699
  301   2HG   GLU  40          1HG       GLU  40  -2.331   4.432   3.577
  302    H    LEU  41           H        LEU  41  -0.377   1.701   3.789
  303    HA   LEU  41           HA       LEU  41  -2.154   1.282   1.499
  304   1HB   LEU  41          2HB       LEU  41   0.061   2.366   1.195
  305   2HB   LEU  41          1HB       LEU  41   0.831   0.889   1.727
  306    HG   LEU  41           HG       LEU  41   0.344  -0.230  -0.255
  307   1HD1  LEU  41          1HD1      LEU  41  -2.081   0.197  -0.238
  308   2HD1  LEU  41          2HD1      LEU  41  -1.411   0.486  -1.843
  309   3HD1  LEU  41          3HD1      LEU  41  -1.801   1.847  -0.794
  310   1HD2  LEU  41          1HD2      LEU  41   1.829   1.840  -0.545
  311   2HD2  LEU  41          2HD2      LEU  41   0.423   2.617  -1.271
  312   3HD2  LEU  41          3HD2      LEU  41   1.118   1.178  -2.016
  313    H    GLY  42           H        GLY  42  -2.292  -0.390   3.965
  314   1HA   GLY  42          2HA       GLY  42  -1.663  -3.035   2.792
  315   2HA   GLY  42          1HA       GLY  42  -1.666  -2.706   4.521
  316    H    LYS  43           H        LYS  43  -4.058  -1.066   4.494
  317    HA   LYS  43           HA       LYS  43  -6.031  -3.136   4.703
  318   1HB   LYS  43          2HB       LYS  43  -7.530  -1.367   5.438
  319   2HB   LYS  43          1HB       LYS  43  -5.963  -1.182   6.225
  320   1HG   LYS  43          2HG       LYS  43  -5.331   0.515   4.516
  321   2HG   LYS  43          1HG       LYS  43  -6.939   0.369   3.807
  322   1HD   LYS  43          2HD       LYS  43  -7.145   2.227   5.241
  323   2HD   LYS  43          1HD       LYS  43  -7.809   0.900   6.193
  324   1HE   LYS  43          2HE       LYS  43  -5.304   0.646   7.005
  325   2HE   LYS  43          1HE       LYS  43  -5.192   2.331   6.502
  326   1HZ   LYS  43          1HZ       LYS  43  -7.127   2.813   7.904
  327   2HZ   LYS  43          2HZ       LYS  43  -5.824   2.200   8.806
  328   3HZ   LYS  43          3HZ       LYS  43  -7.145   1.200   8.431
  329    H    VAL  44           H        VAL  44  -5.137  -0.808   2.249
  330    HA   VAL  44           HA       VAL  44  -7.584  -0.796   0.797
  331    HB   VAL  44           HB       VAL  44  -6.229   0.079  -1.077
  332   1HG1  VAL  44          1HG1      VAL  44  -5.186   2.019   0.255
  333   2HG1  VAL  44          2HG1      VAL  44  -5.758   1.181   1.698
  334   3HG1  VAL  44          3HG1      VAL  44  -6.912   1.735   0.482
  335   1HG2  VAL  44          1HG2      VAL  44  -3.893  -0.498   0.778
  336   2HG2  VAL  44          2HG2      VAL  44  -3.795   0.399  -0.738
  337   3HG2  VAL  44          3HG2      VAL  44  -4.221  -1.311  -0.754
  338    H    MET  45           H        MET  45  -4.765  -2.912   0.805
  339    HA   MET  45           HA       MET  45  -5.377  -4.363  -1.563
  340   1HB   MET  45          2HB       MET  45  -3.895  -5.475   0.826
  341   2HB   MET  45          1HB       MET  45  -3.744  -5.960  -0.861
  342   1HG   MET  45          2HG       MET  45  -3.196  -3.095  -0.275
  343   2HG   MET  45          1HG       MET  45  -2.017  -4.254   0.335
  344   1HE   MET  45          1HE       MET  45  -4.082  -2.945  -2.361
  345   2HE   MET  45          2HE       MET  45  -4.210  -4.509  -3.163
  346   3HE   MET  45          3HE       MET  45  -3.246  -3.228  -3.896
  347    H    ARG  46           H        ARG  46  -6.272  -4.717   1.822
  348    HA   ARG  46           HA       ARG  46  -7.522  -7.257   1.633
  349   1HB   ARG  46          2HB       ARG  46  -7.604  -4.991   3.579
  350   2HB   ARG  46          1HB       ARG  46  -8.879  -6.206   3.665
  351   1HG   ARG  46          2HG       ARG  46  -6.574  -7.728   3.372
  352   2HG   ARG  46          1HG       ARG  46  -6.058  -6.413   4.426
  353   1HD   ARG  46          2HD       ARG  46  -6.905  -8.105   5.876
  354   2HD   ARG  46          1HD       ARG  46  -8.149  -6.863   5.807
  355    HE   ARG  46           HE       ARG  46  -8.717  -8.757   3.809
  356   1HH1  ARG  46          2HH1      ARG  46  -8.534  -8.533   7.290
  357   2HH1  ARG  46          1HH1      ARG  46  -9.731  -9.754   7.556
  358   1HH2  ARG  46          1HH2      ARG  46 -10.282 -10.355   4.180
  359   2HH2  ARG  46          2HH2      ARG  46 -10.720 -10.785   5.799
  360    H    MET  47           H        MET  47  -8.670  -3.949   1.140
  361    HA   MET  47           HA       MET  47 -11.434  -4.606   0.832
  362   1HB   MET  47          2HB       MET  47  -9.737  -2.215   0.211
  363   2HB   MET  47          1HB       MET  47 -11.350  -2.324  -0.493
  364   1HG   MET  47          2HG       MET  47 -10.952  -2.833   2.447
  365   2HG   MET  47          1HG       MET  47 -11.070  -1.181   1.842
  366   1HE   MET  47          1HE       MET  47 -13.363  -0.303   0.376
  367   2HE   MET  47          2HE       MET  47 -12.863  -0.036   2.045
  368   3HE   MET  47          3HE       MET  47 -14.542  -0.433   1.689
  369    H    LEU  48           H        LEU  48  -8.691  -4.329  -1.382
  370    HA   LEU  48           HA       LEU  48 -10.104  -4.504  -3.824
  371   1HB   LEU  48          2HB       LEU  48  -7.439  -4.295  -3.046
  372   2HB   LEU  48          1HB       LEU  48  -7.520  -5.846  -3.851
  373    HG   LEU  48           HG       LEU  48  -6.870  -4.164  -5.451
  374   1HD1  LEU  48          1HD1      LEU  48  -8.537  -5.969  -6.102
  375   2HD1  LEU  48          2HD1      LEU  48  -8.530  -4.543  -7.140
  376   3HD1  LEU  48          3HD1      LEU  48  -9.800  -4.750  -5.932
  377   1HD2  LEU  48          1HD2      LEU  48  -8.083  -2.326  -4.033
  378   2HD2  LEU  48          2HD2      LEU  48  -9.477  -2.712  -5.042
  379   3HD2  LEU  48          3HD2      LEU  48  -7.987  -2.126  -5.783
  380    H    GLY  49           H        GLY  49  -8.680  -6.985  -1.718
  381   1HA   GLY  49          2HA       GLY  49 -10.247  -9.029  -1.626
  382   2HA   GLY  49          1HA       GLY  49  -9.929  -9.104  -3.358
  383    H    GLN  50           H        GLN  50  -7.843  -8.462  -0.531
  384    HA   GLN  50           HA       GLN  50  -6.284 -10.883  -1.109
  385   1HB   GLN  50          2HB       GLN  50  -5.299  -8.063  -1.313
  386   2HB   GLN  50          1HB       GLN  50  -4.208  -9.297  -0.681
  387   1HG   GLN  50          2HG       GLN  50  -3.749  -9.811  -2.829
  388   2HG   GLN  50          1HG       GLN  50  -5.360 -10.525  -2.890
  389   1HE2  GLN  50          1HE2      GLN  50  -3.801  -7.276  -3.224
  390   2HE2  GLN  50          2HE2      GLN  50  -4.851  -6.747  -4.449
  391    H    ASN  51           H        ASN  51  -4.415 -10.985   0.613
  392    HA   ASN  51           HA       ASN  51  -5.077  -9.810   3.182
  393   1HB   ASN  51          2HB       ASN  51  -6.579 -11.915   2.791
  394   2HB   ASN  51          1HB       ASN  51  -5.098 -12.815   3.118
  395   1HD2  ASN  51          1HD2      ASN  51  -4.731 -13.245   5.300
  396   2HD2  ASN  51          2HD2      ASN  51  -5.386 -12.355   6.588
  397    HA   PRO  52           HA       PRO  52  -0.623 -10.993   2.599
  398   1HB   PRO  52          2HB       PRO  52   0.379  -8.450   2.572
  399   2HB   PRO  52          1HB       PRO  52  -0.173  -9.294   1.121
  400   1HG   PRO  52          2HG       PRO  52  -1.445  -7.085   2.608
  401   2HG   PRO  52          1HG       PRO  52  -1.622  -7.545   0.910
  402   1HD   PRO  52          2HD       PRO  52  -3.451  -8.099   3.026
  403   2HD   PRO  52          1HD       PRO  52  -3.515  -8.739   1.367
  404    H    THR  53           H        THR  53   1.312  -9.667   3.899
  405    HA   THR  53           HA       THR  53   0.398  -9.564   6.712
  406    HB   THR  53           HB       THR  53   2.442 -10.458   7.400
  407    HG1  THR  53           HG1      THR  53   4.268  -9.943   6.493
  408   1HG2  THR  53          1HG2      THR  53   2.033 -11.598   4.626
  409   2HG2  THR  53          2HG2      THR  53   1.249 -12.156   6.106
  410   3HG2  THR  53          3HG2      THR  53   2.991 -12.348   5.902
  411    HA   PRO  54           HA       PRO  54   1.714  -5.376   7.033
  412   1HB   PRO  54          2HB       PRO  54   3.137  -5.314   9.377
  413   2HB   PRO  54          1HB       PRO  54   1.373  -5.414   9.290
  414   1HG   PRO  54          2HG       PRO  54   3.363  -7.552   9.879
  415   2HG   PRO  54          1HG       PRO  54   1.719  -7.339  10.504
  416   1HD   PRO  54          2HD       PRO  54   2.412  -9.141   8.510
  417   2HD   PRO  54          1HD       PRO  54   0.772  -8.492   8.748
  418    H    GLU  55           H        GLU  55   4.238  -7.785   7.306
  419    HA   GLU  55           HA       GLU  55   6.412  -5.924   6.781
  420   1HB   GLU  55          2HB       GLU  55   6.554  -8.937   6.604
  421   2HB   GLU  55          1HB       GLU  55   7.862  -7.801   6.930
  422   1HG   GLU  55          2HG       GLU  55   6.400  -7.145   9.014
  423   2HG   GLU  55          1HG       GLU  55   5.661  -8.725   8.753
  424    H    GLU  56           H        GLU  56   4.452  -8.295   5.054
  425    HA   GLU  56           HA       GLU  56   5.915  -8.340   2.625
  426   1HB   GLU  56          2HB       GLU  56   4.018  -9.920   3.466
  427   2HB   GLU  56          1HB       GLU  56   2.938  -8.738   2.730
  428   1HG   GLU  56          2HG       GLU  56   3.767  -9.128   0.573
  429   2HG   GLU  56          1HG       GLU  56   5.281  -9.808   1.174
  430    H    LEU  57           H        LEU  57   2.840  -6.652   3.419
  431    HA   LEU  57           HA       LEU  57   2.678  -5.169   1.045
  432   1HB   LEU  57          2HB       LEU  57   1.111  -3.743   2.179
  433   2HB   LEU  57          1HB       LEU  57   0.815  -5.406   2.621
  434    HG   LEU  57           HG       LEU  57   2.397  -4.673   4.687
  435   1HD1  LEU  57          1HD1      LEU  57   1.304  -2.339   5.286
  436   2HD1  LEU  57          2HD1      LEU  57   1.187  -2.179   3.533
  437   3HD1  LEU  57          3HD1      LEU  57   2.761  -2.405   4.297
  438   1HD2  LEU  57          1HD2      LEU  57   0.217  -4.194   5.894
  439   2HD2  LEU  57          2HD2      LEU  57   0.230  -5.696   4.968
  440   3HD2  LEU  57          3HD2      LEU  57  -0.585  -4.272   4.326
  441    H    GLN  58           H        GLN  58   4.459  -4.532   4.021
  442    HA   GLN  58           HA       GLN  58   5.067  -1.824   3.666
  443   1HB   GLN  58          2HB       GLN  58   5.851  -3.843   5.447
  444   2HB   GLN  58          1HB       GLN  58   7.349  -3.261   4.720
  445   1HG   GLN  58          2HG       GLN  58   5.221  -1.505   5.984
  446   2HG   GLN  58          1HG       GLN  58   6.755  -1.948   6.733
  447   1HE2  GLN  58          1HE2      GLN  58   5.247   0.157   4.369
  448   2HE2  GLN  58          2HE2      GLN  58   6.655   1.000   3.937
  449    H    GLU  59           H        GLU  59   6.881  -4.692   2.566
  450    HA   GLU  59           HA       GLU  59   8.972  -3.288   1.284
  451   1HB   GLU  59          2HB       GLU  59   7.862  -6.070   0.971
  452   2HB   GLU  59          1HB       GLU  59   9.146  -5.481  -0.085
  453   1HG   GLU  59          2HG       GLU  59   9.354  -5.276   2.923
  454   2HG   GLU  59          1HG       GLU  59   9.873  -6.720   2.055
  455    H    MET  60           H        MET  60   5.793  -4.353   0.145
  456    HA   MET  60           HA       MET  60   6.176  -3.812  -2.610
  457   1HB   MET  60          2HB       MET  60   3.693  -3.909  -0.890
  458   2HB   MET  60          1HB       MET  60   3.635  -3.615  -2.628
  459   1HG   MET  60          2HG       MET  60   4.376  -5.754  -3.154
  460   2HG   MET  60          1HG       MET  60   5.200  -5.962  -1.609
  461   1HE   MET  60          1HE       MET  60   2.001  -5.690  -3.544
  462   2HE   MET  60          2HE       MET  60   0.941  -6.881  -2.795
  463   3HE   MET  60          3HE       MET  60   2.435  -7.404  -3.570
  464    H    ILE  61           H        ILE  61   4.937  -1.815   0.064
  465    HA   ILE  61           HA       ILE  61   4.134   0.445  -1.358
  466    HB   ILE  61           HB       ILE  61   5.325   0.172   1.405
  467   1HG1  ILE  61          2HG1      ILE  61   2.490   0.881   0.892
  468   2HG1  ILE  61          1HG1      ILE  61   2.967  -0.763   0.476
  469   1HG2  ILE  61          1HG2      ILE  61   4.163   2.437   1.733
  470   2HG2  ILE  61          2HG2      ILE  61   4.157   2.560  -0.027
  471   3HG2  ILE  61          3HG2      ILE  61   5.686   2.444   0.845
  472   1HD1  ILE  61          1HD1      ILE  61   3.638   0.482   3.144
  473   2HD1  ILE  61          2HD1      ILE  61   3.695  -1.220   2.693
  474   3HD1  ILE  61          3HD1      ILE  61   2.140  -0.408   2.870
  475    H    ASP  62           H        ASP  62   7.184   0.273   0.487
  476    HA   ASP  62           HA       ASP  62   8.430   2.494  -0.597
  477   1HB   ASP  62          2HB       ASP  62   9.570  -0.073   0.502
  478   2HB   ASP  62          1HB       ASP  62  10.600   1.260  -0.021
  479    H    GLU  63           H        GLU  63   8.268  -0.790  -1.909
  480    HA   GLU  63           HA       GLU  63  10.230  -0.517  -3.931
  481   1HB   GLU  63          2HB       GLU  63   7.943  -2.366  -3.436
  482   2HB   GLU  63          1HB       GLU  63   8.630  -2.324  -5.060
  483   1HG   GLU  63          2HG       GLU  63  10.524  -2.474  -2.751
  484   2HG   GLU  63          1HG       GLU  63   9.623  -3.930  -3.173
  485    H    VAL  64           H        VAL  64   6.709   0.074  -3.978
  486    HA   VAL  64           HA       VAL  64   6.778   0.881  -6.766
  487    HB   VAL  64           HB       VAL  64   4.396   1.330  -6.524
  488   1HG1  VAL  64          1HG1      VAL  64   5.407  -1.043  -6.731
  489   2HG1  VAL  64          2HG1      VAL  64   3.711  -0.901  -6.274
  490   3HG1  VAL  64          3HG1      VAL  64   4.929  -1.236  -5.045
  491   1HG2  VAL  64          1HG2      VAL  64   4.730   0.565  -3.612
  492   2HG2  VAL  64          2HG2      VAL  64   3.245   1.072  -4.412
  493   3HG2  VAL  64          3HG2      VAL  64   4.557   2.227  -4.178
  494    H    ASP  65           H        ASP  65   7.145   2.494  -3.712
  495    HA   ASP  65           HA       ASP  65   6.189   5.056  -4.519
  496   1HB   ASP  65          2HB       ASP  65   6.967   4.004  -2.123
  497   2HB   ASP  65          1HB       ASP  65   8.351   5.024  -2.512
  498    H    GLU  66           H        GLU  66   7.055   5.338  -6.589
  499    HA   GLU  66           HA       GLU  66   9.846   5.335  -7.173
  500   1HB   GLU  66          2HB       GLU  66   7.454   6.502  -8.595
  501   2HB   GLU  66          1HB       GLU  66   9.094   6.662  -9.221
  502   1HG   GLU  66          2HG       GLU  66   9.172   4.497  -9.891
  503   2HG   GLU  66          1HG       GLU  66   8.425   3.919  -8.403
  504    H    ASP  67           H        ASP  67   7.669   7.778  -5.899
  505    HA   ASP  67           HA       ASP  67   9.484   9.976  -6.430
  506   1HB   ASP  67          2HB       ASP  67   7.118   9.958  -4.543
  507   2HB   ASP  67          1HB       ASP  67   7.912  11.364  -5.245
  508    H    GLY  68           H        GLY  68   8.399   8.181  -3.542
  509   1HA   GLY  68          2HA       GLY  68   9.529   7.708  -1.571
  510   2HA   GLY  68          1HA       GLY  68  10.964   8.474  -2.251
  511    H    SER  69           H        SER  69   7.733   9.877  -1.911
  512    HA   SER  69           HA       SER  69   8.855  12.165  -0.502
  513   1HB   SER  69          2HB       SER  69   5.971  12.168  -0.889
  514   2HB   SER  69          1HB       SER  69   7.172  13.322  -1.452
  515    HG   SER  69           HG       SER  69   5.885  11.420  -2.818
  516    H    GLY  70           H        GLY  70   6.182   9.853  -0.078
  517   1HA   GLY  70          2HA       GLY  70   6.444   9.027   2.472
  518   2HA   GLY  70          1HA       GLY  70   5.763  10.638   2.693
  519    H    THR  71           H        THR  71   4.209  10.574   0.233
  520    HA   THR  71           HA       THR  71   2.030   8.798   1.126
  521    HB   THR  71           HB       THR  71   0.506  10.280  -0.025
  522    HG1  THR  71           HG1      THR  71   2.782  11.771  -0.826
  523   1HG2  THR  71          1HG2      THR  71   0.975  12.423   1.173
  524   2HG2  THR  71          2HG2      THR  71   2.577  11.805   1.575
  525   3HG2  THR  71          3HG2      THR  71   1.139  11.002   2.205
  526    H    VAL  72           H        VAL  72   0.841   7.591  -0.418
  527    HA   VAL  72           HA       VAL  72   2.454   6.841  -2.764
  528    HB   VAL  72           HB       VAL  72   0.085   5.387  -1.574
  529   1HG1  VAL  72          1HG1      VAL  72   0.716   3.576  -2.987
  530   2HG1  VAL  72          2HG1      VAL  72   2.264   4.323  -3.378
  531   3HG1  VAL  72          3HG1      VAL  72   0.769   5.006  -4.019
  532   1HG2  VAL  72          1HG2      VAL  72   1.707   3.931  -0.496
  533   2HG2  VAL  72          2HG2      VAL  72   2.045   5.591  -0.011
  534   3HG2  VAL  72          3HG2      VAL  72   3.045   4.809  -1.235
  535    H    ASP  73           H        ASP  73   1.903   7.601  -4.676
  536    HA   ASP  73           HA       ASP  73  -0.673   8.894  -5.097
  537   1HB   ASP  73          2HB       ASP  73   1.566   8.440  -7.091
  538   2HB   ASP  73          1HB       ASP  73   0.221   9.561  -7.255
  539    H    PHE  74           H        PHE  74  -1.767   8.404  -7.283
  540    HA   PHE  74           HA       PHE  74  -2.696   5.726  -7.263
  541   1HB   PHE  74          2HB       PHE  74  -3.876   7.824  -8.187
  542   2HB   PHE  74          1HB       PHE  74  -2.921   7.568  -9.646
  543    HD1  PHE  74           HD1      PHE  74  -4.609   6.931 -11.185
  544    HD2  PHE  74           HD2      PHE  74  -4.297   4.920  -7.405
  545    HE1  PHE  74           HE1      PHE  74  -6.231   5.223 -11.959
  546    HE2  PHE  74           HE2      PHE  74  -5.915   3.212  -8.178
  547    HZ   PHE  74           HZ       PHE  74  -6.885   3.360 -10.457
  548    H    ASP  75           H        ASP  75  -0.159   7.360  -9.085
  549    HA   ASP  75           HA       ASP  75   0.274   5.341 -11.042
  550   1HB   ASP  75          2HB       ASP  75   2.162   7.428  -9.912
  551   2HB   ASP  75          1HB       ASP  75   2.475   6.448 -11.339
  552    H    GLU  76           H        GLU  76   1.622   5.993  -7.826
  553    HA   GLU  76           HA       GLU  76   3.469   3.771  -7.886
  554   1HB   GLU  76          2HB       GLU  76   2.508   5.099  -5.361
  555   2HB   GLU  76          1HB       GLU  76   4.088   4.400  -5.709
  556   1HG   GLU  76          2HG       GLU  76   4.428   6.233  -7.414
  557   2HG   GLU  76          1HG       GLU  76   2.936   6.972  -6.828
  558    H    PHE  77           H        PHE  77   0.143   4.259  -7.091
  559    HA   PHE  77           HA       PHE  77  -0.180   1.951  -5.398
  560   1HB   PHE  77          2HB       PHE  77  -1.647   3.913  -5.189
  561   2HB   PHE  77          1HB       PHE  77  -2.215   3.680  -6.839
  562    HD1  PHE  77           HD1      PHE  77  -2.215   2.261  -3.406
  563    HD2  PHE  77           HD2      PHE  77  -3.831   1.995  -7.385
  564    HE1  PHE  77           HE1      PHE  77  -3.962   0.697  -2.596
  565    HE2  PHE  77           HE2      PHE  77  -5.577   0.427  -6.567
  566    HZ   PHE  77           HZ       PHE  77  -5.640  -0.220  -4.174
  567    H    LEU  78           H        LEU  78  -0.682   2.685  -8.839
  568    HA   LEU  78           HA       LEU  78  -1.904   0.128  -9.402
  569   1HB   LEU  78          2HB       LEU  78  -0.878   2.343 -11.152
  570   2HB   LEU  78          1HB       LEU  78  -1.537   0.855 -11.798
  571    HG   LEU  78           HG       LEU  78  -3.304   2.134  -9.844
  572   1HD1  LEU  78          1HD1      LEU  78  -1.964   3.815 -11.737
  573   2HD1  LEU  78          2HD1      LEU  78  -3.241   4.242 -10.602
  574   3HD1  LEU  78          3HD1      LEU  78  -3.655   3.668 -12.217
  575   1HD2  LEU  78          1HD2      LEU  78  -3.688   0.246 -11.611
  576   2HD2  LEU  78          2HD2      LEU  78  -3.869   1.582 -12.750
  577   3HD2  LEU  78          3HD2      LEU  78  -4.954   1.451 -11.365
  578    H    VAL  79           H        VAL  79   1.354   1.503  -9.694
  579    HA   VAL  79           HA       VAL  79   2.507  -0.460 -11.327
  580    HB   VAL  79           HB       VAL  79   4.671   0.096 -10.126
  581   1HG1  VAL  79          1HG1      VAL  79   4.423   1.321 -12.066
  582   2HG1  VAL  79          2HG1      VAL  79   4.391   2.631 -10.886
  583   3HG1  VAL  79          3HG1      VAL  79   2.882   2.012 -11.557
  584   1HG2  VAL  79          1HG2      VAL  79   4.704   1.845  -8.518
  585   2HG2  VAL  79          2HG2      VAL  79   3.424   0.753  -7.991
  586   3HG2  VAL  79          3HG2      VAL  79   3.016   2.253  -8.820
  587    H    MET  80           H        MET  80   1.580  -0.601  -7.975
  588    HA   MET  80           HA       MET  80   3.140  -2.566  -6.870
  589   1HB   MET  80          2HB       MET  80   0.391  -1.649  -6.495
  590   2HB   MET  80          1HB       MET  80   0.612  -3.345  -6.063
  591   1HG   MET  80          2HG       MET  80   2.813  -2.354  -4.903
  592   2HG   MET  80          1HG       MET  80   1.812  -0.903  -4.843
  593   1HE   MET  80          1HE       MET  80  -0.630  -1.298  -2.258
  594   2HE   MET  80          2HE       MET  80  -1.064  -1.368  -3.964
  595   3HE   MET  80          3HE       MET  80   0.278  -0.350  -3.445
  596    H    MET  81           H        MET  81   0.658  -2.996  -9.339
  597    HA   MET  81           HA       MET  81   0.658  -5.880  -9.180
  598   1HB   MET  81          2HB       MET  81  -0.532  -3.879 -11.090
  599   2HB   MET  81          1HB       MET  81  -0.552  -5.605 -11.453
  600   1HG   MET  81          2HG       MET  81  -1.507  -4.595  -8.781
  601   2HG   MET  81          1HG       MET  81  -2.581  -4.583 -10.178
  602   1HE   MET  81          1HE       MET  81  -0.836  -7.049  -7.443
  603   2HE   MET  81          2HE       MET  81  -2.493  -7.626  -7.291
  604   3HE   MET  81          3HE       MET  81  -2.168  -5.894  -7.293
  605    H    VAL  82           H        VAL  82   1.889  -3.524 -11.580
  606    HA   VAL  82           HA       VAL  82   3.150  -5.472 -13.224
  607    HB   VAL  82           HB       VAL  82   4.400  -3.502 -14.191
  608   1HG1  VAL  82          1HG1      VAL  82   1.646  -2.525 -14.213
  609   2HG1  VAL  82          2HG1      VAL  82   1.738  -4.272 -14.434
  610   3HG1  VAL  82          3HG1      VAL  82   2.610  -3.197 -15.529
  611   1HG2  VAL  82          1HG2      VAL  82   2.672  -1.944 -12.246
  612   2HG2  VAL  82          2HG2      VAL  82   3.751  -1.265 -13.462
  613   3HG2  VAL  82          3HG2      VAL  82   4.417  -2.149 -12.090
  614    H    ARG  83           H        ARG  83   4.327  -3.610 -10.444
  615    HA   ARG  83           HA       ARG  83   7.085  -4.099 -10.796
  616   1HB   ARG  83          2HB       ARG  83   7.340  -3.589  -8.419
  617   2HB   ARG  83          1HB       ARG  83   6.236  -2.446  -9.178
  618   1HG   ARG  83          2HG       ARG  83   4.519  -3.093  -7.868
  619   2HG   ARG  83          1HG       ARG  83   4.841  -4.800  -8.155
  620   1HD   ARG  83          2HD       ARG  83   6.956  -4.104  -6.553
  621   2HD   ARG  83          1HD       ARG  83   5.683  -3.070  -5.920
  622    HE   ARG  83           HE       ARG  83   4.504  -4.982  -5.219
  623   1HH1  ARG  83          2HH1      ARG  83   7.378  -5.824  -7.025
  624   2HH1  ARG  83          1HH1      ARG  83   7.336  -7.487  -6.553
  625   1HH2  ARG  83          1HH2      ARG  83   4.474  -7.169  -4.619
  626   2HH2  ARG  83          2HH2      ARG  83   5.699  -8.247  -5.197
  627    H    CYS  84           H        CYS  84   4.531  -6.228  -9.826
  628    HA   CYS  84           HA       CYS  84   5.952  -8.100  -8.266
  629   1HB   CYS  84          2HB       CYS  84   3.556  -8.397 -10.083
  630   2HB   CYS  84          1HB       CYS  84   4.206  -9.739  -9.143
  631    HG   CYS  84           HG       CYS  84   2.422  -7.628  -8.028
  632    H    MET  85           H        MET  85   5.848  -7.517 -11.725
  633    HA   MET  85           HA       MET  85   7.407  -9.961 -12.256
  634   1HB   MET  85          2HB       MET  85   5.667  -8.164 -13.873
  635   2HB   MET  85          1HB       MET  85   7.050  -8.882 -14.700
  636   1HG   MET  85          2HG       MET  85   6.266 -11.120 -13.683
  637   2HG   MET  85          1HG       MET  85   4.751 -10.286 -13.338
  638   1HE   MET  85          1HE       MET  85   3.492 -12.222 -16.321
  639   2HE   MET  85          2HE       MET  85   3.044 -11.426 -14.814
  640   3HE   MET  85          3HE       MET  85   4.318 -12.642 -14.814
  641    H    LYS  86           H        LYS  86   8.874  -8.272 -10.795
  642    HA   LYS  86           HA       LYS  86  10.273  -6.256 -12.218
  643   1HB   LYS  86          2HB       LYS  86  12.095  -6.805 -10.360
  644   2HB   LYS  86          1HB       LYS  86  10.619  -5.930  -9.974
  645   1HG   LYS  86          2HG       LYS  86   9.739  -7.677  -8.773
  646   2HG   LYS  86          1HG       LYS  86  10.465  -8.898  -9.817
  647   1HD   LYS  86          2HD       LYS  86  11.685  -9.130  -7.822
  648   2HD   LYS  86          1HD       LYS  86  12.725  -8.095  -8.800
  649   1HE   LYS  86          2HE       LYS  86  11.961  -6.116  -7.654
  650   2HE   LYS  86          1HE       LYS  86  10.702  -7.022  -6.816
  651   1HZ   LYS  86          1HZ       LYS  86  12.357  -8.245  -5.622
  652   2HZ   LYS  86          2HZ       LYS  86  12.690  -6.588  -5.444
  653   3HZ   LYS  86          3HZ       LYS  86  13.613  -7.532  -6.513
  654    H    ASP  87           H        ASP  87  12.128  -8.992 -10.916
  655    HA   ASP  87           HA       ASP  87  12.944  -9.888 -13.549
  656   1HB   ASP  87          2HB       ASP  87  14.669  -8.120 -11.876
  657   2HB   ASP  87          1HB       ASP  87  15.444  -9.478 -12.687
  658    H    ASP  88           H        ASP  88  11.635 -11.309 -11.631
  659    HA   ASP  88           HA       ASP  88  13.295 -12.714  -9.801
  660   1HB   ASP  88          2HB       ASP  88  10.690 -12.584  -9.926
  661   2HB   ASP  88          1HB       ASP  88  10.844 -13.951 -11.029
  662    H    SER  89           HN       SER  89  15.094 -13.668 -10.572
  663    HA   SER  89           HA       SER  89  14.750 -15.900 -12.446
  664   1HB   SER  89          2HB       SER  89  15.489 -13.768 -13.691
  665   2HB   SER  89          1HB       SER  89  17.023 -13.958 -12.847
  666    HG   SER  89           HG       SER  89  17.076 -15.033 -14.836
  Start of MODEL   34
    1   1H    MET   1          1H        MET   1  12.300   2.576 -14.236
    2   2H    MET   1          2H        MET   1  12.761   3.895 -15.202
    3   3H    MET   1          3H        MET   1  13.725   2.496 -15.152
    4    HA   MET   1           HA       MET   1  10.998   2.738 -16.307
    5   1HB   MET   1          2HB       MET   1  13.774   2.415 -17.453
    6   2HB   MET   1          1HB       MET   1  12.346   1.925 -18.364
    7   1HG   MET   1          2HG       MET   1  12.623   4.682 -17.148
    8   2HG   MET   1          1HG       MET   1  13.172   4.309 -18.781
    9   1HE   MET   1          1HE       MET   1  11.314   6.311 -17.565
   10   2HE   MET   1          2HE       MET   1   9.628   6.250 -18.071
   11   3HE   MET   1          3HE       MET   1  10.889   6.525 -19.269
   12    H    ASN   2           H        ASN   2  10.074   0.804 -17.064
   13    HA   ASN   2           HA       ASN   2  11.400  -1.708 -16.261
   14   1HB   ASN   2          2HB       ASN   2   8.866  -0.606 -15.221
   15   2HB   ASN   2          1HB       ASN   2   8.807  -2.299 -15.713
   16   1HD2  ASN   2          1HD2      ASN   2  10.676  -3.695 -14.810
   17   2HD2  ASN   2          2HD2      ASN   2  11.223  -3.336 -13.244
   18    H    ASP   3           H        ASP   3  10.861  -3.518 -17.466
   19    HA   ASP   3           HA       ASP   3   9.617  -2.928 -20.067
   20   1HB   ASP   3          2HB       ASP   3  11.970  -4.029 -19.724
   21   2HB   ASP   3          1HB       ASP   3  11.033  -5.497 -19.451
   22    H    ILE   4           H        ILE   4   9.155  -4.891 -17.185
   23    HA   ILE   4           HA       ILE   4   7.208  -6.615 -18.452
   24    HB   ILE   4           HB       ILE   4   6.889  -7.644 -16.339
   25   1HG1  ILE   4          2HG1      ILE   4   8.143  -6.441 -14.314
   26   2HG1  ILE   4          1HG1      ILE   4   7.812  -5.001 -15.279
   27   1HG2  ILE   4          1HG2      ILE   4   9.184  -7.851 -17.439
   28   2HG2  ILE   4          2HG2      ILE   4   9.105  -8.264 -15.726
   29   3HG2  ILE   4          3HG2      ILE   4   9.759  -6.704 -16.229
   30   1HD1  ILE   4          1HD1      ILE   4   5.465  -5.359 -15.206
   31   2HD1  ILE   4          2HD1      ILE   4   6.020  -5.687 -13.565
   32   3HD1  ILE   4          3HD1      ILE   4   5.656  -7.024 -14.656
   33    H    TYR   5           H        TYR   5   7.184  -3.504 -16.923
   34    HA   TYR   5           HA       TYR   5   4.470  -3.394 -16.097
   35   1HB   TYR   5          2HB       TYR   5   6.352  -1.188 -16.980
   36   2HB   TYR   5          1HB       TYR   5   4.759  -0.904 -16.295
   37    HD1  TYR   5           HD1      TYR   5   6.485  -3.801 -14.972
   38    HD2  TYR   5           HD2      TYR   5   6.023   0.442 -14.542
   39    HE1  TYR   5           HE1      TYR   5   7.476  -3.931 -12.721
   40    HE2  TYR   5           HE2      TYR   5   7.003   0.314 -12.272
   41    HH   TYR   5           HH       TYR   5   7.144  -2.096 -10.462
   42    H    LYS   6           H        LYS   6   6.105  -2.963 -19.147
   43    HA   LYS   6           HA       LYS   6   3.804  -1.875 -20.544
   44   1HB   LYS   6          2HB       LYS   6   6.229  -3.121 -21.848
   45   2HB   LYS   6          1HB       LYS   6   5.162  -1.875 -22.491
   46   1HG   LYS   6          2HG       LYS   6   7.222  -1.609 -20.292
   47   2HG   LYS   6          1HG       LYS   6   7.137  -0.723 -21.813
   48   1HD   LYS   6          2HD       LYS   6   5.294   0.572 -21.093
   49   2HD   LYS   6          1HD       LYS   6   4.913  -0.546 -19.783
   50   1HE   LYS   6          2HE       LYS   6   5.966   1.416 -18.822
   51   2HE   LYS   6          1HE       LYS   6   7.091   0.065 -18.701
   52   1HZ   LYS   6          1HZ       LYS   6   7.152   1.946 -20.984
   53   2HZ   LYS   6          2HZ       LYS   6   8.364   0.875 -20.465
   54   3HZ   LYS   6          3HZ       LYS   6   7.999   2.258 -19.550
   55    H    ALA   7           H        ALA   7   5.464  -4.970 -20.224
   56    HA   ALA   7           HA       ALA   7   3.849  -6.425 -22.074
   57   1HB   ALA   7          1HB       ALA   7   5.059  -7.777 -19.696
   58   2HB   ALA   7          2HB       ALA   7   6.137  -7.044 -20.883
   59   3HB   ALA   7          3HB       ALA   7   5.004  -8.303 -21.378
   60    H    ALA   8           H        ALA   8   3.551  -5.607 -18.666
   61    HA   ALA   8           HA       ALA   8   1.402  -7.393 -18.064
   62   1HB   ALA   8          1HB       ALA   8   1.484  -4.940 -16.468
   63   2HB   ALA   8          2HB       ALA   8   3.047  -5.748 -16.564
   64   3HB   ALA   8          3HB       ALA   8   1.640  -6.621 -15.958
   65    H    VAL   9           H        VAL   9   1.614  -4.009 -19.122
   66    HA   VAL   9           HA       VAL   9  -1.028  -3.198 -18.806
   67    HB   VAL   9           HB       VAL   9   1.112  -2.492 -20.795
   68   1HG1  VAL   9          1HG1      VAL   9  -1.769  -1.565 -20.815
   69   2HG1  VAL   9          2HG1      VAL   9  -0.845  -2.256 -22.149
   70   3HG1  VAL   9          3HG1      VAL   9  -0.464  -0.638 -21.557
   71   1HG2  VAL   9          1HG2      VAL   9  -0.325  -0.538 -19.060
   72   2HG2  VAL   9          2HG2      VAL   9   1.388  -0.628 -19.473
   73   3HG2  VAL   9          3HG2      VAL   9   0.717  -1.712 -18.255
   74    H    GLU  10           H        GLU  10   0.439  -4.895 -21.569
   75    HA   GLU  10           HA       GLU  10  -1.927  -5.070 -23.128
   76   1HB   GLU  10          2HB       GLU  10   0.702  -6.528 -23.146
   77   2HB   GLU  10          1HB       GLU  10  -0.617  -7.049 -24.194
   78   1HG   GLU  10          2HG       GLU  10   0.200  -4.152 -24.110
   79   2HG   GLU  10          1HG       GLU  10   1.087  -5.299 -25.112
   80    H    GLN  11           H        GLN  11  -0.853  -6.842 -20.349
   81    HA   GLN  11           HA       GLN  11  -2.527  -9.156 -20.901
   82   1HB   GLN  11          2HB       GLN  11  -0.903  -8.422 -18.457
   83   2HB   GLN  11          1HB       GLN  11  -1.762  -9.944 -18.678
   84   1HG   GLN  11          2HG       GLN  11   0.180  -9.042 -20.783
   85   2HG   GLN  11          1HG       GLN  11   0.794  -9.774 -19.301
   86   1HE2  GLN  11          1HE2      GLN  11  -1.102 -10.399 -22.227
   87   2HE2  GLN  11          2HE2      GLN  11  -1.153 -12.085 -22.042
   88    H    LEU  12           H        LEU  12  -2.435  -6.464 -18.590
   89    HA   LEU  12           HA       LEU  12  -4.911  -7.203 -17.323
   90   1HB   LEU  12          2HB       LEU  12  -4.712  -5.024 -16.198
   91   2HB   LEU  12          1HB       LEU  12  -3.278  -6.008 -16.042
   92    HG   LEU  12           HG       LEU  12  -2.839  -4.397 -18.310
   93   1HD1  LEU  12          1HD1      LEU  12  -4.808  -3.067 -17.300
   94   2HD1  LEU  12          2HD1      LEU  12  -3.328  -2.176 -17.653
   95   3HD1  LEU  12          3HD1      LEU  12  -3.693  -2.656 -15.996
   96   1HD2  LEU  12          1HD2      LEU  12  -1.067  -3.456 -16.910
   97   2HD2  LEU  12          2HD2      LEU  12  -1.203  -5.187 -16.606
   98   3HD2  LEU  12          3HD2      LEU  12  -1.878  -4.035 -15.456
   99    H    THR  13           H        THR  13  -6.666  -5.474 -17.115
  100    HA   THR  13           HA       THR  13  -7.271  -4.302 -19.770
  101    HB   THR  13           HB       THR  13  -9.746  -4.752 -18.805
  102    HG1  THR  13           HG1      THR  13  -9.112  -5.839 -16.978
  103   1HG2  THR  13          1HG2      THR  13  -7.931  -6.590 -20.363
  104   2HG2  THR  13          2HG2      THR  13  -9.132  -5.459 -20.985
  105   3HG2  THR  13          3HG2      THR  13  -9.650  -6.920 -20.148
  106    H    ASP  14           H        ASP  14  -9.207  -2.728 -19.522
  107    HA   ASP  14           HA       ASP  14  -8.411  -0.560 -17.892
  108   1HB   ASP  14          2HB       ASP  14  -9.870  -0.493 -19.999
  109   2HB   ASP  14          1HB       ASP  14 -11.208  -0.962 -18.949
  110    H    GLU  15           H        GLU  15 -10.576  -3.262 -17.376
  111    HA   GLU  15           HA       GLU  15 -12.105  -2.343 -15.224
  112   1HB   GLU  15          2HB       GLU  15 -11.253  -5.028 -16.192
  113   2HB   GLU  15          1HB       GLU  15 -11.892  -4.921 -14.551
  114   1HG   GLU  15          2HG       GLU  15 -13.329  -3.644 -16.880
  115   2HG   GLU  15          1HG       GLU  15 -13.587  -5.336 -16.457
  116    H    GLN  16           H        GLN  16  -8.838  -3.782 -15.239
  117    HA   GLN  16           HA       GLN  16  -8.561  -3.967 -12.424
  118   1HB   GLN  16          2HB       GLN  16  -6.305  -4.447 -12.777
  119   2HB   GLN  16          1HB       GLN  16  -7.044  -4.971 -14.286
  120   1HG   GLN  16          2HG       GLN  16  -5.396  -3.703 -15.224
  121   2HG   GLN  16          1HG       GLN  16  -6.501  -2.375 -14.895
  122   1HE2  GLN  16          1HE2      GLN  16  -3.883  -4.233 -13.228
  123   2HE2  GLN  16          2HE2      GLN  16  -3.270  -2.889 -12.392
  124    H    LYS  17           H        LYS  17  -8.096  -1.314 -14.693
  125    HA   LYS  17           HA       LYS  17  -6.871   0.460 -12.776
  126   1HB   LYS  17          2HB       LYS  17  -7.824   0.663 -15.581
  127   2HB   LYS  17          1HB       LYS  17  -7.838   2.154 -14.640
  128   1HG   LYS  17          2HG       LYS  17  -5.655   2.276 -15.304
  129   2HG   LYS  17          1HG       LYS  17  -5.402   1.182 -13.943
  130   1HD   LYS  17          2HD       LYS  17  -4.400  -0.105 -15.553
  131   2HD   LYS  17          1HD       LYS  17  -6.061  -0.622 -15.843
  132   1HE   LYS  17          2HE       LYS  17  -5.448  -0.020 -17.994
  133   2HE   LYS  17          1HE       LYS  17  -6.093   1.517 -17.419
  134   1HZ   LYS  17          1HZ       LYS  17  -3.964   1.867 -18.443
  135   2HZ   LYS  17          2HZ       LYS  17  -3.238   0.698 -17.446
  136   3HZ   LYS  17          3HZ       LYS  17  -3.821   2.147 -16.776
  137    H    ASN  18           H        ASN  18 -10.123  -0.302 -13.865
  138    HA   ASN  18           HA       ASN  18 -11.499   1.905 -12.746
  139   1HB   ASN  18          2HB       ASN  18 -12.186  -0.651 -13.947
  140   2HB   ASN  18          1HB       ASN  18 -13.215  -0.309 -12.555
  141   1HD2  ASN  18          1HD2      ASN  18 -12.511   0.603 -15.849
  142   2HD2  ASN  18          2HD2      ASN  18 -13.668   1.840 -15.962
  143    H    GLU  19           H        GLU  19 -10.563  -1.266 -11.458
  144    HA   GLU  19           HA       GLU  19 -11.822  -0.913  -8.900
  145   1HB   GLU  19          2HB       GLU  19  -9.536  -2.766  -9.642
  146   2HB   GLU  19          1HB       GLU  19 -10.562  -2.888  -8.213
  147   1HG   GLU  19          2HG       GLU  19 -11.657  -2.987 -11.034
  148   2HG   GLU  19          1HG       GLU  19 -11.195  -4.431 -10.136
  149    H    PHE  20           H        PHE  20  -8.558  -0.465 -10.196
  150    HA   PHE  20           HA       PHE  20  -7.251   0.190  -7.778
  151   1HB   PHE  20          2HB       PHE  20  -6.690   0.667 -10.680
  152   2HB   PHE  20          1HB       PHE  20  -5.743   1.543  -9.481
  153    HD1  PHE  20           HD1      PHE  20  -3.719   0.328 -10.275
  154    HD2  PHE  20           HD2      PHE  20  -7.067  -1.733  -8.546
  155    HE1  PHE  20           HE1      PHE  20  -2.306  -1.673  -9.917
  156    HE2  PHE  20           HE2      PHE  20  -5.658  -3.732  -8.189
  157    HZ   PHE  20           HZ       PHE  20  -3.272  -3.707  -8.873
  158    H    LYS  21           H        LYS  21  -8.857   2.212 -10.221
  159    HA   LYS  21           HA       LYS  21  -8.268   4.724  -9.082
  160   1HB   LYS  21          2HB       LYS  21  -9.166   4.445 -11.378
  161   2HB   LYS  21          1HB       LYS  21 -10.710   3.934 -10.699
  162   1HG   LYS  21          2HG       LYS  21 -10.807   6.313 -11.284
  163   2HG   LYS  21          1HG       LYS  21 -10.899   6.125  -9.533
  164   1HD   LYS  21          2HD       LYS  21  -8.561   6.698  -9.281
  165   2HD   LYS  21          1HD       LYS  21  -8.324   6.687 -11.030
  166   1HE   LYS  21          2HE       LYS  21  -8.582   8.970 -10.596
  167   2HE   LYS  21          1HE       LYS  21 -10.222   8.495 -11.033
  168   1HZ   LYS  21          1HZ       LYS  21  -9.182   8.660  -8.255
  169   2HZ   LYS  21          2HZ       LYS  21 -10.776   8.288  -8.712
  170   3HZ   LYS  21          3HZ       LYS  21 -10.145   9.837  -9.004
  171    H    ALA  22           H        ALA  22 -11.182   2.675  -8.796
  172    HA   ALA  22           HA       ALA  22 -12.581   4.264  -6.949
  173   1HB   ALA  22          1HB       ALA  22 -13.626   2.392  -8.145
  174   2HB   ALA  22          2HB       ALA  22 -13.838   2.227  -6.403
  175   3HB   ALA  22          3HB       ALA  22 -12.630   1.254  -7.238
  176    H    ALA  23           H        ALA  23 -10.298   1.586  -6.419
  177    HA   ALA  23           HA       ALA  23 -10.447   1.553  -3.590
  178   1HB   ALA  23          1HB       ALA  23  -8.365   0.612  -5.555
  179   2HB   ALA  23          2HB       ALA  23  -9.457  -0.352  -4.563
  180   3HB   ALA  23          3HB       ALA  23  -8.104   0.495  -3.814
  181    H    PHE  24           H        PHE  24  -8.983   3.786  -5.761
  182    HA   PHE  24           HA       PHE  24  -7.090   4.792  -3.779
  183   1HB   PHE  24          2HB       PHE  24  -6.699   4.636  -6.358
  184   2HB   PHE  24          1HB       PHE  24  -7.652   6.118  -6.417
  185    HD1  PHE  24           HD1      PHE  24  -4.546   4.566  -5.139
  186    HD2  PHE  24           HD2      PHE  24  -6.792   8.212  -5.530
  187    HE1  PHE  24           HE1      PHE  24  -2.549   5.870  -4.462
  188    HE2  PHE  24           HE2      PHE  24  -4.794   9.511  -4.855
  189    HZ   PHE  24           HZ       PHE  24  -2.674   8.343  -4.321
  190    H    ASP  25           H        ASP  25  -9.818   6.129  -5.722
  191    HA   ASP  25           HA       ASP  25  -9.917   8.576  -4.352
  192   1HB   ASP  25          2HB       ASP  25 -12.264   8.761  -5.239
  193   2HB   ASP  25          1HB       ASP  25 -11.018   8.482  -6.440
  194    H    ILE  26           H        ILE  26 -11.300   5.463  -3.457
  195    HA   ILE  26           HA       ILE  26 -13.256   6.343  -1.637
  196    HB   ILE  26           HB       ILE  26 -12.833   4.185  -0.416
  197   1HG1  ILE  26          2HG1      ILE  26 -10.740   3.812  -2.585
  198   2HG1  ILE  26          1HG1      ILE  26 -10.390   4.071  -0.879
  199   1HG2  ILE  26          1HG2      ILE  26 -13.507   4.525  -3.272
  200   2HG2  ILE  26          2HG2      ILE  26 -14.422   3.744  -1.983
  201   3HG2  ILE  26          3HG2      ILE  26 -13.122   2.873  -2.794
  202   1HD1  ILE  26          1HD1      ILE  26 -11.805   2.021  -0.392
  203   2HD1  ILE  26          2HD1      ILE  26 -10.293   1.705  -1.243
  204   3HD1  ILE  26          3HD1      ILE  26 -11.817   1.719  -2.129
  205    H    PHE  27           H        PHE  27  -9.763   5.981  -1.294
  206    HA   PHE  27           HA       PHE  27  -9.794   6.818   1.498
  207   1HB   PHE  27          2HB       PHE  27  -7.622   6.062  -0.453
  208   2HB   PHE  27          1HB       PHE  27  -7.244   6.804   1.099
  209    HD1  PHE  27           HD1      PHE  27  -7.945   5.670   3.231
  210    HD2  PHE  27           HD2      PHE  27  -8.319   3.777  -0.606
  211    HE1  PHE  27           HE1      PHE  27  -8.187   3.466   4.341
  212    HE2  PHE  27           HE2      PHE  27  -8.563   1.572   0.504
  213    HZ   PHE  27           HZ       PHE  27  -8.496   1.418   2.978
  214    H    ILE  28           H        ILE  28  -9.115   8.139  -1.704
  215    HA   ILE  28           HA       ILE  28  -8.239  10.704  -0.583
  216    HB   ILE  28           HB       ILE  28  -8.562  10.067  -3.515
  217   1HG1  ILE  28          2HG1      ILE  28  -7.117   8.322  -2.903
  218   2HG1  ILE  28          1HG1      ILE  28  -6.004   9.616  -3.323
  219   1HG2  ILE  28          1HG2      ILE  28  -6.532  11.676  -3.526
  220   2HG2  ILE  28          2HG2      ILE  28  -7.027  12.075  -1.879
  221   3HG2  ILE  28          3HG2      ILE  28  -8.131  12.360  -3.227
  222   1HD1  ILE  28          1HD1      ILE  28  -6.703   8.528  -0.621
  223   2HD1  ILE  28          2HD1      ILE  28  -6.219  10.220  -0.759
  224   3HD1  ILE  28          3HD1      ILE  28  -5.122   8.940  -1.284
  225    H    GLN  29           H        GLN  29 -10.934   9.980  -0.049
  226    HA   GLN  29           HA       GLN  29 -12.724  11.240  -1.897
  227   1HB   GLN  29          2HB       GLN  29 -14.346  11.179   0.064
  228   2HB   GLN  29          1HB       GLN  29 -13.717   9.620  -0.464
  229   1HG   GLN  29          2HG       GLN  29 -12.080   9.625   1.356
  230   2HG   GLN  29          1HG       GLN  29 -12.604  11.233   1.854
  231   1HE2  GLN  29          1HE2      GLN  29 -13.288   7.836   2.114
  232   2HE2  GLN  29          2HE2      GLN  29 -14.703   7.982   3.039
  233    H    ASP  30           H        ASP  30 -10.882  12.299   0.895
  234    HA   ASP  30           HA       ASP  30 -11.271  15.065   0.156
  235   1HB   ASP  30          2HB       ASP  30 -11.909  15.558   2.664
  236   2HB   ASP  30          1HB       ASP  30 -13.158  15.165   1.489
  237    H    ALA  31           H        ALA  31  -8.995  13.544   0.092
  238    HA   ALA  31           HA       ALA  31  -7.429  13.749   2.484
  239   1HB   ALA  31          1HB       ALA  31  -6.598  13.333  -0.397
  240   2HB   ALA  31          2HB       ALA  31  -6.864  12.076   0.810
  241   3HB   ALA  31          3HB       ALA  31  -5.517  13.201   0.991
  242    H    GLU  32           H        GLU  32  -5.711  15.148   2.920
  243    HA   GLU  32           HA       GLU  32  -6.145  17.873   2.165
  244   1HB   GLU  32          2HB       GLU  32  -4.167  18.358   3.555
  245   2HB   GLU  32          1HB       GLU  32  -5.312  17.311   4.388
  246   1HG   GLU  32          2HG       GLU  32  -3.714  15.467   3.134
  247   2HG   GLU  32          1HG       GLU  32  -2.556  16.745   3.501
  248    H    ASP  33           H        ASP  33  -3.829  15.391   1.205
  249    HA   ASP  33           HA       ASP  33  -2.567  17.296  -0.668
  250   1HB   ASP  33          2HB       ASP  33  -1.625  14.776   0.656
  251   2HB   ASP  33          1HB       ASP  33  -0.915  15.265  -0.883
  252    H    GLY  34           H        GLY  34  -4.106  14.110  -0.440
  253   1HA   GLY  34          2HA       GLY  34  -5.634  13.421  -2.206
  254   2HA   GLY  34          1HA       GLY  34  -4.550  14.177  -3.366
  255    H    CYS  35           H        CYS  35  -3.766  12.037  -0.632
  256    HA   CYS  35           HA       CYS  35  -3.190   9.782  -2.372
  257   1HB   CYS  35          2HB       CYS  35  -0.770   9.846  -1.123
  258   2HB   CYS  35          1HB       CYS  35  -1.048  10.429  -2.761
  259    HG   CYS  35           HG       CYS  35  -1.048  12.843  -1.917
  260    H    ILE  36           H        ILE  36  -2.113   7.963  -1.008
  261    HA   ILE  36           HA       ILE  36  -3.469   7.950   1.621
  262    HB   ILE  36           HB       ILE  36  -3.375   5.481   1.453
  263   1HG1  ILE  36          2HG1      ILE  36  -2.908   5.135  -1.316
  264   2HG1  ILE  36          1HG1      ILE  36  -1.574   6.119  -0.715
  265   1HG2  ILE  36          1HG2      ILE  36  -5.191   5.289  -0.050
  266   2HG2  ILE  36          2HG2      ILE  36  -4.582   6.580  -1.086
  267   3HG2  ILE  36          3HG2      ILE  36  -5.262   6.965   0.495
  268   1HD1  ILE  36          1HD1      ILE  36  -2.152   3.302  -0.230
  269   2HD1  ILE  36          2HD1      ILE  36  -1.926   4.205   1.271
  270   3HD1  ILE  36          3HD1      ILE  36  -0.661   4.204   0.043
  271    H    SER  37           H        SER  37  -2.333   6.300   3.171
  272    HA   SER  37           HA       SER  37   0.434   7.227   3.448
  273   1HB   SER  37          2HB       SER  37  -1.281   7.345   5.345
  274   2HB   SER  37          1HB       SER  37  -1.126   5.595   5.452
  275    HG   SER  37           HG       SER  37   0.706   7.615   6.051
  276    H    THR  38           H        THR  38   2.098   5.743   4.112
  277    HA   THR  38           HA       THR  38   2.356   3.477   2.444
  278    HB   THR  38           HB       THR  38   4.332   2.910   3.859
  279    HG1  THR  38           HG1      THR  38   3.710   5.245   5.321
  280   1HG2  THR  38          1HG2      THR  38   5.328   4.374   2.475
  281   2HG2  THR  38          2HG2      THR  38   5.017   5.644   3.659
  282   3HG2  THR  38          3HG2      THR  38   3.852   5.334   2.372
  283    H    LYS  39           H        LYS  39   1.440   3.834   5.847
  284    HA   LYS  39           HA       LYS  39   1.246   1.046   6.428
  285   1HB   LYS  39          2HB       LYS  39   0.110   1.744   8.465
  286   2HB   LYS  39          1HB       LYS  39   1.489   2.802   8.169
  287   1HG   LYS  39          2HG       LYS  39   0.056   4.538   7.280
  288   2HG   LYS  39          1HG       LYS  39  -1.347   3.469   7.329
  289   1HD   LYS  39          2HD       LYS  39  -0.863   3.279   9.863
  290   2HD   LYS  39          1HD       LYS  39   0.151   4.704   9.636
  291   1HE   LYS  39          2HE       LYS  39  -1.931   5.637  10.197
  292   2HE   LYS  39          1HE       LYS  39  -1.935   5.708   8.436
  293   1HZ   LYS  39          1HZ       LYS  39  -3.156   3.542  10.064
  294   2HZ   LYS  39          2HZ       LYS  39  -3.198   3.666   8.370
  295   3HZ   LYS  39          3HZ       LYS  39  -4.009   4.810   9.330
  296    H    GLU  40           H        GLU  40  -0.873   3.331   4.869
  297    HA   GLU  40           HA       GLU  40  -3.295   1.808   5.256
  298   1HB   GLU  40          2HB       GLU  40  -2.557   4.223   3.628
  299   2HB   GLU  40          1HB       GLU  40  -4.094   3.402   3.364
  300   1HG   GLU  40          2HG       GLU  40  -4.656   3.664   5.750
  301   2HG   GLU  40          1HG       GLU  40  -3.115   4.475   6.027
  302    H    LEU  41           H        LEU  41  -0.601   1.237   3.351
  303    HA   LEU  41           HA       LEU  41  -1.706   0.487   0.864
  304   1HB   LEU  41          2HB       LEU  41   0.802   0.620   1.817
  305   2HB   LEU  41          1HB       LEU  41   0.546  -1.103   1.957
  306    HG   LEU  41           HG       LEU  41   1.654  -0.521  -0.148
  307   1HD1  LEU  41          1HD1      LEU  41  -0.013  -2.433   0.022
  308   2HD1  LEU  41          2HD1      LEU  41   0.254  -1.815  -1.608
  309   3HD1  LEU  41          3HD1      LEU  41  -1.199  -1.358  -0.719
  310   1HD2  LEU  41          1HD2      LEU  41   0.356   1.759  -0.199
  311   2HD2  LEU  41          2HD2      LEU  41  -0.872   0.835  -1.064
  312   3HD2  LEU  41          3HD2      LEU  41   0.759   0.969  -1.723
  313    H    GLY  42           H        GLY  42  -1.250  -1.298   3.897
  314   1HA   GLY  42          2HA       GLY  42  -2.085  -3.840   2.944
  315   2HA   GLY  42          1HA       GLY  42  -2.059  -3.329   4.627
  316    H    LYS  43           H        LYS  43  -3.863  -0.966   3.579
  317    HA   LYS  43           HA       LYS  43  -6.369  -2.282   4.219
  318   1HB   LYS  43          2HB       LYS  43  -5.875   0.613   3.487
  319   2HB   LYS  43          1HB       LYS  43  -7.307  -0.049   4.273
  320   1HG   LYS  43          2HG       LYS  43  -4.524  -0.222   5.464
  321   2HG   LYS  43          1HG       LYS  43  -5.658   1.074   5.839
  322   1HD   LYS  43          2HD       LYS  43  -7.308  -0.921   6.348
  323   2HD   LYS  43          1HD       LYS  43  -5.814  -1.839   6.542
  324   1HE   LYS  43          2HE       LYS  43  -6.298   0.800   7.943
  325   2HE   LYS  43          1HE       LYS  43  -6.726  -0.750   8.663
  326   1HZ   LYS  43          1HZ       LYS  43  -4.385  -1.439   8.322
  327   2HZ   LYS  43          2HZ       LYS  43  -4.560  -0.143   9.406
  328   3HZ   LYS  43          3HZ       LYS  43  -4.023   0.140   7.820
  329    H    VAL  44           H        VAL  44  -4.857  -0.689   1.424
  330    HA   VAL  44           HA       VAL  44  -7.195  -0.850  -0.228
  331    HB   VAL  44           HB       VAL  44  -5.638  -0.288  -2.095
  332   1HG1  VAL  44          1HG1      VAL  44  -6.700   1.470  -0.737
  333   2HG1  VAL  44          2HG1      VAL  44  -5.081   1.958  -1.237
  334   3HG1  VAL  44          3HG1      VAL  44  -5.364   1.396   0.412
  335   1HG2  VAL  44          1HG2      VAL  44  -3.516  -0.123   0.061
  336   2HG2  VAL  44          2HG2      VAL  44  -3.307   0.119  -1.673
  337   3HG2  VAL  44          3HG2      VAL  44  -3.655  -1.491  -1.045
  338    H    MET  45           H        MET  45  -4.399  -2.932   0.342
  339    HA   MET  45           HA       MET  45  -4.737  -4.682  -1.848
  340   1HB   MET  45          2HB       MET  45  -3.707  -5.463   0.890
  341   2HB   MET  45          1HB       MET  45  -3.376  -6.266  -0.643
  342   1HG   MET  45          2HG       MET  45  -2.682  -3.382  -0.517
  343   2HG   MET  45          1HG       MET  45  -1.690  -4.461   0.461
  344   1HE   MET  45          1HE       MET  45  -3.390  -5.283  -3.247
  345   2HE   MET  45          2HE       MET  45  -2.276  -4.134  -3.987
  346   3HE   MET  45          3HE       MET  45  -3.310  -3.618  -2.652
  347    H    ARG  46           H        ARG  46  -6.166  -4.598   1.371
  348    HA   ARG  46           HA       ARG  46  -7.482  -7.101   1.307
  349   1HB   ARG  46          2HB       ARG  46  -7.757  -4.593   2.884
  350   2HB   ARG  46          1HB       ARG  46  -9.141  -5.684   2.873
  351   1HG   ARG  46          2HG       ARG  46  -7.606  -7.557   3.515
  352   2HG   ARG  46          1HG       ARG  46  -6.300  -6.381   3.665
  353   1HD   ARG  46          2HD       ARG  46  -7.640  -5.140   5.348
  354   2HD   ARG  46          1HD       ARG  46  -8.898  -6.363   5.225
  355    HE   ARG  46           HE       ARG  46  -7.581  -7.796   6.499
  356   1HH1  ARG  46          2HH1      ARG  46  -5.712  -5.038   5.442
  357   2HH1  ARG  46          1HH1      ARG  46  -4.349  -5.426   6.433
  358   1HH2  ARG  46          1HH2      ARG  46  -5.776  -8.288   7.781
  359   2HH2  ARG  46          2HH2      ARG  46  -4.383  -7.260   7.753
  360    H    MET  47           H        MET  47  -8.425  -3.886   0.171
  361    HA   MET  47           HA       MET  47 -11.104  -4.645  -0.542
  362   1HB   MET  47          2HB       MET  47  -9.392  -2.225  -0.949
  363   2HB   MET  47          1HB       MET  47 -10.834  -2.423  -1.946
  364   1HG   MET  47          2HG       MET  47 -11.844  -3.047   0.503
  365   2HG   MET  47          1HG       MET  47 -10.604  -1.876   0.956
  366   1HE   MET  47          1HE       MET  47 -13.673  -0.776   1.568
  367   2HE   MET  47          2HE       MET  47 -12.963   0.792   1.191
  368   3HE   MET  47          3HE       MET  47 -11.972  -0.460   1.936
  369    H    LEU  48           H        LEU  48  -8.001  -4.497  -2.230
  370    HA   LEU  48           HA       LEU  48  -9.136  -4.892  -4.848
  371   1HB   LEU  48          2HB       LEU  48  -6.326  -5.103  -3.786
  372   2HB   LEU  48          1HB       LEU  48  -6.732  -5.441  -5.455
  373    HG   LEU  48           HG       LEU  48  -7.243  -2.790  -4.085
  374   1HD1  LEU  48          1HD1      LEU  48  -4.868  -3.057  -4.203
  375   2HD1  LEU  48          2HD1      LEU  48  -5.314  -2.058  -5.585
  376   3HD1  LEU  48          3HD1      LEU  48  -4.960  -3.770  -5.813
  377   1HD2  LEU  48          1HD2      LEU  48  -7.459  -2.035  -6.483
  378   2HD2  LEU  48          2HD2      LEU  48  -8.726  -3.146  -5.966
  379   3HD2  LEU  48          3HD2      LEU  48  -7.396  -3.731  -6.965
  380    H    GLY  49           H        GLY  49  -7.029  -7.012  -2.863
  381   1HA   GLY  49          2HA       GLY  49  -8.452  -9.308  -2.723
  382   2HA   GLY  49          1HA       GLY  49  -7.855  -9.354  -4.378
  383    H    GLN  50           H        GLN  50  -6.412  -8.336  -1.273
  384    HA   GLN  50           HA       GLN  50  -4.480 -10.502  -1.327
  385   1HB   GLN  50          2HB       GLN  50  -3.815  -7.825  -2.308
  386   2HB   GLN  50          1HB       GLN  50  -2.765  -8.356  -0.993
  387   1HG   GLN  50          2HG       GLN  50  -2.522 -10.559  -2.254
  388   2HG   GLN  50          1HG       GLN  50  -3.293  -9.753  -3.619
  389   1HE2  GLN  50          1HE2      GLN  50  -1.750  -8.998  -5.068
  390   2HE2  GLN  50          2HE2      GLN  50  -0.238  -8.358  -4.637
  391    H    ASN  51           H        ASN  51  -3.292 -10.695   0.637
  392    HA   ASN  51           HA       ASN  51  -4.007  -8.857   2.814
  393   1HB   ASN  51          2HB       ASN  51  -5.621 -10.901   2.631
  394   2HB   ASN  51          1HB       ASN  51  -4.266 -11.811   3.298
  395   1HD2  ASN  51          1HD2      ASN  51  -6.875  -9.696   4.102
  396   2HD2  ASN  51          2HD2      ASN  51  -6.456  -9.452   5.729
  397    HA   PRO  52           HA       PRO  52   0.375 -10.306   3.088
  398   1HB   PRO  52          2HB       PRO  52   1.512  -7.824   2.942
  399   2HB   PRO  52          1HB       PRO  52   1.116  -8.802   1.523
  400   1HG   PRO  52          2HG       PRO  52  -0.218  -6.387   2.570
  401   2HG   PRO  52          1HG       PRO  52  -0.194  -7.035   0.924
  402   1HD   PRO  52          2HD       PRO  52  -2.311  -7.268   2.823
  403   2HD   PRO  52          1HD       PRO  52  -2.200  -8.076   1.242
  404    H    THR  53           H        THR  53   2.183  -8.890   4.522
  405    HA   THR  53           HA       THR  53   0.871  -8.451   7.142
  406    HB   THR  53           HB       THR  53   2.676  -9.446   8.220
  407    HG1  THR  53           HG1      THR  53   4.645  -9.050   7.641
  408   1HG2  THR  53          1HG2      THR  53   1.575 -11.146   6.827
  409   2HG2  THR  53          2HG2      THR  53   3.296 -11.492   7.000
  410   3HG2  THR  53          3HG2      THR  53   2.683 -10.784   5.504
  411    HA   PRO  54           HA       PRO  54   2.592  -4.394   7.296
  412   1HB   PRO  54          2HB       PRO  54   3.749  -4.210   9.774
  413   2HB   PRO  54          1HB       PRO  54   2.000  -4.191   9.495
  414   1HG   PRO  54          2HG       PRO  54   3.728  -6.384  10.522
  415   2HG   PRO  54          1HG       PRO  54   2.037  -6.011  10.892
  416   1HD   PRO  54          2HD       PRO  54   2.888  -8.031   9.162
  417   2HD   PRO  54          1HD       PRO  54   1.255  -7.323   9.177
  418    H    GLU  55           H        GLU  55   4.849  -6.949   8.127
  419    HA   GLU  55           HA       GLU  55   7.218  -5.324   7.662
  420   1HB   GLU  55          2HB       GLU  55   7.142  -8.333   7.896
  421   2HB   GLU  55          1HB       GLU  55   8.479  -7.242   8.255
  422   1HG   GLU  55          2HG       GLU  55   7.104  -6.260  10.112
  423   2HG   GLU  55          1HG       GLU  55   5.886  -7.498   9.802
  424    H    GLU  56           H        GLU  56   5.317  -7.801   6.007
  425    HA   GLU  56           HA       GLU  56   7.120  -8.154   3.813
  426   1HB   GLU  56          2HB       GLU  56   5.254  -9.745   4.644
  427   2HB   GLU  56          1HB       GLU  56   4.169  -8.732   3.692
  428   1HG   GLU  56          2HG       GLU  56   5.433  -9.172   1.671
  429   2HG   GLU  56          1HG       GLU  56   6.670 -10.037   2.584
  430    H    LEU  57           H        LEU  57   4.002  -6.416   4.150
  431    HA   LEU  57           HA       LEU  57   3.979  -5.370   1.522
  432   1HB   LEU  57          2HB       LEU  57   1.968  -4.669   2.129
  433   2HB   LEU  57          1HB       LEU  57   2.271  -5.313   3.722
  434    HG   LEU  57           HG       LEU  57   2.977  -2.482   2.923
  435   1HD1  LEU  57          1HD1      LEU  57   0.901  -1.788   3.963
  436   2HD1  LEU  57          2HD1      LEU  57   0.515  -3.453   4.395
  437   3HD1  LEU  57          3HD1      LEU  57   0.528  -2.962   2.702
  438   1HD2  LEU  57          1HD2      LEU  57   2.331  -2.934   5.699
  439   2HD2  LEU  57          2HD2      LEU  57   3.842  -2.347   5.001
  440   3HD2  LEU  57          3HD2      LEU  57   3.570  -4.081   5.190
  441    H    GLN  58           H        GLN  58   5.654  -4.337   4.413
  442    HA   GLN  58           HA       GLN  58   6.099  -1.641   3.869
  443   1HB   GLN  58          2HB       GLN  58   6.820  -3.033   5.931
  444   2HB   GLN  58          1HB       GLN  58   8.275  -3.386   5.000
  445   1HG   GLN  58          2HG       GLN  58   8.691  -1.423   6.381
  446   2HG   GLN  58          1HG       GLN  58   8.617  -0.922   4.693
  447   1HE2  GLN  58          1HE2      GLN  58   6.759   0.352   4.000
  448   2HE2  GLN  58          2HE2      GLN  58   5.674   1.021   5.122
  449    H    GLU  59           H        GLU  59   7.976  -4.479   2.791
  450    HA   GLU  59           HA       GLU  59   9.953  -3.062   1.367
  451   1HB   GLU  59          2HB       GLU  59   9.053  -5.850   1.548
  452   2HB   GLU  59          1HB       GLU  59   9.731  -5.417  -0.021
  453   1HG   GLU  59          2HG       GLU  59  11.108  -4.718   2.577
  454   2HG   GLU  59          1HG       GLU  59  11.398  -6.243   1.740
  455    H    MET  60           H        MET  60   6.737  -4.194   0.433
  456    HA   MET  60           HA       MET  60   6.999  -3.663  -2.352
  457   1HB   MET  60          2HB       MET  60   4.711  -4.169  -0.495
  458   2HB   MET  60          1HB       MET  60   4.368  -3.479  -2.081
  459   1HG   MET  60          2HG       MET  60   4.269  -5.778  -2.512
  460   2HG   MET  60          1HG       MET  60   5.927  -5.385  -2.966
  461   1HE   MET  60          1HE       MET  60   5.942  -8.928  -1.543
  462   2HE   MET  60          2HE       MET  60   7.196  -7.985  -2.342
  463   3HE   MET  60          3HE       MET  60   5.535  -7.893  -2.919
  464    H    ILE  61           H        ILE  61   5.773  -1.735   0.388
  465    HA   ILE  61           HA       ILE  61   4.774   0.454  -1.020
  466    HB   ILE  61           HB       ILE  61   6.065   0.271   1.705
  467   1HG1  ILE  61          2HG1      ILE  61   3.189   0.851   1.253
  468   2HG1  ILE  61          1HG1      ILE  61   3.729  -0.776   0.854
  469   1HG2  ILE  61          1HG2      ILE  61   4.821   2.487   2.056
  470   2HG2  ILE  61          2HG2      ILE  61   4.740   2.595   0.298
  471   3HG2  ILE  61          3HG2      ILE  61   6.307   2.559   1.109
  472   1HD1  ILE  61          1HD1      ILE  61   4.325   0.577   3.494
  473   2HD1  ILE  61          2HD1      ILE  61   4.599  -1.112   3.066
  474   3HD1  ILE  61          3HD1      ILE  61   2.953  -0.502   3.238
  475    H    ASP  62           H        ASP  62   7.917   0.510   0.704
  476    HA   ASP  62           HA       ASP  62   8.941   2.779  -0.514
  477   1HB   ASP  62          2HB       ASP  62  11.100   2.130   0.243
  478   2HB   ASP  62          1HB       ASP  62   9.958   1.525   1.435
  479    H    GLU  63           H        GLU  63   8.929  -0.532  -1.727
  480    HA   GLU  63           HA       GLU  63  10.763  -0.261  -3.842
  481   1HB   GLU  63          2HB       GLU  63   8.524  -2.107  -3.205
  482   2HB   GLU  63          1HB       GLU  63   9.022  -2.035  -4.894
  483   1HG   GLU  63          2HG       GLU  63  11.145  -2.250  -2.789
  484   2HG   GLU  63          1HG       GLU  63  10.221  -3.694  -3.202
  485    H    VAL  64           H        VAL  64   7.216   0.173  -3.836
  486    HA   VAL  64           HA       VAL  64   7.192   1.142  -6.562
  487    HB   VAL  64           HB       VAL  64   4.808   1.528  -6.216
  488   1HG1  VAL  64          1HG1      VAL  64   4.194  -0.714  -6.078
  489   2HG1  VAL  64          2HG1      VAL  64   5.342  -1.054  -4.780
  490   3HG1  VAL  64          3HG1      VAL  64   5.916  -0.852  -6.436
  491   1HG2  VAL  64          1HG2      VAL  64   5.089   2.364  -3.844
  492   2HG2  VAL  64          2HG2      VAL  64   5.250   0.679  -3.342
  493   3HG2  VAL  64          3HG2      VAL  64   3.746   1.241  -4.072
  494    H    ASP  65           H        ASP  65   7.521   2.566  -3.396
  495    HA   ASP  65           HA       ASP  65   6.656   5.205  -4.074
  496   1HB   ASP  65          2HB       ASP  65   7.280   3.952  -1.716
  497   2HB   ASP  65          1HB       ASP  65   8.697   4.970  -1.954
  498    H    GLU  66           H        GLU  66   7.681   5.535  -6.087
  499    HA   GLU  66           HA       GLU  66  10.465   5.432  -6.546
  500   1HB   GLU  66          2HB       GLU  66   8.197   6.866  -7.894
  501   2HB   GLU  66          1HB       GLU  66   9.863   7.147  -8.401
  502   1HG   GLU  66          2HG       GLU  66  10.016   4.530  -8.445
  503   2HG   GLU  66          1HG       GLU  66   8.255   4.609  -8.525
  504    H    ASP  67           H        ASP  67   8.395   8.049  -5.358
  505    HA   ASP  67           HA       ASP  67  10.556   9.979  -5.377
  506   1HB   ASP  67          2HB       ASP  67   8.873  11.410  -4.108
  507   2HB   ASP  67          1HB       ASP  67   8.401  10.921  -5.733
  508    H    GLY  68           H        GLY  68   8.855   8.035  -2.935
  509   1HA   GLY  68          2HA       GLY  68   9.552   7.324  -0.851
  510   2HA   GLY  68          1HA       GLY  68  11.130   8.030  -1.190
  511    H    SER  69           H        SER  69   7.862   9.446  -0.996
  512    HA   SER  69           HA       SER  69   8.923  11.569   0.719
  513   1HB   SER  69          2HB       SER  69   6.765  12.694   0.309
  514   2HB   SER  69          1HB       SER  69   7.571  12.271  -1.198
  515    HG   SER  69           HG       SER  69   5.171  11.695  -0.672
  516    H    GLY  70           H        GLY  70   6.184   9.294   0.653
  517   1HA   GLY  70          2HA       GLY  70   6.191   8.170   3.072
  518   2HA   GLY  70          1HA       GLY  70   5.602   9.781   3.473
  519    H    THR  71           H        THR  71   4.200  10.112   0.913
  520    HA   THR  71           HA       THR  71   1.836   8.473   1.536
  521    HB   THR  71           HB       THR  71   0.545  10.123   0.312
  522    HG1  THR  71           HG1      THR  71   2.981  11.489  -0.164
  523   1HG2  THR  71          1HG2      THR  71   1.049  10.655   2.639
  524   2HG2  THR  71          2HG2      THR  71   1.053  12.137   1.681
  525   3HG2  THR  71          3HG2      THR  71   2.579  11.394   2.163
  526    H    VAL  72           H        VAL  72   0.645   7.445  -0.141
  527    HA   VAL  72           HA       VAL  72   2.338   6.685  -2.441
  528    HB   VAL  72           HB       VAL  72  -0.114   5.235  -1.427
  529   1HG1  VAL  72          1HG1      VAL  72   2.213   4.283  -3.123
  530   2HG1  VAL  72          2HG1      VAL  72   0.678   4.840  -3.790
  531   3HG1  VAL  72          3HG1      VAL  72   0.727   3.403  -2.768
  532   1HG2  VAL  72          1HG2      VAL  72   2.813   4.921  -0.718
  533   2HG2  VAL  72          2HG2      VAL  72   1.628   3.639  -0.462
  534   3HG2  VAL  72          3HG2      VAL  72   1.460   5.178   0.383
  535    H    ASP  73           H        ASP  73   1.877   7.692  -4.258
  536    HA   ASP  73           HA       ASP  73  -0.747   8.873  -4.718
  537   1HB   ASP  73          2HB       ASP  73   1.809   8.882  -6.344
  538   2HB   ASP  73          1HB       ASP  73   0.318   9.665  -6.863
  539    H    PHE  74           H        PHE  74  -1.430   8.615  -7.198
  540    HA   PHE  74           HA       PHE  74  -2.361   5.949  -7.469
  541   1HB   PHE  74          2HB       PHE  74  -3.363   8.143  -8.427
  542   2HB   PHE  74          1HB       PHE  74  -2.256   7.880  -9.774
  543    HD1  PHE  74           HD1      PHE  74  -3.599   7.175 -11.562
  544    HD2  PHE  74           HD2      PHE  74  -4.130   5.389  -7.694
  545    HE1  PHE  74           HE1      PHE  74  -5.176   5.529 -12.537
  546    HE2  PHE  74           HE2      PHE  74  -5.702   3.742  -8.668
  547    HZ   PHE  74           HZ       PHE  74  -6.229   3.811 -11.090
  548    H    ASP  75           H        ASP  75   0.402   7.658  -8.856
  549    HA   ASP  75           HA       ASP  75   1.057   5.750 -10.857
  550   1HB   ASP  75          2HB       ASP  75   2.407   8.046  -9.563
  551   2HB   ASP  75          1HB       ASP  75   3.479   6.810 -10.222
  552    H    GLU  76           H        GLU  76   1.895   6.071  -7.445
  553    HA   GLU  76           HA       GLU  76   3.671   3.769  -7.457
  554   1HB   GLU  76          2HB       GLU  76   2.532   5.050  -4.982
  555   2HB   GLU  76          1HB       GLU  76   4.083   4.241  -5.192
  556   1HG   GLU  76          2HG       GLU  76   4.985   6.068  -6.433
  557   2HG   GLU  76          1HG       GLU  76   3.391   6.793  -6.660
  558    H    PHE  77           H        PHE  77   0.320   4.429  -7.021
  559    HA   PHE  77           HA       PHE  77  -0.343   2.098  -5.466
  560   1HB   PHE  77          2HB       PHE  77  -1.717   4.152  -5.413
  561   2HB   PHE  77          1HB       PHE  77  -2.111   3.928  -7.115
  562    HD1  PHE  77           HD1      PHE  77  -2.514   2.504  -3.707
  563    HD2  PHE  77           HD2      PHE  77  -3.733   2.319  -7.825
  564    HE1  PHE  77           HE1      PHE  77  -4.387   1.003  -3.089
  565    HE2  PHE  77           HE2      PHE  77  -5.604   0.815  -7.201
  566    HZ   PHE  77           HZ       PHE  77  -5.932   0.157  -4.833
  567    H    LEU  78           H        LEU  78  -0.398   2.977  -8.913
  568    HA   LEU  78           HA       LEU  78  -1.685   0.550  -9.767
  569   1HB   LEU  78          2HB       LEU  78  -0.111   2.630 -11.270
  570   2HB   LEU  78          1HB       LEU  78  -0.948   1.293 -12.032
  571    HG   LEU  78           HG       LEU  78  -2.564   3.044 -10.249
  572   1HD1  LEU  78          1HD1      LEU  78  -1.233   3.923 -12.795
  573   2HD1  LEU  78          2HD1      LEU  78  -1.493   4.827 -11.304
  574   3HD1  LEU  78          3HD1      LEU  78  -2.842   4.524 -12.399
  575   1HD2  LEU  78          1HD2      LEU  78  -3.448   2.450 -12.986
  576   2HD2  LEU  78          2HD2      LEU  78  -4.257   2.132 -11.451
  577   3HD2  LEU  78          3HD2      LEU  78  -3.049   1.002 -12.062
  578    H    VAL  79           H        VAL  79   1.701   1.651  -9.628
  579    HA   VAL  79           HA       VAL  79   2.879  -0.454 -11.059
  580    HB   VAL  79           HB       VAL  79   4.932   0.012  -9.660
  581   1HG1  VAL  79          1HG1      VAL  79   5.052   2.447 -10.518
  582   2HG1  VAL  79          2HG1      VAL  79   3.424   2.169 -11.136
  583   3HG1  VAL  79          3HG1      VAL  79   4.765   1.181 -11.712
  584   1HG2  VAL  79          1HG2      VAL  79   3.615   0.752  -7.639
  585   2HG2  VAL  79          2HG2      VAL  79   3.213   2.225  -8.517
  586   3HG2  VAL  79          3HG2      VAL  79   4.892   1.867  -8.120
  587    H    MET  80           H        MET  80   1.591  -0.392  -7.834
  588    HA   MET  80           HA       MET  80   2.864  -2.466  -6.534
  589   1HB   MET  80          2HB       MET  80   0.129  -1.320  -6.462
  590   2HB   MET  80          1HB       MET  80   0.346  -2.900  -5.707
  591   1HG   MET  80          2HG       MET  80   1.632  -2.061  -4.022
  592   2HG   MET  80          1HG       MET  80   2.446  -0.913  -5.083
  593   1HE   MET  80          1HE       MET  80  -1.601  -0.555  -3.015
  594   2HE   MET  80          2HE       MET  80  -0.698  -2.000  -3.465
  595   3HE   MET  80          3HE       MET  80  -1.639  -1.142  -4.683
  596    H    MET  81           H        MET  81   0.538  -2.686  -9.173
  597    HA   MET  81           HA       MET  81   0.083  -5.517  -8.827
  598   1HB   MET  81          2HB       MET  81  -1.206  -5.374 -10.907
  599   2HB   MET  81          1HB       MET  81  -1.671  -4.100  -9.782
  600   1HG   MET  81          2HG       MET  81  -1.299  -2.627 -11.438
  601   2HG   MET  81          1HG       MET  81   0.415  -2.990 -11.285
  602   1HE   MET  81          1HE       MET  81   0.223  -2.825 -14.944
  603   2HE   MET  81          2HE       MET  81   0.105  -1.888 -13.457
  604   3HE   MET  81          3HE       MET  81  -1.354  -2.271 -14.367
  605    H    VAL  82           H        VAL  82   2.121  -3.536 -10.964
  606    HA   VAL  82           HA       VAL  82   2.979  -5.824 -12.512
  607    HB   VAL  82           HB       VAL  82   4.730  -4.179 -13.401
  608   1HG1  VAL  82          1HG1      VAL  82   3.129  -4.271 -14.987
  609   2HG1  VAL  82          2HG1      VAL  82   2.533  -2.758 -14.304
  610   3HG1  VAL  82          3HG1      VAL  82   1.834  -4.293 -13.792
  611   1HG2  VAL  82          1HG2      VAL  82   4.541  -2.629 -11.416
  612   2HG2  VAL  82          2HG2      VAL  82   2.941  -2.172 -12.002
  613   3HG2  VAL  82          3HG2      VAL  82   4.368  -1.829 -12.977
  614    H    ARG  83           H        ARG  83   4.226  -4.044  -9.731
  615    HA   ARG  83           HA       ARG  83   6.862  -5.100  -9.774
  616   1HB   ARG  83          2HB       ARG  83   6.935  -4.492  -7.360
  617   2HB   ARG  83          1HB       ARG  83   6.372  -3.175  -8.387
  618   1HG   ARG  83          2HG       ARG  83   4.371  -3.114  -7.352
  619   2HG   ARG  83          1HG       ARG  83   4.164  -4.857  -7.505
  620   1HD   ARG  83          2HD       ARG  83   5.907  -4.995  -5.575
  621   2HD   ARG  83          1HD       ARG  83   5.506  -3.304  -5.303
  622    HE   ARG  83           HE       ARG  83   3.413  -3.962  -4.506
  623   1HH1  ARG  83          2HH1      ARG  83   5.063  -6.645  -6.015
  624   2HH1  ARG  83          1HH1      ARG  83   3.916  -7.817  -5.471
  625   1HH2  ARG  83          1HH2      ARG  83   1.918  -5.521  -3.810
  626   2HH2  ARG  83          2HH2      ARG  83   2.139  -7.186  -4.231
  627    H    CYS  84           H        CYS  84   3.864  -6.606  -9.080
  628    HA   CYS  84           HA       CYS  84   4.816  -8.596  -7.237
  629   1HB   CYS  84          2HB       CYS  84   2.351  -7.775  -7.800
  630   2HB   CYS  84          1HB       CYS  84   2.434  -9.100  -8.961
  631    HG   CYS  84           HG       CYS  84   2.995 -10.716  -6.930
  632    H    MET  85           H        MET  85   5.136  -8.145 -10.614
  633    HA   MET  85           HA       MET  85   5.026 -10.673 -11.718
  634   1HB   MET  85          2HB       MET  85   6.579  -9.882 -13.404
  635   2HB   MET  85          1HB       MET  85   5.475  -8.576 -12.973
  636   1HG   MET  85          2HG       MET  85   7.384  -7.357 -12.747
  637   2HG   MET  85          1HG       MET  85   7.486  -8.149 -11.176
  638   1HE   MET  85          1HE       MET  85   9.855  -7.873 -10.874
  639   2HE   MET  85          2HE       MET  85  10.101  -6.999 -12.385
  640   3HE   MET  85          3HE       MET  85  11.157  -8.349 -11.974
  641    H    LYS  86           H        LYS  86   7.488  -9.354  -9.575
  642    HA   LYS  86           HA       LYS  86   9.557 -11.213 -10.036
  643   1HB   LYS  86          2HB       LYS  86  10.330 -10.631  -7.742
  644   2HB   LYS  86          1HB       LYS  86   9.969  -9.210  -8.719
  645   1HG   LYS  86          2HG       LYS  86   8.724  -8.561  -6.927
  646   2HG   LYS  86          1HG       LYS  86   7.530  -9.695  -7.557
  647   1HD   LYS  86          2HD       LYS  86   9.166 -11.375  -6.142
  648   2HD   LYS  86          1HD       LYS  86   9.252  -9.907  -5.168
  649   1HE   LYS  86          2HE       LYS  86   6.697  -9.835  -5.312
  650   2HE   LYS  86          1HE       LYS  86   6.786 -11.477  -5.948
  651   1HZ   LYS  86          1HZ       LYS  86   7.890 -12.196  -3.966
  652   2HZ   LYS  86          2HZ       LYS  86   6.469 -11.379  -3.520
  653   3HZ   LYS  86          3HZ       LYS  86   7.975 -10.610  -3.368
  654    H    ASP  87           H        ASP  87  10.227 -13.026  -8.729
  655    HA   ASP  87           HA       ASP  87   8.025 -14.393  -7.308
  656   1HB   ASP  87          2HB       ASP  87   9.826 -15.557  -9.440
  657   2HB   ASP  87          1HB       ASP  87   8.885 -16.548  -8.326
  658    H    ASP  88           H        ASP  88   8.798 -14.174  -5.274
  659    HA   ASP  88           HA       ASP  88  11.580 -15.001  -4.730
  660   1HB   ASP  88          2HB       ASP  88   9.633 -13.218  -3.303
  661   2HB   ASP  88          1HB       ASP  88  10.910 -14.016  -2.385
  662    H    SER  89           HN       SER  89  11.167 -17.247  -4.900
  663    HA   SER  89           HA       SER  89  10.098 -18.407  -2.439
  664   1HB   SER  89          2HB       SER  89   8.860 -18.791  -5.135
  665   2HB   SER  89          1HB       SER  89   8.926 -20.165  -4.035
  666    HG   SER  89           HG       SER  89   7.253 -18.106  -4.010
  Start of MODEL   35
    1   1H    MET   1          1H        MET   1  14.636   4.679 -18.033
    2   2H    MET   1          2H        MET   1  13.734   5.199 -16.690
    3   3H    MET   1          3H        MET   1  14.002   6.252 -17.996
    4    HA   MET   1           HA       MET   1  11.755   5.409 -18.083
    5   1HB   MET   1          2HB       MET   1  13.791   4.781 -20.151
    6   2HB   MET   1          1HB       MET   1  12.236   3.969 -20.339
    7   1HG   MET   1          2HG       MET   1  11.609   5.899 -21.369
    8   2HG   MET   1          1HG       MET   1  11.431   6.514 -19.727
    9   1HE   MET   1          1HE       MET   1  12.857   9.560 -21.364
   10   2HE   MET   1          2HE       MET   1  11.426   8.573 -21.079
   11   3HE   MET   1          3HE       MET   1  12.326   8.395 -22.584
   12    H    ASN   2           H        ASN   2  10.330   3.615 -18.256
   13    HA   ASN   2           HA       ASN   2  11.473   1.016 -17.409
   14   1HB   ASN   2          2HB       ASN   2   9.225   2.593 -16.229
   15   2HB   ASN   2          1HB       ASN   2   9.097   0.833 -16.246
   16   1HD2  ASN   2          1HD2      ASN   2  11.312  -0.271 -15.472
   17   2HD2  ASN   2          2HD2      ASN   2  12.012   0.433 -14.096
   18    H    ASP   3           H        ASP   3  10.524  -0.821 -18.243
   19    HA   ASP   3           HA       ASP   3   8.397  -0.410 -20.261
   20   1HB   ASP   3          2HB       ASP   3  11.030  -1.814 -20.530
   21   2HB   ASP   3          1HB       ASP   3   9.644  -2.386 -21.458
   22    H    ILE   4           H        ILE   4   8.838  -1.727 -17.357
   23    HA   ILE   4           HA       ILE   4   7.817  -4.402 -17.911
   24    HB   ILE   4           HB       ILE   4   8.034  -4.885 -15.613
   25   1HG1  ILE   4          2HG1      ILE   4   6.877  -2.712 -14.893
   26   2HG1  ILE   4          1HG1      ILE   4   8.157  -3.306 -13.840
   27   1HG2  ILE   4          1HG2      ILE   4  10.187  -4.684 -16.734
   28   2HG2  ILE   4          2HG2      ILE   4  10.334  -4.137 -15.064
   29   3HG2  ILE   4          3HG2      ILE   4  10.246  -2.959 -16.373
   30   1HD1  ILE   4          1HD1      ILE   4   8.796  -1.092 -14.004
   31   2HD1  ILE   4          2HD1      ILE   4   8.123  -0.906 -15.622
   32   3HD1  ILE   4          3HD1      ILE   4   9.662  -1.736 -15.397
   33    H    TYR   5           H        TYR   5   6.606  -1.265 -17.011
   34    HA   TYR   5           HA       TYR   5   4.080  -2.098 -15.972
   35   1HB   TYR   5          2HB       TYR   5   4.647   0.542 -17.335
   36   2HB   TYR   5          1HB       TYR   5   3.434   0.197 -16.105
   37    HD1  TYR   5           HD1      TYR   5   4.819  -1.293 -14.063
   38    HD2  TYR   5           HD2      TYR   5   6.253   1.985 -16.439
   39    HE1  TYR   5           HE1      TYR   5   6.448  -0.718 -12.289
   40    HE2  TYR   5           HE2      TYR   5   7.883   2.553 -14.667
   41    HH   TYR   5           HH       TYR   5   8.998   0.810 -12.559
   42    H    LYS   6           H        LYS   6   5.343  -1.418 -19.171
   43    HA   LYS   6           HA       LYS   6   2.764  -1.475 -20.489
   44   1HB   LYS   6          2HB       LYS   6   5.435  -1.854 -21.847
   45   2HB   LYS   6          1HB       LYS   6   3.949  -1.192 -22.525
   46   1HG   LYS   6          2HG       LYS   6   5.817   0.094 -20.524
   47   2HG   LYS   6          1HG       LYS   6   5.349   0.694 -22.114
   48   1HD   LYS   6          2HD       LYS   6   3.102   1.140 -21.369
   49   2HD   LYS   6          1HD       LYS   6   3.387   0.309 -19.839
   50   1HE   LYS   6          2HE       LYS   6   4.773   2.022 -19.021
   51   2HE   LYS   6          1HE       LYS   6   5.093   2.663 -20.632
   52   1HZ   LYS   6          1HZ       LYS   6   2.782   3.368 -20.768
   53   2HZ   LYS   6          2HZ       LYS   6   3.556   4.072 -19.430
   54   3HZ   LYS   6          3HZ       LYS   6   2.489   2.769 -19.208
   55    H    ALA   7           H        ALA   7   5.459  -3.687 -19.965
   56    HA   ALA   7           HA       ALA   7   4.422  -5.810 -21.588
   57   1HB   ALA   7          1HB       ALA   7   6.850  -5.381 -20.564
   58   2HB   ALA   7          2HB       ALA   7   6.278  -7.003 -20.952
   59   3HB   ALA   7          3HB       ALA   7   6.218  -6.422 -19.289
   60    H    ALA   8           H        ALA   8   3.988  -4.809 -18.249
   61    HA   ALA   8           HA       ALA   8   2.699  -7.278 -17.448
   62   1HB   ALA   8          1HB       ALA   8   3.074  -4.613 -16.082
   63   2HB   ALA   8          2HB       ALA   8   3.878  -6.141 -15.719
   64   3HB   ALA   8          3HB       ALA   8   2.161  -5.941 -15.365
   65    H    VAL   9           H        VAL   9   1.714  -4.021 -18.458
   66    HA   VAL   9           HA       VAL   9  -0.998  -4.153 -17.738
   67    HB   VAL   9           HB       VAL   9   0.395  -2.162 -18.711
   68   1HG1  VAL   9          1HG1      VAL   9   0.485  -3.645 -20.963
   69   2HG1  VAL   9          2HG1      VAL   9   0.512  -1.884 -20.984
   70   3HG1  VAL   9          3HG1      VAL   9  -0.998  -2.745 -21.273
   71   1HG2  VAL   9          1HG2      VAL   9  -2.500  -2.628 -19.484
   72   2HG2  VAL   9          2HG2      VAL   9  -1.707  -1.057 -19.383
   73   3HG2  VAL   9          3HG2      VAL   9  -1.937  -2.024 -17.925
   74    H    GLU  10           H        GLU  10   0.736  -5.658 -20.370
   75    HA   GLU  10           HA       GLU  10  -1.506  -6.284 -22.019
   76   1HB   GLU  10          2HB       GLU  10   1.226  -7.569 -21.774
   77   2HB   GLU  10          1HB       GLU  10   0.033  -8.021 -22.991
   78   1HG   GLU  10          2HG       GLU  10   0.864  -5.142 -22.658
   79   2HG   GLU  10          1HG       GLU  10   1.832  -6.250 -23.630
   80    H    GLN  11           H        GLN  11  -0.088  -7.743 -19.157
   81    HA   GLN  11           HA       GLN  11  -1.489 -10.260 -19.437
   82   1HB   GLN  11          2HB       GLN  11  -0.105  -9.087 -17.011
   83   2HB   GLN  11          1HB       GLN  11  -0.637 -10.757 -17.196
   84   1HG   GLN  11          2HG       GLN  11   1.328  -9.447 -19.093
   85   2HG   GLN  11          1HG       GLN  11   1.835 -10.335 -17.657
   86   1HE2  GLN  11          1HE2      GLN  11   1.038 -10.698 -20.954
   87   2HE2  GLN  11          2HE2      GLN  11   0.845 -12.384 -20.966
   88    H    LEU  12           H        LEU  12  -1.779  -7.373 -17.398
   89    HA   LEU  12           HA       LEU  12  -4.237  -8.282 -16.170
   90   1HB   LEU  12          2HB       LEU  12  -2.979  -5.539 -16.115
   91   2HB   LEU  12          1HB       LEU  12  -4.231  -6.132 -15.051
   92    HG   LEU  12           HG       LEU  12  -2.046  -7.925 -14.810
   93   1HD1  LEU  12          1HD1      LEU  12  -0.635  -5.754 -13.819
   94   2HD1  LEU  12          2HD1      LEU  12  -1.237  -5.160 -15.367
   95   3HD1  LEU  12          3HD1      LEU  12  -0.259  -6.626 -15.304
   96   1HD2  LEU  12          1HD2      LEU  12  -3.421  -5.853 -13.122
   97   2HD2  LEU  12          2HD2      LEU  12  -1.969  -6.639 -12.505
   98   3HD2  LEU  12          3HD2      LEU  12  -3.385  -7.604 -12.923
   99    H    THR  13           H        THR  13  -6.034  -6.435 -16.113
  100    HA   THR  13           HA       THR  13  -6.588  -5.635 -18.912
  101    HB   THR  13           HB       THR  13  -9.081  -5.891 -17.924
  102    HG1  THR  13           HG1      THR  13  -8.965  -6.941 -16.121
  103   1HG2  THR  13          1HG2      THR  13  -9.070  -8.173 -18.998
  104   2HG2  THR  13          2HG2      THR  13  -7.321  -8.018 -19.153
  105   3HG2  THR  13          3HG2      THR  13  -8.384  -6.888 -19.991
  106    H    ASP  14           H        ASP  14  -8.399  -3.967 -18.997
  107    HA   ASP  14           HA       ASP  14  -7.602  -1.619 -17.637
  108   1HB   ASP  14          2HB       ASP  14 -10.107  -2.324 -19.174
  109   2HB   ASP  14          1HB       ASP  14  -9.845  -0.727 -18.473
  110    H    GLU  15           H        GLU  15  -9.983  -4.096 -16.928
  111    HA   GLU  15           HA       GLU  15 -11.571  -2.814 -15.021
  112   1HB   GLU  15          2HB       GLU  15 -10.734  -5.678 -15.397
  113   2HB   GLU  15          1HB       GLU  15 -11.717  -5.206 -14.011
  114   1HG   GLU  15          2HG       GLU  15 -12.492  -4.371 -16.802
  115   2HG   GLU  15          1HG       GLU  15 -12.940  -5.958 -16.180
  116    H    GLN  16           H        GLN  16  -8.390  -4.358 -14.661
  117    HA   GLN  16           HA       GLN  16  -8.221  -4.265 -11.840
  118   1HB   GLN  16          2HB       GLN  16  -6.250  -4.464 -14.070
  119   2HB   GLN  16          1HB       GLN  16  -5.638  -3.992 -12.485
  120   1HG   GLN  16          2HG       GLN  16  -7.525  -6.309 -12.621
  121   2HG   GLN  16          1HG       GLN  16  -5.868  -6.561 -13.167
  122   1HE2  GLN  16          1HE2      GLN  16  -4.955  -7.694 -11.408
  123   2HE2  GLN  16          2HE2      GLN  16  -4.943  -7.113  -9.813
  124    H    LYS  17           H        LYS  17  -7.249  -1.916 -14.333
  125    HA   LYS  17           HA       LYS  17  -6.242   0.040 -12.514
  126   1HB   LYS  17          2HB       LYS  17  -7.049   0.039 -15.399
  127   2HB   LYS  17          1HB       LYS  17  -6.828   1.584 -14.578
  128   1HG   LYS  17          2HG       LYS  17  -4.614   1.364 -14.948
  129   2HG   LYS  17          1HG       LYS  17  -4.625   0.037 -13.786
  130   1HD   LYS  17          2HD       LYS  17  -3.892  -1.220 -15.531
  131   2HD   LYS  17          1HD       LYS  17  -5.581  -1.207 -16.037
  132   1HE   LYS  17          2HE       LYS  17  -3.689   1.002 -16.849
  133   2HE   LYS  17          1HE       LYS  17  -3.803  -0.492 -17.778
  134   1HZ   LYS  17          1HZ       LYS  17  -5.948   1.481 -17.239
  135   2HZ   LYS  17          2HZ       LYS  17  -6.267  -0.076 -17.842
  136   3HZ   LYS  17          3HZ       LYS  17  -5.318   1.009 -18.740
  137    H    ASN  18           H        ASN  18  -9.421  -0.674 -13.857
  138    HA   ASN  18           HA       ASN  18 -10.764   1.698 -13.093
  139   1HB   ASN  18          2HB       ASN  18 -11.556  -1.054 -13.884
  140   2HB   ASN  18          1HB       ASN  18 -12.740  -0.143 -12.947
  141   1HD2  ASN  18          1HD2      ASN  18 -10.664   0.144 -15.877
  142   2HD2  ASN  18          2HD2      ASN  18 -11.716   1.195 -16.695
  143    H    GLU  19           H        GLU  19 -10.284  -1.417 -11.445
  144    HA   GLU  19           HA       GLU  19 -11.753  -0.777  -9.089
  145   1HB   GLU  19          2HB       GLU  19  -9.449  -2.724  -9.412
  146   2HB   GLU  19          1HB       GLU  19 -10.588  -2.681  -8.068
  147   1HG   GLU  19          2HG       GLU  19 -11.572  -2.957 -10.901
  148   2HG   GLU  19          1HG       GLU  19 -11.022  -4.369 -10.002
  149    H    PHE  20           H        PHE  20  -8.343  -0.533 -10.004
  150    HA   PHE  20           HA       PHE  20  -7.270   0.331  -7.555
  151   1HB   PHE  20          2HB       PHE  20  -6.461   0.655 -10.425
  152   2HB   PHE  20          1HB       PHE  20  -5.600   1.551  -9.180
  153    HD1  PHE  20           HD1      PHE  20  -3.550   0.283  -9.770
  154    HD2  PHE  20           HD2      PHE  20  -7.058  -1.678  -8.252
  155    HE1  PHE  20           HE1      PHE  20  -2.204  -1.721  -9.250
  156    HE2  PHE  20           HE2      PHE  20  -5.708  -3.686  -7.730
  157    HZ   PHE  20           HZ       PHE  20  -3.277  -3.712  -8.228
  158    H    LYS  21           H        LYS  21  -8.698   2.171 -10.243
  159    HA   LYS  21           HA       LYS  21  -8.149   4.757  -9.239
  160   1HB   LYS  21          2HB       LYS  21  -8.855   4.278 -11.586
  161   2HB   LYS  21          1HB       LYS  21 -10.477   3.932 -10.991
  162   1HG   LYS  21          2HG       LYS  21 -10.270   6.268 -11.823
  163   2HG   LYS  21          1HG       LYS  21 -10.673   6.210 -10.108
  164   1HD   LYS  21          2HD       LYS  21  -8.397   6.680  -9.475
  165   2HD   LYS  21          1HD       LYS  21  -7.836   6.480 -11.137
  166   1HE   LYS  21          2HE       LYS  21  -8.676   8.524 -11.817
  167   2HE   LYS  21          1HE       LYS  21  -9.964   8.513 -10.613
  168   1HZ   LYS  21          1HZ       LYS  21  -8.214  10.136 -10.113
  169   2HZ   LYS  21          2HZ       LYS  21  -7.079   8.876 -10.006
  170   3HZ   LYS  21          3HZ       LYS  21  -8.362   8.965  -8.896
  171    H    ALA  22           H        ALA  22 -11.074   2.722  -8.990
  172    HA   ALA  22           HA       ALA  22 -12.562   4.544  -7.400
  173   1HB   ALA  22          1HB       ALA  22 -12.817   1.529  -7.438
  174   2HB   ALA  22          2HB       ALA  22 -13.549   2.601  -8.631
  175   3HB   ALA  22          3HB       ALA  22 -14.046   2.690  -6.941
  176    H    ALA  23           H        ALA  23 -10.516   1.754  -6.570
  177    HA   ALA  23           HA       ALA  23 -10.879   1.814  -3.775
  178   1HB   ALA  23          1HB       ALA  23  -8.656   0.618  -3.713
  179   2HB   ALA  23          2HB       ALA  23  -8.560   0.847  -5.459
  180   3HB   ALA  23          3HB       ALA  23  -9.862  -0.121  -4.767
  181    H    PHE  24           H        PHE  24  -8.942   3.790  -5.902
  182    HA   PHE  24           HA       PHE  24  -7.272   4.859  -3.781
  183   1HB   PHE  24          2HB       PHE  24  -6.710   4.595  -6.337
  184   2HB   PHE  24          1HB       PHE  24  -7.561   6.129  -6.489
  185    HD1  PHE  24           HD1      PHE  24  -4.615   4.424  -5.080
  186    HD2  PHE  24           HD2      PHE  24  -6.662   8.182  -5.495
  187    HE1  PHE  24           HE1      PHE  24  -2.587   5.617  -4.300
  188    HE2  PHE  24           HE2      PHE  24  -4.633   9.371  -4.717
  189    HZ   PHE  24           HZ       PHE  24  -2.599   8.090  -4.119
  190    H    ASP  25           H        ASP  25  -9.740   6.181  -6.003
  191    HA   ASP  25           HA       ASP  25  -9.962   8.729  -4.919
  192   1HB   ASP  25          2HB       ASP  25 -11.099   7.580  -7.020
  193   2HB   ASP  25          1HB       ASP  25 -12.448   7.401  -5.900
  194    H    ILE  26           H        ILE  26 -11.662   5.759  -3.886
  195    HA   ILE  26           HA       ILE  26 -13.501   6.951  -2.133
  196    HB   ILE  26           HB       ILE  26 -13.540   4.774  -0.942
  197   1HG1  ILE  26          2HG1      ILE  26 -11.264   4.088  -2.833
  198   2HG1  ILE  26          1HG1      ILE  26 -11.119   4.287  -1.090
  199   1HG2  ILE  26          1HG2      ILE  26 -14.987   4.497  -2.672
  200   2HG2  ILE  26          2HG2      ILE  26 -13.725   3.468  -3.349
  201   3HG2  ILE  26          3HG2      ILE  26 -13.852   5.153  -3.852
  202   1HD1  ILE  26          1HD1      ILE  26 -12.888   2.458  -0.870
  203   2HD1  ILE  26          2HD1      ILE  26 -11.306   1.939  -1.453
  204   3HD1  ILE  26          3HD1      ILE  26 -12.638   2.151  -2.590
  205    H    PHE  27           H        PHE  27 -10.090   6.192  -1.700
  206    HA   PHE  27           HA       PHE  27 -10.143   6.897   1.130
  207   1HB   PHE  27          2HB       PHE  27  -8.098   5.799  -0.753
  208   2HB   PHE  27          1HB       PHE  27  -7.541   6.646   0.691
  209    HD1  PHE  27           HD1      PHE  27  -9.424   3.733  -0.570
  210    HD2  PHE  27           HD2      PHE  27  -7.957   5.759   2.921
  211    HE1  PHE  27           HE1      PHE  27  -9.917   1.726   0.799
  212    HE2  PHE  27           HE2      PHE  27  -8.450   3.752   4.291
  213    HZ   PHE  27           HZ       PHE  27  -9.431   1.735   3.230
  214    H    ILE  28           H        ILE  28  -9.334   8.369  -1.952
  215    HA   ILE  28           HA       ILE  28  -8.038  10.661  -0.661
  216    HB   ILE  28           HB       ILE  28  -8.590  10.320  -3.611
  217   1HG1  ILE  28          2HG1      ILE  28  -7.298   8.414  -3.253
  218   2HG1  ILE  28          1HG1      ILE  28  -6.059   9.624  -3.548
  219   1HG2  ILE  28          1HG2      ILE  28  -6.326  11.666  -3.548
  220   2HG2  ILE  28          2HG2      ILE  28  -6.860  12.090  -1.920
  221   3HG2  ILE  28          3HG2      ILE  28  -7.860  12.504  -3.313
  222   1HD1  ILE  28          1HD1      ILE  28  -6.865   8.345  -0.955
  223   2HD1  ILE  28          2HD1      ILE  28  -6.158   9.960  -0.941
  224   3HD1  ILE  28          3HD1      ILE  28  -5.250   8.605  -1.612
  225    H    GLN  29           H        GLN  29 -11.002  10.011  -0.421
  226    HA   GLN  29           HA       GLN  29 -12.478  11.925  -1.910
  227   1HB   GLN  29          2HB       GLN  29 -14.225  11.636  -0.123
  228   2HB   GLN  29          1HB       GLN  29 -13.694  10.134  -0.874
  229   1HG   GLN  29          2HG       GLN  29 -12.264   9.620   1.017
  230   2HG   GLN  29          1HG       GLN  29 -12.579  11.198   1.737
  231   1HE2  GLN  29          1HE2      GLN  29 -13.943   7.988   1.183
  232   2HE2  GLN  29          2HE2      GLN  29 -15.312   8.206   2.163
  233    H    ASP  30           H        ASP  30 -10.689  12.094   1.111
  234    HA   ASP  30           HA       ASP  30 -10.788  15.004   1.015
  235   1HB   ASP  30          2HB       ASP  30 -11.290  14.986   3.572
  236   2HB   ASP  30          1HB       ASP  30 -12.632  14.857   2.440
  237    H    ALA  31           H        ALA  31  -8.700  13.264   0.474
  238    HA   ALA  31           HA       ALA  31  -7.010  12.763   2.713
  239   1HB   ALA  31          1HB       ALA  31  -6.689  11.535   0.639
  240   2HB   ALA  31          2HB       ALA  31  -5.230  12.457   1.000
  241   3HB   ALA  31          3HB       ALA  31  -6.355  13.032  -0.230
  242    H    GLU  32           H        GLU  32  -4.928  13.775   3.106
  243    HA   GLU  32           HA       GLU  32  -5.162  16.649   3.250
  244   1HB   GLU  32          2HB       GLU  32  -2.990  14.729   4.111
  245   2HB   GLU  32          1HB       GLU  32  -2.882  16.475   4.335
  246   1HG   GLU  32          2HG       GLU  32  -5.311  14.981   5.302
  247   2HG   GLU  32          1HG       GLU  32  -3.843  15.009   6.279
  248    H    ASP  33           H        ASP  33  -2.991  14.362   1.601
  249    HA   ASP  33           HA       ASP  33  -2.001  16.599  -0.068
  250   1HB   ASP  33          2HB       ASP  33  -0.722  14.016   0.802
  251   2HB   ASP  33          1HB       ASP  33  -0.114  14.924  -0.582
  252    H    GLY  34           H        GLY  34  -4.315  14.323  -0.266
  253   1HA   GLY  34          2HA       GLY  34  -5.506  13.564  -2.106
  254   2HA   GLY  34          1HA       GLY  34  -4.286  14.281  -3.151
  255    H    CYS  35           H        CYS  35  -3.595  11.986  -0.564
  256    HA   CYS  35           HA       CYS  35  -3.378   9.716  -2.361
  257   1HB   CYS  35          2HB       CYS  35  -0.863   9.538  -1.354
  258   2HB   CYS  35          1HB       CYS  35  -1.232  10.214  -2.938
  259    HG   CYS  35           HG       CYS  35  -0.815  11.990  -0.389
  260    H    ILE  36           H        ILE  36  -2.280   7.815  -1.074
  261    HA   ILE  36           HA       ILE  36  -3.525   7.822   1.602
  262    HB   ILE  36           HB       ILE  36  -3.361   5.353   1.462
  263   1HG1  ILE  36          2HG1      ILE  36  -2.916   4.970  -1.302
  264   2HG1  ILE  36          1HG1      ILE  36  -1.612   6.020  -0.748
  265   1HG2  ILE  36          1HG2      ILE  36  -4.636   6.484  -1.040
  266   2HG2  ILE  36          2HG2      ILE  36  -5.335   6.683   0.567
  267   3HG2  ILE  36          3HG2      ILE  36  -5.144   5.069  -0.118
  268   1HD1  ILE  36          1HD1      ILE  36  -2.064   3.957   1.208
  269   2HD1  ILE  36          2HD1      ILE  36  -0.605   4.297   0.278
  270   3HD1  ILE  36          3HD1      ILE  36  -1.838   3.222  -0.381
  271    H    SER  37           H        SER  37  -2.260   6.098   3.081
  272    HA   SER  37           HA       SER  37   0.435   7.217   3.353
  273   1HB   SER  37          2HB       SER  37  -1.423   6.814   5.249
  274   2HB   SER  37          1HB       SER  37  -0.616   5.252   5.325
  275    HG   SER  37           HG       SER  37   0.281   6.971   6.677
  276    H    THR  38           H        THR  38   2.283   6.023   3.287
  277    HA   THR  38           HA       THR  38   2.477   3.806   1.619
  278    HB   THR  38           HB       THR  38   4.728   3.429   2.830
  279    HG1  THR  38           HG1      THR  38   4.794   4.428   4.668
  280   1HG2  THR  38          1HG2      THR  38   5.539   5.734   1.943
  281   2HG2  THR  38          2HG2      THR  38   3.864   5.950   1.435
  282   3HG2  THR  38          3HG2      THR  38   4.812   4.605   0.800
  283    H    LYS  39           H        LYS  39   2.593   3.846   5.189
  284    HA   LYS  39           HA       LYS  39   2.629   1.019   5.483
  285   1HB   LYS  39          2HB       LYS  39   2.168   1.453   7.848
  286   2HB   LYS  39          1HB       LYS  39   3.408   2.550   7.243
  287   1HG   LYS  39          2HG       LYS  39   0.719   3.642   6.894
  288   2HG   LYS  39          1HG       LYS  39   1.083   3.299   8.583
  289   1HD   LYS  39          2HD       LYS  39   3.409   4.458   7.889
  290   2HD   LYS  39          1HD       LYS  39   2.348   5.261   6.731
  291   1HE   LYS  39          2HE       LYS  39   0.830   5.875   8.626
  292   2HE   LYS  39          1HE       LYS  39   2.010   5.192   9.743
  293   1HZ   LYS  39          1HZ       LYS  39   2.317   7.567   9.524
  294   2HZ   LYS  39          2HZ       LYS  39   2.493   7.423   7.840
  295   3HZ   LYS  39          3HZ       LYS  39   3.657   6.751   8.880
  296    H    GLU  40           H        GLU  40   0.044   3.267   4.881
  297    HA   GLU  40           HA       GLU  40  -2.022   1.422   5.811
  298   1HB   GLU  40          2HB       GLU  40  -2.086   4.208   4.660
  299   2HB   GLU  40          1HB       GLU  40  -3.550   3.262   4.914
  300   1HG   GLU  40          2HG       GLU  40  -2.717   2.927   7.325
  301   2HG   GLU  40          1HG       GLU  40  -1.569   4.221   6.982
  302    H    LEU  41           H        LEU  41  -0.149   1.274   3.189
  303    HA   LEU  41           HA       LEU  41  -1.970   1.236   1.006
  304   1HB   LEU  41          2HB       LEU  41   0.797   0.802   1.378
  305   2HB   LEU  41          1HB       LEU  41   0.163  -0.639   0.614
  306    HG   LEU  41           HG       LEU  41  -0.054   2.192  -0.410
  307   1HD1  LEU  41          1HD1      LEU  41   2.133   1.349  -0.845
  308   2HD1  LEU  41          2HD1      LEU  41   1.233   1.105  -2.341
  309   3HD1  LEU  41          3HD1      LEU  41   1.513  -0.252  -1.250
  310   1HD2  LEU  41          1HD2      LEU  41  -2.095   0.940  -0.922
  311   2HD2  LEU  41          2HD2      LEU  41  -1.138  -0.411  -1.527
  312   3HD2  LEU  41          3HD2      LEU  41  -1.132   1.128  -2.388
  313    H    GLY  42           H        GLY  42  -0.852  -1.220   3.279
  314   1HA   GLY  42          2HA       GLY  42  -1.976  -3.496   2.055
  315   2HA   GLY  42          1HA       GLY  42  -1.628  -3.332   3.771
  316    H    LYS  43           H        LYS  43  -3.514  -0.841   3.660
  317    HA   LYS  43           HA       LYS  43  -5.894  -2.301   4.431
  318   1HB   LYS  43          2HB       LYS  43  -4.932  -0.207   5.581
  319   2HB   LYS  43          1HB       LYS  43  -5.645   0.696   4.245
  320   1HG   LYS  43          2HG       LYS  43  -7.371   0.726   5.807
  321   2HG   LYS  43          1HG       LYS  43  -7.807  -0.675   4.830
  322   1HD   LYS  43          2HD       LYS  43  -7.431  -2.126   6.536
  323   2HD   LYS  43          1HD       LYS  43  -5.959  -1.295   7.040
  324   1HE   LYS  43          2HE       LYS  43  -8.404   0.263   7.529
  325   2HE   LYS  43          1HE       LYS  43  -8.351  -1.258   8.420
  326   1HZ   LYS  43          1HZ       LYS  43  -6.165   0.753   8.378
  327   2HZ   LYS  43          2HZ       LYS  43  -6.217  -0.666   9.312
  328   3HZ   LYS  43          3HZ       LYS  43  -7.309   0.598   9.621
  329    H    VAL  44           H        VAL  44  -4.930  -0.050   1.842
  330    HA   VAL  44           HA       VAL  44  -7.552   0.057   0.675
  331    HB   VAL  44           HB       VAL  44  -6.401   1.144  -1.247
  332   1HG1  VAL  44          1HG1      VAL  44  -6.999   2.209   1.116
  333   2HG1  VAL  44          2HG1      VAL  44  -6.143   3.144  -0.110
  334   3HG1  VAL  44          3HG1      VAL  44  -5.248   2.396   1.214
  335   1HG2  VAL  44          1HG2      VAL  44  -4.011   1.579  -1.138
  336   2HG2  VAL  44          2HG2      VAL  44  -4.265  -0.162  -1.028
  337   3HG2  VAL  44          3HG2      VAL  44  -3.898   0.770   0.426
  338    H    MET  45           H        MET  45  -4.658  -1.913   0.151
  339    HA   MET  45           HA       MET  45  -5.623  -3.173  -2.249
  340   1HB   MET  45          2HB       MET  45  -3.488  -4.100  -0.310
  341   2HB   MET  45          1HB       MET  45  -3.764  -4.742  -1.930
  342   1HG   MET  45          2HG       MET  45  -3.340  -2.470  -2.863
  343   2HG   MET  45          1HG       MET  45  -2.965  -1.902  -1.238
  344   1HE   MET  45          1HE       MET  45  -0.385  -4.209  -0.013
  345   2HE   MET  45          2HE       MET  45  -1.673  -3.037   0.260
  346   3HE   MET  45          3HE       MET  45  -0.065  -2.478  -0.194
  347    H    ARG  46           H        ARG  46  -6.017  -3.707   1.168
  348    HA   ARG  46           HA       ARG  46  -6.752  -6.429   1.178
  349   1HB   ARG  46          2HB       ARG  46  -6.933  -4.172   3.025
  350   2HB   ARG  46          1HB       ARG  46  -8.307  -5.269   3.163
  351   1HG   ARG  46          2HG       ARG  46  -6.973  -7.085   3.765
  352   2HG   ARG  46          1HG       ARG  46  -5.531  -6.407   3.008
  353   1HD   ARG  46          2HD       ARG  46  -4.907  -5.565   4.992
  354   2HD   ARG  46          1HD       ARG  46  -6.352  -4.562   5.003
  355    HE   ARG  46           HE       ARG  46  -7.075  -7.143   5.864
  356   1HH1  ARG  46          2HH1      ARG  46  -5.126  -4.429   6.883
  357   2HH1  ARG  46          1HH1      ARG  46  -5.315  -4.766   8.570
  358   1HH2  ARG  46          1HH2      ARG  46  -7.306  -7.567   8.082
  359   2HH2  ARG  46          2HH2      ARG  46  -6.544  -6.536   9.247
  360    H    MET  47           H        MET  47  -8.641  -3.475   0.650
  361    HA   MET  47           HA       MET  47 -11.196  -4.716   0.536
  362   1HB   MET  47          2HB       MET  47 -10.145  -2.106  -0.563
  363   2HB   MET  47          1HB       MET  47 -11.822  -2.612  -0.767
  364   1HG   MET  47          2HG       MET  47 -10.521  -2.573   1.958
  365   2HG   MET  47          1HG       MET  47 -11.269  -1.129   1.277
  366   1HE   MET  47          1HE       MET  47 -12.593  -0.688   2.820
  367   2HE   MET  47          2HE       MET  47 -13.867  -1.620   3.600
  368   3HE   MET  47          3HE       MET  47 -14.186  -0.819   2.064
  369    H    LEU  48           H        LEU  48  -8.660  -4.182  -1.860
  370    HA   LEU  48           HA       LEU  48 -10.169  -4.716  -4.194
  371   1HB   LEU  48          2HB       LEU  48  -7.272  -4.802  -3.496
  372   2HB   LEU  48          1HB       LEU  48  -7.788  -5.566  -4.983
  373    HG   LEU  48           HG       LEU  48  -8.556  -2.718  -4.392
  374   1HD1  LEU  48          1HD1      LEU  48  -6.123  -2.836  -4.087
  375   2HD1  LEU  48          2HD1      LEU  48  -6.504  -2.023  -5.605
  376   3HD1  LEU  48          3HD1      LEU  48  -5.958  -3.701  -5.616
  377   1HD2  LEU  48          1HD2      LEU  48  -9.507  -4.135  -6.316
  378   2HD2  LEU  48          2HD2      LEU  48  -7.890  -4.074  -7.015
  379   3HD2  LEU  48          3HD2      LEU  48  -8.798  -2.583  -6.762
  380    H    GLY  49           H        GLY  49  -7.927  -6.889  -2.433
  381   1HA   GLY  49          2HA       GLY  49  -9.446  -9.120  -2.117
  382   2HA   GLY  49          1HA       GLY  49  -8.960  -9.226  -3.806
  383    H    GLN  50           H        GLN  50  -7.352  -8.296  -0.749
  384    HA   GLN  50           HA       GLN  50  -5.437 -10.480  -1.014
  385   1HB   GLN  50          2HB       GLN  50  -4.763  -7.649  -1.611
  386   2HB   GLN  50          1HB       GLN  50  -3.626  -8.524  -0.585
  387   1HG   GLN  50          2HG       GLN  50  -3.623 -10.371  -2.306
  388   2HG   GLN  50          1HG       GLN  50  -4.570  -9.315  -3.355
  389   1HE2  GLN  50          1HE2      GLN  50  -1.361  -9.876  -2.018
  390   2HE2  GLN  50          2HE2      GLN  50  -0.582  -8.653  -2.899
  391    H    ASN  51           H        ASN  51  -4.052 -10.688   0.893
  392    HA   ASN  51           HA       ASN  51  -4.681  -9.050   3.210
  393   1HB   ASN  51          2HB       ASN  51  -6.439 -11.023   2.869
  394   2HB   ASN  51          1HB       ASN  51  -5.167 -11.962   3.649
  395   1HD2  ASN  51          1HD2      ASN  51  -5.666 -12.108   5.845
  396   2HD2  ASN  51          2HD2      ASN  51  -6.219 -10.819   6.800
  397    HA   PRO  52           HA       PRO  52  -0.469 -11.023   3.272
  398   1HB   PRO  52          2HB       PRO  52   0.977  -8.736   2.891
  399   2HB   PRO  52          1HB       PRO  52   0.380  -9.739   1.564
  400   1HG   PRO  52          2HG       PRO  52  -0.565  -7.105   2.499
  401   2HG   PRO  52          1HG       PRO  52  -0.707  -7.847   0.900
  402   1HD   PRO  52          2HD       PRO  52  -2.745  -7.673   2.887
  403   2HD   PRO  52          1HD       PRO  52  -2.813  -8.593   1.366
  404    H    THR  53           H        THR  53   1.576  -9.773   4.535
  405    HA   THR  53           HA       THR  53   0.456  -9.106   7.184
  406    HB   THR  53           HB       THR  53   2.481  -9.846   8.151
  407    HG1  THR  53           HG1      THR  53   4.348  -9.720   7.170
  408   1HG2  THR  53          1HG2      THR  53   1.195 -11.726   7.278
  409   2HG2  THR  53          2HG2      THR  53   2.920 -12.062   7.128
  410   3HG2  THR  53          3HG2      THR  53   1.990 -11.570   5.712
  411    HA   PRO  54           HA       PRO  54   1.820  -4.939   6.895
  412   1HB   PRO  54          2HB       PRO  54   2.928  -4.493   9.367
  413   2HB   PRO  54          1HB       PRO  54   1.185  -4.565   9.057
  414   1HG   PRO  54          2HG       PRO  54   2.984  -6.624  10.255
  415   2HG   PRO  54          1HG       PRO  54   1.293  -6.248  10.629
  416   1HD   PRO  54          2HD       PRO  54   2.082  -8.402   9.089
  417   2HD   PRO  54          1HD       PRO  54   0.484  -7.628   8.963
  418    H    GLU  55           H        GLU  55   4.168  -7.327   7.870
  419    HA   GLU  55           HA       GLU  55   6.480  -5.632   7.406
  420   1HB   GLU  55          2HB       GLU  55   6.496  -8.644   7.636
  421   2HB   GLU  55          1HB       GLU  55   7.802  -7.515   7.996
  422   1HG   GLU  55          2HG       GLU  55   6.218  -6.541   9.786
  423   2HG   GLU  55          1HG       GLU  55   5.273  -8.014   9.564
  424    H    GLU  56           H        GLU  56   4.643  -8.129   5.703
  425    HA   GLU  56           HA       GLU  56   6.497  -8.432   3.540
  426   1HB   GLU  56          2HB       GLU  56   3.629  -9.242   3.962
  427   2HB   GLU  56          1HB       GLU  56   4.408  -9.445   2.393
  428   1HG   GLU  56          2HG       GLU  56   5.621 -10.492   4.962
  429   2HG   GLU  56          1HG       GLU  56   4.540 -11.458   3.960
  430    H    LEU  57           H        LEU  57   3.271  -6.855   3.699
  431    HA   LEU  57           HA       LEU  57   3.344  -5.725   1.138
  432   1HB   LEU  57          2HB       LEU  57   1.652  -4.152   1.934
  433   2HB   LEU  57          1HB       LEU  57   1.297  -5.797   2.401
  434    HG   LEU  57           HG       LEU  57   2.547  -4.979   4.645
  435   1HD1  LEU  57          1HD1      LEU  57   1.490  -2.517   3.266
  436   2HD1  LEU  57          2HD1      LEU  57   3.008  -2.729   4.139
  437   3HD1  LEU  57          3HD1      LEU  57   1.487  -2.623   5.026
  438   1HD2  LEU  57          1HD2      LEU  57   0.205  -4.406   5.471
  439   2HD2  LEU  57          2HD2      LEU  57   0.355  -5.965   4.661
  440   3HD2  LEU  57          3HD2      LEU  57  -0.338  -4.590   3.804
  441    H    GLN  58           H        GLN  58   4.827  -4.629   4.129
  442    HA   GLN  58           HA       GLN  58   5.313  -1.949   3.569
  443   1HB   GLN  58          2HB       GLN  58   5.885  -3.288   5.697
  444   2HB   GLN  58          1HB       GLN  58   7.396  -3.684   4.880
  445   1HG   GLN  58          2HG       GLN  58   7.788  -1.706   6.211
  446   2HG   GLN  58          1HG       GLN  58   7.748  -1.208   4.520
  447   1HE2  GLN  58          1HE2      GLN  58   5.934   0.091   3.794
  448   2HE2  GLN  58          2HE2      GLN  58   4.813   0.750   4.885
  449    H    GLU  59           H        GLU  59   7.392  -4.745   2.772
  450    HA   GLU  59           HA       GLU  59   9.461  -3.378   1.484
  451   1HB   GLU  59          2HB       GLU  59   8.342  -6.145   1.019
  452   2HB   GLU  59          1HB       GLU  59   9.784  -5.544   0.200
  453   1HG   GLU  59          2HG       GLU  59  11.053  -5.540   2.129
  454   2HG   GLU  59          1HG       GLU  59   9.659  -5.253   3.172
  455    H    MET  60           H        MET  60   6.361  -4.510   0.170
  456    HA   MET  60           HA       MET  60   6.928  -3.911  -2.550
  457   1HB   MET  60          2HB       MET  60   4.323  -4.196  -1.044
  458   2HB   MET  60          1HB       MET  60   4.399  -3.905  -2.781
  459   1HG   MET  60          2HG       MET  60   5.980  -6.156  -1.561
  460   2HG   MET  60          1HG       MET  60   4.266  -6.372  -1.922
  461   1HE   MET  60          1HE       MET  60   7.042  -7.746  -3.024
  462   2HE   MET  60          2HE       MET  60   6.603  -8.106  -4.691
  463   3HE   MET  60          3HE       MET  60   5.452  -8.426  -3.397
  464    H    ILE  61           H        ILE  61   5.345  -2.056   0.040
  465    HA   ILE  61           HA       ILE  61   4.474   0.150  -1.412
  466    HB   ILE  61           HB       ILE  61   5.497  -0.055   1.425
  467   1HG1  ILE  61          2HG1      ILE  61   2.653   0.423   0.745
  468   2HG1  ILE  61          1HG1      ILE  61   3.285  -1.166   0.324
  469   1HG2  ILE  61          1HG2      ILE  61   5.694   2.246   0.929
  470   2HG2  ILE  61          2HG2      ILE  61   4.101   2.097   1.672
  471   3HG2  ILE  61          3HG2      ILE  61   4.245   2.243  -0.080
  472   1HD1  ILE  61          1HD1      ILE  61   2.284  -0.849   2.694
  473   2HD1  ILE  61          2HD1      ILE  61   3.777   0.022   3.047
  474   3HD1  ILE  61          3HD1      ILE  61   3.838  -1.669   2.552
  475    H    ASP  62           H        ASP  62   7.406   0.224   0.636
  476    HA   ASP  62           HA       ASP  62   8.503   2.545  -0.418
  477   1HB   ASP  62          2HB       ASP  62  10.581   1.920   0.588
  478   2HB   ASP  62          1HB       ASP  62   9.296   1.334   1.636
  479    H    GLU  63           H        GLU  63   8.743  -0.751  -1.649
  480    HA   GLU  63           HA       GLU  63  10.832  -0.366  -3.508
  481   1HB   GLU  63          2HB       GLU  63   8.685  -2.367  -3.113
  482   2HB   GLU  63          1HB       GLU  63   9.341  -2.255  -4.746
  483   1HG   GLU  63          2HG       GLU  63  11.291  -2.281  -2.485
  484   2HG   GLU  63          1HG       GLU  63  10.482  -3.798  -2.879
  485    H    VAL  64           H        VAL  64   7.324   0.142  -3.813
  486    HA   VAL  64           HA       VAL  64   7.624   0.948  -6.610
  487    HB   VAL  64           HB       VAL  64   5.194   1.131  -6.640
  488   1HG1  VAL  64          1HG1      VAL  64   5.694  -1.391  -5.099
  489   2HG1  VAL  64          2HG1      VAL  64   6.536  -1.146  -6.630
  490   3HG1  VAL  64          3HG1      VAL  64   4.774  -1.149  -6.584
  491   1HG2  VAL  64          1HG2      VAL  64   5.231   0.305  -3.727
  492   2HG2  VAL  64          2HG2      VAL  64   3.841   0.804  -4.688
  493   3HG2  VAL  64          3HG2      VAL  64   5.070   1.985  -4.239
  494    H    ASP  65           H        ASP  65   7.703   2.483  -3.550
  495    HA   ASP  65           HA       ASP  65   6.410   4.914  -4.036
  496   1HB   ASP  65          2HB       ASP  65   7.832   3.888  -1.940
  497   2HB   ASP  65          1HB       ASP  65   8.942   5.118  -2.536
  498    H    GLU  66           H        GLU  66   6.687   5.920  -5.936
  499    HA   GLU  66           HA       GLU  66   9.223   6.097  -7.280
  500   1HB   GLU  66          2HB       GLU  66   6.522   7.341  -7.762
  501   2HB   GLU  66          1HB       GLU  66   7.927   7.781  -8.733
  502   1HG   GLU  66          2HG       GLU  66   8.179   5.582  -9.575
  503   2HG   GLU  66          1HG       GLU  66   7.149   4.892  -8.320
  504    H    ASP  67           H        ASP  67   7.295   8.317  -5.290
  505    HA   ASP  67           HA       ASP  67   9.153  10.514  -5.701
  506   1HB   ASP  67          2HB       ASP  67   6.964  10.385  -3.624
  507   2HB   ASP  67          1HB       ASP  67   7.708  11.817  -4.327
  508    H    GLY  68           H        GLY  68   8.312   8.273  -3.069
  509   1HA   GLY  68          2HA       GLY  68   9.586   7.557  -1.263
  510   2HA   GLY  68          1HA       GLY  68  10.935   8.509  -1.884
  511    H    SER  69           H        SER  69   7.696   9.728  -1.271
  512    HA   SER  69           HA       SER  69   8.768  11.768   0.515
  513   1HB   SER  69          2HB       SER  69   6.337  12.606   0.318
  514   2HB   SER  69          1HB       SER  69   7.346  12.672  -1.123
  515    HG   SER  69           HG       SER  69   5.044  11.412  -0.803
  516    H    GLY  70           H        GLY  70   6.061   9.441   0.524
  517   1HA   GLY  70          2HA       GLY  70   6.263   8.218   2.904
  518   2HA   GLY  70          1HA       GLY  70   5.655   9.798   3.390
  519    H    THR  71           H        THR  71   4.165  10.022   0.775
  520    HA   THR  71           HA       THR  71   1.863   8.330   1.524
  521    HB   THR  71           HB       THR  71   0.475   9.984   0.351
  522    HG1  THR  71           HG1      THR  71   2.827  11.533   0.068
  523   1HG2  THR  71          1HG2      THR  71   0.887  10.344   2.721
  524   2HG2  THR  71          2HG2      THR  71   0.877  11.902   1.895
  525   3HG2  THR  71          3HG2      THR  71   2.409  11.163   2.363
  526    H    VAL  72           H        VAL  72   0.629   7.341  -0.149
  527    HA   VAL  72           HA       VAL  72   2.246   6.733  -2.542
  528    HB   VAL  72           HB       VAL  72   0.018   5.216  -1.178
  529   1HG1  VAL  72          1HG1      VAL  72  -0.475   4.287  -3.175
  530   2HG1  VAL  72          2HG1      VAL  72   1.164   3.639  -3.226
  531   3HG1  VAL  72          3HG1      VAL  72   0.809   5.199  -3.969
  532   1HG2  VAL  72          1HG2      VAL  72   2.406   5.119  -0.295
  533   2HG2  VAL  72          2HG2      VAL  72   2.859   4.384  -1.835
  534   3HG2  VAL  72          3HG2      VAL  72   1.720   3.563  -0.766
  535    H    ASP  73           H        ASP  73   1.709   7.809  -4.300
  536    HA   ASP  73           HA       ASP  73  -0.956   8.933  -4.641
  537   1HB   ASP  73          2HB       ASP  73   1.463   9.010  -6.473
  538   2HB   ASP  73          1HB       ASP  73  -0.032   9.915  -6.707
  539    H    PHE  74           H        PHE  74  -1.800   8.664  -7.040
  540    HA   PHE  74           HA       PHE  74  -2.578   5.963  -7.324
  541   1HB   PHE  74          2HB       PHE  74  -3.792   8.070  -8.140
  542   2HB   PHE  74          1HB       PHE  74  -2.722   8.002  -9.539
  543    HD1  PHE  74           HD1      PHE  74  -4.295   7.465 -11.232
  544    HD2  PHE  74           HD2      PHE  74  -4.058   5.067  -7.681
  545    HE1  PHE  74           HE1      PHE  74  -5.777   5.774 -12.280
  546    HE2  PHE  74           HE2      PHE  74  -5.539   3.373  -8.725
  547    HZ   PHE  74           HZ       PHE  74  -6.400   3.725 -11.027
  548    H    ASP  75           H        ASP  75   0.143   7.710  -8.594
  549    HA   ASP  75           HA       ASP  75   0.694   6.031 -10.831
  550   1HB   ASP  75          2HB       ASP  75   2.140   8.167  -9.355
  551   2HB   ASP  75          1HB       ASP  75   3.127   7.036 -10.278
  552    H    GLU  76           H        GLU  76   2.231   6.208  -7.594
  553    HA   GLU  76           HA       GLU  76   3.728   3.800  -8.042
  554   1HB   GLU  76          2HB       GLU  76   4.273   3.958  -5.606
  555   2HB   GLU  76          1HB       GLU  76   4.649   5.405  -6.533
  556   1HG   GLU  76          2HG       GLU  76   2.185   6.097  -5.796
  557   2HG   GLU  76          1HG       GLU  76   2.534   4.978  -4.476
  558    H    PHE  77           H        PHE  77   0.503   4.391  -7.232
  559    HA   PHE  77           HA       PHE  77   0.040   2.054  -5.606
  560   1HB   PHE  77          2HB       PHE  77  -1.408   4.054  -5.438
  561   2HB   PHE  77          1HB       PHE  77  -1.911   3.828  -7.110
  562    HD1  PHE  77           HD1      PHE  77  -1.904   2.209  -3.745
  563    HD2  PHE  77           HD2      PHE  77  -3.657   2.318  -7.671
  564    HE1  PHE  77           HE1      PHE  77  -3.676   0.644  -3.000
  565    HE2  PHE  77           HE2      PHE  77  -5.432   0.754  -6.919
  566    HZ   PHE  77           HZ       PHE  77  -5.439  -0.082  -4.584
  567    H    LEU  78           H        LEU  78  -0.322   2.924  -9.041
  568    HA   LEU  78           HA       LEU  78  -1.522   0.386  -9.740
  569   1HB   LEU  78          2HB       LEU  78  -0.409   2.636 -11.396
  570   2HB   LEU  78          1HB       LEU  78  -1.132   1.197 -12.082
  571    HG   LEU  78           HG       LEU  78  -2.785   2.657 -10.100
  572   1HD1  LEU  78          1HD1      LEU  78  -3.309   4.479 -11.512
  573   2HD1  LEU  78          2HD1      LEU  78  -2.504   3.749 -12.900
  574   3HD1  LEU  78          3HD1      LEU  78  -1.550   4.386 -11.560
  575   1HD2  LEU  78          1HD2      LEU  78  -3.343   0.595 -11.603
  576   2HD2  LEU  78          2HD2      LEU  78  -3.518   1.787 -12.892
  577   3HD2  LEU  78          3HD2      LEU  78  -4.542   1.880 -11.459
  578    H    VAL  79           H        VAL  79   1.734   1.782  -9.878
  579    HA   VAL  79           HA       VAL  79   2.931  -0.113 -11.563
  580    HB   VAL  79           HB       VAL  79   5.072   0.454 -10.397
  581   1HG1  VAL  79          1HG1      VAL  79   4.500   1.814 -12.259
  582   2HG1  VAL  79          2HG1      VAL  79   4.896   2.951 -10.971
  583   3HG1  VAL  79          3HG1      VAL  79   3.210   2.624 -11.370
  584   1HG2  VAL  79          1HG2      VAL  79   4.125   0.816  -8.145
  585   2HG2  VAL  79          2HG2      VAL  79   3.255   2.225  -8.744
  586   3HG2  VAL  79          3HG2      VAL  79   5.016   2.234  -8.696
  587    H    MET  80           H        MET  80   2.085  -0.304  -8.165
  588    HA   MET  80           HA       MET  80   3.650  -2.393  -7.255
  589   1HB   MET  80          2HB       MET  80   0.990  -1.316  -6.579
  590   2HB   MET  80          1HB       MET  80   1.267  -2.984  -6.077
  591   1HG   MET  80          2HG       MET  80   3.534  -2.099  -5.163
  592   2HG   MET  80          1HG       MET  80   2.789  -0.507  -5.292
  593   1HE   MET  80          1HE       MET  80  -0.228  -1.296  -4.915
  594   2HE   MET  80          2HE       MET  80   0.491   0.135  -4.182
  595   3HE   MET  80          3HE       MET  80  -0.470  -0.963  -3.196
  596    H    MET  81           H        MET  81   0.662  -2.632  -9.189
  597    HA   MET  81           HA       MET  81   0.628  -5.516  -9.047
  598   1HB   MET  81          2HB       MET  81  -1.263  -5.393 -10.588
  599   2HB   MET  81          1HB       MET  81  -1.463  -4.255  -9.261
  600   1HG   MET  81          2HG       MET  81  -1.091  -2.403 -10.614
  601   2HG   MET  81          1HG       MET  81  -0.170  -3.320 -11.802
  602   1HE   MET  81          1HE       MET  81  -1.294  -1.860 -13.267
  603   2HE   MET  81          2HE       MET  81  -2.875  -1.282 -12.749
  604   3HE   MET  81          3HE       MET  81  -2.746  -2.323 -14.164
  605    H    VAL  82           H        VAL  82   1.771  -3.156 -11.405
  606    HA   VAL  82           HA       VAL  82   2.286  -5.217 -13.398
  607    HB   VAL  82           HB       VAL  82   3.360  -3.265 -14.662
  608   1HG1  VAL  82          1HG1      VAL  82   1.303  -3.670 -15.554
  609   2HG1  VAL  82          2HG1      VAL  82   0.863  -2.179 -14.721
  610   3HG1  VAL  82          3HG1      VAL  82   0.520  -3.740 -13.975
  611   1HG2  VAL  82          1HG2      VAL  82   3.619  -1.902 -12.511
  612   2HG2  VAL  82          2HG2      VAL  82   1.880  -1.620 -12.597
  613   3HG2  VAL  82          3HG2      VAL  82   2.931  -1.046 -13.891
  614    H    ARG  83           H        ARG  83   4.148  -3.481 -10.970
  615    HA   ARG  83           HA       ARG  83   6.722  -4.088 -12.068
  616   1HB   ARG  83          2HB       ARG  83   7.623  -3.375  -9.931
  617   2HB   ARG  83          1HB       ARG  83   6.350  -2.261 -10.425
  618   1HG   ARG  83          2HG       ARG  83   5.198  -2.688  -8.540
  619   2HG   ARG  83          1HG       ARG  83   5.176  -4.412  -8.909
  620   1HD   ARG  83          2HD       ARG  83   7.697  -3.207  -7.839
  621   2HD   ARG  83          1HD       ARG  83   6.369  -3.499  -6.722
  622    HE   ARG  83           HE       ARG  83   6.593  -5.879  -8.012
  623   1HH1  ARG  83          2HH1      ARG  83   8.889  -3.787  -6.413
  624   2HH1  ARG  83          1HH1      ARG  83   9.945  -5.083  -5.966
  625   1HH2  ARG  83          1HH2      ARG  83   7.990  -7.560  -7.417
  626   2HH2  ARG  83          2HH2      ARG  83   9.438  -7.214  -6.531
  627    H    CYS  84           H        CYS  84   4.394  -5.967 -10.391
  628    HA   CYS  84           HA       CYS  84   6.208  -7.828  -9.154
  629   1HB   CYS  84          2HB       CYS  84   3.247  -7.732  -9.613
  630   2HB   CYS  84          1HB       CYS  84   4.005  -9.240  -9.108
  631    HG   CYS  84           HG       CYS  84   3.507  -8.037  -6.895
  632    H    MET  85           H        MET  85   5.090  -7.389 -12.375
  633    HA   MET  85           HA       MET  85   4.880 -10.000 -13.338
  634   1HB   MET  85          2HB       MET  85   5.187  -9.119 -15.519
  635   2HB   MET  85          1HB       MET  85   4.404  -7.838 -14.596
  636   1HG   MET  85          2HG       MET  85   6.429  -6.605 -14.387
  637   2HG   MET  85          1HG       MET  85   7.410  -7.979 -14.890
  638   1HE   MET  85          1HE       MET  85   8.201  -7.186 -18.252
  639   2HE   MET  85          2HE       MET  85   7.696  -8.733 -17.577
  640   3HE   MET  85          3HE       MET  85   8.635  -7.614 -16.592
  641    H    LYS  86           H        LYS  86   7.779  -8.111 -12.621
  642    HA   LYS  86           HA       LYS  86   9.497 -10.220 -13.726
  643   1HB   LYS  86          2HB       LYS  86  11.363  -8.680 -13.215
  644   2HB   LYS  86          1HB       LYS  86  10.145  -7.920 -14.239
  645   1HG   LYS  86          2HG       LYS  86   9.384  -6.529 -12.538
  646   2HG   LYS  86          1HG       LYS  86   9.910  -7.626 -11.262
  647   1HD   LYS  86          2HD       LYS  86  12.021  -6.766 -11.213
  648   2HD   LYS  86          1HD       LYS  86  12.081  -6.555 -12.963
  649   1HE   LYS  86          2HE       LYS  86  11.134  -4.451 -12.885
  650   2HE   LYS  86          1HE       LYS  86  10.212  -4.805 -11.424
  651   1HZ   LYS  86          1HZ       LYS  86  12.229  -4.691 -10.134
  652   2HZ   LYS  86          2HZ       LYS  86  12.041  -3.254 -11.020
  653   3HZ   LYS  86          3HZ       LYS  86  13.157  -4.429 -11.530
  654    H    ASP  87           H        ASP  87  11.294 -11.047 -12.442
  655    HA   ASP  87           HA       ASP  87  10.399 -11.926  -9.843
  656   1HB   ASP  87          2HB       ASP  87  11.859 -13.186 -11.647
  657   2HB   ASP  87          1HB       ASP  87  13.193 -12.394 -10.810
  658    H    ASP  88           H        ASP  88  12.850  -9.690 -11.083
  659    HA   ASP  88           HA       ASP  88  14.092  -8.052 -10.069
  660   1HB   ASP  88          2HB       ASP  88  11.819  -7.503  -9.052
  661   2HB   ASP  88          1HB       ASP  88  12.344  -8.398  -7.627
  662    H    SER  89           HN       SER  89  15.896  -9.462 -10.056
  663    HA   SER  89           HA       SER  89  16.634 -10.408  -7.348
  664   1HB   SER  89          2HB       SER  89  17.091 -11.769 -10.006
  665   2HB   SER  89          1HB       SER  89  17.996 -12.186  -8.553
  666    HG   SER  89           HG       SER  89  15.331 -12.626  -9.209
  Start of MODEL   36
    1   1H    MET   1          1H        MET   1  15.310   1.051 -19.340
    2   2H    MET   1          2H        MET   1  16.969   0.758 -19.133
    3   3H    MET   1          3H        MET   1  16.046   1.362 -17.843
    4    HA   MET   1           HA       MET   1  15.947  -1.339 -19.059
    5   1HB   MET   1          2HB       MET   1  16.437  -2.081 -16.769
    6   2HB   MET   1          1HB       MET   1  17.672  -0.962 -17.340
    7   1HG   MET   1          2HG       MET   1  17.076   0.668 -15.843
    8   2HG   MET   1          1HG       MET   1  15.364   0.260 -15.917
    9   1HE   MET   1          1HE       MET   1  18.710  -1.215 -13.341
   10   2HE   MET   1          2HE       MET   1  18.760  -0.517 -14.958
   11   3HE   MET   1          3HE       MET   1  18.569  -2.257 -14.764
   12    H    ASN   2           H        ASN   2  14.076   1.153 -17.494
   13    HA   ASN   2           HA       ASN   2  12.047  -0.567 -16.412
   14   1HB   ASN   2          2HB       ASN   2  12.264   2.395 -16.890
   15   2HB   ASN   2          1HB       ASN   2  10.726   1.672 -16.413
   16   1HD2  ASN   2          1HD2      ASN   2  11.084  -0.005 -14.444
   17   2HD2  ASN   2          2HD2      ASN   2  12.059   0.590 -13.191
   18    H    ASP   3           H        ASP   3  11.566  -1.933 -18.198
   19    HA   ASP   3           HA       ASP   3   9.796  -0.668 -20.207
   20   1HB   ASP   3          2HB       ASP   3  11.792  -2.904 -20.620
   21   2HB   ASP   3          1HB       ASP   3  10.547  -2.469 -21.791
   22    H    ILE   4           H        ILE   4   9.631  -2.427 -17.532
   23    HA   ILE   4           HA       ILE   4   8.064  -4.683 -18.454
   24    HB   ILE   4           HB       ILE   4   7.722  -5.200 -16.100
   25   1HG1  ILE   4          2HG1      ILE   4   9.054  -3.547 -14.496
   26   2HG1  ILE   4          1HG1      ILE   4   8.670  -2.373 -15.759
   27   1HG2  ILE   4          1HG2      ILE   4  10.184  -5.191 -15.375
   28   2HG2  ILE   4          2HG2      ILE   4  10.513  -4.355 -16.893
   29   3HG2  ILE   4          3HG2      ILE   4   9.815  -5.975 -16.910
   30   1HD1  ILE   4          1HD1      ILE   4   6.469  -4.150 -14.810
   31   2HD1  ILE   4          2HD1      ILE   4   6.405  -2.476 -15.355
   32   3HD1  ILE   4          3HD1      ILE   4   6.991  -2.852 -13.735
   33    H    TYR   5           H        TYR   5   7.493  -1.397 -17.459
   34    HA   TYR   5           HA       TYR   5   4.749  -1.609 -16.739
   35   1HB   TYR   5          2HB       TYR   5   6.131   0.794 -17.966
   36   2HB   TYR   5          1HB       TYR   5   4.665   0.793 -16.987
   37    HD1  TYR   5           HD1      TYR   5   8.050   1.486 -16.857
   38    HD2  TYR   5           HD2      TYR   5   5.027  -0.641 -14.673
   39    HE1  TYR   5           HE1      TYR   5   9.420   1.656 -14.799
   40    HE2  TYR   5           HE2      TYR   5   6.395  -0.466 -12.609
   41    HH   TYR   5           HH       TYR   5   8.554   1.543 -12.000
   42    H    LYS   6           H        LYS   6   6.463  -1.236 -19.769
   43    HA   LYS   6           HA       LYS   6   4.081  -0.731 -21.346
   44   1HB   LYS   6          2HB       LYS   6   6.749  -1.645 -22.430
   45   2HB   LYS   6          1HB       LYS   6   5.509  -0.690 -23.241
   46   1HG   LYS   6          2HG       LYS   6   7.353   0.177 -21.004
   47   2HG   LYS   6          1HG       LYS   6   7.216   0.864 -22.623
   48   1HD   LYS   6          2HD       LYS   6   5.020   1.746 -22.140
   49   2HD   LYS   6          1HD       LYS   6   4.960   0.887 -20.599
   50   1HE   LYS   6          2HE       LYS   6   6.598   2.284 -19.623
   51   2HE   LYS   6          1HE       LYS   6   7.144   2.887 -21.188
   52   1HZ   LYS   6          1HZ       LYS   6   5.048   4.026 -21.463
   53   2HZ   LYS   6          2HZ       LYS   6   5.770   4.503 -20.002
   54   3HZ   LYS   6          3HZ       LYS   6   4.472   3.406 -19.993
   55    H    ALA   7           H        ALA   7   6.160  -3.450 -20.549
   56    HA   ALA   7           HA       ALA   7   4.897  -5.321 -22.327
   57   1HB   ALA   7          1HB       ALA   7   6.291  -6.270 -19.870
   58   2HB   ALA   7          2HB       ALA   7   7.245  -5.382 -21.057
   59   3HB   ALA   7          3HB       ALA   7   6.404  -6.859 -21.529
   60    H    ALA   8           H        ALA   8   4.274  -4.171 -19.079
   61    HA   ALA   8           HA       ALA   8   2.457  -6.350 -18.439
   62   1HB   ALA   8          1HB       ALA   8   3.308  -3.849 -16.974
   63   2HB   ALA   8          2HB       ALA   8   3.683  -5.528 -16.580
   64   3HB   ALA   8          3HB       ALA   8   2.042  -4.920 -16.371
   65    H    VAL   9           H        VAL   9   2.262  -2.991 -19.554
   66    HA   VAL   9           HA       VAL   9  -0.404  -2.436 -18.960
   67    HB   VAL   9           HB       VAL   9   1.391  -0.896 -20.006
   68   1HG1  VAL   9          1HG1      VAL   9   1.561  -0.756 -22.327
   69   2HG1  VAL   9          2HG1      VAL   9   0.025  -1.581 -22.590
   70   3HG1  VAL   9          3HG1      VAL   9   1.444  -2.498 -22.089
   71   1HG2  VAL   9          1HG2      VAL   9  -1.434  -0.731 -21.088
   72   2HG2  VAL   9          2HG2      VAL   9  -0.333   0.610 -20.775
   73   3HG2  VAL   9          3HG2      VAL   9  -0.997  -0.316 -19.430
   74    H    GLU  10           H        GLU  10   0.912  -4.326 -21.655
   75    HA   GLU  10           HA       GLU  10  -1.533  -4.556 -23.094
   76   1HB   GLU  10          2HB       GLU  10  -0.424  -6.264 -24.383
   77   2HB   GLU  10          1HB       GLU  10   0.735  -4.978 -24.057
   78   1HG   GLU  10          2HG       GLU  10   2.113  -6.471 -23.101
   79   2HG   GLU  10          1HG       GLU  10   0.886  -6.810 -21.884
   80    H    GLN  11           H        GLN  11  -0.265  -6.171 -20.288
   81    HA   GLN  11           HA       GLN  11  -2.088  -8.429 -20.500
   82   1HB   GLN  11          2HB       GLN  11  -0.180  -7.619 -18.295
   83   2HB   GLN  11          1HB       GLN  11  -1.112  -9.115 -18.329
   84   1HG   GLN  11          2HG       GLN  11   0.570  -8.464 -20.715
   85   2HG   GLN  11          1HG       GLN  11   1.389  -9.021 -19.255
   86   1HE2  GLN  11          1HE2      GLN  11  -1.166  -9.943 -21.601
   87   2HE2  GLN  11          2HE2      GLN  11  -1.055 -11.609 -21.296
   88    H    LEU  12           H        LEU  12  -1.646  -5.559 -18.461
   89    HA   LEU  12           HA       LEU  12  -3.808  -6.023 -16.701
   90   1HB   LEU  12          2HB       LEU  12  -2.643  -3.384 -17.584
   91   2HB   LEU  12          1HB       LEU  12  -3.668  -3.633 -16.189
   92    HG   LEU  12           HG       LEU  12  -1.344  -5.366 -16.082
   93   1HD1  LEU  12          1HD1      LEU  12   0.398  -3.760 -16.004
   94   2HD1  LEU  12          2HD1      LEU  12  -0.735  -2.408 -16.005
   95   3HD1  LEU  12          3HD1      LEU  12  -0.504  -3.369 -17.465
   96   1HD2  LEU  12          1HD2      LEU  12  -2.760  -4.789 -14.160
   97   2HD2  LEU  12          2HD2      LEU  12  -2.360  -3.082 -14.358
   98   3HD2  LEU  12          3HD2      LEU  12  -1.111  -4.231 -13.880
   99    H    THR  13           H        THR  13  -5.919  -5.337 -16.701
  100    HA   THR  13           HA       THR  13  -6.970  -4.365 -19.299
  101    HB   THR  13           HB       THR  13  -9.159  -5.462 -18.170
  102    HG1  THR  13           HG1      THR  13  -8.551  -6.614 -16.539
  103   1HG2  THR  13          1HG2      THR  13  -8.785  -7.370 -19.627
  104   2HG2  THR  13          2HG2      THR  13  -7.054  -7.033 -19.677
  105   3HG2  THR  13          3HG2      THR  13  -8.196  -5.910 -20.418
  106    H    ASP  14           H        ASP  14  -9.155  -3.296 -19.057
  107    HA   ASP  14           HA       ASP  14  -8.938  -0.982 -17.452
  108   1HB   ASP  14          2HB       ASP  14 -11.309  -2.217 -18.865
  109   2HB   ASP  14          1HB       ASP  14 -11.372  -0.653 -18.052
  110    H    GLU  15           H        GLU  15 -10.430  -4.111 -16.915
  111    HA   GLU  15           HA       GLU  15 -12.108  -3.491 -14.746
  112   1HB   GLU  15          2HB       GLU  15 -10.743  -5.993 -15.676
  113   2HB   GLU  15          1HB       GLU  15 -11.554  -5.978 -14.110
  114   1HG   GLU  15          2HG       GLU  15 -12.972  -4.924 -16.546
  115   2HG   GLU  15          1HG       GLU  15 -12.921  -6.659 -16.237
  116    H    GLN  16           H        GLN  16  -8.660  -4.424 -14.818
  117    HA   GLN  16           HA       GLN  16  -8.342  -4.512 -11.994
  118   1HB   GLN  16          2HB       GLN  16  -6.094  -4.891 -12.374
  119   2HB   GLN  16          1HB       GLN  16  -6.769  -5.397 -13.919
  120   1HG   GLN  16          2HG       GLN  16  -5.120  -4.006 -14.710
  121   2HG   GLN  16          1HG       GLN  16  -6.379  -2.797 -14.483
  122   1HE2  GLN  16          1HE2      GLN  16  -3.974  -4.432 -12.317
  123   2HE2  GLN  16          2HE2      GLN  16  -3.460  -2.992 -11.581
  124    H    LYS  17           H        LYS  17  -8.175  -1.904 -14.348
  125    HA   LYS  17           HA       LYS  17  -7.076   0.017 -12.490
  126   1HB   LYS  17          2HB       LYS  17  -7.954   0.026 -15.310
  127   2HB   LYS  17          1HB       LYS  17  -8.175   1.547 -14.445
  128   1HG   LYS  17          2HG       LYS  17  -5.991   1.935 -14.898
  129   2HG   LYS  17          1HG       LYS  17  -5.652   0.756 -13.631
  130   1HD   LYS  17          2HD       LYS  17  -4.450  -0.136 -15.420
  131   2HD   LYS  17          1HD       LYS  17  -5.984  -0.995 -15.569
  132   1HE   LYS  17          2HE       LYS  17  -6.568   1.195 -17.038
  133   2HE   LYS  17          1HE       LYS  17  -4.826   1.131 -17.301
  134   1HZ   LYS  17          1HZ       LYS  17  -5.104  -1.232 -17.921
  135   2HZ   LYS  17          2HZ       LYS  17  -5.902  -0.162 -18.973
  136   3HZ   LYS  17          3HZ       LYS  17  -6.785  -1.037 -17.816
  137    H    ASN  18           H        ASN  18 -10.252  -1.105 -13.421
  138    HA   ASN  18           HA       ASN  18 -11.775   1.097 -12.465
  139   1HB   ASN  18          2HB       ASN  18 -13.282  -0.152 -13.588
  140   2HB   ASN  18          1HB       ASN  18 -12.280  -1.591 -13.486
  141   1HD2  ASN  18          1HD2      ASN  18 -12.916  -3.197 -11.990
  142   2HD2  ASN  18          2HD2      ASN  18 -14.190  -3.006 -10.885
  143    H    GLU  19           H        GLU  19 -10.702  -1.954 -10.993
  144    HA   GLU  19           HA       GLU  19 -11.889  -1.475  -8.429
  145   1HB   GLU  19          2HB       GLU  19  -9.533  -3.257  -9.121
  146   2HB   GLU  19          1HB       GLU  19 -10.488  -3.318  -7.639
  147   1HG   GLU  19          2HG       GLU  19 -12.519  -3.787  -9.042
  148   2HG   GLU  19          1HG       GLU  19 -11.461  -3.893 -10.449
  149    H    PHE  20           H        PHE  20  -8.659  -0.994  -9.810
  150    HA   PHE  20           HA       PHE  20  -7.348  -0.094  -7.482
  151   1HB   PHE  20          2HB       PHE  20  -6.854   0.195 -10.421
  152   2HB   PHE  20          1HB       PHE  20  -5.928   1.195  -9.306
  153    HD1  PHE  20           HD1      PHE  20  -7.112  -2.104  -8.207
  154    HD2  PHE  20           HD2      PHE  20  -3.842   0.061  -9.962
  155    HE1  PHE  20           HE1      PHE  20  -5.600  -4.007  -7.742
  156    HE2  PHE  20           HE2      PHE  20  -2.330  -1.845  -9.491
  157    HZ   PHE  20           HZ       PHE  20  -3.209  -3.879  -8.380
  158    H    LYS  21           H        LYS  21  -9.095   1.694 -10.017
  159    HA   LYS  21           HA       LYS  21  -8.550   4.292  -9.040
  160   1HB   LYS  21          2HB       LYS  21  -9.427   3.830 -11.322
  161   2HB   LYS  21          1HB       LYS  21 -10.977   3.379 -10.611
  162   1HG   LYS  21          2HG       LYS  21 -10.973   5.734 -11.408
  163   2HG   LYS  21          1HG       LYS  21 -11.227   5.632  -9.666
  164   1HD   LYS  21          2HD       LYS  21  -8.990   6.298  -9.194
  165   2HD   LYS  21          1HD       LYS  21  -8.475   6.019 -10.858
  166   1HE   LYS  21          2HE       LYS  21  -8.708   8.378 -10.682
  167   2HE   LYS  21          1HE       LYS  21 -10.165   7.841 -11.517
  168   1HZ   LYS  21          1HZ       LYS  21  -9.995   8.279  -8.583
  169   2HZ   LYS  21          2HZ       LYS  21 -11.394   7.950  -9.491
  170   3HZ   LYS  21          3HZ       LYS  21 -10.581   9.430  -9.682
  171    H    ALA  22           H        ALA  22 -11.281   2.071  -8.460
  172    HA   ALA  22           HA       ALA  22 -12.726   3.857  -6.764
  173   1HB   ALA  22          1HB       ALA  22 -14.001   1.867  -6.082
  174   2HB   ALA  22          2HB       ALA  22 -12.818   0.830  -6.881
  175   3HB   ALA  22          3HB       ALA  22 -13.815   1.928  -7.835
  176    H    ALA  23           H        ALA  23 -10.410   1.238  -6.149
  177    HA   ALA  23           HA       ALA  23 -10.516   1.280  -3.324
  178   1HB   ALA  23          1HB       ALA  23  -9.479  -0.608  -4.325
  179   2HB   ALA  23          2HB       ALA  23  -8.172   0.270  -3.530
  180   3HB   ALA  23          3HB       ALA  23  -8.386   0.398  -5.276
  181    H    PHE  24           H        PHE  24  -8.891   3.316  -5.651
  182    HA   PHE  24           HA       PHE  24  -7.144   4.546  -3.676
  183   1HB   PHE  24          2HB       PHE  24  -6.722   4.187  -6.254
  184   2HB   PHE  24          1HB       PHE  24  -7.636   5.683  -6.412
  185    HD1  PHE  24           HD1      PHE  24  -4.604   4.138  -4.934
  186    HD2  PHE  24           HD2      PHE  24  -6.707   7.800  -5.731
  187    HE1  PHE  24           HE1      PHE  24  -2.582   5.435  -4.319
  188    HE2  PHE  24           HE2      PHE  24  -4.686   9.096  -5.111
  189    HZ   PHE  24           HZ       PHE  24  -2.624   7.911  -4.407
  190    H    ASP  25           H        ASP  25  -9.808   5.621  -5.801
  191    HA   ASP  25           HA       ASP  25 -10.146   8.209  -4.923
  192   1HB   ASP  25          2HB       ASP  25 -11.389   6.947  -6.788
  193   2HB   ASP  25          1HB       ASP  25 -12.519   6.456  -5.525
  194    H    ILE  26           H        ILE  26 -11.589   5.274  -3.462
  195    HA   ILE  26           HA       ILE  26 -13.244   6.533  -1.594
  196    HB   ILE  26           HB       ILE  26 -13.017   4.462  -0.226
  197   1HG1  ILE  26          2HG1      ILE  26 -11.002   3.713  -2.370
  198   2HG1  ILE  26          1HG1      ILE  26 -10.634   4.014  -0.675
  199   1HG2  ILE  26          1HG2      ILE  26 -13.715   4.578  -3.103
  200   2HG2  ILE  26          2HG2      ILE  26 -14.692   4.074  -1.725
  201   3HG2  ILE  26          3HG2      ILE  26 -13.527   2.958  -2.435
  202   1HD1  ILE  26          1HD1      ILE  26 -12.347   2.157  -0.161
  203   2HD1  ILE  26          2HD1      ILE  26 -10.792   1.659  -0.825
  204   3HD1  ILE  26          3HD1      ILE  26 -12.211   1.738  -1.868
  205    H    PHE  27           H        PHE  27  -9.776   5.854  -1.414
  206    HA   PHE  27           HA       PHE  27  -9.591   6.827   1.320
  207   1HB   PHE  27          2HB       PHE  27  -7.640   5.717  -0.667
  208   2HB   PHE  27          1HB       PHE  27  -7.050   6.608   0.736
  209    HD1  PHE  27           HD1      PHE  27  -7.462   5.783   3.025
  210    HD2  PHE  27           HD2      PHE  27  -8.742   3.566  -0.422
  211    HE1  PHE  27           HE1      PHE  27  -7.815   3.779   4.442
  212    HE2  PHE  27           HE2      PHE  27  -9.094   1.563   0.994
  213    HZ   PHE  27           HZ       PHE  27  -8.631   1.670   3.426
  214    H    ILE  28           H        ILE  28  -9.184   8.104  -1.918
  215    HA   ILE  28           HA       ILE  28  -7.815  10.502  -0.944
  216    HB   ILE  28           HB       ILE  28  -8.756   9.992  -3.769
  217   1HG1  ILE  28          2HG1      ILE  28  -7.376   8.123  -3.436
  218   2HG1  ILE  28          1HG1      ILE  28  -6.252   9.328  -4.042
  219   1HG2  ILE  28          1HG2      ILE  28  -6.449  11.366  -3.966
  220   2HG2  ILE  28          2HG2      ILE  28  -6.991  11.947  -2.389
  221   3HG2  ILE  28          3HG2      ILE  28  -8.016  12.162  -3.807
  222   1HD1  ILE  28          1HD1      ILE  28  -5.118   8.462  -2.178
  223   2HD1  ILE  28          2HD1      ILE  28  -6.596   8.331  -1.225
  224   3HD1  ILE  28          3HD1      ILE  28  -5.881   9.915  -1.531
  225    H    GLN  29           H        GLN  29 -10.571   9.933  -0.069
  226    HA   GLN  29           HA       GLN  29 -12.383  11.649  -1.462
  227   1HB   GLN  29          2HB       GLN  29 -13.760  11.490   0.635
  228   2HB   GLN  29          1HB       GLN  29 -13.315   9.929  -0.050
  229   1HG   GLN  29          2HG       GLN  29 -11.834   9.441   1.665
  230   2HG   GLN  29          1HG       GLN  29 -11.495  11.138   1.999
  231   1HE2  GLN  29          1HE2      GLN  29 -13.038   8.493   3.310
  232   2HE2  GLN  29          2HE2      GLN  29 -14.201   9.294   4.253
  233    H    ASP  30           H        ASP  30 -10.033  12.094   1.107
  234    HA   ASP  30           HA       ASP  30 -10.249  14.986   0.830
  235   1HB   ASP  30          2HB       ASP  30 -11.767  13.954   2.797
  236   2HB   ASP  30          1HB       ASP  30 -10.229  14.044   3.656
  237    H    ALA  31           H        ALA  31  -8.226  13.352  -0.061
  238    HA   ALA  31           HA       ALA  31  -6.108  13.028   1.841
  239   1HB   ALA  31          1HB       ALA  31  -5.863  13.184  -1.168
  240   2HB   ALA  31          2HB       ALA  31  -6.339  11.724  -0.299
  241   3HB   ALA  31          3HB       ALA  31  -4.741  12.424  -0.040
  242    H    GLU  32           H        GLU  32  -3.966  14.087   1.564
  243    HA   GLU  32           HA       GLU  32  -4.305  16.974   1.539
  244   1HB   GLU  32          2HB       GLU  32  -1.858  15.286   2.109
  245   2HB   GLU  32          1HB       GLU  32  -1.959  17.035   2.313
  246   1HG   GLU  32          2HG       GLU  32  -3.780  15.060   3.723
  247   2HG   GLU  32          1HG       GLU  32  -2.325  15.745   4.444
  248    H    ASP  33           H        ASP  33  -2.442  14.539  -0.263
  249    HA   ASP  33           HA       ASP  33  -2.015  16.565  -2.383
  250   1HB   ASP  33          2HB       ASP  33  -0.086  14.520  -1.287
  251   2HB   ASP  33          1HB       ASP  33   0.125  15.242  -2.882
  252    H    GLY  34           H        GLY  34  -4.123  14.451  -2.037
  253   1HA   GLY  34          2HA       GLY  34  -5.287  13.007  -3.405
  254   2HA   GLY  34          1HA       GLY  34  -4.242  13.540  -4.718
  255    H    CYS  35           H        CYS  35  -3.607  11.774  -1.679
  256    HA   CYS  35           HA       CYS  35  -2.911   9.348  -3.123
  257   1HB   CYS  35          2HB       CYS  35  -0.644   9.503  -1.634
  258   2HB   CYS  35          1HB       CYS  35  -0.734   9.955  -3.333
  259    HG   CYS  35           HG       CYS  35  -0.931  12.037  -1.000
  260    H    ILE  36           H        ILE  36  -2.138   7.631  -1.567
  261    HA   ILE  36           HA       ILE  36  -3.699   7.854   0.933
  262    HB   ILE  36           HB       ILE  36  -3.654   5.380   0.957
  263   1HG1  ILE  36          2HG1      ILE  36  -2.903   4.750  -1.679
  264   2HG1  ILE  36          1HG1      ILE  36  -1.637   5.824  -1.087
  265   1HG2  ILE  36          1HG2      ILE  36  -4.548   6.279  -1.782
  266   2HG2  ILE  36          2HG2      ILE  36  -5.386   6.808  -0.325
  267   3HG2  ILE  36          3HG2      ILE  36  -5.299   5.091  -0.716
  268   1HD1  ILE  36          1HD1      ILE  36  -0.786   4.186   0.187
  269   2HD1  ILE  36          2HD1      ILE  36  -1.978   3.077  -0.492
  270   3HD1  ILE  36          3HD1      ILE  36  -2.339   3.964   0.991
  271    H    SER  37           H        SER  37  -2.712   6.231   2.666
  272    HA   SER  37           HA       SER  37   0.022   7.186   3.129
  273   1HB   SER  37          2HB       SER  37  -1.933   7.226   4.875
  274   2HB   SER  37          1HB       SER  37  -1.526   5.528   5.096
  275    HG   SER  37           HG       SER  37  -0.281   7.685   6.047
  276    H    THR  38           H        THR  38   1.772   5.867   3.274
  277    HA   THR  38           HA       THR  38   1.823   3.428   1.891
  278    HB   THR  38           HB       THR  38   4.055   3.083   3.089
  279    HG1  THR  38           HG1      THR  38   4.360   4.289   4.758
  280   1HG2  THR  38          1HG2      THR  38   3.359   5.557   1.509
  281   2HG2  THR  38          2HG2      THR  38   4.126   4.075   0.942
  282   3HG2  THR  38          3HG2      THR  38   5.022   5.195   1.970
  283    H    LYS  39           H        LYS  39   1.528   4.101   5.363
  284    HA   LYS  39           HA       LYS  39   1.594   1.361   6.194
  285   1HB   LYS  39          2HB       LYS  39   0.903   2.172   8.358
  286   2HB   LYS  39          1HB       LYS  39   2.073   3.314   7.699
  287   1HG   LYS  39          2HG       LYS  39   0.004   4.588   6.785
  288   2HG   LYS  39          1HG       LYS  39  -0.920   3.619   7.933
  289   1HD   LYS  39          2HD       LYS  39   0.476   4.439   9.781
  290   2HD   LYS  39          1HD       LYS  39   1.450   5.375   8.646
  291   1HE   LYS  39          2HE       LYS  39  -0.053   6.993   9.391
  292   2HE   LYS  39          1HE       LYS  39  -0.873   6.403   7.947
  293   1HZ   LYS  39          1HZ       LYS  39  -1.380   5.480  10.726
  294   2HZ   LYS  39          2HZ       LYS  39  -2.170   4.910   9.334
  295   3HZ   LYS  39          3HZ       LYS  39  -2.377   6.520   9.833
  296    H    GLU  40           H        GLU  40  -0.880   3.480   4.949
  297    HA   GLU  40           HA       GLU  40  -3.117   1.898   5.864
  298   1HB   GLU  40          2HB       GLU  40  -2.976   4.459   5.196
  299   2HB   GLU  40          1HB       GLU  40  -3.371   3.825   3.599
  300   1HG   GLU  40          2HG       GLU  40  -5.478   3.174   4.226
  301   2HG   GLU  40          1HG       GLU  40  -4.980   2.775   5.871
  302    H    LEU  41           H        LEU  41  -0.822   1.240   3.552
  303    HA   LEU  41           HA       LEU  41  -2.316   0.455   1.298
  304   1HB   LEU  41          2HB       LEU  41   0.100   0.627   1.210
  305   2HB   LEU  41          1HB       LEU  41   0.270  -0.652   2.391
  306    HG   LEU  41           HG       LEU  41  -0.555  -2.293   0.804
  307   1HD1  LEU  41          1HD1      LEU  41  -0.833  -0.004  -1.165
  308   2HD1  LEU  41          2HD1      LEU  41  -2.188  -0.728  -0.299
  309   3HD1  LEU  41          3HD1      LEU  41  -1.252  -1.695  -1.437
  310   1HD2  LEU  41          1HD2      LEU  41   1.845  -1.664   0.698
  311   2HD2  LEU  41          2HD2      LEU  41   1.458  -0.440  -0.512
  312   3HD2  LEU  41          3HD2      LEU  41   1.229  -2.149  -0.882
  313    H    GLY  42           H        GLY  42  -1.759  -1.130   4.393
  314   1HA   GLY  42          2HA       GLY  42  -2.649  -3.735   3.613
  315   2HA   GLY  42          1HA       GLY  42  -2.518  -3.132   5.262
  316    H    LYS  43           H        LYS  43  -4.306  -0.775   4.209
  317    HA   LYS  43           HA       LYS  43  -6.808  -1.976   5.040
  318   1HB   LYS  43          2HB       LYS  43  -5.900   0.372   5.664
  319   2HB   LYS  43          1HB       LYS  43  -6.483   0.852   4.071
  320   1HG   LYS  43          2HG       LYS  43  -8.345   1.281   5.399
  321   2HG   LYS  43          1HG       LYS  43  -8.694  -0.347   4.820
  322   1HD   LYS  43          2HD       LYS  43  -7.763  -1.295   6.895
  323   2HD   LYS  43          1HD       LYS  43  -7.386   0.328   7.474
  324   1HE   LYS  43          2HE       LYS  43  -9.914   0.809   7.088
  325   2HE   LYS  43          1HE       LYS  43 -10.088  -0.945   7.072
  326   1HZ   LYS  43          1HZ       LYS  43  -9.005  -1.024   9.242
  327   2HZ   LYS  43          2HZ       LYS  43 -10.413  -0.074   9.288
  328   3HZ   LYS  43          3HZ       LYS  43  -8.885   0.669   9.258
  329    H    VAL  44           H        VAL  44  -5.423  -0.575   2.077
  330    HA   VAL  44           HA       VAL  44  -7.845  -0.672   0.569
  331    HB   VAL  44           HB       VAL  44  -6.349  -0.450  -1.428
  332   1HG1  VAL  44          1HG1      VAL  44  -6.017   1.403   0.936
  333   2HG1  VAL  44          2HG1      VAL  44  -7.115   1.576  -0.435
  334   3HG1  VAL  44          3HG1      VAL  44  -5.379   1.786  -0.663
  335   1HG2  VAL  44          1HG2      VAL  44  -4.432  -1.727  -0.382
  336   2HG2  VAL  44          2HG2      VAL  44  -4.125  -0.312   0.624
  337   3HG2  VAL  44          3HG2      VAL  44  -3.968  -0.199  -1.128
  338    H    MET  45           H        MET  45  -5.262  -2.970   1.207
  339    HA   MET  45           HA       MET  45  -5.810  -4.852  -0.811
  340   1HB   MET  45          2HB       MET  45  -4.851  -5.511   1.985
  341   2HB   MET  45          1HB       MET  45  -4.608  -6.459   0.519
  342   1HG   MET  45          2HG       MET  45  -3.631  -3.660   0.408
  343   2HG   MET  45          1HG       MET  45  -2.755  -4.734   1.497
  344   1HE   MET  45          1HE       MET  45  -4.487  -5.723  -2.167
  345   2HE   MET  45          2HE       MET  45  -3.263  -4.742  -2.969
  346   3HE   MET  45          3HE       MET  45  -4.265  -4.029  -1.703
  347    H    ARG  46           H        ARG  46  -7.297  -4.269   2.325
  348    HA   ARG  46           HA       ARG  46  -8.794  -6.653   2.557
  349   1HB   ARG  46          2HB       ARG  46  -9.058  -3.893   3.680
  350   2HB   ARG  46          1HB       ARG  46 -10.426  -4.995   3.828
  351   1HG   ARG  46          2HG       ARG  46  -9.181  -6.563   5.084
  352   2HG   ARG  46          1HG       ARG  46  -7.639  -5.855   4.603
  353   1HD   ARG  46          2HD       ARG  46  -7.720  -4.273   6.226
  354   2HD   ARG  46          1HD       ARG  46  -9.434  -3.966   5.965
  355    HE   ARG  46           HE       ARG  46  -9.008  -6.486   7.266
  356   1HH1  ARG  46          2HH1      ARG  46  -9.076  -3.032   7.780
  357   2HH1  ARG  46          1HH1      ARG  46  -9.508  -3.163   9.450
  358   1HH2  ARG  46          1HH2      ARG  46  -9.574  -6.630   9.461
  359   2HH2  ARG  46          2HH2      ARG  46  -9.788  -5.191  10.398
  360    H    MET  47           H        MET  47  -9.491  -3.594   0.907
  361    HA   MET  47           HA       MET  47 -12.153  -4.404   0.105
  362   1HB   MET  47          2HB       MET  47 -10.406  -2.020  -0.418
  363   2HB   MET  47          1HB       MET  47 -11.821  -2.306  -1.431
  364   1HG   MET  47          2HG       MET  47 -12.719  -0.991   0.280
  365   2HG   MET  47          1HG       MET  47 -13.066  -2.620   0.857
  366   1HE   MET  47          1HE       MET  47 -12.395   0.527   2.342
  367   2HE   MET  47          2HE       MET  47 -11.172   0.559   1.075
  368   3HE   MET  47          3HE       MET  47 -10.681   0.627   2.766
  369    H    LEU  48           H        LEU  48  -8.934  -4.291  -1.363
  370    HA   LEU  48           HA       LEU  48  -9.785  -4.864  -4.031
  371   1HB   LEU  48          2HB       LEU  48  -7.455  -4.033  -2.940
  372   2HB   LEU  48          1HB       LEU  48  -7.087  -5.726  -3.178
  373    HG   LEU  48           HG       LEU  48  -7.677  -5.452  -5.598
  374   1HD1  LEU  48          1HD1      LEU  48  -7.862  -2.534  -4.782
  375   2HD1  LEU  48          2HD1      LEU  48  -9.163  -3.525  -5.439
  376   3HD1  LEU  48          3HD1      LEU  48  -7.784  -3.099  -6.451
  377   1HD2  LEU  48          1HD2      LEU  48  -5.663  -3.579  -5.781
  378   2HD2  LEU  48          2HD2      LEU  48  -5.408  -5.306  -5.530
  379   3HD2  LEU  48          3HD2      LEU  48  -5.432  -4.207  -4.150
  380    H    GLY  49           H        GLY  49  -8.079  -6.925  -1.650
  381   1HA   GLY  49          2HA       GLY  49  -9.460  -9.153  -1.415
  382   2HA   GLY  49          1HA       GLY  49  -8.970  -9.326  -3.097
  383    H    GLN  50           H        GLN  50  -7.288  -8.176  -0.164
  384    HA   GLN  50           HA       GLN  50  -5.456 -10.433  -0.189
  385   1HB   GLN  50          2HB       GLN  50  -4.689  -7.740  -1.204
  386   2HB   GLN  50          1HB       GLN  50  -3.541  -8.552  -0.140
  387   1HG   GLN  50          2HG       GLN  50  -3.772 -10.598  -1.622
  388   2HG   GLN  50          1HG       GLN  50  -4.678  -9.588  -2.749
  389   1HE2  GLN  50          1HE2      GLN  50  -1.573 -10.691  -2.105
  390   2HE2  GLN  50          2HE2      GLN  50  -0.695  -9.463  -2.880
  391    H    ASN  51           H        ASN  51  -3.974 -10.384   1.664
  392    HA   ASN  51           HA       ASN  51  -4.457  -8.405   3.735
  393   1HB   ASN  51          2HB       ASN  51  -6.293 -10.282   3.817
  394   2HB   ASN  51          1HB       ASN  51  -5.003 -11.243   4.540
  395   1HD2  ASN  51          1HD2      ASN  51  -5.273 -11.182   6.781
  396   2HD2  ASN  51          2HD2      ASN  51  -5.642  -9.786   7.674
  397    HA   PRO  52           HA       PRO  52  -0.252 -10.282   3.868
  398   1HB   PRO  52          2HB       PRO  52   1.104  -7.927   3.571
  399   2HB   PRO  52          1HB       PRO  52   0.527  -8.901   2.213
  400   1HG   PRO  52          2HG       PRO  52  -0.500  -6.340   3.256
  401   2HG   PRO  52          1HG       PRO  52  -0.646  -7.034   1.636
  402   1HD   PRO  52          2HD       PRO  52  -2.646  -7.007   3.671
  403   2HD   PRO  52          1HD       PRO  52  -2.718  -7.862   2.112
  404    H    THR  53           H        THR  53   1.771  -9.035   5.118
  405    HA   THR  53           HA       THR  53   0.747  -8.506   7.842
  406    HB   THR  53           HB       THR  53   2.766  -9.406   8.689
  407    HG1  THR  53           HG1      THR  53   4.525  -9.842   7.192
  408   1HG2  THR  53          1HG2      THR  53   1.351 -11.153   7.728
  409   2HG2  THR  53          2HG2      THR  53   3.054 -11.564   7.525
  410   3HG2  THR  53          3HG2      THR  53   2.130 -10.936   6.160
  411    HA   PRO  54           HA       PRO  54   2.505  -4.454   7.830
  412   1HB   PRO  54          2HB       PRO  54   3.967  -4.300  10.144
  413   2HB   PRO  54          1HB       PRO  54   2.197  -4.271  10.084
  414   1HG   PRO  54          2HG       PRO  54   4.025  -6.479  10.874
  415   2HG   PRO  54          1HG       PRO  54   2.391  -6.107  11.447
  416   1HD   PRO  54          2HD       PRO  54   3.033  -8.105   9.605
  417   2HD   PRO  54          1HD       PRO  54   1.413  -7.411   9.833
  418    H    GLU  55           H        GLU  55   4.860  -7.022   8.352
  419    HA   GLU  55           HA       GLU  55   7.124  -5.355   7.602
  420   1HB   GLU  55          2HB       GLU  55   8.438  -7.449   7.789
  421   2HB   GLU  55          1HB       GLU  55   7.517  -7.100   9.249
  422   1HG   GLU  55          2HG       GLU  55   5.834  -8.732   8.661
  423   2HG   GLU  55          1HG       GLU  55   6.548  -8.968   7.066
  424    H    GLU  56           H        GLU  56   5.021  -7.765   6.121
  425    HA   GLU  56           HA       GLU  56   6.594  -8.088   3.740
  426   1HB   GLU  56          2HB       GLU  56   3.773  -8.836   4.493
  427   2HB   GLU  56          1HB       GLU  56   4.376  -9.057   2.849
  428   1HG   GLU  56          2HG       GLU  56   5.924 -10.102   5.220
  429   2HG   GLU  56          1HG       GLU  56   4.615 -11.043   4.504
  430    H    LEU  57           H        LEU  57   3.573  -6.310   4.485
  431    HA   LEU  57           HA       LEU  57   3.244  -5.150   1.938
  432   1HB   LEU  57          2HB       LEU  57   1.354  -4.546   2.938
  433   2HB   LEU  57          1HB       LEU  57   2.005  -4.961   4.503
  434    HG   LEU  57           HG       LEU  57   2.636  -2.293   3.276
  435   1HD1  LEU  57          1HD1      LEU  57   0.626  -1.371   4.334
  436   2HD1  LEU  57          2HD1      LEU  57   0.151  -2.982   4.872
  437   3HD1  LEU  57          3HD1      LEU  57   0.176  -2.598   3.151
  438   1HD2  LEU  57          1HD2      LEU  57   2.068  -2.289   6.085
  439   2HD2  LEU  57          2HD2      LEU  57   3.615  -2.001   5.286
  440   3HD2  LEU  57          3HD2      LEU  57   3.150  -3.640   5.745
  441    H    GLN  58           H        GLN  58   5.283  -4.270   4.657
  442    HA   GLN  58           HA       GLN  58   5.886  -1.613   3.997
  443   1HB   GLN  58          2HB       GLN  58   6.798  -3.484   5.890
  444   2HB   GLN  58          1HB       GLN  58   8.231  -2.983   4.993
  445   1HG   GLN  58          2HG       GLN  58   6.221  -1.105   6.274
  446   2HG   GLN  58          1HG       GLN  58   7.812  -1.494   6.926
  447   1HE2  GLN  58          1HE2      GLN  58   6.114   0.348   4.444
  448   2HE2  GLN  58          2HE2      GLN  58   7.479   1.169   3.860
  449    H    GLU  59           H        GLU  59   7.311  -4.659   2.850
  450    HA   GLU  59           HA       GLU  59   9.440  -3.534   1.356
  451   1HB   GLU  59          2HB       GLU  59   7.904  -6.117   0.980
  452   2HB   GLU  59          1HB       GLU  59   9.339  -5.687   0.050
  453   1HG   GLU  59          2HG       GLU  59  10.595  -5.432   2.206
  454   2HG   GLU  59          1HG       GLU  59   9.169  -6.028   3.059
  455    H    MET  60           H        MET  60   6.085  -4.325   0.504
  456    HA   MET  60           HA       MET  60   6.200  -3.729  -2.243
  457   1HB   MET  60          2HB       MET  60   3.915  -3.528  -0.270
  458   2HB   MET  60          1HB       MET  60   3.722  -3.287  -2.005
  459   1HG   MET  60          2HG       MET  60   4.281  -5.521  -2.502
  460   2HG   MET  60          1HG       MET  60   5.047  -5.773  -0.933
  461   1HE   MET  60          1HE       MET  60   1.889  -6.225  -3.030
  462   2HE   MET  60          2HE       MET  60   1.806  -4.532  -2.548
  463   3HE   MET  60          3HE       MET  60   0.590  -5.666  -1.967
  464    H    ILE  61           H        ILE  61   5.636  -1.656   0.581
  465    HA   ILE  61           HA       ILE  61   4.853   0.708  -0.638
  466    HB   ILE  61           HB       ILE  61   6.586   0.260   1.804
  467   1HG1  ILE  61          2HG1      ILE  61   4.436  -0.640   2.220
  468   2HG1  ILE  61          1HG1      ILE  61   4.367   0.976   2.909
  469   1HG2  ILE  61          1HG2      ILE  61   5.413   2.776   0.638
  470   2HG2  ILE  61          2HG2      ILE  61   7.061   2.479   1.192
  471   3HG2  ILE  61          3HG2      ILE  61   5.751   2.632   2.364
  472   1HD1  ILE  61          1HD1      ILE  61   3.283   0.105   0.219
  473   2HD1  ILE  61          2HD1      ILE  61   3.335   1.782   0.766
  474   3HD1  ILE  61          3HD1      ILE  61   2.343   0.605   1.624
  475    H    ASP  62           H        ASP  62   8.186   0.192   0.531
  476    HA   ASP  62           HA       ASP  62   9.358   2.259  -0.942
  477   1HB   ASP  62          2HB       ASP  62  10.354   0.830   0.977
  478   2HB   ASP  62          1HB       ASP  62  10.866  -0.265  -0.306
  479    H    GLU  63           H        GLU  63   8.668  -1.074  -1.890
  480    HA   GLU  63           HA       GLU  63  10.293  -1.224  -4.187
  481   1HB   GLU  63          2HB       GLU  63   7.860  -2.651  -3.227
  482   2HB   GLU  63          1HB       GLU  63   8.287  -2.815  -4.929
  483   1HG   GLU  63          2HG       GLU  63  10.589  -3.489  -4.256
  484   2HG   GLU  63          1HG       GLU  63  10.090  -3.412  -2.565
  485    H    VAL  64           H        VAL  64   7.054   0.137  -3.722
  486    HA   VAL  64           HA       VAL  64   6.957   0.822  -6.591
  487    HB   VAL  64           HB       VAL  64   4.587   1.144  -6.325
  488   1HG1  VAL  64          1HG1      VAL  64   5.891  -1.281  -6.032
  489   2HG1  VAL  64          2HG1      VAL  64   4.169  -1.079  -6.350
  490   3HG1  VAL  64          3HG1      VAL  64   4.741  -1.290  -4.695
  491   1HG2  VAL  64          1HG2      VAL  64   4.548   2.191  -4.125
  492   2HG2  VAL  64          2HG2      VAL  64   5.127   0.706  -3.370
  493   3HG2  VAL  64          3HG2      VAL  64   3.517   0.760  -4.088
  494    H    ASP  65           H        ASP  65   7.492   2.279  -3.506
  495    HA   ASP  65           HA       ASP  65   6.455   4.873  -4.103
  496   1HB   ASP  65          2HB       ASP  65   7.441   3.685  -1.828
  497   2HB   ASP  65          1HB       ASP  65   8.748   4.781  -2.263
  498    H    GLU  66           H        GLU  66   7.158   5.461  -6.123
  499    HA   GLU  66           HA       GLU  66   9.829   5.340  -7.050
  500   1HB   GLU  66          2HB       GLU  66   7.485   7.043  -7.902
  501   2HB   GLU  66          1HB       GLU  66   9.037   7.047  -8.743
  502   1HG   GLU  66          2HG       GLU  66   7.692   4.420  -8.186
  503   2HG   GLU  66          1HG       GLU  66   7.108   5.412  -9.521
  504    H    ASP  67           H        ASP  67   7.990   8.006  -5.560
  505    HA   ASP  67           HA       ASP  67  10.301   9.768  -5.658
  506   1HB   ASP  67          2HB       ASP  67   8.723  11.253  -4.197
  507   2HB   ASP  67          1HB       ASP  67   8.373  11.035  -5.908
  508    H    GLY  68           H        GLY  68   8.599   7.853  -3.213
  509   1HA   GLY  68          2HA       GLY  68   9.329   7.093  -1.153
  510   2HA   GLY  68          1HA       GLY  68  10.911   7.784  -1.511
  511    H    SER  69           H        SER  69   7.671   9.243  -1.256
  512    HA   SER  69           HA       SER  69   8.771  11.356   0.438
  513   1HB   SER  69          2HB       SER  69   6.522  12.410   0.100
  514   2HB   SER  69          1HB       SER  69   7.401  12.110  -1.395
  515    HG   SER  69           HG       SER  69   5.884  10.773  -1.971
  516    H    GLY  70           H        GLY  70   6.055   9.048   0.496
  517   1HA   GLY  70          2HA       GLY  70   6.141   7.982   2.942
  518   2HA   GLY  70          1HA       GLY  70   5.542   9.595   3.320
  519    H    THR  71           H        THR  71   4.127   9.753   0.699
  520    HA   THR  71           HA       THR  71   1.781   8.105   1.411
  521    HB   THR  71           HB       THR  71   0.458   9.761   0.168
  522    HG1  THR  71           HG1      THR  71   1.753  10.558  -1.360
  523   1HG2  THR  71          1HG2      THR  71   0.875  11.716   1.654
  524   2HG2  THR  71          2HG2      THR  71   2.392  10.970   2.164
  525   3HG2  THR  71          3HG2      THR  71   0.854  10.189   2.537
  526    H    VAL  72           H        VAL  72   0.617   7.043  -0.255
  527    HA   VAL  72           HA       VAL  72   2.286   6.394  -2.601
  528    HB   VAL  72           HB       VAL  72  -0.124   4.884  -1.575
  529   1HG1  VAL  72          1HG1      VAL  72   2.131   3.998  -3.394
  530   2HG1  VAL  72          2HG1      VAL  72   0.593   4.620  -3.994
  531   3HG1  VAL  72          3HG1      VAL  72   0.634   3.133  -3.047
  532   1HG2  VAL  72          1HG2      VAL  72   1.560   4.797   0.155
  533   2HG2  VAL  72          2HG2      VAL  72   2.837   4.521  -1.030
  534   3HG2  VAL  72          3HG2      VAL  72   1.634   3.269  -0.723
  535    H    ASP  73           H        ASP  73   1.781   7.370  -4.431
  536    HA   ASP  73           HA       ASP  73  -0.835   8.601  -4.807
  537   1HB   ASP  73          2HB       ASP  73   1.563   8.485  -6.660
  538   2HB   ASP  73          1HB       ASP  73   0.117   9.462  -6.907
  539    H    PHE  74           H        PHE  74  -1.731   8.308  -7.178
  540    HA   PHE  74           HA       PHE  74  -2.612   5.622  -7.395
  541   1HB   PHE  74          2HB       PHE  74  -3.742   7.779  -8.291
  542   2HB   PHE  74          1HB       PHE  74  -2.708   7.558  -9.702
  543    HD1  PHE  74           HD1      PHE  74  -4.217   6.882 -11.383
  544    HD2  PHE  74           HD2      PHE  74  -4.288   4.928  -7.558
  545    HE1  PHE  74           HE1      PHE  74  -5.789   5.186 -12.276
  546    HE2  PHE  74           HE2      PHE  74  -5.855   3.231  -8.455
  547    HZ   PHE  74           HZ       PHE  74  -6.609   3.359 -10.812
  548    H    ASP  75           H        ASP  75  -0.006   7.416  -8.962
  549    HA   ASP  75           HA       ASP  75   0.599   5.496 -10.973
  550   1HB   ASP  75          2HB       ASP  75   2.019   7.822  -9.748
  551   2HB   ASP  75          1HB       ASP  75   2.974   6.653 -10.660
  552    H    GLU  76           H        GLU  76   1.700   5.990  -7.646
  553    HA   GLU  76           HA       GLU  76   3.596   3.808  -7.701
  554   1HB   GLU  76          2HB       GLU  76   2.446   5.003  -5.187
  555   2HB   GLU  76          1HB       GLU  76   4.055   4.335  -5.455
  556   1HG   GLU  76          2HG       GLU  76   4.483   6.238  -7.064
  557   2HG   GLU  76          1HG       GLU  76   2.945   6.934  -6.551
  558    H    PHE  77           H        PHE  77   0.216   4.184  -7.154
  559    HA   PHE  77           HA       PHE  77  -0.186   1.792  -5.593
  560   1HB   PHE  77          2HB       PHE  77  -1.711   3.747  -5.462
  561   2HB   PHE  77          1HB       PHE  77  -2.181   3.475  -7.137
  562    HD1  PHE  77           HD1      PHE  77  -2.072   1.810  -3.782
  563    HD2  PHE  77           HD2      PHE  77  -3.912   1.981  -7.666
  564    HE1  PHE  77           HE1      PHE  77  -3.789   0.179  -3.043
  565    HE2  PHE  77           HE2      PHE  77  -5.627   0.349  -6.920
  566    HZ   PHE  77           HZ       PHE  77  -5.565  -0.551  -4.610
  567    H    LEU  78           H        LEU  78  -0.602   2.723  -9.006
  568    HA   LEU  78           HA       LEU  78  -1.670   0.191  -9.830
  569   1HB   LEU  78          2HB       LEU  78  -0.439   2.444 -11.398
  570   2HB   LEU  78          1HB       LEU  78  -1.213   1.050 -12.121
  571    HG   LEU  78           HG       LEU  78  -2.823   2.612 -10.164
  572   1HD1  LEU  78          1HD1      LEU  78  -2.024   4.509 -11.256
  573   2HD1  LEU  78          2HD1      LEU  78  -3.416   4.091 -12.256
  574   3HD1  LEU  78          3HD1      LEU  78  -1.789   3.659 -12.783
  575   1HD2  LEU  78          1HD2      LEU  78  -4.571   1.701 -11.330
  576   2HD2  LEU  78          2HD2      LEU  78  -3.345   0.540 -11.840
  577   3HD2  LEU  78          3HD2      LEU  78  -3.768   1.894 -12.889
  578    H    VAL  79           H        VAL  79   1.597   1.550  -9.687
  579    HA   VAL  79           HA       VAL  79   2.876  -0.301 -11.383
  580    HB   VAL  79           HB       VAL  79   4.952   0.208 -10.023
  581   1HG1  VAL  79          1HG1      VAL  79   4.706   1.508 -11.951
  582   2HG1  VAL  79          2HG1      VAL  79   4.790   2.736 -10.684
  583   3HG1  VAL  79          3HG1      VAL  79   3.228   2.273 -11.363
  584   1HG2  VAL  79          1HG2      VAL  79   4.853   1.918  -8.344
  585   2HG2  VAL  79          2HG2      VAL  79   3.632   0.720  -7.917
  586   3HG2  VAL  79          3HG2      VAL  79   3.153   2.234  -8.680
  587    H    MET  80           H        MET  80   1.726  -0.625  -8.123
  588    HA   MET  80           HA       MET  80   3.234  -2.644  -7.028
  589   1HB   MET  80          2HB       MET  80   0.362  -1.888  -6.865
  590   2HB   MET  80          1HB       MET  80   0.811  -3.470  -6.230
  591   1HG   MET  80          2HG       MET  80   2.137  -2.577  -4.554
  592   2HG   MET  80          1HG       MET  80   2.496  -1.117  -5.475
  593   1HE   MET  80          1HE       MET  80  -1.470  -2.095  -3.356
  594   2HE   MET  80          2HE       MET  80   0.026  -3.008  -3.174
  595   3HE   MET  80          3HE       MET  80  -0.807  -2.996  -4.727
  596    H    MET  81           H        MET  81   0.870  -2.942  -9.635
  597    HA   MET  81           HA       MET  81   0.891  -5.837  -9.595
  598   1HB   MET  81          2HB       MET  81  -0.254  -3.816 -11.530
  599   2HB   MET  81          1HB       MET  81  -0.375  -5.559 -11.771
  600   1HG   MET  81          2HG       MET  81  -1.248  -4.297  -9.175
  601   2HG   MET  81          1HG       MET  81  -2.335  -4.357 -10.561
  602   1HE   MET  81          1HE       MET  81  -3.458  -7.824 -10.980
  603   2HE   MET  81          2HE       MET  81  -2.590  -6.667 -11.987
  604   3HE   MET  81          3HE       MET  81  -3.890  -6.108 -10.935
  605    H    VAL  82           H        VAL  82   2.130  -3.330 -11.813
  606    HA   VAL  82           HA       VAL  82   3.443  -5.165 -13.556
  607    HB   VAL  82           HB       VAL  82   4.581  -3.147 -14.470
  608   1HG1  VAL  82          1HG1      VAL  82   1.903  -3.874 -14.598
  609   2HG1  VAL  82          2HG1      VAL  82   2.723  -2.748 -15.681
  610   3HG1  VAL  82          3HG1      VAL  82   1.847  -2.141 -14.275
  611   1HG2  VAL  82          1HG2      VAL  82   3.709  -0.933 -13.537
  612   2HG2  VAL  82          2HG2      VAL  82   4.878  -1.782 -12.527
  613   3HG2  VAL  82          3HG2      VAL  82   3.163  -1.849 -12.136
  614    H    ARG  83           H        ARG  83   4.520  -3.429 -10.662
  615    HA   ARG  83           HA       ARG  83   7.291  -3.645 -10.972
  616   1HB   ARG  83          2HB       ARG  83   7.455  -3.499  -8.529
  617   2HB   ARG  83          1HB       ARG  83   6.267  -2.355  -9.147
  618   1HG   ARG  83          2HG       ARG  83   4.914  -3.250  -7.554
  619   2HG   ARG  83          1HG       ARG  83   4.700  -4.554  -8.721
  620   1HD   ARG  83          2HD       ARG  83   7.061  -5.252  -7.467
  621   2HD   ARG  83          1HD       ARG  83   6.122  -4.554  -6.151
  622    HE   ARG  83           HE       ARG  83   4.505  -6.365  -7.629
  623   1HH1  ARG  83          2HH1      ARG  83   7.187  -6.276  -5.393
  624   2HH1  ARG  83          1HH1      ARG  83   6.844  -7.836  -4.727
  625   1HH2  ARG  83          1HH2      ARG  83   4.075  -8.406  -6.742
  626   2HH2  ARG  83          2HH2      ARG  83   5.088  -9.039  -5.487
  627    H    CYS  84           H        CYS  84   4.947  -6.117 -10.252
  628    HA   CYS  84           HA       CYS  84   6.623  -8.043  -9.044
  629   1HB   CYS  84          2HB       CYS  84   4.050  -8.067  -9.333
  630   2HB   CYS  84          1HB       CYS  84   4.379  -8.782 -10.911
  631    HG   CYS  84           HG       CYS  84   5.040 -10.117  -8.176
  632    H    MET  85           H        MET  85   6.148  -7.113 -12.411
  633    HA   MET  85           HA       MET  85   7.484  -9.368 -13.569
  634   1HB   MET  85          2HB       MET  85   6.519  -6.716 -14.533
  635   2HB   MET  85          1HB       MET  85   7.764  -7.523 -15.485
  636   1HG   MET  85          2HG       MET  85   5.422  -9.148 -14.583
  637   2HG   MET  85          1HG       MET  85   5.177  -8.007 -15.904
  638   1HE   MET  85          1HE       MET  85   5.900  -7.961 -17.896
  639   2HE   MET  85          2HE       MET  85   5.189  -9.503 -18.365
  640   3HE   MET  85          3HE       MET  85   6.846  -9.129 -18.828
  641    H    LYS  86           H        LYS  86   8.474  -6.146 -12.497
  642    HA   LYS  86           HA       LYS  86  11.084  -6.119 -13.553
  643   1HB   LYS  86          2HB       LYS  86   9.543  -4.362 -12.108
  644   2HB   LYS  86          1HB       LYS  86  10.767  -4.832 -10.928
  645   1HG   LYS  86          2HG       LYS  86  12.395  -4.464 -13.002
  646   2HG   LYS  86          1HG       LYS  86  11.091  -3.400 -13.530
  647   1HD   LYS  86          2HD       LYS  86  11.562  -1.854 -11.944
  648   2HD   LYS  86          1HD       LYS  86  11.758  -3.081 -10.693
  649   1HE   LYS  86          2HE       LYS  86  13.859  -2.724 -12.824
  650   2HE   LYS  86          1HE       LYS  86  13.847  -1.691 -11.395
  651   1HZ   LYS  86          1HZ       LYS  86  15.243  -3.618 -11.048
  652   2HZ   LYS  86          2HZ       LYS  86  13.950  -4.663 -11.398
  653   3HZ   LYS  86          3HZ       LYS  86  13.904  -3.682 -10.011
  654    H    ASP  87           H        ASP  87  13.081  -6.602 -12.642
  655    HA   ASP  87           HA       ASP  87  13.030  -8.802 -10.708
  656   1HB   ASP  87          2HB       ASP  87  15.526  -8.922 -11.300
  657   2HB   ASP  87          1HB       ASP  87  14.381  -9.348 -12.568
  658    H    ASP  88           H        ASP  88  12.450  -7.414  -8.917
  659    HA   ASP  88           HA       ASP  88  14.369  -5.441  -8.006
  660   1HB   ASP  88          2HB       ASP  88  12.892  -5.453  -5.910
  661   2HB   ASP  88          1HB       ASP  88  12.148  -4.899  -7.405
  662    H    SER  89           HN       SER  89  16.262  -6.108  -7.256
  663    HA   SER  89           HA       SER  89  16.336  -8.024  -5.052
  664   1HB   SER  89          2HB       SER  89  16.617  -9.335  -7.221
  665   2HB   SER  89          1HB       SER  89  18.135  -8.467  -7.440
  666    HG   SER  89           HG       SER  89  18.767 -10.171  -6.294
  Start of MODEL   37
    1   1H    MET   1          1H        MET   1  14.710   0.284 -14.834
    2   2H    MET   1          2H        MET   1  16.010   1.018 -15.643
    3   3H    MET   1          3H        MET   1  16.233  -0.464 -14.843
    4    HA   MET   1           HA       MET   1  14.518  -0.012 -17.228
    5   1HB   MET   1          2HB       MET   1  17.101  -0.021 -17.453
    6   2HB   MET   1          1HB       MET   1  16.991  -1.735 -17.054
    7   1HG   MET   1          2HG       MET   1  15.148  -1.760 -18.936
    8   2HG   MET   1          1HG       MET   1  15.952  -0.284 -19.469
    9   1HE   MET   1          1HE       MET   1  17.118  -4.571 -19.873
   10   2HE   MET   1          2HE       MET   1  15.880  -3.713 -20.786
   11   3HE   MET   1          3HE       MET   1  15.752  -3.827 -19.032
   12    H    ASN   2           H        ASN   2  12.874  -1.394 -17.296
   13    HA   ASN   2           HA       ASN   2  13.217  -4.139 -16.315
   14   1HB   ASN   2          2HB       ASN   2  11.480  -2.100 -15.072
   15   2HB   ASN   2          1HB       ASN   2  10.698  -3.647 -15.405
   16   1HD2  ASN   2          1HD2      ASN   2  12.084  -5.639 -14.663
   17   2HD2  ASN   2          2HD2      ASN   2  12.900  -5.472 -13.185
   18    H    ASP   3           H        ASP   3  11.780  -5.636 -17.227
   19    HA   ASP   3           HA       ASP   3  10.355  -4.637 -19.620
   20   1HB   ASP   3          2HB       ASP   3  11.863  -7.172 -19.072
   21   2HB   ASP   3          1HB       ASP   3  10.599  -7.143 -20.302
   22    H    ILE   4           H        ILE   4   9.718  -5.731 -16.531
   23    HA   ILE   4           HA       ILE   4   7.522  -7.505 -17.103
   24    HB   ILE   4           HB       ILE   4   6.993  -7.343 -14.713
   25   1HG1  ILE   4          2HG1      ILE   4   8.847  -5.953 -13.399
   26   2HG1  ILE   4          1HG1      ILE   4   8.859  -5.001 -14.884
   27   1HG2  ILE   4          1HG2      ILE   4   9.855  -7.742 -15.558
   28   2HG2  ILE   4          2HG2      ILE   4   8.648  -8.954 -15.126
   29   3HG2  ILE   4          3HG2      ILE   4   9.379  -7.952 -13.872
   30   1HD1  ILE   4          1HD1      ILE   4   6.728  -4.212 -14.555
   31   2HD1  ILE   4          2HD1      ILE   4   7.146  -4.505 -12.868
   32   3HD1  ILE   4          3HD1      ILE   4   6.190  -5.689 -13.758
   33    H    TYR   5           H        TYR   5   7.919  -4.054 -16.697
   34    HA   TYR   5           HA       TYR   5   5.170  -3.399 -16.281
   35   1HB   TYR   5          2HB       TYR   5   7.421  -1.713 -17.414
   36   2HB   TYR   5          1HB       TYR   5   5.849  -1.104 -16.897
   37    HD1  TYR   5           HD1      TYR   5   5.131  -1.460 -14.477
   38    HD2  TYR   5           HD2      TYR   5   9.152  -2.102 -15.847
   39    HE1  TYR   5           HE1      TYR   5   5.949  -1.346 -12.140
   40    HE2  TYR   5           HE2      TYR   5   9.968  -1.992 -13.511
   41    HH   TYR   5           HH       TYR   5   8.387  -2.475 -10.987
   42    H    LYS   6           H        LYS   6   7.214  -3.882 -19.100
   43    HA   LYS   6           HA       LYS   6   5.366  -2.871 -21.046
   44   1HB   LYS   6          2HB       LYS   6   7.473  -4.968 -21.582
   45   2HB   LYS   6          1HB       LYS   6   6.822  -3.768 -22.697
   46   1HG   LYS   6          2HG       LYS   6   8.705  -3.333 -20.372
   47   2HG   LYS   6          1HG       LYS   6   8.958  -2.929 -22.070
   48   1HD   LYS   6          2HD       LYS   6   7.421  -1.118 -21.981
   49   2HD   LYS   6          1HD       LYS   6   6.740  -1.670 -20.449
   50   1HE   LYS   6          2HE       LYS   6   8.525  -0.874 -19.206
   51   2HE   LYS   6          1HE       LYS   6   9.662  -1.022 -20.546
   52   1HZ   LYS   6          1HZ       LYS   6   7.500   1.004 -20.311
   53   2HZ   LYS   6          2HZ       LYS   6   8.566   0.850 -21.626
   54   3HZ   LYS   6          3HZ       LYS   6   9.158   1.288 -20.096
   55    H    ALA   7           H        ALA   7   6.048  -6.018 -19.627
   56    HA   ALA   7           HA       ALA   7   4.306  -7.545 -21.292
   57   1HB   ALA   7          1HB       ALA   7   6.184  -8.285 -19.565
   58   2HB   ALA   7          2HB       ALA   7   4.816  -9.337 -19.929
   59   3HB   ALA   7          3HB       ALA   7   4.811  -8.361 -18.461
   60    H    ALA   8           H        ALA   8   3.856  -5.633 -18.369
   61    HA   ALA   8           HA       ALA   8   1.198  -6.618 -17.825
   62   1HB   ALA   8          1HB       ALA   8   2.407  -5.833 -15.936
   63   2HB   ALA   8          2HB       ALA   8   1.160  -4.625 -16.242
   64   3HB   ALA   8          3HB       ALA   8   2.826  -4.320 -16.738
   65    H    VAL   9           H        VAL   9   2.600  -4.075 -19.771
   66    HA   VAL   9           HA       VAL   9   0.549  -2.216 -19.942
   67    HB   VAL   9           HB       VAL   9   2.578  -3.179 -21.946
   68   1HG1  VAL   9          1HG1      VAL   9   0.397  -1.116 -22.344
   69   2HG1  VAL   9          2HG1      VAL   9   0.770  -2.504 -23.366
   70   3HG1  VAL   9          3HG1      VAL   9   1.878  -1.133 -23.303
   71   1HG2  VAL   9          1HG2      VAL   9   3.781  -1.330 -21.288
   72   2HG2  VAL   9          2HG2      VAL   9   2.861  -1.581 -19.805
   73   3HG2  VAL   9          3HG2      VAL   9   2.336  -0.371 -20.974
   74    H    GLU  10           H        GLU  10   0.986  -5.111 -21.996
   75    HA   GLU  10           HA       GLU  10  -1.479  -4.777 -23.397
   76   1HB   GLU  10          2HB       GLU  10   0.356  -7.153 -23.059
   77   2HB   GLU  10          1HB       GLU  10  -1.098  -7.194 -24.058
   78   1HG   GLU  10          2HG       GLU  10  -0.186  -5.868 -25.680
   79   2HG   GLU  10          1HG       GLU  10   0.702  -4.882 -24.518
   80    H    GLN  11           H        GLN  11  -0.767  -5.957 -20.249
   81    HA   GLN  11           HA       GLN  11  -3.134  -7.648 -20.084
   82   1HB   GLN  11          2HB       GLN  11  -1.177  -6.871 -17.911
   83   2HB   GLN  11          1HB       GLN  11  -2.409  -8.127 -17.809
   84   1HG   GLN  11          2HG       GLN  11  -0.229  -8.148 -19.907
   85   2HG   GLN  11          1HG       GLN  11  -0.052  -8.940 -18.342
   86   1HE2  GLN  11          1HE2      GLN  11  -1.621  -9.148 -21.480
   87   2HE2  GLN  11          2HE2      GLN  11  -2.363 -10.651 -21.218
   88    H    LEU  12           H        LEU  12  -2.016  -4.491 -18.933
   89    HA   LEU  12           HA       LEU  12  -3.999  -3.914 -17.069
   90   1HB   LEU  12          2HB       LEU  12  -2.509  -2.134 -18.975
   91   2HB   LEU  12          1HB       LEU  12  -3.639  -1.503 -17.797
   92    HG   LEU  12           HG       LEU  12  -1.728  -3.290 -16.548
   93   1HD1  LEU  12          1HD1      LEU  12   0.291  -2.054 -16.936
   94   2HD1  LEU  12          2HD1      LEU  12  -0.571  -0.820 -17.859
   95   3HD1  LEU  12          3HD1      LEU  12  -0.384  -2.446 -18.518
   96   1HD2  LEU  12          1HD2      LEU  12  -2.197  -0.307 -16.231
   97   2HD2  LEU  12          2HD2      LEU  12  -1.484  -1.397 -15.042
   98   3HD2  LEU  12          3HD2      LEU  12  -3.189  -1.547 -15.465
   99    H    THR  13           H        THR  13  -6.094  -3.702 -17.180
  100    HA   THR  13           HA       THR  13  -7.365  -2.915 -19.736
  101    HB   THR  13           HB       THR  13  -9.321  -4.380 -18.623
  102    HG1  THR  13           HG1      THR  13  -8.585  -5.627 -17.129
  103   1HG2  THR  13          1HG2      THR  13  -8.785  -6.085 -20.191
  104   2HG2  THR  13          2HG2      THR  13  -7.063  -5.702 -20.126
  105   3HG2  THR  13          3HG2      THR  13  -8.190  -4.579 -20.888
  106    H    ASP  14           H        ASP  14  -9.706  -2.229 -19.326
  107    HA   ASP  14           HA       ASP  14  -9.775   0.030 -17.654
  108   1HB   ASP  14          2HB       ASP  14 -11.417  -0.961 -19.604
  109   2HB   ASP  14          1HB       ASP  14 -12.379  -1.262 -18.158
  110    H    GLU  15           H        GLU  15 -10.622  -3.335 -17.105
  111    HA   GLU  15           HA       GLU  15 -12.041  -3.025 -14.664
  112   1HB   GLU  15          2HB       GLU  15 -10.596  -5.314 -15.972
  113   2HB   GLU  15          1HB       GLU  15 -11.201  -5.472 -14.322
  114   1HG   GLU  15          2HG       GLU  15 -13.037  -4.384 -16.428
  115   2HG   GLU  15          1HG       GLU  15 -12.738  -6.121 -16.381
  116    H    GLN  16           H        GLN  16  -8.610  -3.792 -15.331
  117    HA   GLN  16           HA       GLN  16  -7.751  -3.965 -12.647
  118   1HB   GLN  16          2HB       GLN  16  -6.373  -3.420 -15.253
  119   2HB   GLN  16          1HB       GLN  16  -5.490  -3.171 -13.747
  120   1HG   GLN  16          2HG       GLN  16  -7.025  -5.720 -14.086
  121   2HG   GLN  16          1HG       GLN  16  -5.492  -5.543 -14.940
  122   1HE2  GLN  16          1HE2      GLN  16  -3.528  -5.176 -13.604
  123   2HE2  GLN  16          2HE2      GLN  16  -3.520  -5.619 -11.965
  124    H    LYS  17           H        LYS  17  -7.754  -1.199 -14.902
  125    HA   LYS  17           HA       LYS  17  -6.656   0.678 -13.088
  126   1HB   LYS  17          2HB       LYS  17  -8.174   0.840 -15.649
  127   2HB   LYS  17          1HB       LYS  17  -8.134   2.287 -14.641
  128   1HG   LYS  17          2HG       LYS  17  -6.087   2.725 -15.473
  129   2HG   LYS  17          1HG       LYS  17  -5.498   1.299 -14.620
  130   1HD   LYS  17          2HD       LYS  17  -4.912   0.685 -16.760
  131   2HD   LYS  17          1HD       LYS  17  -6.565   0.068 -16.749
  132   1HE   LYS  17          2HE       LYS  17  -7.096   2.577 -17.520
  133   2HE   LYS  17          1HE       LYS  17  -5.445   2.468 -18.127
  134   1HZ   LYS  17          1HZ       LYS  17  -6.085   0.395 -19.261
  135   2HZ   LYS  17          2HZ       LYS  17  -6.964   1.740 -19.813
  136   3HZ   LYS  17          3HZ       LYS  17  -7.688   0.625 -18.755
  137    H    ASN  18           H        ASN  18  -9.960  -0.410 -13.712
  138    HA   ASN  18           HA       ASN  18 -11.291   1.527 -12.110
  139   1HB   ASN  18          2HB       ASN  18 -11.997  -1.068 -13.366
  140   2HB   ASN  18          1HB       ASN  18 -12.963  -0.597 -11.968
  141   1HD2  ASN  18          1HD2      ASN  18 -13.313  -0.528 -15.138
  142   2HD2  ASN  18          2HD2      ASN  18 -14.012   1.000 -15.377
  143    H    GLU  19           H        GLU  19  -9.844  -1.626 -11.431
  144    HA   GLU  19           HA       GLU  19 -10.828  -1.997  -8.807
  145   1HB   GLU  19          2HB       GLU  19  -8.236  -2.935 -10.071
  146   2HB   GLU  19          1HB       GLU  19  -8.835  -3.481  -8.505
  147   1HG   GLU  19          2HG       GLU  19 -10.812  -3.644 -10.685
  148   2HG   GLU  19          1HG       GLU  19  -9.414  -4.698 -10.889
  149    H    PHE  20           H        PHE  20  -7.665  -0.760  -9.913
  150    HA   PHE  20           HA       PHE  20  -6.836   0.052  -7.306
  151   1HB   PHE  20          2HB       PHE  20  -5.822   0.928 -10.017
  152   2HB   PHE  20          1HB       PHE  20  -5.016   1.236  -8.480
  153    HD1  PHE  20           HD1      PHE  20  -4.930  -1.060  -6.944
  154    HD2  PHE  20           HD2      PHE  20  -4.966  -0.842 -11.230
  155    HE1  PHE  20           HE1      PHE  20  -3.866  -3.293  -7.064
  156    HE2  PHE  20           HE2      PHE  20  -3.891  -3.071 -11.353
  157    HZ   PHE  20           HZ       PHE  20  -3.348  -4.302  -9.270
  158    H    LYS  21           H        LYS  21  -8.336   1.804 -10.015
  159    HA   LYS  21           HA       LYS  21  -8.063   4.413  -8.984
  160   1HB   LYS  21          2HB       LYS  21  -8.736   3.944 -11.318
  161   2HB   LYS  21          1HB       LYS  21 -10.292   3.350 -10.740
  162   1HG   LYS  21          2HG       LYS  21 -10.479   5.693 -11.478
  163   2HG   LYS  21          1HG       LYS  21 -10.763   5.566  -9.743
  164   1HD   LYS  21          2HD       LYS  21  -8.621   6.434  -9.213
  165   2HD   LYS  21          1HD       LYS  21  -8.020   6.173 -10.851
  166   1HE   LYS  21          2HE       LYS  21 -10.376   7.985 -10.461
  167   2HE   LYS  21          1HE       LYS  21  -8.768   8.591 -10.067
  168   1HZ   LYS  21          1HZ       LYS  21  -8.026   8.037 -12.280
  169   2HZ   LYS  21          2HZ       LYS  21  -9.393   9.042 -12.373
  170   3HZ   LYS  21          3HZ       LYS  21  -9.540   7.375 -12.666
  171    H    ALA  22           H        ALA  22 -10.823   2.149  -8.736
  172    HA   ALA  22           HA       ALA  22 -12.422   3.831  -7.109
  173   1HB   ALA  22          1HB       ALA  22 -13.725   1.839  -6.604
  174   2HB   ALA  22          2HB       ALA  22 -12.428   0.806  -7.204
  175   3HB   ALA  22          3HB       ALA  22 -13.308   1.852  -8.317
  176    H    ALA  23           H        ALA  23 -10.097   1.259  -6.320
  177    HA   ALA  23           HA       ALA  23 -10.460   1.324  -3.505
  178   1HB   ALA  23          1HB       ALA  23  -9.312  -0.521  -4.740
  179   2HB   ALA  23          2HB       ALA  23  -8.386   0.085  -3.367
  180   3HB   ALA  23          3HB       ALA  23  -7.946   0.562  -5.007
  181    H    PHE  24           H        PHE  24  -8.783   3.417  -5.699
  182    HA   PHE  24           HA       PHE  24  -7.079   4.610  -3.667
  183   1HB   PHE  24          2HB       PHE  24  -6.596   4.353  -6.228
  184   2HB   PHE  24          1HB       PHE  24  -7.594   5.795  -6.385
  185    HD1  PHE  24           HD1      PHE  24  -4.441   4.418  -5.080
  186    HD2  PHE  24           HD2      PHE  24  -6.858   7.951  -5.465
  187    HE1  PHE  24           HE1      PHE  24  -2.501   5.819  -4.433
  188    HE2  PHE  24           HE2      PHE  24  -4.916   9.348  -4.818
  189    HZ   PHE  24           HZ       PHE  24  -2.740   8.284  -4.303
  190    H    ASP  25           H        ASP  25  -9.724   5.734  -5.795
  191    HA   ASP  25           HA       ASP  25 -10.062   8.270  -4.696
  192   1HB   ASP  25          2HB       ASP  25 -11.126   7.204  -6.811
  193   2HB   ASP  25          1HB       ASP  25 -12.414   6.703  -5.715
  194    H    ILE  26           H        ILE  26 -11.491   5.188  -3.602
  195    HA   ILE  26           HA       ILE  26 -13.436   6.206  -1.871
  196    HB   ILE  26           HB       ILE  26 -13.126   4.104  -0.544
  197   1HG1  ILE  26          2HG1      ILE  26 -10.914   3.615  -2.568
  198   2HG1  ILE  26          1HG1      ILE  26 -10.681   3.886  -0.843
  199   1HG2  ILE  26          1HG2      ILE  26 -13.639   4.305  -3.450
  200   2HG2  ILE  26          2HG2      ILE  26 -14.649   3.636  -2.170
  201   3HG2  ILE  26          3HG2      ILE  26 -13.341   2.673  -2.853
  202   1HD1  ILE  26          1HD1      ILE  26 -12.207   1.875  -0.459
  203   2HD1  ILE  26          2HD1      ILE  26 -10.621   1.518  -1.142
  204   3HD1  ILE  26          3HD1      ILE  26 -12.042   1.544  -2.183
  205    H    PHE  27           H        PHE  27  -9.960   5.821  -1.368
  206    HA   PHE  27           HA       PHE  27 -10.135   6.743   1.391
  207   1HB   PHE  27          2HB       PHE  27  -7.851   5.880  -0.378
  208   2HB   PHE  27          1HB       PHE  27  -7.584   6.610   1.203
  209    HD1  PHE  27           HD1      PHE  27  -8.271   3.576  -0.539
  210    HD2  PHE  27           HD2      PHE  27  -8.901   5.574   3.209
  211    HE1  PHE  27           HE1      PHE  27  -8.750   1.397   0.541
  212    HE2  PHE  27           HE2      PHE  27  -9.378   3.395   4.290
  213    HZ   PHE  27           HZ       PHE  27  -9.302   1.306   2.956
  214    H    ILE  28           H        ILE  28  -9.379   8.028  -1.789
  215    HA   ILE  28           HA       ILE  28  -8.357  10.533  -0.660
  216    HB   ILE  28           HB       ILE  28  -8.793   9.929  -3.586
  217   1HG1  ILE  28          2HG1      ILE  28  -7.347   8.175  -3.043
  218   2HG1  ILE  28          1HG1      ILE  28  -6.223   9.462  -3.448
  219   1HG2  ILE  28          1HG2      ILE  28  -8.327  12.220  -3.300
  220   2HG2  ILE  28          2HG2      ILE  28  -6.755  11.516  -3.671
  221   3HG2  ILE  28          3HG2      ILE  28  -7.172  11.915  -2.004
  222   1HD1  ILE  28          1HD1      ILE  28  -6.303  10.032  -0.908
  223   2HD1  ILE  28          2HD1      ILE  28  -5.359   8.632  -1.427
  224   3HD1  ILE  28          3HD1      ILE  28  -6.960   8.405  -0.728
  225    H    GLN  29           H        GLN  29 -11.139   9.808  -0.162
  226    HA   GLN  29           HA       GLN  29 -12.842  11.307  -1.909
  227   1HB   GLN  29          2HB       GLN  29 -14.526  11.102  -0.059
  228   2HB   GLN  29          1HB       GLN  29 -13.855   9.561  -0.588
  229   1HG   GLN  29          2HG       GLN  29 -12.494   9.358   1.335
  230   2HG   GLN  29          1HG       GLN  29 -12.656  11.067   1.738
  231   1HE2  GLN  29          1HE2      GLN  29 -13.661   8.130   2.818
  232   2HE2  GLN  29          2HE2      GLN  29 -15.181   8.550   3.449
  233    H    ASP  30           H        ASP  30 -11.069  12.004   1.055
  234    HA   ASP  30           HA       ASP  30 -11.438  14.869   0.595
  235   1HB   ASP  30          2HB       ASP  30 -12.218  13.476   3.169
  236   2HB   ASP  30          1HB       ASP  30 -11.956  15.214   3.042
  237    H    ALA  31           H        ALA  31  -9.170  13.257   0.171
  238    HA   ALA  31           HA       ALA  31  -7.391  13.267   2.405
  239   1HB   ALA  31          1HB       ALA  31  -6.972  11.750   0.569
  240   2HB   ALA  31          2HB       ALA  31  -5.623  12.881   0.678
  241   3HB   ALA  31          3HB       ALA  31  -6.854  13.093  -0.567
  242    H    GLU  32           H        GLU  32  -5.565  14.584   2.755
  243    HA   GLU  32           HA       GLU  32  -6.021  17.378   2.410
  244   1HB   GLU  32          2HB       GLU  32  -3.627  15.821   3.400
  245   2HB   GLU  32          1HB       GLU  32  -3.672  17.583   3.350
  246   1HG   GLU  32          2HG       GLU  32  -5.418  17.704   4.935
  247   2HG   GLU  32          1HG       GLU  32  -5.857  16.010   4.710
  248    H    ASP  33           H        ASP  33  -3.528  15.195   1.099
  249    HA   ASP  33           HA       ASP  33  -2.792  17.234  -0.885
  250   1HB   ASP  33          2HB       ASP  33  -0.814  15.937  -1.301
  251   2HB   ASP  33          1HB       ASP  33  -1.011  16.059   0.445
  252    H    GLY  34           H        GLY  34  -4.364  14.118  -0.628
  253   1HA   GLY  34          2HA       GLY  34  -5.983  13.526  -2.348
  254   2HA   GLY  34          1HA       GLY  34  -4.869  14.176  -3.544
  255    H    CYS  35           H        CYS  35  -3.765  12.185  -0.863
  256    HA   CYS  35           HA       CYS  35  -3.624   9.778  -2.523
  257   1HB   CYS  35          2HB       CYS  35  -1.159  11.054  -1.315
  258   2HB   CYS  35          1HB       CYS  35  -1.219   9.493  -2.118
  259    HG   CYS  35           HG       CYS  35  -1.914  10.791  -4.342
  260    H    ILE  36           H        ILE  36  -2.353   8.039  -1.132
  261    HA   ILE  36           HA       ILE  36  -3.586   8.110   1.553
  262    HB   ILE  36           HB       ILE  36  -3.306   5.659   1.561
  263   1HG1  ILE  36          2HG1      ILE  36  -2.822   5.014  -1.108
  264   2HG1  ILE  36          1HG1      ILE  36  -1.638   6.272  -0.758
  265   1HG2  ILE  36          1HG2      ILE  36  -4.624   6.578  -1.006
  266   2HG2  ILE  36          2HG2      ILE  36  -5.351   6.772   0.589
  267   3HG2  ILE  36          3HG2      ILE  36  -5.034   5.157  -0.046
  268   1HD1  ILE  36          1HD1      ILE  36  -0.469   4.946   0.672
  269   2HD1  ILE  36          2HD1      ILE  36  -1.300   3.622  -0.143
  270   3HD1  ILE  36          3HD1      ILE  36  -1.929   4.255   1.380
  271    H    SER  37           H        SER  37  -2.219   6.578   3.113
  272    HA   SER  37           HA       SER  37   0.429   7.826   3.249
  273   1HB   SER  37          2HB       SER  37  -1.242   7.665   5.229
  274   2HB   SER  37          1HB       SER  37  -0.723   5.985   5.332
  275    HG   SER  37           HG       SER  37   0.480   8.053   6.347
  276    H    THR  38           H        THR  38   2.305   6.737   3.035
  277    HA   THR  38           HA       THR  38   2.445   4.314   1.642
  278    HB   THR  38           HB       THR  38   4.854   4.248   2.487
  279    HG1  THR  38           HG1      THR  38   5.056   5.375   4.249
  280   1HG2  THR  38          1HG2      THR  38   4.596   5.243   0.393
  281   2HG2  THR  38          2HG2      THR  38   5.329   6.546   1.328
  282   3HG2  THR  38          3HG2      THR  38   3.591   6.546   1.026
  283    H    LYS  39           H        LYS  39   2.547   4.963   5.123
  284    HA   LYS  39           HA       LYS  39   3.120   2.270   5.910
  285   1HB   LYS  39          2HB       LYS  39   1.799   4.465   7.523
  286   2HB   LYS  39          1HB       LYS  39   2.567   3.012   8.162
  287   1HG   LYS  39          2HG       LYS  39   3.883   5.359   6.775
  288   2HG   LYS  39          1HG       LYS  39   4.176   4.762   8.407
  289   1HD   LYS  39          2HD       LYS  39   5.149   2.700   7.513
  290   2HD   LYS  39          1HD       LYS  39   4.788   3.221   5.867
  291   1HE   LYS  39          2HE       LYS  39   7.079   3.775   6.199
  292   2HE   LYS  39          1HE       LYS  39   6.207   5.297   6.375
  293   1HZ   LYS  39          1HZ       LYS  39   6.928   3.552   8.664
  294   2HZ   LYS  39          2HZ       LYS  39   6.332   5.143   8.723
  295   3HZ   LYS  39          3HZ       LYS  39   7.896   4.841   8.132
  296    H    GLU  40           H        GLU  40   0.196   4.056   5.163
  297    HA   GLU  40           HA       GLU  40  -1.514   1.906   6.191
  298   1HB   GLU  40          2HB       GLU  40  -2.058   4.682   5.153
  299   2HB   GLU  40          1HB       GLU  40  -3.353   3.511   5.392
  300   1HG   GLU  40          2HG       GLU  40  -2.996   3.401   7.718
  301   2HG   GLU  40          1HG       GLU  40  -1.373   4.080   7.592
  302    H    LEU  41           H        LEU  41   0.241   1.645   3.714
  303    HA   LEU  41           HA       LEU  41  -1.719   1.399   1.568
  304   1HB   LEU  41          2HB       LEU  41   0.562   2.270   1.135
  305   2HB   LEU  41          1HB       LEU  41   1.222   0.722   1.613
  306    HG   LEU  41           HG       LEU  41   0.502  -0.329  -0.344
  307   1HD1  LEU  41          1HD1      LEU  41  -1.576   1.833  -0.382
  308   2HD1  LEU  41          2HD1      LEU  41  -1.773   0.091  -0.553
  309   3HD1  LEU  41          3HD1      LEU  41  -1.141   1.042  -1.897
  310   1HD2  LEU  41          1HD2      LEU  41   2.174   1.645  -0.642
  311   2HD2  LEU  41          2HD2      LEU  41   0.823   2.468  -1.421
  312   3HD2  LEU  41          3HD2      LEU  41   1.434   0.955  -2.086
  313    H    GLY  42           H        GLY  42  -1.259  -0.433   4.172
  314   1HA   GLY  42          2HA       GLY  42  -1.158  -3.034   2.799
  315   2HA   GLY  42          1HA       GLY  42  -0.981  -2.772   4.530
  316    H    LYS  43           H        LYS  43  -3.309  -0.920   4.608
  317    HA   LYS  43           HA       LYS  43  -5.351  -2.907   5.035
  318   1HB   LYS  43          2HB       LYS  43  -6.682  -1.096   5.913
  319   2HB   LYS  43          1HB       LYS  43  -5.032  -0.909   6.506
  320   1HG   LYS  43          2HG       LYS  43  -4.579   0.740   4.718
  321   2HG   LYS  43          1HG       LYS  43  -6.239   0.570   4.147
  322   1HD   LYS  43          2HD       LYS  43  -6.962   1.215   6.519
  323   2HD   LYS  43          1HD       LYS  43  -5.287   1.701   6.783
  324   1HE   LYS  43          2HE       LYS  43  -5.502   3.131   4.684
  325   2HE   LYS  43          1HE       LYS  43  -7.233   2.810   4.750
  326   1HZ   LYS  43          1HZ       LYS  43  -5.605   4.085   6.882
  327   2HZ   LYS  43          2HZ       LYS  43  -7.262   3.725   7.002
  328   3HZ   LYS  43          3HZ       LYS  43  -6.717   4.868   5.869
  329    H    VAL  44           H        VAL  44  -4.538  -0.660   2.488
  330    HA   VAL  44           HA       VAL  44  -7.131  -0.652   1.246
  331    HB   VAL  44           HB       VAL  44  -6.001   0.450  -0.628
  332   1HG1  VAL  44          1HG1      VAL  44  -6.459   1.540   1.742
  333   2HG1  VAL  44          2HG1      VAL  44  -5.580   2.436   0.504
  334   3HG1  VAL  44          3HG1      VAL  44  -4.699   1.628   1.802
  335   1HG2  VAL  44          1HG2      VAL  44  -3.476  -0.221   0.918
  336   2HG2  VAL  44          2HG2      VAL  44  -3.545   0.868  -0.469
  337   3HG2  VAL  44          3HG2      VAL  44  -3.926  -0.841  -0.672
  338    H    MET  45           H        MET  45  -4.259  -2.660   1.061
  339    HA   MET  45           HA       MET  45  -4.782  -3.960  -1.394
  340   1HB   MET  45          2HB       MET  45  -3.441  -5.229   1.004
  341   2HB   MET  45          1HB       MET  45  -3.233  -5.655  -0.693
  342   1HG   MET  45          2HG       MET  45  -2.647  -2.830   0.030
  343   2HG   MET  45          1HG       MET  45  -1.515  -4.041   0.627
  344   1HE   MET  45          1HE       MET  45  -2.578  -2.791  -3.584
  345   2HE   MET  45          2HE       MET  45  -3.466  -2.581  -2.074
  346   3HE   MET  45          3HE       MET  45  -3.591  -4.102  -2.956
  347    H    ARG  46           H        ARG  46  -5.974  -4.462   1.868
  348    HA   ARG  46           HA       ARG  46  -7.145  -7.011   1.536
  349   1HB   ARG  46          2HB       ARG  46  -7.519  -4.730   3.414
  350   2HB   ARG  46          1HB       ARG  46  -8.820  -5.917   3.320
  351   1HG   ARG  46          2HG       ARG  46  -6.742  -7.611   3.452
  352   2HG   ARG  46          1HG       ARG  46  -6.024  -6.242   4.301
  353   1HD   ARG  46          2HD       ARG  46  -7.096  -7.562   5.977
  354   2HD   ARG  46          1HD       ARG  46  -8.134  -6.165   5.716
  355    HE   ARG  46           HE       ARG  46  -8.957  -8.299   4.030
  356   1HH1  ARG  46          2HH1      ARG  46  -8.919  -7.303   7.376
  357   2HH1  ARG  46          1HH1      ARG  46 -10.339  -8.201   7.789
  358   1HH2  ARG  46          1HH2      ARG  46 -10.816  -9.468   4.591
  359   2HH2  ARG  46          2HH2      ARG  46 -11.411  -9.424   6.217
  360    H    MET  47           H        MET  47  -8.372  -3.738   0.927
  361    HA   MET  47           HA       MET  47 -11.022  -4.494   0.219
  362   1HB   MET  47          2HB       MET  47  -9.383  -2.052  -0.496
  363   2HB   MET  47          1HB       MET  47 -11.090  -2.241  -0.898
  364   1HG   MET  47          2HG       MET  47 -11.402  -2.749   1.634
  365   2HG   MET  47          1HG       MET  47  -9.813  -2.007   1.823
  366   1HE   MET  47          1HE       MET  47 -13.282  -1.874   1.620
  367   2HE   MET  47          2HE       MET  47 -13.479  -1.115   0.042
  368   3HE   MET  47          3HE       MET  47 -13.807  -0.188   1.504
  369    H    LEU  48           H        LEU  48  -8.007  -4.198  -1.598
  370    HA   LEU  48           HA       LEU  48  -9.040  -4.337  -4.217
  371   1HB   LEU  48          2HB       LEU  48  -6.442  -4.683  -2.930
  372   2HB   LEU  48          1HB       LEU  48  -6.647  -5.731  -4.315
  373    HG   LEU  48           HG       LEU  48  -5.547  -3.684  -4.995
  374   1HD1  LEU  48          1HD1      LEU  48  -8.436  -3.562  -5.904
  375   2HD1  LEU  48          2HD1      LEU  48  -7.269  -4.739  -6.507
  376   3HD1  LEU  48          3HD1      LEU  48  -7.015  -3.018  -6.795
  377   1HD2  LEU  48          1HD2      LEU  48  -6.495  -2.303  -3.108
  378   2HD2  LEU  48          2HD2      LEU  48  -8.007  -2.211  -4.011
  379   3HD2  LEU  48          3HD2      LEU  48  -6.536  -1.501  -4.679
  380    H    GLY  49           H        GLY  49  -8.086  -6.900  -1.937
  381   1HA   GLY  49          2HA       GLY  49  -9.837  -8.835  -2.292
  382   2HA   GLY  49          1HA       GLY  49  -8.978  -8.969  -3.823
  383    H    GLN  50           H        GLN  50  -6.385  -8.215  -2.623
  384    HA   GLN  50           HA       GLN  50  -5.625 -10.857  -1.684
  385   1HB   GLN  50          2HB       GLN  50  -3.347 -10.095  -1.895
  386   2HB   GLN  50          1HB       GLN  50  -4.235  -9.549  -3.316
  387   1HG   GLN  50          2HG       GLN  50  -4.604  -7.468  -1.518
  388   2HG   GLN  50          1HG       GLN  50  -2.943  -7.972  -1.206
  389   1HE2  GLN  50          1HE2      GLN  50  -5.129  -7.097  -3.938
  390   2HE2  GLN  50          2HE2      GLN  50  -3.893  -6.460  -4.911
  391    H    ASN  51           H        ASN  51  -4.003 -10.964   0.167
  392    HA   ASN  51           HA       ASN  51  -4.442  -9.022   2.303
  393   1HB   ASN  51          2HB       ASN  51  -6.284 -10.875   2.333
  394   2HB   ASN  51          1HB       ASN  51  -4.996 -11.905   2.953
  395   1HD2  ASN  51          1HD2      ASN  51  -7.508 -10.444   4.210
  396   2HD2  ASN  51          2HD2      ASN  51  -6.861  -9.773   5.629
  397    HA   PRO  52           HA       PRO  52  -0.228 -10.861   2.372
  398   1HB   PRO  52          2HB       PRO  52   1.095  -8.471   2.410
  399   2HB   PRO  52          1HB       PRO  52   0.570  -9.272   0.925
  400   1HG   PRO  52          2HG       PRO  52  -0.535  -6.886   2.267
  401   2HG   PRO  52          1HG       PRO  52  -0.609  -7.352   0.561
  402   1HD   PRO  52          2HD       PRO  52  -2.690  -7.623   2.487
  403   2HD   PRO  52          1HD       PRO  52  -2.672  -8.294   0.839
  404    H    THR  53           H        THR  53   1.735  -9.800   3.831
  405    HA   THR  53           HA       THR  53   0.632  -9.637   6.566
  406    HB   THR  53           HB       THR  53   2.702 -10.515   7.346
  407    HG1  THR  53           HG1      THR  53   4.462 -10.754   5.814
  408   1HG2  THR  53          1HG2      THR  53   3.045 -12.542   5.953
  409   2HG2  THR  53          2HG2      THR  53   2.049 -11.811   4.693
  410   3HG2  THR  53          3HG2      THR  53   1.338 -12.215   6.256
  411    HA   PRO  54           HA       PRO  54   2.088  -5.518   7.126
  412   1HB   PRO  54          2HB       PRO  54   3.371  -5.602   9.551
  413   2HB   PRO  54          1HB       PRO  54   1.610  -5.616   9.354
  414   1HG   PRO  54          2HG       PRO  54   3.465  -7.870   9.966
  415   2HG   PRO  54          1HG       PRO  54   1.806  -7.593  10.521
  416   1HD   PRO  54          2HD       PRO  54   2.488  -9.363   8.507
  417   2HD   PRO  54          1HD       PRO  54   0.883  -8.611   8.666
  418    H    GLU  55           H        GLU  55   4.508  -8.042   7.492
  419    HA   GLU  55           HA       GLU  55   6.749  -6.222   7.121
  420   1HB   GLU  55          2HB       GLU  55   8.127  -8.279   7.115
  421   2HB   GLU  55          1HB       GLU  55   7.096  -8.178   8.538
  422   1HG   GLU  55          2HG       GLU  55   5.479  -9.708   7.499
  423   2HG   GLU  55          1HG       GLU  55   6.462  -9.776   6.037
  424    H    GLU  56           H        GLU  56   4.795  -8.438   5.217
  425    HA   GLU  56           HA       GLU  56   6.476  -8.473   2.902
  426   1HB   GLU  56          2HB       GLU  56   4.594 -10.126   3.536
  427   2HB   GLU  56          1HB       GLU  56   3.498  -8.927   2.849
  428   1HG   GLU  56          2HG       GLU  56   4.454  -9.117   0.696
  429   2HG   GLU  56          1HG       GLU  56   5.907  -9.901   1.315
  430    H    LEU  57           H        LEU  57   3.373  -6.798   3.600
  431    HA   LEU  57           HA       LEU  57   3.306  -5.269   1.242
  432   1HB   LEU  57          2HB       LEU  57   1.656  -3.917   2.302
  433   2HB   LEU  57          1HB       LEU  57   1.396  -5.574   2.790
  434    HG   LEU  57           HG       LEU  57   2.904  -4.739   4.867
  435   1HD1  LEU  57          1HD1      LEU  57   1.673  -2.400   5.319
  436   2HD1  LEU  57          2HD1      LEU  57   1.753  -2.311   3.560
  437   3HD1  LEU  57          3HD1      LEU  57   3.234  -2.484   4.502
  438   1HD2  LEU  57          1HD2      LEU  57   0.722  -5.802   5.061
  439   2HD2  LEU  57          2HD2      LEU  57  -0.077  -4.352   4.459
  440   3HD2  LEU  57          3HD2      LEU  57   0.720  -4.331   6.032
  441    H    GLN  58           H        GLN  58   5.047  -4.781   4.254
  442    HA   GLN  58           HA       GLN  58   5.644  -2.051   4.080
  443   1HB   GLN  58          2HB       GLN  58   6.441  -4.161   5.726
  444   2HB   GLN  58          1HB       GLN  58   7.937  -3.607   4.978
  445   1HG   GLN  58          2HG       GLN  58   5.929  -1.846   6.418
  446   2HG   GLN  58          1HG       GLN  58   7.486  -2.366   7.062
  447   1HE2  GLN  58          1HE2      GLN  58   5.926  -0.173   4.780
  448   2HE2  GLN  58          2HE2      GLN  58   7.331   0.688   4.368
  449    H    GLU  59           H        GLU  59   7.384  -4.850   2.739
  450    HA   GLU  59           HA       GLU  59   9.462  -3.398   1.474
  451   1HB   GLU  59          2HB       GLU  59   8.269  -6.110   0.857
  452   2HB   GLU  59          1HB       GLU  59   9.704  -5.467   0.059
  453   1HG   GLU  59          2HG       GLU  59  10.937  -5.411   2.105
  454   2HG   GLU  59          1HG       GLU  59   9.484  -5.678   3.069
  455    H    MET  60           H        MET  60   6.227  -4.371   0.409
  456    HA   MET  60           HA       MET  60   6.471  -3.709  -2.326
  457   1HB   MET  60          2HB       MET  60   4.050  -3.698  -0.506
  458   2HB   MET  60          1HB       MET  60   3.970  -3.476  -2.253
  459   1HG   MET  60          2HG       MET  60   5.121  -5.675  -2.541
  460   2HG   MET  60          1HG       MET  60   5.048  -5.905  -0.795
  461   1HE   MET  60          1HE       MET  60   3.527  -7.182   0.222
  462   2HE   MET  60          2HE       MET  60   3.671  -8.244  -1.175
  463   3HE   MET  60          3HE       MET  60   2.083  -7.914  -0.490
  464    H    ILE  61           H        ILE  61   5.378  -1.798   0.470
  465    HA   ILE  61           HA       ILE  61   4.601   0.545  -0.801
  466    HB   ILE  61           HB       ILE  61   5.907   0.092   1.886
  467   1HG1  ILE  61          2HG1      ILE  61   3.079   0.926   1.517
  468   2HG1  ILE  61          1HG1      ILE  61   3.488  -0.714   1.019
  469   1HG2  ILE  61          1HG2      ILE  61   6.327   2.391   1.344
  470   2HG2  ILE  61          2HG2      ILE  61   4.936   2.367   2.428
  471   3HG2  ILE  61          3HG2      ILE  61   4.698   2.601   0.696
  472   1HD1  ILE  61          1HD1      ILE  61   4.311  -1.267   3.190
  473   2HD1  ILE  61          2HD1      ILE  61   2.759  -0.467   3.442
  474   3HD1  ILE  61          3HD1      ILE  61   4.261   0.415   3.715
  475    H    ASP  62           H        ASP  62   7.735   0.195   0.866
  476    HA   ASP  62           HA       ASP  62   8.988   2.432  -0.179
  477   1HB   ASP  62          2HB       ASP  62  10.208  -0.221   0.619
  478   2HB   ASP  62          1HB       ASP  62  11.133   1.247   0.313
  479    H    GLU  63           H        GLU  63   8.694  -0.795  -1.610
  480    HA   GLU  63           HA       GLU  63  10.555  -0.407  -3.727
  481   1HB   GLU  63          2HB       GLU  63   8.345  -2.355  -3.194
  482   2HB   GLU  63          1HB       GLU  63   9.059  -2.283  -4.804
  483   1HG   GLU  63          2HG       GLU  63  10.918  -2.359  -2.465
  484   2HG   GLU  63          1HG       GLU  63  10.083  -3.849  -2.898
  485    H    VAL  64           H        VAL  64   6.973  -0.220  -3.698
  486    HA   VAL  64           HA       VAL  64   6.820   0.661  -6.418
  487    HB   VAL  64           HB       VAL  64   4.464   1.035  -6.027
  488   1HG1  VAL  64          1HG1      VAL  64   5.815  -1.396  -5.561
  489   2HG1  VAL  64          2HG1      VAL  64   4.136  -1.185  -6.053
  490   3HG1  VAL  64          3HG1      VAL  64   4.544  -1.309  -4.342
  491   1HG2  VAL  64          1HG2      VAL  64   5.149   0.701  -3.089
  492   2HG2  VAL  64          2HG2      VAL  64   3.511   0.779  -3.735
  493   3HG2  VAL  64          3HG2      VAL  64   4.579   2.177  -3.867
  494    H    ASP  65           H        ASP  65   7.257   2.335  -3.382
  495    HA   ASP  65           HA       ASP  65   6.278   4.874  -3.990
  496   1HB   ASP  65          2HB       ASP  65   7.579   3.814  -1.853
  497   2HB   ASP  65          1HB       ASP  65   8.855   4.812  -2.539
  498    H    GLU  66           H        GLU  66   6.631   5.664  -5.991
  499    HA   GLU  66           HA       GLU  66   9.204   5.564  -7.284
  500   1HB   GLU  66          2HB       GLU  66   6.535   6.750  -7.963
  501   2HB   GLU  66          1HB       GLU  66   7.964   7.237  -8.873
  502   1HG   GLU  66          2HG       GLU  66   7.343   4.322  -8.411
  503   2HG   GLU  66          1HG       GLU  66   6.609   5.204  -9.748
  504    H    ASP  67           H        ASP  67   7.330   8.035  -5.560
  505    HA   ASP  67           HA       ASP  67   9.312  10.098  -6.107
  506   1HB   ASP  67          2HB       ASP  67   7.077  10.321  -4.095
  507   2HB   ASP  67          1HB       ASP  67   7.885  11.610  -4.983
  508    H    GLY  68           H        GLY  68   8.186   8.228  -3.296
  509   1HA   GLY  68          2HA       GLY  68   9.329   7.606  -1.372
  510   2HA   GLY  68          1HA       GLY  68  10.777   8.373  -2.024
  511    H    SER  69           H        SER  69   7.587   9.823  -1.594
  512    HA   SER  69           HA       SER  69   8.762  11.999  -0.042
  513   1HB   SER  69          2HB       SER  69   6.393  12.945  -0.366
  514   2HB   SER  69          1HB       SER  69   7.401  12.778  -1.799
  515    HG   SER  69           HG       SER  69   5.412  11.889  -2.260
  516    H    GLY  70           H        GLY  70   5.856   9.932   0.166
  517   1HA   GLY  70          2HA       GLY  70   6.034   8.974   2.711
  518   2HA   GLY  70          1HA       GLY  70   5.409  10.605   2.942
  519    H    THR  71           H        THR  71   3.947  10.597   0.385
  520    HA   THR  71           HA       THR  71   1.673   8.902   1.210
  521    HB   THR  71           HB       THR  71   0.252  10.426  -0.056
  522    HG1  THR  71           HG1      THR  71   2.572  11.968  -0.564
  523   1HG2  THR  71          1HG2      THR  71   0.661  11.067   2.237
  524   2HG2  THR  71          2HG2      THR  71   0.693  12.530   1.252
  525   3HG2  THR  71          3HG2      THR  71   2.204  11.805   1.804
  526    H    VAL  72           H        VAL  72   0.537   7.686  -0.355
  527    HA   VAL  72           HA       VAL  72   2.203   6.949  -2.670
  528    HB   VAL  72           HB       VAL  72  -0.025   5.510  -1.234
  529   1HG1  VAL  72          1HG1      VAL  72   0.791   5.298  -4.024
  530   2HG1  VAL  72          2HG1      VAL  72  -0.532   4.488  -3.186
  531   3HG1  VAL  72          3HG1      VAL  72   1.086   3.789  -3.159
  532   1HG2  VAL  72          1HG2      VAL  72   1.645   4.031  -0.536
  533   2HG2  VAL  72          2HG2      VAL  72   2.510   5.567  -0.525
  534   3HG2  VAL  72          3HG2      VAL  72   2.715   4.450  -1.876
  535    H    ASP  73           H        ASP  73   1.724   7.815  -4.536
  536    HA   ASP  73           HA       ASP  73  -0.883   8.991  -5.057
  537   1HB   ASP  73          2HB       ASP  73   1.526   8.739  -6.885
  538   2HB   ASP  73          1HB       ASP  73   0.107   9.744  -7.165
  539    H    PHE  74           H        PHE  74  -1.782   8.520  -7.347
  540    HA   PHE  74           HA       PHE  74  -2.615   5.822  -7.427
  541   1HB   PHE  74          2HB       PHE  74  -3.825   7.851  -8.387
  542   2HB   PHE  74          1HB       PHE  74  -2.735   7.724  -9.767
  543    HD1  PHE  74           HD1      PHE  74  -4.207   7.032 -11.485
  544    HD2  PHE  74           HD2      PHE  74  -4.135   4.927  -7.747
  545    HE1  PHE  74           HE1      PHE  74  -5.645   5.259 -12.458
  546    HE2  PHE  74           HE2      PHE  74  -5.570   3.153  -8.715
  547    HZ   PHE  74           HZ       PHE  74  -6.327   3.317 -11.072
  548    H    ASP  75           H        ASP  75   0.116   7.436  -8.873
  549    HA   ASP  75           HA       ASP  75   0.635   5.576 -10.962
  550   1HB   ASP  75          2HB       ASP  75   2.256   7.683  -9.564
  551   2HB   ASP  75          1HB       ASP  75   3.034   6.561 -10.677
  552    H    GLU  76           H        GLU  76   2.185   5.989  -7.751
  553    HA   GLU  76           HA       GLU  76   3.625   3.514  -7.991
  554   1HB   GLU  76          2HB       GLU  76   4.181   3.880  -5.580
  555   2HB   GLU  76          1HB       GLU  76   4.594   5.224  -6.635
  556   1HG   GLU  76          2HG       GLU  76   2.198   6.105  -5.968
  557   2HG   GLU  76          1HG       GLU  76   2.429   5.038  -4.581
  558    H    PHE  77           H        PHE  77   0.426   4.264  -7.248
  559    HA   PHE  77           HA       PHE  77  -0.113   2.106  -5.411
  560   1HB   PHE  77          2HB       PHE  77  -1.470   4.200  -5.491
  561   2HB   PHE  77          1HB       PHE  77  -2.038   3.736  -7.091
  562    HD1  PHE  77           HD1      PHE  77  -2.010   2.758  -3.503
  563    HD2  PHE  77           HD2      PHE  77  -3.747   2.096  -7.380
  564    HE1  PHE  77           HE1      PHE  77  -3.785   1.367  -2.471
  565    HE2  PHE  77           HE2      PHE  77  -5.520   0.703  -6.343
  566    HZ   PHE  77           HZ       PHE  77  -5.539   0.340  -3.890
  567    H    LEU  78           H        LEU  78  -0.359   2.651  -8.913
  568    HA   LEU  78           HA       LEU  78  -1.711   0.148  -9.432
  569   1HB   LEU  78          2HB       LEU  78  -0.314   2.089 -11.261
  570   2HB   LEU  78          1HB       LEU  78  -1.225   0.696 -11.804
  571    HG   LEU  78           HG       LEU  78  -2.639   2.618 -10.028
  572   1HD1  LEU  78          1HD1      LEU  78  -2.116   3.198 -12.955
  573   2HD1  LEU  78          2HD1      LEU  78  -1.305   4.024 -11.624
  574   3HD1  LEU  78          3HD1      LEU  78  -3.050   4.182 -11.828
  575   1HD2  LEU  78          1HD2      LEU  78  -4.467   1.653 -10.970
  576   2HD2  LEU  78          2HD2      LEU  78  -3.338   0.406 -11.505
  577   3HD2  LEU  78          3HD2      LEU  78  -3.783   1.721 -12.594
  578    H    VAL  79           H        VAL  79   1.652   1.274  -9.530
  579    HA   VAL  79           HA       VAL  79   2.765  -0.879 -10.954
  580    HB   VAL  79           HB       VAL  79   4.888  -0.356  -9.673
  581   1HG1  VAL  79          1HG1      VAL  79   3.382   1.861 -11.087
  582   2HG1  VAL  79          2HG1      VAL  79   4.426   0.652 -11.838
  583   3HG1  VAL  79          3HG1      VAL  79   5.118   1.878 -10.776
  584   1HG2  VAL  79          1HG2      VAL  79   4.921   1.604  -8.265
  585   2HG2  VAL  79          2HG2      VAL  79   3.673   0.521  -7.649
  586   3HG2  VAL  79          3HG2      VAL  79   3.224   1.932  -8.604
  587    H    MET  80           H        MET  80   1.605  -0.692  -7.698
  588    HA   MET  80           HA       MET  80   2.958  -2.668  -6.340
  589   1HB   MET  80          2HB       MET  80   0.160  -1.657  -6.282
  590   2HB   MET  80          1HB       MET  80   0.495  -3.164  -5.429
  591   1HG   MET  80          2HG       MET  80   2.509  -1.888  -4.402
  592   2HG   MET  80          1HG       MET  80   1.680  -0.433  -4.954
  593   1HE   MET  80          1HE       MET  80  -1.688  -0.472  -3.162
  594   2HE   MET  80          2HE       MET  80  -1.307  -1.077  -4.771
  595   3HE   MET  80          3HE       MET  80  -0.549   0.404  -4.192
  596    H    MET  81           H        MET  81   0.544  -3.079  -8.896
  597    HA   MET  81           HA       MET  81   0.298  -5.926  -8.464
  598   1HB   MET  81          2HB       MET  81  -1.234  -5.936 -10.290
  599   2HB   MET  81          1HB       MET  81  -1.553  -4.480  -9.356
  600   1HG   MET  81          2HG       MET  81  -1.477  -3.461 -11.386
  601   2HG   MET  81          1HG       MET  81   0.269  -3.530 -11.143
  602   1HE   MET  81          1HE       MET  81  -1.670  -3.274 -13.488
  603   2HE   MET  81          2HE       MET  81  -1.512  -4.497 -14.745
  604   3HE   MET  81          3HE       MET  81  -0.133  -3.478 -14.340
  605    H    VAL  82           H        VAL  82   2.068  -3.852 -10.729
  606    HA   VAL  82           HA       VAL  82   3.003  -6.089 -12.314
  607    HB   VAL  82           HB       VAL  82   4.566  -4.337 -13.320
  608   1HG1  VAL  82          1HG1      VAL  82   2.062  -5.046 -13.950
  609   2HG1  VAL  82          2HG1      VAL  82   2.935  -3.793 -14.831
  610   3HG1  VAL  82          3HG1      VAL  82   1.773  -3.346 -13.579
  611   1HG2  VAL  82          1HG2      VAL  82   2.773  -2.452 -11.769
  612   2HG2  VAL  82          2HG2      VAL  82   4.082  -2.011 -12.862
  613   3HG2  VAL  82          3HG2      VAL  82   4.445  -2.803 -11.329
  614    H    ARG  83           H        ARG  83   4.259  -4.200  -9.614
  615    HA   ARG  83           HA       ARG  83   6.970  -4.959  -9.800
  616   1HB   ARG  83          2HB       ARG  83   7.142  -4.364  -7.425
  617   2HB   ARG  83          1HB       ARG  83   6.223  -3.152  -8.314
  618   1HG   ARG  83          2HG       ARG  83   4.490  -3.446  -6.917
  619   2HG   ARG  83          1HG       ARG  83   4.378  -5.134  -7.412
  620   1HD   ARG  83          2HD       ARG  83   6.582  -4.553  -5.542
  621   2HD   ARG  83          1HD       ARG  83   4.976  -4.295  -4.870
  622    HE   ARG  83           HE       ARG  83   4.710  -6.734  -5.990
  623   1HH1  ARG  83          2HH1      ARG  83   7.180  -5.363  -3.930
  624   2HH1  ARG  83          1HH1      ARG  83   7.598  -6.880  -3.214
  625   1HH2  ARG  83          1HH2      ARG  83   5.278  -8.709  -5.036
  626   2HH2  ARG  83          2HH2      ARG  83   6.526  -8.770  -3.838
  627    H    CYS  84           H        CYS  84   4.187  -6.793  -8.900
  628    HA   CYS  84           HA       CYS  84   5.355  -8.705  -7.171
  629   1HB   CYS  84          2HB       CYS  84   2.855  -8.332  -7.762
  630   2HB   CYS  84          1HB       CYS  84   3.177  -9.399  -9.128
  631    HG   CYS  84           HG       CYS  84   3.252 -10.240  -6.139
  632    H    MET  85           H        MET  85   5.386  -8.342 -10.669
  633    HA   MET  85           HA       MET  85   6.156 -10.942 -11.426
  634   1HB   MET  85          2HB       MET  85   6.442  -8.223 -12.638
  635   2HB   MET  85          1HB       MET  85   7.375  -9.552 -13.326
  636   1HG   MET  85          2HG       MET  85   5.136 -10.857 -13.317
  637   2HG   MET  85          1HG       MET  85   4.380  -9.277 -13.107
  638   1HE   MET  85          1HE       MET  85   3.054  -9.167 -15.467
  639   2HE   MET  85          2HE       MET  85   3.949  -7.974 -16.406
  640   3HE   MET  85          3HE       MET  85   3.823  -7.795 -14.657
  641    H    LYS  86           H        LYS  86   8.053  -8.175 -10.292
  642    HA   LYS  86           HA       LYS  86  10.196  -7.995  -9.501
  643   1HB   LYS  86          2HB       LYS  86   9.577 -10.869  -9.126
  644   2HB   LYS  86          1HB       LYS  86  11.284 -10.433  -9.099
  645   1HG   LYS  86          2HG       LYS  86  11.083  -9.213  -7.167
  646   2HG   LYS  86          1HG       LYS  86   9.448  -8.678  -7.553
  647   1HD   LYS  86          2HD       LYS  86   8.915 -10.165  -5.884
  648   2HD   LYS  86          1HD       LYS  86   8.955 -11.303  -7.230
  649   1HE   LYS  86          2HE       LYS  86  11.527 -10.720  -5.818
  650   2HE   LYS  86          1HE       LYS  86  10.351 -11.747  -5.000
  651   1HZ   LYS  86          1HZ       LYS  86  11.766 -13.133  -6.288
  652   2HZ   LYS  86          2HZ       LYS  86  11.556 -12.179  -7.677
  653   3HZ   LYS  86          3HZ       LYS  86  10.261 -13.096  -7.070
  654    H    ASP  87           H        ASP  87  12.546  -8.868  -9.967
  655    HA   ASP  87           HA       ASP  87  12.936  -8.580 -12.813
  656   1HB   ASP  87          2HB       ASP  87  14.867  -8.985 -10.519
  657   2HB   ASP  87          1HB       ASP  87  15.379  -8.815 -12.198
  658    H    ASP  88           H        ASP  88  12.025 -10.422 -13.744
  659    HA   ASP  88           HA       ASP  88  13.308 -13.003 -13.091
  660   1HB   ASP  88          2HB       ASP  88  10.690 -12.589 -13.162
  661   2HB   ASP  88          1HB       ASP  88  10.927 -12.815 -14.894
  662    H    SER  89           HN       SER  89  15.227 -12.478 -14.255
  663    HA   SER  89           HA       SER  89  14.966 -12.988 -17.138
  664   1HB   SER  89          2HB       SER  89  16.151 -10.533 -15.901
  665   2HB   SER  89          1HB       SER  89  16.892 -11.193 -17.357
  666    HG   SER  89           HG       SER  89  14.359 -10.078 -16.959
  Start of MODEL   38
    1   1H    MET   1          1H        MET   1  14.113   2.479 -20.709
    2   2H    MET   1          2H        MET   1  13.994   4.101 -20.217
    3   3H    MET   1          3H        MET   1  12.634   3.086 -20.144
    4    HA   MET   1           HA       MET   1  15.103   2.864 -18.508
    5   1HB   MET   1          2HB       MET   1  13.294   4.647 -17.993
    6   2HB   MET   1          1HB       MET   1  12.273   3.283 -17.540
    7   1HG   MET   1          2HG       MET   1  13.267   3.791 -15.496
    8   2HG   MET   1          1HG       MET   1  14.376   2.567 -16.114
    9   1HE   MET   1          1HE       MET   1  14.939   7.103 -15.895
   10   2HE   MET   1          2HE       MET   1  14.016   6.127 -14.756
   11   3HE   MET   1          3HE       MET   1  13.477   6.263 -16.429
   12    H    ASN   2           H        ASN   2  11.719   1.673 -18.633
   13    HA   ASN   2           HA       ASN   2  12.742  -1.082 -18.314
   14   1HB   ASN   2          2HB       ASN   2  11.037   0.426 -16.468
   15   2HB   ASN   2          1HB       ASN   2  10.354  -1.129 -16.943
   16   1HD2  ASN   2          1HD2      ASN   2  13.612   0.165 -16.041
   17   2HD2  ASN   2          2HD2      ASN   2  14.024  -1.168 -15.079
   18    H    ASP   3           H        ASP   3  11.208  -2.744 -19.007
   19    HA   ASP   3           HA       ASP   3   9.295  -1.719 -21.023
   20   1HB   ASP   3          2HB       ASP   3  11.461  -2.981 -21.766
   21   2HB   ASP   3          1HB       ASP   3  10.571  -4.419 -21.266
   22    H    ILE   4           H        ILE   4   9.335  -3.220 -18.056
   23    HA   ILE   4           HA       ILE   4   7.413  -5.304 -18.577
   24    HB   ILE   4           HB       ILE   4   7.326  -5.704 -16.260
   25   1HG1  ILE   4          2HG1      ILE   4   6.930  -3.219 -15.722
   26   2HG1  ILE   4          1HG1      ILE   4   7.834  -4.155 -14.536
   27   1HG2  ILE   4          1HG2      ILE   4   9.537  -6.130 -17.392
   28   2HG2  ILE   4          2HG2      ILE   4   9.631  -5.942 -15.642
   29   3HG2  ILE   4          3HG2      ILE   4  10.116  -4.616 -16.697
   30   1HD1  ILE   4          1HD1      ILE   4   8.804  -2.045 -16.438
   31   2HD1  ILE   4          2HD1      ILE   4   9.922  -3.299 -15.907
   32   3HD1  ILE   4          3HD1      ILE   4   9.155  -2.245 -14.721
   33    H    TYR   5           H        TYR   5   7.274  -1.897 -17.877
   34    HA   TYR   5           HA       TYR   5   4.541  -1.800 -17.018
   35   1HB   TYR   5          2HB       TYR   5   6.161   0.411 -18.310
   36   2HB   TYR   5          1HB       TYR   5   4.720   0.594 -17.311
   37    HD1  TYR   5           HD1      TYR   5   8.222   0.724 -17.276
   38    HD2  TYR   5           HD2      TYR   5   4.897  -0.661 -14.940
   39    HE1  TYR   5           HE1      TYR   5   9.639   0.757 -15.243
   40    HE2  TYR   5           HE2      TYR   5   6.314  -0.625 -12.905
   41    HH   TYR   5           HH       TYR   5   8.965   1.001 -12.536
   42    H    LYS   6           H        LYS   6   6.218  -1.600 -20.102
   43    HA   LYS   6           HA       LYS   6   3.885  -0.849 -21.632
   44   1HB   LYS   6          2HB       LYS   6   6.386  -2.118 -22.756
   45   2HB   LYS   6          1HB       LYS   6   5.260  -1.026 -23.560
   46   1HG   LYS   6          2HG       LYS   6   7.272  -0.370 -21.400
   47   2HG   LYS   6          1HG       LYS   6   7.147   0.321 -23.017
   48   1HD   LYS   6          2HD       LYS   6   5.127   1.494 -22.454
   49   2HD   LYS   6          1HD       LYS   6   4.978   0.623 -20.927
   50   1HE   LYS   6          2HE       LYS   6   6.655   1.850 -19.901
   51   2HE   LYS   6          1HE       LYS   6   7.481   2.191 -21.421
   52   1HZ   LYS   6          1HZ       LYS   6   6.352   4.143 -20.467
   53   2HZ   LYS   6          2HZ       LYS   6   4.860   3.349 -20.636
   54   3HZ   LYS   6          3HZ       LYS   6   5.775   3.746 -22.012
   55    H    ALA   7           H        ALA   7   5.634  -3.818 -20.907
   56    HA   ALA   7           HA       ALA   7   4.031  -5.502 -22.601
   57   1HB   ALA   7          1HB       ALA   7   5.074  -7.322 -21.055
   58   2HB   ALA   7          2HB       ALA   7   6.048  -5.993 -20.426
   59   3HB   ALA   7          3HB       ALA   7   6.134  -6.418 -22.136
   60    H    ALA   8           H        ALA   8   3.795  -4.296 -19.323
   61    HA   ALA   8           HA       ALA   8   1.795  -6.217 -18.492
   62   1HB   ALA   8          1HB       ALA   8   2.823  -3.676 -17.212
   63   2HB   ALA   8          2HB       ALA   8   3.245  -5.335 -16.784
   64   3HB   ALA   8          3HB       ALA   8   1.616  -4.734 -16.479
   65    H    VAL   9           H        VAL   9   1.850  -2.890 -19.725
   66    HA   VAL   9           HA       VAL   9  -0.754  -2.123 -19.083
   67    HB   VAL   9           HB       VAL   9   1.162  -0.769 -20.214
   68   1HG1  VAL   9          1HG1      VAL   9  -0.381  -1.316 -22.728
   69   2HG1  VAL   9          2HG1      VAL   9   0.937  -2.395 -22.279
   70   3HG1  VAL   9          3HG1      VAL   9   1.253  -0.679 -22.537
   71   1HG2  VAL   9          1HG2      VAL   9  -0.614   0.755 -21.250
   72   2HG2  VAL   9          2HG2      VAL   9  -0.852   0.328 -19.555
   73   3HG2  VAL   9          3HG2      VAL   9  -1.790  -0.483 -20.808
   74    H    GLU  10           H        GLU  10   0.370  -4.226 -21.676
   75    HA   GLU  10           HA       GLU  10  -2.194  -4.311 -23.013
   76   1HB   GLU  10          2HB       GLU  10   0.341  -5.929 -23.314
   77   2HB   GLU  10          1HB       GLU  10  -1.116  -6.244 -24.258
   78   1HG   GLU  10          2HG       GLU  10  -1.075  -3.957 -25.138
   79   2HG   GLU  10          1HG       GLU  10   0.336  -3.583 -24.148
   80    H    GLN  11           H        GLN  11  -0.759  -5.913 -20.314
   81    HA   GLN  11           HA       GLN  11  -2.511  -8.243 -20.499
   82   1HB   GLN  11          2HB       GLN  11  -0.512  -7.496 -18.352
   83   2HB   GLN  11          1HB       GLN  11  -1.349  -9.040 -18.503
   84   1HG   GLN  11          2HG       GLN  11   0.460  -7.892 -20.648
   85   2HG   GLN  11          1HG       GLN  11   0.996  -9.050 -19.432
   86   1HE2  GLN  11          1HE2      GLN  11  -0.244  -8.846 -22.565
   87   2HE2  GLN  11          2HE2      GLN  11  -0.849 -10.426 -22.700
   88    H    LEU  12           H        LEU  12  -2.037  -5.374 -18.465
   89    HA   LEU  12           HA       LEU  12  -3.932  -5.952 -16.475
   90   1HB   LEU  12          2HB       LEU  12  -3.014  -3.316 -17.604
   91   2HB   LEU  12          1HB       LEU  12  -4.071  -3.453 -16.217
   92    HG   LEU  12           HG       LEU  12  -1.698  -5.075 -15.855
   93   1HD1  LEU  12          1HD1      LEU  12   0.007  -3.460 -15.979
   94   2HD1  LEU  12          2HD1      LEU  12  -1.139  -2.121 -16.055
   95   3HD1  LEU  12          3HD1      LEU  12  -0.923  -3.178 -17.450
   96   1HD2  LEU  12          1HD2      LEU  12  -1.650  -3.939 -13.747
   97   2HD2  LEU  12          2HD2      LEU  12  -3.356  -4.139 -14.149
   98   3HD2  LEU  12          3HD2      LEU  12  -2.571  -2.576 -14.382
   99    H    THR  13           H        THR  13  -6.070  -5.983 -16.429
  100    HA   THR  13           HA       THR  13  -7.563  -5.313 -18.854
  101    HB   THR  13           HB       THR  13  -9.485  -6.188 -17.209
  102    HG1  THR  13           HG1      THR  13  -8.655  -7.680 -15.779
  103   1HG2  THR  13          1HG2      THR  13  -9.238  -8.326 -18.236
  104   2HG2  THR  13          2HG2      THR  13  -7.496  -8.116 -18.416
  105   3HG2  THR  13          3HG2      THR  13  -8.607  -7.155 -19.392
  106    H    ASP  14           H        ASP  14  -9.748  -4.266 -18.517
  107    HA   ASP  14           HA       ASP  14  -9.379  -1.661 -17.395
  108   1HB   ASP  14          2HB       ASP  14 -11.841  -3.070 -18.455
  109   2HB   ASP  14          1HB       ASP  14 -11.832  -1.390 -17.917
  110    H    GLU  15           H        GLU  15 -10.877  -4.648 -16.326
  111    HA   GLU  15           HA       GLU  15 -12.325  -3.599 -14.120
  112   1HB   GLU  15          2HB       GLU  15 -12.542  -5.882 -13.394
  113   2HB   GLU  15          1HB       GLU  15 -12.709  -5.834 -15.141
  114   1HG   GLU  15          2HG       GLU  15 -11.126  -7.424 -15.248
  115   2HG   GLU  15          1HG       GLU  15  -9.970  -6.216 -14.710
  116    H    GLN  16           H        GLN  16  -9.032  -4.773 -14.508
  117    HA   GLN  16           HA       GLN  16  -8.305  -4.842 -11.764
  118   1HB   GLN  16          2HB       GLN  16  -6.805  -4.761 -14.349
  119   2HB   GLN  16          1HB       GLN  16  -5.929  -4.375 -12.866
  120   1HG   GLN  16          2HG       GLN  16  -7.676  -6.821 -12.977
  121   2HG   GLN  16          1HG       GLN  16  -6.052  -6.870 -13.662
  122   1HE2  GLN  16          1HE2      GLN  16  -4.340  -7.195 -12.203
  123   2HE2  GLN  16          2HE2      GLN  16  -4.494  -7.105 -10.515
  124    H    LYS  17           H        LYS  17  -7.927  -2.326 -14.261
  125    HA   LYS  17           HA       LYS  17  -6.741  -0.418 -12.495
  126   1HB   LYS  17          2HB       LYS  17  -7.820  -0.378 -15.266
  127   2HB   LYS  17          1HB       LYS  17  -7.737   1.165 -14.417
  128   1HG   LYS  17          2HG       LYS  17  -5.595   1.130 -15.267
  129   2HG   LYS  17          1HG       LYS  17  -5.303   0.234 -13.775
  130   1HD   LYS  17          2HD       LYS  17  -4.386  -1.276 -15.244
  131   2HD   LYS  17          1HD       LYS  17  -6.062  -1.816 -15.347
  132   1HE   LYS  17          2HE       LYS  17  -5.763  -1.506 -17.588
  133   2HE   LYS  17          1HE       LYS  17  -6.069   0.186 -17.198
  134   1HZ   LYS  17          1HZ       LYS  17  -3.645   0.447 -16.873
  135   2HZ   LYS  17          2HZ       LYS  17  -4.069   0.041 -18.466
  136   3HZ   LYS  17          3HZ       LYS  17  -3.422  -1.140 -17.430
  137    H    ASN  18           H        ASN  18 -10.040  -1.288 -13.323
  138    HA   ASN  18           HA       ASN  18 -11.345   1.024 -12.303
  139   1HB   ASN  18          2HB       ASN  18 -12.135  -1.658 -13.196
  140   2HB   ASN  18          1HB       ASN  18 -13.127  -1.046 -11.873
  141   1HD2  ASN  18          1HD2      ASN  18 -12.148  -0.442 -15.230
  142   2HD2  ASN  18          2HD2      ASN  18 -13.335   0.730 -15.545
  143    H    GLU  19           H        GLU  19 -10.384  -2.071 -10.854
  144    HA   GLU  19           HA       GLU  19 -11.506  -1.562  -8.268
  145   1HB   GLU  19          2HB       GLU  19  -9.227  -3.415  -9.033
  146   2HB   GLU  19          1HB       GLU  19 -10.110  -3.437  -7.507
  147   1HG   GLU  19          2HG       GLU  19 -12.123  -3.545  -9.426
  148   2HG   GLU  19          1HG       GLU  19 -10.854  -4.573 -10.091
  149    H    PHE  20           H        PHE  20  -8.291  -1.217  -9.711
  150    HA   PHE  20           HA       PHE  20  -6.910  -0.346  -7.408
  151   1HB   PHE  20          2HB       PHE  20  -6.441  -0.107 -10.357
  152   2HB   PHE  20          1HB       PHE  20  -5.449   0.845  -9.256
  153    HD1  PHE  20           HD1      PHE  20  -6.727  -2.284  -7.923
  154    HD2  PHE  20           HD2      PHE  20  -3.508  -0.498 -10.138
  155    HE1  PHE  20           HE1      PHE  20  -5.320  -4.275  -7.489
  156    HE2  PHE  20           HE2      PHE  20  -2.098  -2.482  -9.694
  157    HZ   PHE  20           HZ       PHE  20  -3.002  -4.376  -8.368
  158    H    LYS  21           H        LYS  21  -8.529   1.503  -9.995
  159    HA   LYS  21           HA       LYS  21  -7.879   4.065  -8.964
  160   1HB   LYS  21          2HB       LYS  21  -8.939   3.259 -11.298
  161   2HB   LYS  21          1HB       LYS  21 -10.417   3.752 -10.473
  162   1HG   LYS  21          2HG       LYS  21  -7.987   5.532 -10.460
  163   2HG   LYS  21          1HG       LYS  21  -9.107   5.552 -11.824
  164   1HD   LYS  21          2HD       LYS  21 -10.957   5.850 -10.043
  165   2HD   LYS  21          1HD       LYS  21  -9.637   6.258  -8.944
  166   1HE   LYS  21          2HE       LYS  21  -9.793   7.614 -11.617
  167   2HE   LYS  21          1HE       LYS  21 -10.835   8.167 -10.306
  168   1HZ   LYS  21          1HZ       LYS  21  -8.755   9.375 -10.311
  169   2HZ   LYS  21          2HZ       LYS  21  -7.875   7.926 -10.200
  170   3HZ   LYS  21          3HZ       LYS  21  -8.866   8.422  -8.912
  171    H    ALA  22           H        ALA  22 -10.881   2.132  -8.737
  172    HA   ALA  22           HA       ALA  22 -12.323   3.893  -7.093
  173   1HB   ALA  22          1HB       ALA  22 -13.643   1.922  -6.416
  174   2HB   ALA  22          2HB       ALA  22 -12.435   0.870  -7.154
  175   3HB   ALA  22          3HB       ALA  22 -13.384   1.965  -8.159
  176    H    ALA  23           H        ALA  23 -10.168   1.198  -6.226
  177    HA   ALA  23           HA       ALA  23 -10.427   1.412  -3.417
  178   1HB   ALA  23          1HB       ALA  23  -8.236   0.301  -5.181
  179   2HB   ALA  23          2HB       ALA  23  -9.441  -0.586  -4.248
  180   3HB   ALA  23          3HB       ALA  23  -8.138   0.265  -3.420
  181    H    PHE  24           H        PHE  24  -8.735   3.355  -5.725
  182    HA   PHE  24           HA       PHE  24  -6.954   4.529  -3.740
  183   1HB   PHE  24          2HB       PHE  24  -6.437   4.071  -6.273
  184   2HB   PHE  24          1HB       PHE  24  -7.281   5.597  -6.526
  185    HD1  PHE  24           HD1      PHE  24  -6.321   7.707  -5.799
  186    HD2  PHE  24           HD2      PHE  24  -4.367   3.981  -4.915
  187    HE1  PHE  24           HE1      PHE  24  -4.277   8.935  -5.123
  188    HE2  PHE  24           HE2      PHE  24  -2.326   5.215  -4.234
  189    HZ   PHE  24           HZ       PHE  24  -2.282   7.691  -4.340
  190    H    ASP  25           H        ASP  25  -9.480   5.769  -6.014
  191    HA   ASP  25           HA       ASP  25  -9.548   8.344  -4.908
  192   1HB   ASP  25          2HB       ASP  25 -11.770   8.587  -5.994
  193   2HB   ASP  25          1HB       ASP  25 -10.520   7.984  -7.066
  194    H    ILE  26           H        ILE  26 -11.136   5.413  -3.753
  195    HA   ILE  26           HA       ILE  26 -13.142   6.627  -2.182
  196    HB   ILE  26           HB       ILE  26 -12.989   4.586  -0.729
  197   1HG1  ILE  26          2HG1      ILE  26 -10.767   3.844  -2.661
  198   2HG1  ILE  26          1HG1      ILE  26 -10.551   4.215  -0.955
  199   1HG2  ILE  26          1HG2      ILE  26 -13.426   4.650  -3.652
  200   2HG2  ILE  26          2HG2      ILE  26 -14.500   4.111  -2.362
  201   3HG2  ILE  26          3HG2      ILE  26 -13.233   3.040  -2.959
  202   1HD1  ILE  26          1HD1      ILE  26 -12.029   1.875  -2.165
  203   2HD1  ILE  26          2HD1      ILE  26 -12.191   2.325  -0.467
  204   3HD1  ILE  26          3HD1      ILE  26 -10.622   1.833  -1.104
  205    H    PHE  27           H        PHE  27  -9.718   6.048  -1.573
  206    HA   PHE  27           HA       PHE  27  -9.855   7.151   1.123
  207   1HB   PHE  27          2HB       PHE  27  -7.666   5.982  -0.577
  208   2HB   PHE  27          1HB       PHE  27  -7.274   6.913   0.868
  209    HD1  PHE  27           HD1      PHE  27  -8.032   6.153   3.107
  210    HD2  PHE  27           HD2      PHE  27  -8.707   3.806  -0.428
  211    HE1  PHE  27           HE1      PHE  27  -8.544   4.176   4.515
  212    HE2  PHE  27           HE2      PHE  27  -9.219   1.830   0.981
  213    HZ   PHE  27           HZ       PHE  27  -9.137   2.016   3.452
  214    H    ILE  28           H        ILE  28  -8.928   8.145  -2.127
  215    HA   ILE  28           HA       ILE  28  -7.862  10.700  -1.149
  216    HB   ILE  28           HB       ILE  28  -8.088   9.875  -4.040
  217   1HG1  ILE  28          2HG1      ILE  28  -6.868   8.048  -3.205
  218   2HG1  ILE  28          1HG1      ILE  28  -5.610   9.184  -3.668
  219   1HG2  ILE  28          1HG2      ILE  28  -6.429  11.828  -2.453
  220   2HG2  ILE  28          2HG2      ILE  28  -7.450  12.139  -3.857
  221   3HG2  ILE  28          3HG2      ILE  28  -5.921  11.280  -4.052
  222   1HD1  ILE  28          1HD1      ILE  28  -6.558   8.437  -0.920
  223   2HD1  ILE  28          2HD1      ILE  28  -5.849  10.030  -1.187
  224   3HD1  ILE  28          3HD1      ILE  28  -4.909   8.575  -1.530
  225    H    GLN  29           H        GLN  29 -10.720  10.116  -0.859
  226    HA   GLN  29           HA       GLN  29 -12.183  11.512  -2.883
  227   1HB   GLN  29          2HB       GLN  29 -14.039  11.553  -1.214
  228   2HB   GLN  29          1HB       GLN  29 -13.373   9.942  -1.468
  229   1HG   GLN  29          2HG       GLN  29 -12.106  10.066   0.586
  230   2HG   GLN  29          1HG       GLN  29 -12.513  11.769   0.795
  231   1HE2  GLN  29          1HE2      GLN  29 -14.107   8.544   0.536
  232   2HE2  GLN  29          2HE2      GLN  29 -15.400   8.943   1.563
  233    H    ASP  30           H        ASP  30 -10.696  12.430   0.179
  234    HA   ASP  30           HA       ASP  30 -10.792  15.242  -0.608
  235   1HB   ASP  30          2HB       ASP  30 -12.063  14.170   1.919
  236   2HB   ASP  30          1HB       ASP  30 -11.579  15.855   1.738
  237    H    ALA  31           H        ALA  31  -8.630  13.434  -0.528
  238    HA   ALA  31           HA       ALA  31  -7.167  13.527   1.906
  239   1HB   ALA  31          1HB       ALA  31  -6.250  13.122  -0.948
  240   2HB   ALA  31          2HB       ALA  31  -6.602  11.869   0.242
  241   3HB   ALA  31          3HB       ALA  31  -5.209  12.927   0.462
  242    H    GLU  32           H        GLU  32  -5.367  14.768   2.474
  243    HA   GLU  32           HA       GLU  32  -5.562  17.549   1.901
  244   1HB   GLU  32          2HB       GLU  32  -3.356  15.985   3.265
  245   2HB   GLU  32          1HB       GLU  32  -3.462  17.745   3.225
  246   1HG   GLU  32          2HG       GLU  32  -5.842  16.195   4.184
  247   2HG   GLU  32          1HG       GLU  32  -4.461  16.372   5.267
  248    H    ASP  33           H        ASP  33  -3.133  15.095   1.032
  249    HA   ASP  33           HA       ASP  33  -1.906  16.958  -0.884
  250   1HB   ASP  33          2HB       ASP  33  -1.045  14.232   0.113
  251   2HB   ASP  33          1HB       ASP  33  -0.177  15.155  -1.115
  252    H    GLY  34           H        GLY  34  -3.789  13.998  -0.738
  253   1HA   GLY  34          2HA       GLY  34  -5.238  13.384  -2.562
  254   2HA   GLY  34          1HA       GLY  34  -4.056  14.055  -3.679
  255    H    CYS  35           H        CYS  35  -3.237  11.990  -0.938
  256    HA   CYS  35           HA       CYS  35  -2.837   9.653  -2.667
  257   1HB   CYS  35          2HB       CYS  35  -0.594  10.783  -0.979
  258   2HB   CYS  35          1HB       CYS  35  -0.522   9.378  -2.032
  259    HG   CYS  35           HG       CYS  35   0.428  11.345  -3.425
  260    H    ILE  36           H        ILE  36  -1.827   7.819  -1.208
  261    HA   ILE  36           HA       ILE  36  -3.370   7.824   1.314
  262    HB   ILE  36           HB       ILE  36  -3.216   5.354   1.211
  263   1HG1  ILE  36          2HG1      ILE  36  -2.550   4.917  -1.491
  264   2HG1  ILE  36          1HG1      ILE  36  -1.291   5.981  -0.864
  265   1HG2  ILE  36          1HG2      ILE  36  -4.923   5.088  -0.386
  266   2HG2  ILE  36          2HG2      ILE  36  -4.256   6.333  -1.443
  267   3HG2  ILE  36          3HG2      ILE  36  -5.047   6.788   0.067
  268   1HD1  ILE  36          1HD1      ILE  36  -0.351   4.197   0.126
  269   2HD1  ILE  36          2HD1      ILE  36  -1.705   3.171  -0.345
  270   3HD1  ILE  36          3HD1      ILE  36  -1.770   4.085   1.166
  271    H    SER  37           H        SER  37  -2.291   6.218   2.978
  272    HA   SER  37           HA       SER  37   0.416   7.252   3.404
  273   1HB   SER  37          2HB       SER  37  -1.593   7.117   5.153
  274   2HB   SER  37          1HB       SER  37  -0.925   5.508   5.415
  275    HG   SER  37           HG       SER  37  -0.012   7.273   6.710
  276    H    THR  38           H        THR  38   2.160   5.922   3.943
  277    HA   THR  38           HA       THR  38   2.466   3.583   2.389
  278    HB   THR  38           HB       THR  38   4.564   3.228   3.736
  279    HG1  THR  38           HG1      THR  38   3.936   5.694   4.953
  280   1HG2  THR  38          1HG2      THR  38   5.134   4.504   1.934
  281   2HG2  THR  38          2HG2      THR  38   5.333   5.763   3.151
  282   3HG2  THR  38          3HG2      THR  38   3.839   5.667   2.218
  283    H    LYS  39           H        LYS  39   1.857   4.031   5.873
  284    HA   LYS  39           HA       LYS  39   1.728   1.164   6.336
  285   1HB   LYS  39          2HB       LYS  39   1.054   3.451   8.202
  286   2HB   LYS  39          1HB       LYS  39   1.268   1.761   8.658
  287   1HG   LYS  39          2HG       LYS  39   3.373   3.640   7.546
  288   2HG   LYS  39          1HG       LYS  39   3.332   2.918   9.154
  289   1HD   LYS  39          2HD       LYS  39   3.583   0.674   8.163
  290   2HD   LYS  39          1HD       LYS  39   3.604   1.385   6.549
  291   1HE   LYS  39          2HE       LYS  39   5.778   1.975   6.731
  292   2HE   LYS  39          1HE       LYS  39   5.537   2.653   8.339
  293   1HZ   LYS  39          1HZ       LYS  39   5.759   0.524   9.316
  294   2HZ   LYS  39          2HZ       LYS  39   7.053   0.691   8.228
  295   3HZ   LYS  39          3HZ       LYS  39   5.709  -0.261   7.814
  296    H    GLU  40           H        GLU  40  -0.385   3.203   4.874
  297    HA   GLU  40           HA       GLU  40  -2.799   2.107   6.141
  298   1HB   GLU  40          2HB       GLU  40  -2.234   4.458   4.391
  299   2HB   GLU  40          1HB       GLU  40  -3.836   3.726   4.308
  300   1HG   GLU  40          2HG       GLU  40  -2.543   4.475   6.939
  301   2HG   GLU  40          1HG       GLU  40  -3.541   5.605   6.023
  302    H    LEU  41           H        LEU  41  -0.714   1.225   3.690
  303    HA   LEU  41           HA       LEU  41  -2.432   0.546   1.560
  304   1HB   LEU  41          2HB       LEU  41  -0.015   0.560   1.307
  305   2HB   LEU  41          1HB       LEU  41   0.141  -0.749   2.459
  306    HG   LEU  41           HG       LEU  41  -1.053  -2.248   0.884
  307   1HD1  LEU  41          1HD1      LEU  41  -1.840  -1.547  -1.190
  308   2HD1  LEU  41          2HD1      LEU  41  -0.748  -0.163  -1.252
  309   3HD1  LEU  41          3HD1      LEU  41  -2.171  -0.118  -0.211
  310   1HD2  LEU  41          1HD2      LEU  41   1.287  -0.788  -0.383
  311   2HD2  LEU  41          2HD2      LEU  41   0.779  -2.443  -0.723
  312   3HD2  LEU  41          3HD2      LEU  41   1.435  -2.029   0.862
  313    H    GLY  42           H        GLY  42  -1.736  -1.081   4.605
  314   1HA   GLY  42          2HA       GLY  42  -2.732  -3.647   3.968
  315   2HA   GLY  42          1HA       GLY  42  -2.628  -2.963   5.584
  316    H    LYS  43           H        LYS  43  -4.393  -0.655   4.366
  317    HA   LYS  43           HA       LYS  43  -6.915  -1.844   5.191
  318   1HB   LYS  43          2HB       LYS  43  -6.329   0.980   4.270
  319   2HB   LYS  43          1HB       LYS  43  -7.797   0.425   5.073
  320   1HG   LYS  43          2HG       LYS  43  -5.058   0.149   6.333
  321   2HG   LYS  43          1HG       LYS  43  -6.066   1.575   6.566
  322   1HD   LYS  43          2HD       LYS  43  -7.583   0.463   7.879
  323   2HD   LYS  43          1HD       LYS  43  -7.376  -1.058   7.013
  324   1HE   LYS  43          2HE       LYS  43  -6.412  -1.413   9.168
  325   2HE   LYS  43          1HE       LYS  43  -5.051  -1.187   8.069
  326   1HZ   LYS  43          1HZ       LYS  43  -4.870   0.100  10.153
  327   2HZ   LYS  43          2HZ       LYS  43  -6.255   0.979   9.709
  328   3HZ   LYS  43          3HZ       LYS  43  -4.845   1.076   8.766
  329    H    VAL  44           H        VAL  44  -5.420  -0.589   2.230
  330    HA   VAL  44           HA       VAL  44  -7.848  -0.783   0.687
  331    HB   VAL  44           HB       VAL  44  -6.369  -0.346  -1.268
  332   1HG1  VAL  44          1HG1      VAL  44  -7.303   1.565  -0.192
  333   2HG1  VAL  44          2HG1      VAL  44  -5.593   1.931  -0.418
  334   3HG1  VAL  44          3HG1      VAL  44  -6.186   1.433   1.167
  335   1HG2  VAL  44          1HG2      VAL  44  -4.157  -0.085   0.783
  336   2HG2  VAL  44          2HG2      VAL  44  -4.020   0.062  -0.970
  337   3HG2  VAL  44          3HG2      VAL  44  -4.357  -1.508  -0.241
  338    H    MET  45           H        MET  45  -5.077  -2.873   1.321
  339    HA   MET  45           HA       MET  45  -5.428  -4.713  -0.781
  340   1HB   MET  45          2HB       MET  45  -4.482  -5.407   2.011
  341   2HB   MET  45          1HB       MET  45  -4.148  -6.288   0.522
  342   1HG   MET  45          2HG       MET  45  -3.363  -3.426   0.530
  343   2HG   MET  45          1HG       MET  45  -2.429  -4.485   1.584
  344   1HE   MET  45          1HE       MET  45  -4.054  -5.433  -2.139
  345   2HE   MET  45          2HE       MET  45  -2.892  -4.334  -2.882
  346   3HE   MET  45          3HE       MET  45  -3.954  -3.750  -1.599
  347    H    ARG  46           H        ARG  46  -7.015  -4.401   2.341
  348    HA   ARG  46           HA       ARG  46  -8.372  -6.909   2.307
  349   1HB   ARG  46          2HB       ARG  46  -8.764  -4.330   3.795
  350   2HB   ARG  46          1HB       ARG  46  -9.990  -5.595   3.884
  351   1HG   ARG  46          2HG       ARG  46  -8.392  -7.187   4.744
  352   2HG   ARG  46          1HG       ARG  46  -7.053  -6.075   4.457
  353   1HD   ARG  46          2HD       ARG  46  -7.475  -5.810   6.753
  354   2HD   ARG  46          1HD       ARG  46  -8.337  -4.459   6.027
  355    HE   ARG  46           HE       ARG  46 -10.000  -6.794   6.328
  356   1HH1  ARG  46          2HH1      ARG  46  -8.660  -4.015   7.968
  357   2HH1  ARG  46          1HH1      ARG  46  -9.930  -3.938   9.139
  358   1HH2  ARG  46          1HH2      ARG  46 -11.654  -6.673   7.878
  359   2HH2  ARG  46          2HH2      ARG  46 -11.619  -5.437   9.091
  360    H    MET  47           H        MET  47  -9.162  -3.691   1.067
  361    HA   MET  47           HA       MET  47 -11.856  -4.396   0.298
  362   1HB   MET  47          2HB       MET  47 -10.104  -2.014  -0.340
  363   2HB   MET  47          1HB       MET  47 -11.752  -2.193  -0.940
  364   1HG   MET  47          2HG       MET  47 -11.246  -2.533   1.996
  365   2HG   MET  47          1HG       MET  47 -11.284  -0.903   1.324
  366   1HE   MET  47          1HE       MET  47 -13.071   0.023   2.441
  367   2HE   MET  47          2HE       MET  47 -14.739  -0.107   1.892
  368   3HE   MET  47          3HE       MET  47 -13.481   0.388   0.760
  369    H    LEU  48           H        LEU  48  -8.714  -4.132  -1.309
  370    HA   LEU  48           HA       LEU  48  -9.617  -4.459  -3.975
  371   1HB   LEU  48          2HB       LEU  48  -7.359  -3.642  -3.225
  372   2HB   LEU  48          1HB       LEU  48  -6.957  -5.298  -2.833
  373    HG   LEU  48           HG       LEU  48  -7.415  -5.840  -5.286
  374   1HD1  LEU  48          1HD1      LEU  48  -8.645  -3.573  -5.565
  375   2HD1  LEU  48          2HD1      LEU  48  -7.558  -4.080  -6.858
  376   3HD1  LEU  48          3HD1      LEU  48  -7.031  -2.873  -5.685
  377   1HD2  LEU  48          1HD2      LEU  48  -5.155  -5.214  -4.008
  378   2HD2  LEU  48          2HD2      LEU  48  -5.198  -3.839  -5.112
  379   3HD2  LEU  48          3HD2      LEU  48  -5.176  -5.484  -5.752
  380    H    GLY  49           H        GLY  49  -8.483  -6.791  -1.536
  381   1HA   GLY  49          2HA       GLY  49  -9.770  -8.953  -1.551
  382   2HA   GLY  49          1HA       GLY  49  -9.431  -8.997  -3.279
  383    H    GLN  50           H        GLN  50  -7.550  -8.392  -0.305
  384    HA   GLN  50           HA       GLN  50  -5.816 -10.667  -0.837
  385   1HB   GLN  50          2HB       GLN  50  -5.016  -7.882  -1.431
  386   2HB   GLN  50          1HB       GLN  50  -3.865  -8.803  -0.463
  387   1HG   GLN  50          2HG       GLN  50  -4.433 -10.670  -2.315
  388   2HG   GLN  50          1HG       GLN  50  -4.742  -9.226  -3.280
  389   1HE2  GLN  50          1HE2      GLN  50  -2.875  -7.475  -3.002
  390   2HE2  GLN  50          2HE2      GLN  50  -1.295  -8.093  -3.016
  391    H    ASN  51           H        ASN  51  -4.424 -11.164   0.939
  392    HA   ASN  51           HA       ASN  51  -4.893  -9.631   3.411
  393   1HB   ASN  51          2HB       ASN  51  -6.407 -11.749   3.112
  394   2HB   ASN  51          1HB       ASN  51  -4.935 -12.632   3.514
  395   1HD2  ASN  51          1HD2      ASN  51  -7.520 -10.705   4.829
  396   2HD2  ASN  51          2HD2      ASN  51  -6.957 -10.680   6.431
  397    HA   PRO  52           HA       PRO  52  -0.447 -10.876   2.900
  398   1HB   PRO  52          2HB       PRO  52   0.576  -8.345   2.761
  399   2HB   PRO  52          1HB       PRO  52   0.016  -9.250   1.349
  400   1HG   PRO  52          2HG       PRO  52  -1.238  -6.966   2.737
  401   2HG   PRO  52          1HG       PRO  52  -1.417  -7.498   1.060
  402   1HD   PRO  52          2HD       PRO  52  -3.254  -7.944   3.191
  403   2HD   PRO  52          1HD       PRO  52  -3.318  -8.658   1.563
  404    H    THR  53           H        THR  53   1.501  -9.507   4.144
  405    HA   THR  53           HA       THR  53   0.580  -9.253   6.946
  406    HB   THR  53           HB       THR  53   2.596 -10.190   7.686
  407    HG1  THR  53           HG1      THR  53   4.441  -9.879   6.707
  408   1HG2  THR  53          1HG2      THR  53   3.064 -12.171   6.213
  409   2HG2  THR  53          2HG2      THR  53   1.973 -11.466   5.019
  410   3HG2  THR  53          3HG2      THR  53   1.357 -11.943   6.602
  411    HA   PRO  54           HA       PRO  54   2.183  -5.154   7.098
  412   1HB   PRO  54          2HB       PRO  54   3.689  -5.077   9.389
  413   2HB   PRO  54          1HB       PRO  54   1.919  -5.099   9.367
  414   1HG   PRO  54          2HG       PRO  54   3.829  -7.282  10.013
  415   2HG   PRO  54          1HG       PRO  54   2.188  -7.003  10.617
  416   1HD   PRO  54          2HD       PRO  54   2.894  -8.871   8.656
  417   2HD   PRO  54          1HD       PRO  54   1.247  -8.267   8.951
  418    H    GLU  55           H        GLU  55   4.596  -7.672   7.366
  419    HA   GLU  55           HA       GLU  55   6.834  -5.934   6.714
  420   1HB   GLU  55          2HB       GLU  55   6.823  -8.957   6.670
  421   2HB   GLU  55          1HB       GLU  55   8.201  -7.879   6.881
  422   1HG   GLU  55          2HG       GLU  55   7.198  -7.085   9.029
  423   2HG   GLU  55          1HG       GLU  55   5.911  -8.274   8.829
  424    H    GLU  56           H        GLU  56   4.815  -8.389   5.137
  425    HA   GLU  56           HA       GLU  56   6.196  -8.500   2.668
  426   1HB   GLU  56          2HB       GLU  56   3.394  -9.181   3.517
  427   2HB   GLU  56          1HB       GLU  56   3.854  -9.245   1.817
  428   1HG   GLU  56          2HG       GLU  56   5.883 -10.652   2.666
  429   2HG   GLU  56          1HG       GLU  56   4.905 -10.880   4.116
  430    H    LEU  57           H        LEU  57   3.192  -6.747   3.546
  431    HA   LEU  57           HA       LEU  57   2.967  -5.359   1.097
  432   1HB   LEU  57          2HB       LEU  57   1.040  -4.733   1.990
  433   2HB   LEU  57          1HB       LEU  57   1.497  -5.541   3.469
  434    HG   LEU  57           HG       LEU  57   2.260  -2.670   2.941
  435   1HD1  LEU  57          1HD1      LEU  57  -0.215  -2.976   2.702
  436   2HD1  LEU  57          2HD1      LEU  57   0.234  -1.982   4.087
  437   3HD1  LEU  57          3HD1      LEU  57  -0.246  -3.662   4.327
  438   1HD2  LEU  57          1HD2      LEU  57   2.796  -4.537   4.997
  439   2HD2  LEU  57          2HD2      LEU  57   1.606  -3.417   5.658
  440   3HD2  LEU  57          3HD2      LEU  57   3.132  -2.806   5.017
  441    H    GLN  58           H        GLN  58   4.826  -4.679   4.002
  442    HA   GLN  58           HA       GLN  58   5.389  -1.958   3.598
  443   1HB   GLN  58          2HB       GLN  58   6.361  -4.052   5.303
  444   2HB   GLN  58          1HB       GLN  58   7.734  -3.167   4.642
  445   1HG   GLN  58          2HG       GLN  58   5.330  -1.841   5.928
  446   2HG   GLN  58          1HG       GLN  58   6.840  -2.182   6.774
  447   1HE2  GLN  58          1HE2      GLN  58   5.329  -0.103   4.358
  448   2HE2  GLN  58          2HE2      GLN  58   6.650   0.946   4.169
  449    H    GLU  59           H        GLU  59   7.090  -4.854   2.430
  450    HA   GLU  59           HA       GLU  59   9.236  -3.561   1.149
  451   1HB   GLU  59          2HB       GLU  59   7.871  -6.204   0.637
  452   2HB   GLU  59          1HB       GLU  59   9.260  -5.667  -0.307
  453   1HG   GLU  59          2HG       GLU  59  10.707  -5.745   1.527
  454   2HG   GLU  59          1HG       GLU  59   9.392  -5.609   2.697
  455    H    MET  60           H        MET  60   5.977  -4.363  -0.006
  456    HA   MET  60           HA       MET  60   6.380  -3.636  -2.720
  457   1HB   MET  60          2HB       MET  60   3.931  -3.898  -0.985
  458   2HB   MET  60          1HB       MET  60   3.814  -3.309  -2.643
  459   1HG   MET  60          2HG       MET  60   4.630  -5.336  -3.545
  460   2HG   MET  60          1HG       MET  60   5.279  -5.866  -1.993
  461   1HE   MET  60          1HE       MET  60   2.822  -8.375  -1.127
  462   2HE   MET  60          2HE       MET  60   4.233  -7.472  -0.583
  463   3HE   MET  60          3HE       MET  60   4.224  -8.193  -2.190
  464    H    ILE  61           H        ILE  61   5.108  -1.826   0.073
  465    HA   ILE  61           HA       ILE  61   4.387   0.548  -1.181
  466    HB   ILE  61           HB       ILE  61   5.517   0.047   1.578
  467   1HG1  ILE  61          2HG1      ILE  61   2.704   0.842   1.063
  468   2HG1  ILE  61          1HG1      ILE  61   3.169  -0.771   0.524
  469   1HG2  ILE  61          1HG2      ILE  61   4.407   2.560   0.319
  470   2HG2  ILE  61          2HG2      ILE  61   5.924   2.354   1.197
  471   3HG2  ILE  61          3HG2      ILE  61   4.389   2.298   2.064
  472   1HD1  ILE  61          1HD1      ILE  61   3.912  -1.375   2.730
  473   2HD1  ILE  61          2HD1      ILE  61   2.298  -0.682   2.890
  474   3HD1  ILE  61          3HD1      ILE  61   3.716   0.278   3.308
  475    H    ASP  62           H        ASP  62   7.399   0.204   0.703
  476    HA   ASP  62           HA       ASP  62   8.692   2.473  -0.221
  477   1HB   ASP  62          2HB       ASP  62   9.830  -0.170   0.699
  478   2HB   ASP  62          1HB       ASP  62  10.826   1.247   0.369
  479    H    GLU  63           H        GLU  63   8.507  -0.720  -1.739
  480    HA   GLU  63           HA       GLU  63  10.538  -0.348  -3.681
  481   1HB   GLU  63          2HB       GLU  63   8.281  -2.227  -3.293
  482   2HB   GLU  63          1HB       GLU  63   8.839  -2.030  -4.954
  483   1HG   GLU  63          2HG       GLU  63  10.885  -2.401  -2.793
  484   2HG   GLU  63          1HG       GLU  63   9.981  -3.809  -3.354
  485    H    VAL  64           H        VAL  64   7.005   0.181  -3.865
  486    HA   VAL  64           HA       VAL  64   7.155   1.196  -6.561
  487    HB   VAL  64           HB       VAL  64   4.783   1.647  -6.352
  488   1HG1  VAL  64          1HG1      VAL  64   4.166  -0.555  -6.373
  489   2HG1  VAL  64          2HG1      VAL  64   4.958  -0.900  -4.836
  490   3HG1  VAL  64          3HG1      VAL  64   5.910  -0.810  -6.317
  491   1HG2  VAL  64          1HG2      VAL  64   3.585   1.442  -4.272
  492   2HG2  VAL  64          2HG2      VAL  64   4.954   2.510  -3.972
  493   3HG2  VAL  64          3HG2      VAL  64   5.015   0.829  -3.444
  494    H    ASP  65           H        ASP  65   7.648   2.617  -3.459
  495    HA   ASP  65           HA       ASP  65   6.724   5.253  -4.086
  496   1HB   ASP  65          2HB       ASP  65   7.527   4.022  -1.768
  497   2HB   ASP  65          1HB       ASP  65   8.910   5.054  -2.122
  498    H    GLU  66           H        GLU  66   7.584   5.610  -6.156
  499    HA   GLU  66           HA       GLU  66  10.332   5.492  -6.823
  500   1HB   GLU  66          2HB       GLU  66   7.975   6.925  -8.028
  501   2HB   GLU  66          1HB       GLU  66   9.600   7.110  -8.691
  502   1HG   GLU  66          2HG       GLU  66   9.599   5.022  -9.585
  503   2HG   GLU  66          1HG       GLU  66   8.855   4.311  -8.154
  504    H    ASP  67           H        ASP  67   8.322   8.151  -5.583
  505    HA   ASP  67           HA       ASP  67  10.558  10.012  -5.746
  506   1HB   ASP  67          2HB       ASP  67   8.887  11.549  -4.493
  507   2HB   ASP  67          1HB       ASP  67   8.566  11.146  -6.174
  508    H    GLY  68           H        GLY  68   8.841   8.190  -3.246
  509   1HA   GLY  68          2HA       GLY  68   9.514   7.612  -1.108
  510   2HA   GLY  68          1HA       GLY  68  11.080   8.342  -1.458
  511    H    SER  69           H        SER  69   7.800   9.720  -1.479
  512    HA   SER  69           HA       SER  69   8.731  12.018   0.045
  513   1HB   SER  69          2HB       SER  69   6.369  12.830  -0.324
  514   2HB   SER  69          1HB       SER  69   7.282  12.522  -1.797
  515    HG   SER  69           HG       SER  69   5.006  11.613  -1.459
  516    H    GLY  70           H        GLY  70   6.212   9.521   0.369
  517   1HA   GLY  70          2HA       GLY  70   6.408   8.691   2.894
  518   2HA   GLY  70          1HA       GLY  70   5.697  10.283   3.144
  519    H    THR  71           H        THR  71   4.211  10.185   0.605
  520    HA   THR  71           HA       THR  71   2.048   8.350   1.435
  521    HB   THR  71           HB       THR  71   0.499   9.843   0.332
  522    HG1  THR  71           HG1      THR  71   2.741  11.434  -0.365
  523   1HG2  THR  71          1HG2      THR  71   0.926  11.955   1.616
  524   2HG2  THR  71          2HG2      THR  71   2.520  11.324   2.033
  525   3HG2  THR  71          3HG2      THR  71   1.068  10.494   2.594
  526    H    VAL  72           H        VAL  72   0.932   7.159  -0.174
  527    HA   VAL  72           HA       VAL  72   2.617   6.531  -2.497
  528    HB   VAL  72           HB       VAL  72   0.151   5.067  -1.539
  529   1HG1  VAL  72          1HG1      VAL  72   2.456   4.095  -3.244
  530   2HG1  VAL  72          2HG1      VAL  72   0.984   4.777  -3.933
  531   3HG1  VAL  72          3HG1      VAL  72   0.905   3.300  -2.973
  532   1HG2  VAL  72          1HG2      VAL  72   1.844   3.448  -0.593
  533   2HG2  VAL  72          2HG2      VAL  72   1.788   4.998   0.244
  534   3HG2  VAL  72          3HG2      VAL  72   3.089   4.660  -0.899
  535    H    ASP  73           H        ASP  73   2.165   7.305  -4.428
  536    HA   ASP  73           HA       ASP  73  -0.345   8.702  -4.920
  537   1HB   ASP  73          2HB       ASP  73   1.972   8.227  -6.817
  538   2HB   ASP  73          1HB       ASP  73   0.666   9.390  -7.020
  539    H    PHE  74           H        PHE  74  -1.349   8.310  -7.170
  540    HA   PHE  74           HA       PHE  74  -2.375   5.664  -7.266
  541   1HB   PHE  74          2HB       PHE  74  -3.456   7.827  -8.154
  542   2HB   PHE  74          1HB       PHE  74  -2.452   7.597  -9.584
  543    HD1  PHE  74           HD1      PHE  74  -4.096   7.066 -11.213
  544    HD2  PHE  74           HD2      PHE  74  -3.989   4.913  -7.498
  545    HE1  PHE  74           HE1      PHE  74  -5.735   5.437 -12.108
  546    HE2  PHE  74           HE2      PHE  74  -5.625   3.285  -8.396
  547    HZ   PHE  74           HZ       PHE  74  -6.497   3.542 -10.701
  548    H    ASP  75           H        ASP  75   0.256   7.287  -8.959
  549    HA   ASP  75           HA       ASP  75   0.697   5.285 -10.945
  550   1HB   ASP  75          2HB       ASP  75   2.226   7.616  -9.875
  551   2HB   ASP  75          1HB       ASP  75   3.116   6.386 -10.772
  552    H    GLU  76           H        GLU  76   1.966   5.864  -7.687
  553    HA   GLU  76           HA       GLU  76   3.828   3.661  -7.755
  554   1HB   GLU  76          2HB       GLU  76   2.761   4.905  -5.226
  555   2HB   GLU  76          1HB       GLU  76   4.350   4.205  -5.524
  556   1HG   GLU  76          2HG       GLU  76   4.778   6.085  -7.160
  557   2HG   GLU  76          1HG       GLU  76   3.267   6.817  -6.614
  558    H    PHE  77           H        PHE  77   0.478   4.109  -6.982
  559    HA   PHE  77           HA       PHE  77   0.142   1.727  -5.411
  560   1HB   PHE  77          2HB       PHE  77  -1.371   3.626  -5.146
  561   2HB   PHE  77          1HB       PHE  77  -1.857   3.508  -6.834
  562    HD1  PHE  77           HD1      PHE  77  -1.910   1.732  -3.559
  563    HD2  PHE  77           HD2      PHE  77  -3.515   1.969  -7.541
  564    HE1  PHE  77           HE1      PHE  77  -3.672   0.099  -2.946
  565    HE2  PHE  77           HE2      PHE  77  -5.274   0.331  -6.923
  566    HZ   PHE  77           HZ       PHE  77  -5.354  -0.603  -4.627
  567    H    LEU  78           H        LEU  78  -0.241   2.571  -8.844
  568    HA   LEU  78           HA       LEU  78  -1.416   0.015  -9.536
  569   1HB   LEU  78          2HB       LEU  78  -0.411   2.343 -11.138
  570   2HB   LEU  78          1HB       LEU  78  -0.926   0.853 -11.900
  571    HG   LEU  78           HG       LEU  78  -2.891   1.923 -10.002
  572   1HD1  LEU  78          1HD1      LEU  78  -2.890   3.488 -12.498
  573   2HD1  LEU  78          2HD1      LEU  78  -1.557   3.869 -11.407
  574   3HD1  LEU  78          3HD1      LEU  78  -3.220   4.000 -10.843
  575   1HD2  LEU  78          1HD2      LEU  78  -4.404   1.240 -11.683
  576   2HD2  LEU  78          2HD2      LEU  78  -3.078   0.086 -11.833
  577   3HD2  LEU  78          3HD2      LEU  78  -3.207   1.434 -12.965
  578    H    VAL  79           H        VAL  79   1.811   1.492  -9.787
  579    HA   VAL  79           HA       VAL  79   3.033  -0.447 -11.399
  580    HB   VAL  79           HB       VAL  79   5.175   0.195 -10.247
  581   1HG1  VAL  79          1HG1      VAL  79   3.293   2.217 -11.442
  582   2HG1  VAL  79          2HG1      VAL  79   4.688   1.433 -12.183
  583   3HG1  VAL  79          3HG1      VAL  79   4.925   2.681 -10.960
  584   1HG2  VAL  79          1HG2      VAL  79   5.064   2.139  -8.699
  585   2HG2  VAL  79          2HG2      VAL  79   4.287   0.705  -8.028
  586   3HG2  VAL  79          3HG2      VAL  79   3.306   2.007  -8.696
  587    H    MET  80           H        MET  80   2.153  -0.539  -8.018
  588    HA   MET  80           HA       MET  80   3.695  -2.435  -6.845
  589   1HB   MET  80          2HB       MET  80   0.833  -1.745  -6.676
  590   2HB   MET  80          1HB       MET  80   1.239  -3.358  -6.094
  591   1HG   MET  80          2HG       MET  80   3.218  -2.055  -4.892
  592   2HG   MET  80          1HG       MET  80   2.112  -0.691  -5.053
  593   1HE   MET  80          1HE       MET  80  -0.128  -0.475  -4.125
  594   2HE   MET  80          2HE       MET  80  -1.009  -1.648  -3.152
  595   3HE   MET  80          3HE       MET  80  -0.754  -1.953  -4.867
  596    H    MET  81           H        MET  81   1.204  -3.054  -9.298
  597    HA   MET  81           HA       MET  81   1.209  -5.877  -9.173
  598   1HB   MET  81          2HB       MET  81   0.389  -3.849 -11.213
  599   2HB   MET  81          1HB       MET  81   0.532  -5.533 -11.719
  600   1HG   MET  81          2HG       MET  81  -0.960  -4.870  -9.197
  601   2HG   MET  81          1HG       MET  81  -1.753  -4.659 -10.758
  602   1HE   MET  81          1HE       MET  81  -1.932  -6.234  -8.123
  603   2HE   MET  81          2HE       MET  81  -1.632  -7.969  -8.162
  604   3HE   MET  81          3HE       MET  81  -3.132  -7.327  -8.825
  605    H    VAL  82           H        VAL  82   2.781  -3.816 -11.646
  606    HA   VAL  82           HA       VAL  82   4.375  -5.937 -12.696
  607    HB   VAL  82           HB       VAL  82   5.595  -4.136 -13.905
  608   1HG1  VAL  82          1HG1      VAL  82   2.615  -3.650 -14.005
  609   2HG1  VAL  82          2HG1      VAL  82   3.345  -5.132 -14.622
  610   3HG1  VAL  82          3HG1      VAL  82   3.777  -3.575 -15.330
  611   1HG2  VAL  82          1HG2      VAL  82   5.588  -2.343 -12.315
  612   2HG2  VAL  82          2HG2      VAL  82   3.831  -2.386 -12.174
  613   3HG2  VAL  82          3HG2      VAL  82   4.579  -1.813 -13.660
  614    H    ARG  83           H        ARG  83   4.888  -3.626 -10.114
  615    HA   ARG  83           HA       ARG  83   7.706  -3.732  -9.942
  616   1HB   ARG  83          2HB       ARG  83   5.598  -3.253  -7.826
  617   2HB   ARG  83          1HB       ARG  83   7.329  -3.116  -7.515
  618   1HG   ARG  83          2HG       ARG  83   6.306  -1.673  -9.904
  619   2HG   ARG  83          1HG       ARG  83   5.820  -1.029  -8.335
  620   1HD   ARG  83          2HD       ARG  83   8.154  -0.884  -7.633
  621   2HD   ARG  83          1HD       ARG  83   8.679  -1.636  -9.135
  622    HE   ARG  83           HE       ARG  83   7.142   0.768  -9.563
  623   1HH1  ARG  83          2HH1      ARG  83  10.308  -0.520  -8.843
  624   2HH1  ARG  83          1HH1      ARG  83  11.147   0.852  -9.480
  625   1HH2  ARG  83          1HH2      ARG  83   8.262   2.554 -10.392
  626   2HH2  ARG  83          2HH2      ARG  83   9.994   2.590 -10.353
  627    H    CYS  84           H        CYS  84   5.292  -6.079  -9.187
  628    HA   CYS  84           HA       CYS  84   6.712  -7.570  -7.210
  629   1HB   CYS  84          2HB       CYS  84   4.178  -7.658  -7.970
  630   2HB   CYS  84          1HB       CYS  84   4.783  -8.898  -9.067
  631    HG   CYS  84           HG       CYS  84   4.300 -10.225  -6.942
  632    H    MET  85           H        MET  85   7.144  -7.187 -10.589
  633    HA   MET  85           HA       MET  85   7.972  -9.604 -11.575
  634   1HB   MET  85          2HB       MET  85   9.346  -8.394 -13.134
  635   2HB   MET  85          1HB       MET  85   7.912  -7.420 -12.808
  636   1HG   MET  85          2HG       MET  85   9.330  -6.260 -10.993
  637   2HG   MET  85          1HG       MET  85  10.721  -7.012 -11.773
  638   1HE   MET  85          1HE       MET  85  10.573  -4.375 -11.164
  639   2HE   MET  85          2HE       MET  85  10.101  -3.143 -12.334
  640   3HE   MET  85          3HE       MET  85  11.609  -4.029 -12.556
  641    H    LYS  86           H        LYS  86   9.754  -7.495  -9.359
  642    HA   LYS  86           HA       LYS  86  11.597  -7.837  -8.049
  643   1HB   LYS  86          2HB       LYS  86  10.665 -10.605  -8.600
  644   2HB   LYS  86          1HB       LYS  86  12.295 -10.415  -7.955
  645   1HG   LYS  86          2HG       LYS  86  11.548  -9.523  -5.953
  646   2HG   LYS  86          1HG       LYS  86  10.083  -8.858  -6.674
  647   1HD   LYS  86          2HD       LYS  86   9.160 -10.641  -5.533
  648   2HD   LYS  86          1HD       LYS  86   9.537 -11.441  -7.059
  649   1HE   LYS  86          2HE       LYS  86  11.810 -12.019  -6.019
  650   2HE   LYS  86          1HE       LYS  86  11.110 -11.524  -4.479
  651   1HZ   LYS  86          1HZ       LYS  86   9.325 -13.140  -4.834
  652   2HZ   LYS  86          2HZ       LYS  86  10.850 -13.888  -4.796
  653   3HZ   LYS  86          3HZ       LYS  86  10.059 -13.642  -6.279
  654    H    ASP  87           H        ASP  87  13.234  -6.838  -9.036
  655    HA   ASP  87           HA       ASP  87  15.228  -6.562 -10.123
  656   1HB   ASP  87          2HB       ASP  87  15.050  -9.502  -9.895
  657   2HB   ASP  87          1HB       ASP  87  16.092  -8.914 -11.190
  658    H    ASP  88           H        ASP  88  13.896  -9.245 -12.071
  659    HA   ASP  88           HA       ASP  88  13.323  -9.390 -14.282
  660   1HB   ASP  88          2HB       ASP  88  11.842  -7.348 -13.362
  661   2HB   ASP  88          1HB       ASP  88  12.816  -6.467 -14.537
  662    H    SER  89           HN       SER  89  16.009  -9.212 -13.794
  663    HA   SER  89           HA       SER  89  17.099  -7.295 -15.746
  664   1HB   SER  89          2HB       SER  89  18.407  -9.032 -13.649
  665   2HB   SER  89          1HB       SER  89  19.323  -8.141 -14.861
  666    HG   SER  89           HG       SER  89  19.026  -6.422 -13.704
  Start of MODEL   39
    1   1H    MET   1          1H        MET   1  17.381  -2.888 -13.217
    2   2H    MET   1          2H        MET   1  16.286  -1.595 -13.085
    3   3H    MET   1          3H        MET   1  17.797  -1.359 -13.824
    4    HA   MET   1           HA       MET   1  16.143  -1.493 -15.531
    5   1HB   MET   1          2HB       MET   1  17.992  -3.853 -15.200
    6   2HB   MET   1          1HB       MET   1  16.951  -3.717 -16.617
    7   1HG   MET   1          2HG       MET   1  17.908  -1.339 -16.876
    8   2HG   MET   1          1HG       MET   1  19.146  -1.843 -15.725
    9   1HE   MET   1          1HE       MET   1  19.484  -2.114 -20.021
   10   2HE   MET   1          2HE       MET   1  19.137  -0.862 -18.831
   11   3HE   MET   1          3HE       MET   1  17.856  -1.953 -19.350
   12    H    ASN   2           H        ASN   2  14.076  -1.997 -15.878
   13    HA   ASN   2           HA       ASN   2  13.033  -4.602 -14.985
   14   1HB   ASN   2          2HB       ASN   2  12.079  -1.905 -14.100
   15   2HB   ASN   2          1HB       ASN   2  10.901  -3.198 -14.326
   16   1HD2  ASN   2          1HD2      ASN   2  11.701  -5.403 -13.242
   17   2HD2  ASN   2          2HD2      ASN   2  12.371  -5.237 -11.693
   18    H    ASP   3           H        ASP   3  11.808  -5.540 -16.491
   19    HA   ASP   3           HA       ASP   3  10.749  -3.850 -18.682
   20   1HB   ASP   3          2HB       ASP   3  12.015  -6.578 -18.733
   21   2HB   ASP   3          1HB       ASP   3  10.925  -6.058 -20.019
   22    H    ILE   4           H        ILE   4   9.678  -5.368 -16.021
   23    HA   ILE   4           HA       ILE   4   7.545  -6.973 -17.091
   24    HB   ILE   4           HB       ILE   4   6.786  -7.278 -14.874
   25   1HG1  ILE   4          2HG1      ILE   4   6.844  -4.769 -14.347
   26   2HG1  ILE   4          1HG1      ILE   4   7.238  -5.857 -13.017
   27   1HG2  ILE   4          1HG2      ILE   4   9.780  -6.894 -14.645
   28   2HG2  ILE   4          2HG2      ILE   4   9.007  -8.283 -15.408
   29   3HG2  ILE   4          3HG2      ILE   4   8.773  -7.980 -13.687
   30   1HD1  ILE   4          1HD1      ILE   4   9.068  -4.090 -14.627
   31   2HD1  ILE   4          2HD1      ILE   4   9.710  -5.516 -13.811
   32   3HD1  ILE   4          3HD1      ILE   4   8.931  -4.242 -12.875
   33    H    TYR   5           H        TYR   5   7.993  -3.603 -16.382
   34    HA   TYR   5           HA       TYR   5   5.236  -2.861 -16.176
   35   1HB   TYR   5          2HB       TYR   5   7.583  -1.143 -17.030
   36   2HB   TYR   5          1HB       TYR   5   6.021  -0.576 -16.447
   37    HD1  TYR   5           HD1      TYR   5   5.282  -1.573 -14.097
   38    HD2  TYR   5           HD2      TYR   5   9.332  -1.334 -15.502
   39    HE1  TYR   5           HE1      TYR   5   6.103  -1.713 -11.761
   40    HE2  TYR   5           HE2      TYR   5  10.152  -1.478 -13.168
   41    HH   TYR   5           HH       TYR   5   8.563  -2.603 -10.731
   42    H    LYS   6           H        LYS   6   7.529  -3.287 -18.791
   43    HA   LYS   6           HA       LYS   6   5.899  -2.038 -20.821
   44   1HB   LYS   6          2HB       LYS   6   8.117  -4.021 -21.332
   45   2HB   LYS   6          1HB       LYS   6   7.557  -2.719 -22.377
   46   1HG   LYS   6          2HG       LYS   6   9.151  -2.504 -19.816
   47   2HG   LYS   6          1HG       LYS   6   9.584  -1.916 -21.421
   48   1HD   LYS   6          2HD       LYS   6   7.904  -0.197 -21.333
   49   2HD   LYS   6          1HD       LYS   6   7.200  -0.879 -19.866
   50   1HE   LYS   6          2HE       LYS   6   8.932  -0.115 -18.514
   51   2HE   LYS   6          1HE       LYS   6  10.093  -0.084 -19.841
   52   1HZ   LYS   6          1HZ       LYS   6   7.802   1.779 -19.516
   53   2HZ   LYS   6          2HZ       LYS   6   8.947   1.817 -20.771
   54   3HZ   LYS   6          3HZ       LYS   6   9.422   2.145 -19.174
   55    H    ALA   7           H        ALA   7   6.552  -5.323 -19.716
   56    HA   ALA   7           HA       ALA   7   4.939  -6.598 -21.733
   57   1HB   ALA   7          1HB       ALA   7   6.225  -7.508 -19.169
   58   2HB   ALA   7          2HB       ALA   7   6.577  -8.010 -20.822
   59   3HB   ALA   7          3HB       ALA   7   5.097  -8.555 -20.032
   60    H    ALA   8           H        ALA   8   4.369  -5.183 -18.593
   61    HA   ALA   8           HA       ALA   8   1.769  -6.434 -18.256
   62   1HB   ALA   8          1HB       ALA   8   3.171  -4.279 -16.661
   63   2HB   ALA   8          2HB       ALA   8   3.092  -5.997 -16.268
   64   3HB   ALA   8          3HB       ALA   8   1.627  -5.017 -16.229
   65    H    VAL   9           H        VAL   9   3.055  -3.369 -19.448
   66    HA   VAL   9           HA       VAL   9   0.792  -1.757 -19.208
   67    HB   VAL   9           HB       VAL   9   3.151  -1.138 -20.068
   68   1HG1  VAL   9          1HG1      VAL   9   1.904  -1.470 -22.781
   69   2HG1  VAL   9          2HG1      VAL   9   2.789  -2.810 -22.058
   70   3HG1  VAL   9          3HG1      VAL   9   3.603  -1.275 -22.355
   71   1HG2  VAL   9          1HG2      VAL   9   2.267   0.850 -21.116
   72   2HG2  VAL   9          2HG2      VAL   9   1.150   0.380 -19.834
   73   3HG2  VAL   9          3HG2      VAL   9   0.759   0.027 -21.518
   74    H    GLU  10           H        GLU  10   1.488  -4.270 -21.580
   75    HA   GLU  10           HA       GLU  10  -0.740  -3.623 -23.291
   76   1HB   GLU  10          2HB       GLU  10   0.986  -6.102 -23.090
   77   2HB   GLU  10          1HB       GLU  10  -0.251  -5.849 -24.321
   78   1HG   GLU  10          2HG       GLU  10   1.017  -3.589 -24.744
   79   2HG   GLU  10          1HG       GLU  10   2.358  -4.406 -23.940
   80    H    GLN  11           H        GLN  11  -0.325  -5.420 -20.357
   81    HA   GLN  11           HA       GLN  11  -2.779  -6.963 -20.720
   82   1HB   GLN  11          2HB       GLN  11  -1.007  -6.823 -18.273
   83   2HB   GLN  11          1HB       GLN  11  -2.225  -8.041 -18.643
   84   1HG   GLN  11          2HG       GLN  11   0.241  -7.535 -20.332
   85   2HG   GLN  11          1HG       GLN  11   0.118  -8.805 -19.117
   86   1HE2  GLN  11          1HE2      GLN  11  -0.650  -7.970 -22.396
   87   2HE2  GLN  11          2HE2      GLN  11  -1.538  -9.369 -22.763
   88    H    LEU  12           H        LEU  12  -1.664  -4.064 -19.114
   89    HA   LEU  12           HA       LEU  12  -3.591  -3.764 -17.111
   90   1HB   LEU  12          2HB       LEU  12  -2.434  -1.546 -18.798
   91   2HB   LEU  12          1HB       LEU  12  -3.151  -1.386 -17.213
   92    HG   LEU  12           HG       LEU  12  -0.463  -2.473 -17.980
   93   1HD1  LEU  12          1HD1      LEU  12  -1.303  -0.728 -15.657
   94   2HD1  LEU  12          2HD1      LEU  12  -0.931  -0.071 -17.251
   95   3HD1  LEU  12          3HD1      LEU  12   0.313  -0.925 -16.337
   96   1HD2  LEU  12          1HD2      LEU  12  -1.135  -4.270 -16.621
   97   2HD2  LEU  12          2HD2      LEU  12  -2.144  -3.243 -15.600
   98   3HD2  LEU  12          3HD2      LEU  12  -0.388  -3.171 -15.460
   99    H    THR  13           H        THR  13  -5.711  -3.946 -17.368
  100    HA   THR  13           HA       THR  13  -6.972  -2.780 -19.778
  101    HB   THR  13           HB       THR  13  -8.949  -4.280 -18.700
  102    HG1  THR  13           HG1      THR  13  -8.180  -5.696 -17.382
  103   1HG2  THR  13          1HG2      THR  13  -7.881  -6.149 -20.248
  104   2HG2  THR  13          2HG2      THR  13  -6.788  -4.836 -20.686
  105   3HG2  THR  13          3HG2      THR  13  -8.524  -4.658 -20.934
  106    H    ASP  14           H        ASP  14  -9.285  -2.070 -19.372
  107    HA   ASP  14           HA       ASP  14  -9.325   0.104 -17.577
  108   1HB   ASP  14          2HB       ASP  14 -11.588  -1.363 -18.952
  109   2HB   ASP  14          1HB       ASP  14 -11.799   0.133 -18.042
  110    H    GLU  15           H        GLU  15 -10.305  -3.248 -17.248
  111    HA   GLU  15           HA       GLU  15 -11.888  -3.026 -14.913
  112   1HB   GLU  15          2HB       GLU  15 -10.308  -5.286 -16.125
  113   2HB   GLU  15          1HB       GLU  15 -11.166  -5.478 -14.598
  114   1HG   GLU  15          2HG       GLU  15 -13.252  -5.275 -15.582
  115   2HG   GLU  15          1HG       GLU  15 -12.647  -4.283 -16.908
  116    H    GLN  16           H        GLN  16  -8.422  -3.858 -15.314
  117    HA   GLN  16           HA       GLN  16  -7.856  -4.093 -12.557
  118   1HB   GLN  16          2HB       GLN  16  -5.632  -4.335 -13.147
  119   2HB   GLN  16          1HB       GLN  16  -6.423  -4.763 -14.658
  120   1HG   GLN  16          2HG       GLN  16  -4.964  -3.240 -15.534
  121   2HG   GLN  16          1HG       GLN  16  -6.174  -2.078 -15.003
  122   1HE2  GLN  16          1HE2      GLN  16  -3.215  -3.756 -13.804
  123   2HE2  GLN  16          2HE2      GLN  16  -2.715  -2.474 -12.811
  124    H    LYS  17           H        LYS  17  -7.956  -1.292 -14.687
  125    HA   LYS  17           HA       LYS  17  -6.777   0.491 -12.737
  126   1HB   LYS  17          2HB       LYS  17  -7.817   0.724 -15.498
  127   2HB   LYS  17          1HB       LYS  17  -7.982   2.164 -14.493
  128   1HG   LYS  17          2HG       LYS  17  -5.829   2.589 -15.073
  129   2HG   LYS  17          1HG       LYS  17  -5.423   1.342 -13.895
  130   1HD   LYS  17          2HD       LYS  17  -4.337   0.462 -15.728
  131   2HD   LYS  17          1HD       LYS  17  -5.927  -0.255 -15.985
  132   1HE   LYS  17          2HE       LYS  17  -5.654   0.686 -18.065
  133   2HE   LYS  17          1HE       LYS  17  -6.332   2.089 -17.238
  134   1HZ   LYS  17          1HZ       LYS  17  -4.053   2.815 -16.748
  135   2HZ   LYS  17          2HZ       LYS  17  -4.350   2.716 -18.418
  136   3HZ   LYS  17          3HZ       LYS  17  -3.446   1.505 -17.640
  137    H    ASN  18           H        ASN  18  -9.994  -0.571 -13.634
  138    HA   ASN  18           HA       ASN  18 -11.459   1.519 -12.360
  139   1HB   ASN  18          2HB       ASN  18 -12.060  -1.048 -13.634
  140   2HB   ASN  18          1HB       ASN  18 -13.095  -0.716 -12.245
  141   1HD2  ASN  18          1HD2      ASN  18 -11.788   1.033 -15.133
  142   2HD2  ASN  18          2HD2      ASN  18 -13.214   1.908 -15.419
  143    H    GLU  19           H        GLU  19 -10.376  -1.706 -11.315
  144    HA   GLU  19           HA       GLU  19 -11.549  -1.610  -8.715
  145   1HB   GLU  19          2HB       GLU  19  -9.102  -3.163  -9.605
  146   2HB   GLU  19          1HB       GLU  19 -10.076  -3.480  -8.170
  147   1HG   GLU  19          2HG       GLU  19 -11.938  -4.189  -9.450
  148   2HG   GLU  19          1HG       GLU  19 -11.300  -3.469 -10.927
  149    H    PHE  20           H        PHE  20  -8.315  -0.882  -9.970
  150    HA   PHE  20           HA       PHE  20  -7.097  -0.169  -7.518
  151   1HB   PHE  20          2HB       PHE  20  -6.514   0.463 -10.401
  152   2HB   PHE  20          1HB       PHE  20  -5.591   1.237  -9.119
  153    HD1  PHE  20           HD1      PHE  20  -3.717  -0.024 -10.427
  154    HD2  PHE  20           HD2      PHE  20  -6.719  -1.985  -8.063
  155    HE1  PHE  20           HE1      PHE  20  -2.274  -2.025 -10.253
  156    HE2  PHE  20           HE2      PHE  20  -5.271  -3.986  -7.890
  157    HZ   PHE  20           HZ       PHE  20  -3.048  -4.007  -8.982
  158    H    LYS  21           H        LYS  21  -8.788   1.762  -9.974
  159    HA   LYS  21           HA       LYS  21  -8.355   4.297  -8.783
  160   1HB   LYS  21          2HB       LYS  21  -9.099   3.913 -11.154
  161   2HB   LYS  21          1HB       LYS  21 -10.692   3.488 -10.531
  162   1HG   LYS  21          2HG       LYS  21 -10.611   5.857 -11.220
  163   2HG   LYS  21          1HG       LYS  21 -10.883   5.711  -9.485
  164   1HD   LYS  21          2HD       LYS  21  -8.826   6.575  -8.948
  165   2HD   LYS  21          1HD       LYS  21  -8.044   5.861 -10.358
  166   1HE   LYS  21          2HE       LYS  21  -8.027   8.114 -10.942
  167   2HE   LYS  21          1HE       LYS  21  -9.535   7.586 -11.687
  168   1HZ   LYS  21          1HZ       LYS  21  -9.781   9.638 -10.391
  169   2HZ   LYS  21          2HZ       LYS  21  -9.313   8.805  -8.986
  170   3HZ   LYS  21          3HZ       LYS  21 -10.751   8.383  -9.789
  171    H    ALA  22           H        ALA  22 -11.009   1.942  -8.504
  172    HA   ALA  22           HA       ALA  22 -12.679   3.537  -6.846
  173   1HB   ALA  22          1HB       ALA  22 -13.878   1.495  -6.362
  174   2HB   ALA  22          2HB       ALA  22 -12.519   0.515  -6.910
  175   3HB   ALA  22          3HB       ALA  22 -13.432   1.483  -8.068
  176    H    ALA  23           H        ALA  23 -10.199   1.092  -6.140
  177    HA   ALA  23           HA       ALA  23 -10.481   1.160  -3.305
  178   1HB   ALA  23          1HB       ALA  23  -9.364  -0.737  -4.149
  179   2HB   ALA  23          2HB       ALA  23  -8.083   0.215  -3.401
  180   3HB   ALA  23          3HB       ALA  23  -8.287   0.234  -5.153
  181    H    PHE  24           H        PHE  24  -8.937   3.241  -5.601
  182    HA   PHE  24           HA       PHE  24  -7.158   4.497  -3.686
  183   1HB   PHE  24          2HB       PHE  24  -6.848   4.231  -6.281
  184   2HB   PHE  24          1HB       PHE  24  -7.857   5.672  -6.363
  185    HD1  PHE  24           HD1      PHE  24  -7.058   7.826  -5.540
  186    HD2  PHE  24           HD2      PHE  24  -4.633   4.292  -5.219
  187    HE1  PHE  24           HE1      PHE  24  -5.085   9.227  -5.009
  188    HE2  PHE  24           HE2      PHE  24  -2.661   5.696  -4.680
  189    HZ   PHE  24           HZ       PHE  24  -2.887   8.163  -4.579
  190    H    ASP  25           H        ASP  25  -9.994   5.526  -5.618
  191    HA   ASP  25           HA       ASP  25 -10.313   8.065  -4.511
  192   1HB   ASP  25          2HB       ASP  25 -12.237   6.160  -5.811
  193   2HB   ASP  25          1HB       ASP  25 -12.800   7.693  -5.152
  194    H    ILE  26           H        ILE  26 -11.593   4.949  -3.308
  195    HA   ILE  26           HA       ILE  26 -13.385   5.953  -1.405
  196    HB   ILE  26           HB       ILE  26 -12.926   3.851  -0.111
  197   1HG1  ILE  26          2HG1      ILE  26 -10.953   3.353  -2.364
  198   2HG1  ILE  26          1HG1      ILE  26 -10.515   3.683  -0.691
  199   1HG2  ILE  26          1HG2      ILE  26 -13.445   2.371  -2.265
  200   2HG2  ILE  26          2HG2      ILE  26 -13.622   3.956  -3.015
  201   3HG2  ILE  26          3HG2      ILE  26 -14.628   3.518  -1.635
  202   1HD1  ILE  26          1HD1      ILE  26 -11.957   1.277  -1.800
  203   2HD1  ILE  26          2HD1      ILE  26 -11.988   1.668  -0.081
  204   3HD1  ILE  26          3HD1      ILE  26 -10.454   1.319  -0.878
  205    H    PHE  27           H        PHE  27  -9.882   5.661  -1.295
  206    HA   PHE  27           HA       PHE  27  -9.730   6.537   1.484
  207   1HB   PHE  27          2HB       PHE  27  -7.771   5.607  -0.574
  208   2HB   PHE  27          1HB       PHE  27  -7.182   6.630   0.736
  209    HD1  PHE  27           HD1      PHE  27  -8.896   3.437  -0.057
  210    HD2  PHE  27           HD2      PHE  27  -7.040   5.822   2.996
  211    HE1  PHE  27           HE1      PHE  27  -8.915   1.490   1.475
  212    HE2  PHE  27           HE2      PHE  27  -7.058   3.872   4.528
  213    HZ   PHE  27           HZ       PHE  27  -7.997   1.706   3.768
  214    H    ILE  28           H        ILE  28  -9.338   7.855  -1.759
  215    HA   ILE  28           HA       ILE  28  -8.379  10.423  -0.713
  216    HB   ILE  28           HB       ILE  28  -8.938   9.787  -3.610
  217   1HG1  ILE  28          2HG1      ILE  28  -7.446   8.046  -3.122
  218   2HG1  ILE  28          1HG1      ILE  28  -6.375   9.342  -3.628
  219   1HG2  ILE  28          1HG2      ILE  28  -6.852  11.382  -3.708
  220   2HG2  ILE  28          2HG2      ILE  28  -7.366  11.830  -2.079
  221   3HG2  ILE  28          3HG2      ILE  28  -8.461  12.055  -3.443
  222   1HD1  ILE  28          1HD1      ILE  28  -5.329   8.639  -1.670
  223   2HD1  ILE  28          2HD1      ILE  28  -6.854   8.259  -0.872
  224   3HD1  ILE  28          3HD1      ILE  28  -6.355   9.941  -1.060
  225    H    GLN  29           H        GLN  29 -11.020   9.676   0.039
  226    HA   GLN  29           HA       GLN  29 -12.970  10.917  -1.650
  227   1HB   GLN  29          2HB       GLN  29 -14.411  10.866   0.451
  228   2HB   GLN  29          1HB       GLN  29 -13.825   9.306  -0.119
  229   1HG   GLN  29          2HG       GLN  29 -12.184   9.169   1.588
  230   2HG   GLN  29          1HG       GLN  29 -12.314  10.887   1.966
  231   1HE2  GLN  29          1HE2      GLN  29 -13.445  11.245   3.870
  232   2HE2  GLN  29          2HE2      GLN  29 -14.720  10.282   4.443
  233    H    ASP  30           H        ASP  30 -11.007  11.987   1.082
  234    HA   ASP  30           HA       ASP  30 -11.488  14.769   0.352
  235   1HB   ASP  30          2HB       ASP  30 -12.315  13.584   3.002
  236   2HB   ASP  30          1HB       ASP  30 -11.898  15.290   2.849
  237    H    ALA  31           H        ALA  31  -9.185  13.160   0.081
  238    HA   ALA  31           HA       ALA  31  -7.373  13.413   2.257
  239   1HB   ALA  31          1HB       ALA  31  -7.056  11.816   0.381
  240   2HB   ALA  31          2HB       ALA  31  -5.639  12.832   0.654
  241   3HB   ALA  31          3HB       ALA  31  -6.728  13.178  -0.690
  242    H    GLU  32           H        GLU  32  -5.629  14.822   2.535
  243    HA   GLU  32           HA       GLU  32  -6.181  17.559   1.934
  244   1HB   GLU  32          2HB       GLU  32  -4.078  18.048   3.098
  245   2HB   GLU  32          1HB       GLU  32  -5.060  16.910   4.018
  246   1HG   GLU  32          2HG       GLU  32  -3.613  15.155   2.558
  247   2HG   GLU  32          1HG       GLU  32  -2.458  16.485   2.637
  248    H    ASP  33           H        ASP  33  -3.917  15.178   0.627
  249    HA   ASP  33           HA       ASP  33  -2.986  17.181  -1.339
  250   1HB   ASP  33          2HB       ASP  33  -1.297  15.918   0.110
  251   2HB   ASP  33          1HB       ASP  33  -1.726  14.487  -0.825
  252    H    GLY  34           H        GLY  34  -4.302  13.916  -0.983
  253   1HA   GLY  34          2HA       GLY  34  -6.005  13.217  -2.617
  254   2HA   GLY  34          1HA       GLY  34  -4.991  13.929  -3.867
  255    H    CYS  35           H        CYS  35  -3.955  11.926  -1.128
  256    HA   CYS  35           HA       CYS  35  -3.558   9.570  -2.774
  257   1HB   CYS  35          2HB       CYS  35  -1.025   9.691  -1.789
  258   2HB   CYS  35          1HB       CYS  35  -1.467  10.195  -3.417
  259    HG   CYS  35           HG       CYS  35  -1.170  12.202  -1.030
  260    H    ILE  36           H        ILE  36  -2.347   7.841  -1.398
  261    HA   ILE  36           HA       ILE  36  -3.501   7.978   1.316
  262    HB   ILE  36           HB       ILE  36  -3.239   5.513   1.345
  263   1HG1  ILE  36          2HG1      ILE  36  -2.917   4.917  -1.385
  264   2HG1  ILE  36          1HG1      ILE  36  -1.649   6.084  -1.014
  265   1HG2  ILE  36          1HG2      ILE  36  -5.389   5.988   0.684
  266   2HG2  ILE  36          2HG2      ILE  36  -4.827   5.198  -0.789
  267   3HG2  ILE  36          3HG2      ILE  36  -4.868   6.958  -0.694
  268   1HD1  ILE  36          1HD1      ILE  36  -1.743   3.312  -0.325
  269   2HD1  ILE  36          2HD1      ILE  36  -1.803   4.250   1.169
  270   3HD1  ILE  36          3HD1      ILE  36  -0.474   4.482   0.034
  271    H    SER  37           H        SER  37  -2.160   6.488   2.893
  272    HA   SER  37           HA       SER  37   0.533   7.639   2.941
  273   1HB   SER  37          2HB       SER  37  -1.121   7.651   4.940
  274   2HB   SER  37          1HB       SER  37  -0.669   5.959   5.128
  275    HG   SER  37           HG       SER  37   0.660   8.134   5.890
  276    H    THR  38           H        THR  38   2.386   6.436   3.042
  277    HA   THR  38           HA       THR  38   2.497   3.988   1.658
  278    HB   THR  38           HB       THR  38   4.841   3.837   2.675
  279    HG1  THR  38           HG1      THR  38   5.506   5.676   3.785
  280   1HG2  THR  38          1HG2      THR  38   4.666   4.779   0.518
  281   2HG2  THR  38          2HG2      THR  38   5.534   6.001   1.449
  282   3HG2  THR  38          3HG2      THR  38   3.814   6.202   1.116
  283    H    LYS  39           H        LYS  39   2.283   4.718   5.103
  284    HA   LYS  39           HA       LYS  39   2.684   1.996   5.969
  285   1HB   LYS  39          2HB       LYS  39   1.483   4.330   7.481
  286   2HB   LYS  39          1HB       LYS  39   2.077   2.826   8.182
  287   1HG   LYS  39          2HG       LYS  39   3.684   4.993   6.806
  288   2HG   LYS  39          1HG       LYS  39   3.830   4.436   8.471
  289   1HD   LYS  39          2HD       LYS  39   4.542   2.197   7.616
  290   2HD   LYS  39          1HD       LYS  39   4.501   2.847   5.977
  291   1HE   LYS  39          2HE       LYS  39   6.099   4.267   8.091
  292   2HE   LYS  39          1HE       LYS  39   6.770   2.838   7.304
  293   1HZ   LYS  39          1HZ       LYS  39   5.811   5.306   5.958
  294   2HZ   LYS  39          2HZ       LYS  39   6.347   3.909   5.152
  295   3HZ   LYS  39          3HZ       LYS  39   7.423   4.804   6.114
  296    H    GLU  40           H        GLU  40  -0.013   3.937   4.936
  297    HA   GLU  40           HA       GLU  40  -2.026   2.152   6.046
  298   1HB   GLU  40          2HB       GLU  40  -2.026   4.760   4.633
  299   2HB   GLU  40          1HB       GLU  40  -3.432   3.731   4.369
  300   1HG   GLU  40          2HG       GLU  40  -4.139   4.775   6.292
  301   2HG   GLU  40          1HG       GLU  40  -3.235   3.456   7.032
  302    H    LEU  41           H        LEU  41   0.044   1.636   3.615
  303    HA   LEU  41           HA       LEU  41  -1.435   1.046   1.320
  304   1HB   LEU  41          2HB       LEU  41   1.191   0.677   2.177
  305   2HB   LEU  41          1HB       LEU  41   0.613  -0.942   1.861
  306    HG   LEU  41           HG       LEU  41   1.695  -0.125  -0.115
  307   1HD1  LEU  41          1HD1      LEU  41   0.030  -1.301  -1.103
  308   2HD1  LEU  41          2HD1      LEU  41  -0.644   0.274  -1.517
  309   3HD1  LEU  41          3HD1      LEU  41  -1.212  -0.579  -0.082
  310   1HD2  LEU  41          1HD2      LEU  41   0.042   2.318   0.440
  311   2HD2  LEU  41          2HD2      LEU  41   0.511   1.962  -1.222
  312   3HD2  LEU  41          3HD2      LEU  41   1.748   2.199   0.011
  313    H    GLY  42           H        GLY  42  -0.789  -0.928   4.198
  314   1HA   GLY  42          2HA       GLY  42  -1.930  -3.345   3.341
  315   2HA   GLY  42          1HA       GLY  42  -1.770  -2.839   5.016
  316    H    LYS  43           H        LYS  43  -3.487  -0.366   4.200
  317    HA   LYS  43           HA       LYS  43  -6.019  -1.582   4.922
  318   1HB   LYS  43          2HB       LYS  43  -5.376   1.312   4.300
  319   2HB   LYS  43          1HB       LYS  43  -6.853   0.711   5.051
  320   1HG   LYS  43          2HG       LYS  43  -4.156   0.127   6.270
  321   2HG   LYS  43          1HG       LYS  43  -4.989   1.644   6.603
  322   1HD   LYS  43          2HD       LYS  43  -6.475  -0.951   6.901
  323   2HD   LYS  43          1HD       LYS  43  -5.381  -0.424   8.180
  324   1HE   LYS  43          2HE       LYS  43  -6.648   1.475   8.668
  325   2HE   LYS  43          1HE       LYS  43  -7.392   1.513   7.069
  326   1HZ   LYS  43          1HZ       LYS  43  -8.607  -0.512   7.647
  327   2HZ   LYS  43          2HZ       LYS  43  -8.967   0.759   8.716
  328   3HZ   LYS  43          3HZ       LYS  43  -7.921  -0.490   9.199
  329    H    VAL  44           H        VAL  44  -4.616   0.054   2.104
  330    HA   VAL  44           HA       VAL  44  -7.068   0.024   0.601
  331    HB   VAL  44           HB       VAL  44  -5.613   0.697  -1.322
  332   1HG1  VAL  44          1HG1      VAL  44  -6.465   2.551  -0.224
  333   2HG1  VAL  44          2HG1      VAL  44  -4.736   2.827  -0.018
  334   3HG1  VAL  44          3HG1      VAL  44  -5.682   2.140   1.302
  335   1HG2  VAL  44          1HG2      VAL  44  -3.259   1.180  -0.921
  336   2HG2  VAL  44          2HG2      VAL  44  -3.562  -0.512  -0.535
  337   3HG2  VAL  44          3HG2      VAL  44  -3.406   0.674   0.761
  338    H    MET  45           H        MET  45  -4.191  -2.055   0.757
  339    HA   MET  45           HA       MET  45  -4.947  -3.647  -1.509
  340   1HB   MET  45          2HB       MET  45  -3.198  -5.219  -0.750
  341   2HB   MET  45          1HB       MET  45  -2.607  -3.567  -0.866
  342   1HG   MET  45          2HG       MET  45  -2.923  -3.298   1.577
  343   2HG   MET  45          1HG       MET  45  -3.478  -4.967   1.680
  344   1HE   MET  45          1HE       MET  45   0.424  -3.017   1.197
  345   2HE   MET  45          2HE       MET  45  -1.089  -2.610   0.389
  346   3HE   MET  45          3HE       MET  45   0.088  -3.637  -0.424
  347    H    ARG  46           H        ARG  46  -5.296  -3.998   1.987
  348    HA   ARG  46           HA       ARG  46  -6.334  -6.610   2.055
  349   1HB   ARG  46          2HB       ARG  46  -6.454  -4.261   3.877
  350   2HB   ARG  46          1HB       ARG  46  -7.636  -5.543   4.137
  351   1HG   ARG  46          2HG       ARG  46  -5.624  -7.162   3.986
  352   2HG   ARG  46          1HG       ARG  46  -4.626  -5.728   4.220
  353   1HD   ARG  46          2HD       ARG  46  -6.919  -6.368   6.071
  354   2HD   ARG  46          1HD       ARG  46  -5.319  -7.052   6.328
  355    HE   ARG  46           HE       ARG  46  -6.121  -4.301   6.766
  356   1HH1  ARG  46          2HH1      ARG  46  -3.458  -6.480   6.149
  357   2HH1  ARG  46          1HH1      ARG  46  -2.273  -5.423   6.832
  358   1HH2  ARG  46          1HH2      ARG  46  -4.546  -2.931   7.652
  359   2HH2  ARG  46          2HH2      ARG  46  -2.885  -3.420   7.681
  360    H    MET  47           H        MET  47  -7.940  -3.496   1.537
  361    HA   MET  47           HA       MET  47 -10.590  -4.642   1.433
  362   1HB   MET  47          2HB       MET  47  -9.466  -1.917   0.793
  363   2HB   MET  47          1HB       MET  47 -11.147  -2.331   0.456
  364   1HG   MET  47          2HG       MET  47 -11.098  -3.195   2.960
  365   2HG   MET  47          1HG       MET  47  -9.756  -2.060   3.095
  366   1HE   MET  47          1HE       MET  47 -13.837  -1.286   3.904
  367   2HE   MET  47          2HE       MET  47 -12.431  -1.176   4.961
  368   3HE   MET  47          3HE       MET  47 -12.729  -2.656   4.052
  369    H    LEU  48           H        LEU  48  -8.037  -3.890  -0.855
  370    HA   LEU  48           HA       LEU  48  -9.535  -3.937  -3.248
  371   1HB   LEU  48          2HB       LEU  48  -7.160  -3.158  -2.967
  372   2HB   LEU  48          1HB       LEU  48  -6.679  -4.838  -2.890
  373    HG   LEU  48           HG       LEU  48  -7.592  -5.147  -5.199
  374   1HD1  LEU  48          1HD1      LEU  48  -9.220  -3.381  -5.327
  375   2HD1  LEU  48          2HD1      LEU  48  -7.955  -2.986  -6.490
  376   3HD1  LEU  48          3HD1      LEU  48  -8.012  -2.158  -4.933
  377   1HD2  LEU  48          1HD2      LEU  48  -5.367  -4.841  -5.527
  378   2HD2  LEU  48          2HD2      LEU  48  -5.299  -3.499  -4.385
  379   3HD2  LEU  48          3HD2      LEU  48  -5.805  -3.215  -6.050
  380    H    GLY  49           H        GLY  49  -7.808  -6.546  -1.511
  381   1HA   GLY  49          2HA       GLY  49  -9.535  -8.608  -1.908
  382   2HA   GLY  49          1HA       GLY  49  -8.655  -8.551  -3.429
  383    H    GLN  50           H        GLN  50  -6.118  -7.712  -2.216
  384    HA   GLN  50           HA       GLN  50  -5.192 -10.344  -1.408
  385   1HB   GLN  50          2HB       GLN  50  -4.027  -8.303  -2.827
  386   2HB   GLN  50          1HB       GLN  50  -3.274  -8.119  -1.243
  387   1HG   GLN  50          2HG       GLN  50  -2.632 -10.495  -1.256
  388   2HG   GLN  50          1HG       GLN  50  -3.405 -10.702  -2.828
  389   1HE2  GLN  50          1HE2      GLN  50  -2.387  -9.632  -4.705
  390   2HE2  GLN  50          2HE2      GLN  50  -0.772  -9.117  -4.630
  391    H    ASN  51           H        ASN  51  -4.053 -10.806   0.520
  392    HA   ASN  51           HA       ASN  51  -4.315  -8.858   2.714
  393   1HB   ASN  51          2HB       ASN  51  -6.259 -10.605   2.581
  394   2HB   ASN  51          1HB       ASN  51  -5.055 -11.727   3.213
  395   1HD2  ASN  51          1HD2      ASN  51  -7.139  -9.045   4.034
  396   2HD2  ASN  51          2HD2      ASN  51  -6.682  -8.936   5.665
  397    HA   PRO  52           HA       PRO  52  -0.236 -11.014   2.828
  398   1HB   PRO  52          2HB       PRO  52   1.286  -8.746   2.714
  399   2HB   PRO  52          1HB       PRO  52   0.690  -9.596   1.283
  400   1HG   PRO  52          2HG       PRO  52  -0.191  -7.034   2.445
  401   2HG   PRO  52          1HG       PRO  52  -0.337  -7.625   0.784
  402   1HD   PRO  52          2HD       PRO  52  -2.388  -7.571   2.774
  403   2HD   PRO  52          1HD       PRO  52  -2.479  -8.317   1.161
  404    H    THR  53           H        THR  53   1.825  -9.965   4.218
  405    HA   THR  53           HA       THR  53   0.736  -9.577   6.938
  406    HB   THR  53           HB       THR  53   2.732 -10.552   7.774
  407    HG1  THR  53           HG1      THR  53   4.514 -10.925   6.320
  408   1HG2  THR  53          1HG2      THR  53   2.992 -12.649   6.489
  409   2HG2  THR  53          2HG2      THR  53   2.087 -11.928   5.158
  410   3HG2  THR  53          3HG2      THR  53   1.296 -12.215   6.708
  411    HA   PRO  54           HA       PRO  54   2.544  -5.560   7.250
  412   1HB   PRO  54          2HB       PRO  54   3.902  -5.581   9.628
  413   2HB   PRO  54          1HB       PRO  54   2.138  -5.511   9.494
  414   1HG   PRO  54          2HG       PRO  54   3.891  -7.800  10.222
  415   2HG   PRO  54          1HG       PRO  54   2.240  -7.432  10.746
  416   1HD   PRO  54          2HD       PRO  54   2.925  -9.325   8.812
  417   2HD   PRO  54          1HD       PRO  54   1.308  -8.610   9.009
  418    H    GLU  55           H        GLU  55   4.819  -8.208   7.685
  419    HA   GLU  55           HA       GLU  55   7.150  -6.548   7.155
  420   1HB   GLU  55          2HB       GLU  55   8.405  -8.688   7.219
  421   2HB   GLU  55          1HB       GLU  55   7.445  -8.424   8.671
  422   1HG   GLU  55          2HG       GLU  55   5.737  -9.953   7.904
  423   2HG   GLU  55          1HG       GLU  55   6.501 -10.088   6.320
  424    H    GLU  56           H        GLU  56   5.044  -8.780   5.416
  425    HA   GLU  56           HA       GLU  56   6.692  -8.958   3.070
  426   1HB   GLU  56          2HB       GLU  56   4.950 -10.657   3.710
  427   2HB   GLU  56          1HB       GLU  56   3.717  -9.474   3.279
  428   1HG   GLU  56          2HG       GLU  56   4.066 -10.911   1.362
  429   2HG   GLU  56          1HG       GLU  56   4.754  -9.332   0.987
  430    H    LEU  57           H        LEU  57   3.664  -7.202   3.825
  431    HA   LEU  57           HA       LEU  57   3.485  -5.808   1.381
  432   1HB   LEU  57          2HB       LEU  57   1.563  -5.161   2.277
  433   2HB   LEU  57          1HB       LEU  57   2.022  -5.919   3.781
  434    HG   LEU  57           HG       LEU  57   2.827  -3.085   3.133
  435   1HD1  LEU  57          1HD1      LEU  57   0.427  -3.737   4.809
  436   2HD1  LEU  57          2HD1      LEU  57   0.259  -3.645   3.057
  437   3HD1  LEU  57          3HD1      LEU  57   0.824  -2.242   3.962
  438   1HD2  LEU  57          1HD2      LEU  57   3.297  -4.901   5.282
  439   2HD2  LEU  57          2HD2      LEU  57   2.226  -3.637   5.884
  440   3HD2  LEU  57          3HD2      LEU  57   3.782  -3.208   5.170
  441    H    GLN  58           H        GLN  58   5.388  -5.201   4.266
  442    HA   GLN  58           HA       GLN  58   5.969  -2.501   4.029
  443   1HB   GLN  58          2HB       GLN  58   6.973  -4.630   5.547
  444   2HB   GLN  58          1HB       GLN  58   8.372  -3.981   4.691
  445   1HG   GLN  58          2HG       GLN  58   6.408  -2.361   6.344
  446   2HG   GLN  58          1HG       GLN  58   8.040  -2.811   6.838
  447   1HE2  GLN  58          1HE2      GLN  58   6.176  -0.631   4.792
  448   2HE2  GLN  58          2HE2      GLN  58   7.494   0.300   4.264
  449    H    GLU  59           H        GLU  59   7.800  -5.212   2.583
  450    HA   GLU  59           HA       GLU  59   9.646  -3.670   1.150
  451   1HB   GLU  59          2HB       GLU  59   8.772  -6.455   1.170
  452   2HB   GLU  59          1HB       GLU  59   9.272  -5.903  -0.429
  453   1HG   GLU  59          2HG       GLU  59  10.928  -5.324   2.023
  454   2HG   GLU  59          1HG       GLU  59  11.112  -6.832   1.126
  455    H    MET  60           H        MET  60   6.399  -4.782   0.254
  456    HA   MET  60           HA       MET  60   6.475  -4.023  -2.464
  457   1HB   MET  60          2HB       MET  60   4.183  -4.321  -0.519
  458   2HB   MET  60          1HB       MET  60   3.942  -3.910  -2.217
  459   1HG   MET  60          2HG       MET  60   4.785  -5.970  -2.967
  460   2HG   MET  60          1HG       MET  60   5.624  -6.287  -1.448
  461   1HE   MET  60          1HE       MET  60   4.239  -8.344  -2.836
  462   2HE   MET  60          2HE       MET  60   2.768  -7.614  -3.473
  463   3HE   MET  60          3HE       MET  60   2.657  -8.885  -2.258
  464    H    ILE  61           H        ILE  61   5.555  -2.220   0.460
  465    HA   ILE  61           HA       ILE  61   4.512   0.074  -0.741
  466    HB   ILE  61           HB       ILE  61   6.003  -0.304   1.861
  467   1HG1  ILE  61          2HG1      ILE  61   3.113   0.346   1.669
  468   2HG1  ILE  61          1HG1      ILE  61   3.588  -1.259   1.125
  469   1HG2  ILE  61          1HG2      ILE  61   4.901   1.900   2.470
  470   2HG2  ILE  61          2HG2      ILE  61   4.568   2.120   0.752
  471   3HG2  ILE  61          3HG2      ILE  61   6.235   2.021   1.323
  472   1HD1  ILE  61          1HD1      ILE  61   4.366  -0.082   3.805
  473   2HD1  ILE  61          2HD1      ILE  61   4.637  -1.733   3.247
  474   3HD1  ILE  61          3HD1      ILE  61   2.997  -1.167   3.561
  475    H    ASP  62           H        ASP  62   7.775  -0.045   0.733
  476    HA   ASP  62           HA       ASP  62   8.765   2.257  -0.456
  477   1HB   ASP  62          2HB       ASP  62  10.999   1.424   0.032
  478   2HB   ASP  62          1HB       ASP  62   9.914   1.052   1.361
  479    H    GLU  63           H        GLU  63   8.577  -1.000  -1.793
  480    HA   GLU  63           HA       GLU  63  10.271  -0.585  -4.034
  481   1HB   GLU  63          2HB       GLU  63   8.162  -2.584  -3.329
  482   2HB   GLU  63          1HB       GLU  63   8.706  -2.485  -5.004
  483   1HG   GLU  63          2HG       GLU  63  11.039  -2.770  -4.272
  484   2HG   GLU  63          1HG       GLU  63  10.510  -2.859  -2.594
  485    H    VAL  64           H        VAL  64   6.679  -0.575  -3.842
  486    HA   VAL  64           HA       VAL  64   6.304   0.323  -6.506
  487    HB   VAL  64           HB       VAL  64   4.002   0.773  -5.915
  488   1HG1  VAL  64          1HG1      VAL  64   3.833  -1.464  -6.053
  489   2HG1  VAL  64          2HG1      VAL  64   3.893  -1.496  -4.291
  490   3HG1  VAL  64          3HG1      VAL  64   5.373  -1.699  -5.228
  491   1HG2  VAL  64          1HG2      VAL  64   3.224   0.688  -3.588
  492   2HG2  VAL  64          2HG2      VAL  64   4.451   1.944  -3.772
  493   3HG2  VAL  64          3HG2      VAL  64   4.872   0.399  -3.032
  494    H    ASP  65           H        ASP  65   6.949   2.061  -3.525
  495    HA   ASP  65           HA       ASP  65   6.029   4.610  -4.258
  496   1HB   ASP  65          2HB       ASP  65   7.224   3.602  -2.030
  497   2HB   ASP  65          1HB       ASP  65   8.545   4.546  -2.711
  498    H    GLU  66           H        GLU  66   6.471   5.222  -6.305
  499    HA   GLU  66           HA       GLU  66   9.085   4.982  -7.493
  500   1HB   GLU  66          2HB       GLU  66   6.540   6.355  -8.349
  501   2HB   GLU  66          1HB       GLU  66   8.029   6.464  -9.288
  502   1HG   GLU  66          2HG       GLU  66   8.069   4.141  -9.719
  503   2HG   GLU  66          1HG       GLU  66   6.932   3.792  -8.418
  504    H    ASP  67           H        ASP  67   7.250   7.596  -5.961
  505    HA   ASP  67           HA       ASP  67   9.246   9.599  -6.613
  506   1HB   ASP  67          2HB       ASP  67   7.022   9.887  -4.590
  507   2HB   ASP  67          1HB       ASP  67   7.854  11.161  -5.480
  508    H    GLY  68           H        GLY  68   8.140   7.949  -3.651
  509   1HA   GLY  68          2HA       GLY  68   9.364   7.358  -1.760
  510   2HA   GLY  68          1HA       GLY  68  10.789   8.104  -2.481
  511    H    SER  69           H        SER  69   7.620   9.603  -2.008
  512    HA   SER  69           HA       SER  69   8.875  11.787  -0.523
  513   1HB   SER  69          2HB       SER  69   6.556  12.814  -0.807
  514   2HB   SER  69          1HB       SER  69   7.470  12.531  -2.284
  515    HG   SER  69           HG       SER  69   5.090  11.536  -1.549
  516    H    GLY  70           H        GLY  70   5.994   9.695  -0.196
  517   1HA   GLY  70          2HA       GLY  70   6.244   8.806   2.359
  518   2HA   GLY  70          1HA       GLY  70   5.616  10.436   2.579
  519    H    THR  71           H        THR  71   4.061  10.397   0.099
  520    HA   THR  71           HA       THR  71   1.843   8.666   1.002
  521    HB   THR  71           HB       THR  71   0.344  10.201  -0.142
  522    HG1  THR  71           HG1      THR  71   2.642  11.726  -0.802
  523   1HG2  THR  71          1HG2      THR  71   0.941  10.810   2.135
  524   2HG2  THR  71          2HG2      THR  71   0.825  12.279   1.166
  525   3HG2  THR  71          3HG2      THR  71   2.407  11.613   1.572
  526    H    VAL  72           H        VAL  72   0.586   7.554  -0.584
  527    HA   VAL  72           HA       VAL  72   2.152   6.878  -2.995
  528    HB   VAL  72           HB       VAL  72   0.028   5.331  -1.500
  529   1HG1  VAL  72          1HG1      VAL  72  -0.397   4.235  -3.426
  530   2HG1  VAL  72          2HG1      VAL  72   1.286   3.713  -3.456
  531   3HG1  VAL  72          3HG1      VAL  72   0.808   5.194  -4.284
  532   1HG2  VAL  72          1HG2      VAL  72   1.925   3.715  -1.232
  533   2HG2  VAL  72          2HG2      VAL  72   2.240   5.269  -0.462
  534   3HG2  VAL  72          3HG2      VAL  72   2.988   4.885  -2.012
  535    H    ASP  73           H        ASP  73   1.514   7.829  -4.768
  536    HA   ASP  73           HA       ASP  73  -1.201   8.833  -5.093
  537   1HB   ASP  73          2HB       ASP  73   1.194   8.925  -6.954
  538   2HB   ASP  73          1HB       ASP  73  -0.345   9.739  -7.234
  539    H    PHE  74           H        PHE  74  -2.026   8.453  -7.508
  540    HA   PHE  74           HA       PHE  74  -2.753   5.723  -7.657
  541   1HB   PHE  74          2HB       PHE  74  -4.000   7.770  -8.595
  542   2HB   PHE  74          1HB       PHE  74  -2.931   7.620  -9.988
  543    HD1  PHE  74           HD1      PHE  74  -4.381   6.856 -11.681
  544    HD2  PHE  74           HD2      PHE  74  -4.318   4.880  -7.873
  545    HE1  PHE  74           HE1      PHE  74  -5.823   5.053 -12.595
  546    HE2  PHE  74           HE2      PHE  74  -5.756   3.076  -8.783
  547    HZ   PHE  74           HZ       PHE  74  -6.509   3.161 -11.144
  548    H    ASP  75           H        ASP  75  -0.094   7.492  -9.075
  549    HA   ASP  75           HA       ASP  75   0.520   5.732 -11.206
  550   1HB   ASP  75          2HB       ASP  75   1.987   7.859  -9.718
  551   2HB   ASP  75          1HB       ASP  75   2.941   6.724 -10.670
  552    H    GLU  76           H        GLU  76   2.080   6.019  -7.996
  553    HA   GLU  76           HA       GLU  76   3.473   3.531  -8.300
  554   1HB   GLU  76          2HB       GLU  76   3.988   3.834  -5.845
  555   2HB   GLU  76          1HB       GLU  76   4.508   5.126  -6.914
  556   1HG   GLU  76          2HG       GLU  76   2.021   6.018  -6.240
  557   2HG   GLU  76          1HG       GLU  76   2.491   5.172  -4.766
  558    H    PHE  77           H        PHE  77   0.284   4.278  -7.540
  559    HA   PHE  77           HA       PHE  77  -0.249   2.065  -5.762
  560   1HB   PHE  77          2HB       PHE  77  -1.637   4.137  -5.764
  561   2HB   PHE  77          1HB       PHE  77  -2.182   3.741  -7.393
  562    HD1  PHE  77           HD1      PHE  77  -3.765   1.957  -7.799
  563    HD2  PHE  77           HD2      PHE  77  -2.282   2.728  -3.836
  564    HE1  PHE  77           HE1      PHE  77  -5.523   0.486  -6.849
  565    HE2  PHE  77           HE2      PHE  77  -4.042   1.258  -2.892
  566    HZ   PHE  77           HZ       PHE  77  -5.661   0.136  -4.398
  567    H    LEU  78           H        LEU  78  -0.436   2.721  -9.238
  568    HA   LEU  78           HA       LEU  78  -1.806   0.265  -9.878
  569   1HB   LEU  78          2HB       LEU  78  -0.304   2.207 -11.621
  570   2HB   LEU  78          1HB       LEU  78  -1.256   0.864 -12.214
  571    HG   LEU  78           HG       LEU  78  -2.651   2.781 -10.421
  572   1HD1  LEU  78          1HD1      LEU  78  -1.231   4.225 -11.885
  573   2HD1  LEU  78          2HD1      LEU  78  -2.957   4.419 -12.196
  574   3HD1  LEU  78          3HD1      LEU  78  -1.965   3.462 -13.297
  575   1HD2  LEU  78          1HD2      LEU  78  -3.293   0.704 -12.233
  576   2HD2  LEU  78          2HD2      LEU  78  -3.880   2.196 -12.970
  577   3HD2  LEU  78          3HD2      LEU  78  -4.416   1.740 -11.352
  578    H    VAL  79           H        VAL  79   1.590   1.300  -9.822
  579    HA   VAL  79           HA       VAL  79   2.707  -0.808 -11.294
  580    HB   VAL  79           HB       VAL  79   4.788  -0.426  -9.929
  581   1HG1  VAL  79          1HG1      VAL  79   5.239   1.694 -10.950
  582   2HG1  VAL  79          2HG1      VAL  79   3.530   2.132 -10.940
  583   3HG1  VAL  79          3HG1      VAL  79   4.108   0.860 -12.016
  584   1HG2  VAL  79          1HG2      VAL  79   3.187   1.811  -8.680
  585   2HG2  VAL  79          2HG2      VAL  79   4.841   1.335  -8.303
  586   3HG2  VAL  79          3HG2      VAL  79   3.498   0.283  -7.859
  587    H    MET  80           H        MET  80   1.494  -0.739  -8.018
  588    HA   MET  80           HA       MET  80   2.660  -2.830  -6.721
  589   1HB   MET  80          2HB       MET  80  -0.077  -1.718  -6.772
  590   2HB   MET  80          1HB       MET  80   0.065  -3.347  -6.111
  591   1HG   MET  80          2HG       MET  80   2.065  -2.363  -4.756
  592   2HG   MET  80          1HG       MET  80   1.347  -0.800  -5.144
  593   1HE   MET  80          1HE       MET  80  -2.031  -0.725  -3.507
  594   2HE   MET  80          2HE       MET  80  -1.700  -1.156  -5.182
  595   3HE   MET  80          3HE       MET  80  -0.748   0.103  -4.400
  596    H    MET  81           H        MET  81   0.316  -3.085  -9.372
  597    HA   MET  81           HA       MET  81  -0.338  -5.779  -9.292
  598   1HB   MET  81          2HB       MET  81  -0.324  -3.679 -11.323
  599   2HB   MET  81          1HB       MET  81  -0.017  -5.274 -12.008
  600   1HG   MET  81          2HG       MET  81  -2.095  -5.596 -10.102
  601   2HG   MET  81          1HG       MET  81  -2.501  -4.175 -11.063
  602   1HE   MET  81          1HE       MET  81  -2.067  -8.514 -12.174
  603   2HE   MET  81          2HE       MET  81  -1.351  -7.615 -10.839
  604   3HE   MET  81          3HE       MET  81  -0.542  -7.645 -12.404
  605    H    VAL  82           H        VAL  82   2.274  -4.379 -11.299
  606    HA   VAL  82           HA       VAL  82   3.449  -6.971 -11.778
  607    HB   VAL  82           HB       VAL  82   5.189  -5.737 -12.994
  608   1HG1  VAL  82          1HG1      VAL  82   2.319  -4.915 -13.478
  609   2HG1  VAL  82          2HG1      VAL  82   3.206  -6.234 -14.242
  610   3HG1  VAL  82          3HG1      VAL  82   3.622  -4.560 -14.610
  611   1HG2  VAL  82          1HG2      VAL  82   3.786  -3.347 -11.782
  612   2HG2  VAL  82          2HG2      VAL  82   4.804  -3.216 -13.212
  613   3HG2  VAL  82          3HG2      VAL  82   5.496  -3.763 -11.685
  614    H    ARG  83           H        ARG  83   3.936  -4.410  -9.449
  615    HA   ARG  83           HA       ARG  83   6.593  -4.977  -8.666
  616   1HB   ARG  83          2HB       ARG  83   4.270  -3.841  -7.095
  617   2HB   ARG  83          1HB       ARG  83   5.919  -3.931  -6.477
  618   1HG   ARG  83          2HG       ARG  83   5.594  -2.721  -9.173
  619   2HG   ARG  83          1HG       ARG  83   4.975  -1.780  -7.816
  620   1HD   ARG  83          2HD       ARG  83   7.192  -2.086  -6.678
  621   2HD   ARG  83          1HD       ARG  83   7.788  -2.857  -8.144
  622    HE   ARG  83           HE       ARG  83   6.656  -0.242  -8.619
  623   1HH1  ARG  83          2HH1      ARG  83   9.511  -2.004  -7.640
  624   2HH1  ARG  83          1HH1      ARG  83  10.600  -0.747  -8.114
  625   1HH2  ARG  83          1HH2      ARG  83   8.103   1.393  -9.229
  626   2HH2  ARG  83          2HH2      ARG  83   9.807   1.172  -9.011
  627    H    CYS  84           H        CYS  84   3.654  -6.721  -8.188
  628    HA   CYS  84           HA       CYS  84   4.405  -8.146  -5.813
  629   1HB   CYS  84          2HB       CYS  84   2.036  -7.784  -6.875
  630   2HB   CYS  84          1HB       CYS  84   2.448  -9.213  -7.822
  631    HG   CYS  84           HG       CYS  84   2.985  -9.751  -4.902
  632    H    MET  85           H        MET  85   5.359  -8.364  -9.092
  633    HA   MET  85           HA       MET  85   5.663 -10.981  -9.743
  634   1HB   MET  85          2HB       MET  85   7.606 -10.369 -11.043
  635   2HB   MET  85          1HB       MET  85   6.450  -9.039 -11.094
  636   1HG   MET  85          2HG       MET  85   7.767  -8.075  -9.084
  637   2HG   MET  85          1HG       MET  85   9.030  -9.217  -9.538
  638   1HE   MET  85          1HE       MET  85   8.069  -5.316 -10.527
  639   2HE   MET  85          2HE       MET  85   9.797  -5.565 -10.290
  640   3HE   MET  85          3HE       MET  85   8.648  -6.269  -9.154
  641    H    LYS  86           H        LYS  86   7.642  -9.223  -7.370
  642    HA   LYS  86           HA       LYS  86   9.247 -11.624  -6.860
  643   1HB   LYS  86          2HB       LYS  86   9.507  -8.732  -6.254
  644   2HB   LYS  86          1HB       LYS  86  10.127  -9.835  -5.026
  645   1HG   LYS  86          2HG       LYS  86  10.827 -10.122  -7.955
  646   2HG   LYS  86          1HG       LYS  86  11.785  -9.139  -6.848
  647   1HD   LYS  86          2HD       LYS  86  11.112 -11.970  -6.097
  648   2HD   LYS  86          1HD       LYS  86  12.426 -11.664  -7.232
  649   1HE   LYS  86          2HE       LYS  86  13.731 -11.351  -5.410
  650   2HE   LYS  86          1HE       LYS  86  12.893  -9.813  -5.216
  651   1HZ   LYS  86          1HZ       LYS  86  11.379 -10.760  -3.711
  652   2HZ   LYS  86          2HZ       LYS  86  12.900 -11.342  -3.232
  653   3HZ   LYS  86          3HZ       LYS  86  11.839 -12.346  -4.098
  654    H    ASP  87           H        ASP  87   8.051 -13.081  -5.744
  655    HA   ASP  87           HA       ASP  87   6.795 -12.164  -3.218
  656   1HB   ASP  87          2HB       ASP  87   5.980 -14.345  -5.140
  657   2HB   ASP  87          1HB       ASP  87   5.410 -14.314  -3.473
  658    H    ASP  88           H        ASP  88   9.577 -12.858  -3.507
  659    HA   ASP  88           HA       ASP  88  11.214 -14.133  -2.528
  660   1HB   ASP  88          2HB       ASP  88   9.393 -13.592  -0.584
  661   2HB   ASP  88          1HB       ASP  88   9.390 -15.354  -0.542
  662    H    SER  89           HN       SER  89  10.052 -15.318  -4.749
  663    HA   SER  89           HA       SER  89   9.849 -18.178  -4.010
  664   1HB   SER  89          2HB       SER  89   8.913 -18.396  -6.383
  665   2HB   SER  89          1HB       SER  89   7.887 -17.593  -5.200
  666    HG   SER  89           HG       SER  89   8.102 -15.777  -6.261
  Start of MODEL   40
    1   1H    MET   1          1H        MET   1  14.673  -1.059 -17.385
    2   2H    MET   1          2H        MET   1  16.301  -0.653 -17.132
    3   3H    MET   1          3H        MET   1  15.314  -1.073 -15.816
    4    HA   MET   1           HA       MET   1  16.383  -2.819 -17.953
    5   1HB   MET   1          2HB       MET   1  16.595  -2.646 -14.953
    6   2HB   MET   1          1HB       MET   1  16.888  -4.177 -15.779
    7   1HG   MET   1          2HG       MET   1  18.650  -3.192 -17.117
    8   2HG   MET   1          1HG       MET   1  18.279  -1.583 -16.501
    9   1HE   MET   1          1HE       MET   1  21.708  -2.196 -14.964
   10   2HE   MET   1          2HE       MET   1  20.600  -0.873 -15.313
   11   3HE   MET   1          3HE       MET   1  20.922  -2.089 -16.544
   12    H    ASN   2           H        ASN   2  14.054  -2.693 -15.231
   13    HA   ASN   2           HA       ASN   2  12.875  -5.228 -15.785
   14   1HB   ASN   2          2HB       ASN   2  12.212  -2.901 -14.048
   15   2HB   ASN   2          1HB       ASN   2  10.898  -4.006 -14.451
   16   1HD2  ASN   2          1HD2      ASN   2  11.556  -6.457 -14.162
   17   2HD2  ASN   2          2HD2      ASN   2  12.483  -6.813 -12.786
   18    H    ASP   3           H        ASP   3  11.554  -5.789 -17.376
   19    HA   ASP   3           HA       ASP   3  10.130  -3.664 -18.859
   20   1HB   ASP   3          2HB       ASP   3  11.824  -5.384 -19.943
   21   2HB   ASP   3          1HB       ASP   3  10.411  -6.439 -19.933
   22    H    ILE   4           H        ILE   4   9.377  -5.465 -16.344
   23    HA   ILE   4           HA       ILE   4   7.064  -6.917 -17.240
   24    HB   ILE   4           HB       ILE   4   6.525  -7.177 -14.853
   25   1HG1  ILE   4          2HG1      ILE   4   8.479  -6.221 -13.316
   26   2HG1  ILE   4          1HG1      ILE   4   8.583  -5.009 -14.595
   27   1HG2  ILE   4          1HG2      ILE   4   8.480  -8.396 -16.154
   28   2HG2  ILE   4          2HG2      ILE   4   8.260  -8.650 -14.423
   29   3HG2  ILE   4          3HG2      ILE   4   9.496  -7.532 -15.000
   30   1HD1  ILE   4          1HD1      ILE   4   5.859  -5.671 -13.593
   31   2HD1  ILE   4          2HD1      ILE   4   6.520  -4.122 -14.111
   32   3HD1  ILE   4          3HD1      ILE   4   6.905  -4.754 -12.510
   33    H    TYR   5           H        TYR   5   7.699  -3.643 -16.210
   34    HA   TYR   5           HA       TYR   5   4.995  -2.896 -15.640
   35   1HB   TYR   5          2HB       TYR   5   7.366  -1.175 -16.435
   36   2HB   TYR   5          1HB       TYR   5   5.840  -0.580 -15.780
   37    HD1  TYR   5           HD1      TYR   5   5.094  -1.414 -13.477
   38    HD2  TYR   5           HD2      TYR   5   9.078  -1.952 -14.994
   39    HE1  TYR   5           HE1      TYR   5   5.911  -1.847 -11.178
   40    HE2  TYR   5           HE2      TYR   5   9.895  -2.383 -12.693
   41    HH   TYR   5           HH       TYR   5   8.642  -1.542 -10.108
   42    H    LYS   6           H        LYS   6   7.021  -2.967 -18.506
   43    HA   LYS   6           HA       LYS   6   5.222  -1.490 -20.200
   44   1HB   LYS   6          2HB       LYS   6   7.290  -3.485 -21.147
   45   2HB   LYS   6          1HB       LYS   6   6.658  -2.084 -22.009
   46   1HG   LYS   6          2HG       LYS   6   8.537  -2.126 -19.641
   47   2HG   LYS   6          1HG       LYS   6   8.800  -1.404 -21.229
   48   1HD   LYS   6          2HD       LYS   6   7.260   0.362 -20.798
   49   2HD   LYS   6          1HD       LYS   6   6.593  -0.465 -19.388
   50   1HE   LYS   6          2HE       LYS   6   8.393   0.082 -18.038
   51   2HE   LYS   6          1HE       LYS   6   9.518   0.175 -19.394
   52   1HZ   LYS   6          1HZ       LYS   6   8.997   2.364 -18.474
   53   2HZ   LYS   6          2HZ       LYS   6   7.352   2.132 -18.830
   54   3HZ   LYS   6          3HZ       LYS   6   8.491   2.232 -20.087
   55    H    ALA   7           H        ALA   7   5.871  -4.894 -19.539
   56    HA   ALA   7           HA       ALA   7   4.052  -5.982 -21.440
   57   1HB   ALA   7          1HB       ALA   7   4.526  -8.037 -20.500
   58   2HB   ALA   7          2HB       ALA   7   4.562  -7.397 -18.857
   59   3HB   ALA   7          3HB       ALA   7   5.928  -7.123 -19.939
   60    H    ALA   8           H        ALA   8   3.742  -4.837 -18.122
   61    HA   ALA   8           HA       ALA   8   1.138  -5.817 -17.577
   62   1HB   ALA   8          1HB       ALA   8   1.137  -4.308 -15.715
   63   2HB   ALA   8          2HB       ALA   8   2.388  -3.307 -16.451
   64   3HB   ALA   8          3HB       ALA   8   2.781  -4.927 -15.878
   65    H    VAL   9           H        VAL   9   2.352  -2.860 -19.091
   66    HA   VAL   9           HA       VAL   9   0.095  -1.262 -19.101
   67    HB   VAL   9           HB       VAL   9   2.360  -1.623 -21.037
   68   1HG1  VAL   9          1HG1      VAL   9  -0.056   0.175 -21.377
   69   2HG1  VAL   9          2HG1      VAL   9   0.570  -1.014 -22.520
   70   3HG1  VAL   9          3HG1      VAL   9   1.479   0.462 -22.196
   71   1HG2  VAL   9          1HG2      VAL   9   2.303  -0.362 -18.704
   72   2HG2  VAL   9          2HG2      VAL   9   1.575   0.924 -19.668
   73   3HG2  VAL   9          3HG2      VAL   9   3.181   0.319 -20.074
   74    H    GLU  10           H        GLU  10   0.963  -3.774 -21.479
   75    HA   GLU  10           HA       GLU  10  -1.380  -3.458 -23.072
   76   1HB   GLU  10          2HB       GLU  10   0.629  -5.702 -22.830
   77   2HB   GLU  10          1HB       GLU  10  -0.725  -5.747 -23.959
   78   1HG   GLU  10          2HG       GLU  10   1.187  -3.409 -23.877
   79   2HG   GLU  10          1HG       GLU  10   1.514  -4.838 -24.858
   80    H    GLN  11           H        GLN  11  -0.809  -5.063 -20.059
   81    HA   GLN  11           HA       GLN  11  -3.085  -6.869 -20.344
   82   1HB   GLN  11          2HB       GLN  11  -1.350  -6.333 -17.922
   83   2HB   GLN  11          1HB       GLN  11  -2.508  -7.649 -18.110
   84   1HG   GLN  11          2HG       GLN  11  -1.214  -8.614 -19.915
   85   2HG   GLN  11          1HG       GLN  11  -0.127  -7.225 -19.928
   86   1HE2  GLN  11          1HE2      GLN  11   1.836  -8.114 -19.175
   87   2HE2  GLN  11          2HE2      GLN  11   1.993  -8.957 -17.712
   88    H    LEU  12           H        LEU  12  -2.318  -3.776 -18.924
   89    HA   LEU  12           HA       LEU  12  -4.281  -3.500 -16.981
   90   1HB   LEU  12          2HB       LEU  12  -3.401  -1.334 -18.886
   91   2HB   LEU  12          1HB       LEU  12  -4.136  -1.108 -17.317
   92    HG   LEU  12           HG       LEU  12  -1.336  -1.943 -17.995
   93   1HD1  LEU  12          1HD1      LEU  12  -1.639   0.394 -17.587
   94   2HD1  LEU  12          2HD1      LEU  12  -0.924  -0.268 -16.117
   95   3HD1  LEU  12          3HD1      LEU  12  -2.650   0.086 -16.176
   96   1HD2  LEU  12          1HD2      LEU  12  -1.883  -3.669 -16.460
   97   2HD2  LEU  12          2HD2      LEU  12  -2.897  -2.600 -15.491
   98   3HD2  LEU  12          3HD2      LEU  12  -1.143  -2.418 -15.461
   99    H    THR  13           H        THR  13  -6.308  -4.149 -17.280
  100    HA   THR  13           HA       THR  13  -7.759  -3.393 -19.729
  101    HB   THR  13           HB       THR  13  -9.554  -4.859 -18.324
  102    HG1  THR  13           HG1      THR  13  -8.451  -6.493 -17.268
  103   1HG2  THR  13          1HG2      THR  13  -8.396  -6.862 -19.591
  104   2HG2  THR  13          2HG2      THR  13  -7.390  -5.580 -20.265
  105   3HG2  THR  13          3HG2      THR  13  -9.138  -5.545 -20.500
  106    H    ASP  14           H        ASP  14 -10.133  -2.816 -19.329
  107    HA   ASP  14           HA       ASP  14 -10.266  -0.389 -17.869
  108   1HB   ASP  14          2HB       ASP  14 -12.459  -2.153 -18.992
  109   2HB   ASP  14          1HB       ASP  14 -12.745  -0.565 -18.280
  110    H    GLU  15           H        GLU  15 -11.053  -3.710 -17.114
  111    HA   GLU  15           HA       GLU  15 -12.511  -3.224 -14.713
  112   1HB   GLU  15          2HB       GLU  15 -12.345  -5.589 -14.354
  113   2HB   GLU  15          1HB       GLU  15 -12.576  -5.336 -16.081
  114   1HG   GLU  15          2HG       GLU  15  -9.994  -5.398 -16.234
  115   2HG   GLU  15          1HG       GLU  15 -10.053  -6.112 -14.623
  116    H    GLN  16           H        GLN  16  -9.113  -3.906 -15.454
  117    HA   GLN  16           HA       GLN  16  -8.181  -4.138 -12.782
  118   1HB   GLN  16          2HB       GLN  16  -6.806  -3.411 -15.372
  119   2HB   GLN  16          1HB       GLN  16  -5.938  -3.487 -13.838
  120   1HG   GLN  16          2HG       GLN  16  -7.675  -5.812 -14.506
  121   2HG   GLN  16          1HG       GLN  16  -6.200  -5.628 -15.455
  122   1HE2  GLN  16          1HE2      GLN  16  -4.192  -6.091 -14.425
  123   2HE2  GLN  16          2HE2      GLN  16  -4.072  -6.588 -12.806
  124    H    LYS  17           H        LYS  17  -8.142  -1.378 -15.058
  125    HA   LYS  17           HA       LYS  17  -7.054   0.515 -13.279
  126   1HB   LYS  17          2HB       LYS  17  -8.913   0.838 -15.642
  127   2HB   LYS  17          1HB       LYS  17  -8.251   2.207 -14.749
  128   1HG   LYS  17          2HG       LYS  17  -6.260   2.017 -15.787
  129   2HG   LYS  17          1HG       LYS  17  -6.164   0.298 -15.409
  130   1HD   LYS  17          2HD       LYS  17  -6.304   0.133 -17.700
  131   2HD   LYS  17          1HD       LYS  17  -8.028   0.178 -17.333
  132   1HE   LYS  17          2HE       LYS  17  -8.005   1.890 -18.858
  133   2HE   LYS  17          1HE       LYS  17  -7.530   2.833 -17.445
  134   1HZ   LYS  17          1HZ       LYS  17  -6.030   3.251 -19.266
  135   2HZ   LYS  17          2HZ       LYS  17  -5.697   1.594 -19.429
  136   3HZ   LYS  17          3HZ       LYS  17  -5.202   2.430 -18.035
  137    H    ASN  18           H        ASN  18 -10.366  -0.604 -13.789
  138    HA   ASN  18           HA       ASN  18 -11.675   1.345 -12.190
  139   1HB   ASN  18          2HB       ASN  18 -12.390  -1.126 -13.550
  140   2HB   ASN  18          1HB       ASN  18 -13.177  -1.005 -11.977
  141   1HD2  ASN  18          1HD2      ASN  18 -13.044   0.370 -15.205
  142   2HD2  ASN  18          2HD2      ASN  18 -14.309   1.480 -14.986
  143    H    GLU  19           H        GLU  19 -10.175  -1.779 -11.463
  144    HA   GLU  19           HA       GLU  19 -11.080  -2.030  -8.783
  145   1HB   GLU  19          2HB       GLU  19  -8.578  -3.111 -10.114
  146   2HB   GLU  19          1HB       GLU  19  -9.143  -3.581  -8.510
  147   1HG   GLU  19          2HG       GLU  19 -11.205  -3.736 -10.609
  148   2HG   GLU  19          1HG       GLU  19  -9.854  -4.845 -10.837
  149    H    PHE  20           H        PHE  20  -7.952  -0.925 -10.097
  150    HA   PHE  20           HA       PHE  20  -6.891  -0.075  -7.606
  151   1HB   PHE  20          2HB       PHE  20  -6.179   0.788 -10.417
  152   2HB   PHE  20          1HB       PHE  20  -5.237   1.178  -8.979
  153    HD1  PHE  20           HD1      PHE  20  -5.722  -1.173 -11.586
  154    HD2  PHE  20           HD2      PHE  20  -4.557  -0.869  -7.465
  155    HE1  PHE  20           HE1      PHE  20  -4.590  -3.367 -11.745
  156    HE2  PHE  20           HE2      PHE  20  -3.414  -3.064  -7.625
  157    HZ   PHE  20           HZ       PHE  20  -3.435  -4.314  -9.769
  158    H    LYS  21           H        LYS  21  -8.604   1.684 -10.186
  159    HA   LYS  21           HA       LYS  21  -8.315   4.279  -9.139
  160   1HB   LYS  21          2HB       LYS  21  -9.182   3.724 -11.434
  161   2HB   LYS  21          1HB       LYS  21 -10.710   3.261 -10.685
  162   1HG   LYS  21          2HG       LYS  21 -10.759   5.603 -11.507
  163   2HG   LYS  21          1HG       LYS  21 -10.966   5.518  -9.758
  164   1HD   LYS  21          2HD       LYS  21  -8.810   6.319  -9.327
  165   2HD   LYS  21          1HD       LYS  21  -8.211   5.844 -10.917
  166   1HE   LYS  21          2HE       LYS  21 -10.141   7.603 -11.654
  167   2HE   LYS  21          1HE       LYS  21  -9.669   8.297 -10.104
  168   1HZ   LYS  21          1HZ       LYS  21  -7.768   7.576 -12.268
  169   2HZ   LYS  21          2HZ       LYS  21  -7.401   8.381 -10.818
  170   3HZ   LYS  21          3HZ       LYS  21  -8.360   9.141 -11.995
  171    H    ALA  22           H        ALA  22 -10.924   1.888  -8.667
  172    HA   ALA  22           HA       ALA  22 -12.469   3.504  -6.908
  173   1HB   ALA  22          1HB       ALA  22 -12.347   0.488  -7.148
  174   2HB   ALA  22          2HB       ALA  22 -13.445   1.556  -8.023
  175   3HB   ALA  22          3HB       ALA  22 -13.583   1.392  -6.274
  176    H    ALA  23           H        ALA  23 -10.004   0.998  -6.365
  177    HA   ALA  23           HA       ALA  23 -10.093   0.987  -3.536
  178   1HB   ALA  23          1HB       ALA  23  -8.963  -0.782  -4.808
  179   2HB   ALA  23          2HB       ALA  23  -7.847  -0.033  -3.668
  180   3HB   ALA  23          3HB       ALA  23  -7.765   0.379  -5.381
  181    H    PHE  24           H        PHE  24  -8.697   3.203  -5.822
  182    HA   PHE  24           HA       PHE  24  -6.935   4.464  -3.883
  183   1HB   PHE  24          2HB       PHE  24  -6.629   4.226  -6.491
  184   2HB   PHE  24          1HB       PHE  24  -7.634   5.672  -6.541
  185    HD1  PHE  24           HD1      PHE  24  -6.804   7.806  -5.771
  186    HD2  PHE  24           HD2      PHE  24  -4.437   4.249  -5.333
  187    HE1  PHE  24           HE1      PHE  24  -4.826   9.192  -5.212
  188    HE2  PHE  24           HE2      PHE  24  -2.460   5.634  -4.770
  189    HZ   PHE  24           HZ       PHE  24  -2.654   8.106  -4.710
  190    H    ASP  25           H        ASP  25  -9.731   5.492  -5.863
  191    HA   ASP  25           HA       ASP  25 -10.130   8.001  -4.739
  192   1HB   ASP  25          2HB       ASP  25 -11.913   6.066  -6.156
  193   2HB   ASP  25          1HB       ASP  25 -12.639   7.476  -5.385
  194    H    ILE  26           H        ILE  26 -11.376   4.860  -3.565
  195    HA   ILE  26           HA       ILE  26 -13.209   5.818  -1.683
  196    HB   ILE  26           HB       ILE  26 -12.761   3.716  -0.407
  197   1HG1  ILE  26          2HG1      ILE  26 -10.655   3.305  -2.557
  198   2HG1  ILE  26          1HG1      ILE  26 -10.333   3.579  -0.848
  199   1HG2  ILE  26          1HG2      ILE  26 -13.074   2.281  -2.695
  200   2HG2  ILE  26          2HG2      ILE  26 -13.439   3.902  -3.284
  201   3HG2  ILE  26          3HG2      ILE  26 -14.365   3.218  -1.947
  202   1HD1  ILE  26          1HD1      ILE  26 -10.209   1.218  -1.151
  203   2HD1  ILE  26          2HD1      ILE  26 -11.682   1.195  -2.121
  204   3HD1  ILE  26          3HD1      ILE  26 -11.771   1.517  -0.389
  205    H    PHE  27           H        PHE  27  -9.700   5.555  -1.499
  206    HA   PHE  27           HA       PHE  27  -9.639   6.440   1.281
  207   1HB   PHE  27          2HB       PHE  27  -7.631   5.452  -0.689
  208   2HB   PHE  27          1HB       PHE  27  -7.062   6.512   0.601
  209    HD1  PHE  27           HD1      PHE  27  -7.072   5.804   2.917
  210    HD2  PHE  27           HD2      PHE  27  -8.702   3.281  -0.155
  211    HE1  PHE  27           HE1      PHE  27  -7.142   3.905   4.511
  212    HE2  PHE  27           HE2      PHE  27  -8.772   1.384   1.440
  213    HZ   PHE  27           HZ       PHE  27  -7.992   1.696   3.772
  214    H    ILE  28           H        ILE  28  -9.164   7.755  -1.954
  215    HA   ILE  28           HA       ILE  28  -8.185  10.303  -0.880
  216    HB   ILE  28           HB       ILE  28  -8.730   9.716  -3.788
  217   1HG1  ILE  28          2HG1      ILE  28  -7.274   7.942  -3.300
  218   2HG1  ILE  28          1HG1      ILE  28  -6.182   9.222  -3.802
  219   1HG2  ILE  28          1HG2      ILE  28  -7.163  11.722  -2.209
  220   2HG2  ILE  28          2HG2      ILE  28  -8.213  11.971  -3.603
  221   3HG2  ILE  28          3HG2      ILE  28  -6.604  11.283  -3.823
  222   1HD1  ILE  28          1HD1      ILE  28  -6.719   8.199  -1.021
  223   2HD1  ILE  28          2HD1      ILE  28  -6.079   9.825  -1.268
  224   3HD1  ILE  28          3HD1      ILE  28  -5.171   8.420  -1.837
  225    H    GLN  29           H        GLN  29 -10.876   9.523  -0.211
  226    HA   GLN  29           HA       GLN  29 -12.768  10.864  -1.882
  227   1HB   GLN  29          2HB       GLN  29 -14.259  10.740   0.165
  228   2HB   GLN  29          1HB       GLN  29 -13.643   9.194  -0.411
  229   1HG   GLN  29          2HG       GLN  29 -12.180   8.951   1.383
  230   2HG   GLN  29          1HG       GLN  29 -12.077  10.687   1.669
  231   1HE2  GLN  29          1HE2      GLN  29 -12.986  11.092   3.688
  232   2HE2  GLN  29          2HE2      GLN  29 -14.445  10.427   4.245
  233    H    ASP  30           H        ASP  30 -10.718  11.836   0.798
  234    HA   ASP  30           HA       ASP  30 -11.216  14.633   0.197
  235   1HB   ASP  30          2HB       ASP  30 -12.885  13.661   2.051
  236   2HB   ASP  30          1HB       ASP  30 -11.494  13.971   3.091
  237    H    ALA  31           H        ALA  31  -8.930  13.089  -0.194
  238    HA   ALA  31           HA       ALA  31  -7.080  13.277   1.977
  239   1HB   ALA  31          1HB       ALA  31  -6.456  13.069  -0.976
  240   2HB   ALA  31          2HB       ALA  31  -6.849  11.690   0.049
  241   3HB   ALA  31          3HB       ALA  31  -5.396  12.637   0.367
  242    H    GLU  32           H        GLU  32  -5.174  14.614   2.036
  243    HA   GLU  32           HA       GLU  32  -5.773  17.387   1.491
  244   1HB   GLU  32          2HB       GLU  32  -3.278  16.089   2.616
  245   2HB   GLU  32          1HB       GLU  32  -3.579  17.826   2.555
  246   1HG   GLU  32          2HG       GLU  32  -5.487  17.622   4.021
  247   2HG   GLU  32          1HG       GLU  32  -5.422  15.861   3.943
  248    H    ASP  33           H        ASP  33  -3.329  15.055   0.371
  249    HA   ASP  33           HA       ASP  33  -2.492  16.938  -1.732
  250   1HB   ASP  33          2HB       ASP  33  -0.787  15.748  -0.279
  251   2HB   ASP  33          1HB       ASP  33  -1.263  14.253  -1.084
  252    H    GLY  34           H        GLY  34  -3.851  13.695  -1.281
  253   1HA   GLY  34          2HA       GLY  34  -5.581  13.023  -2.920
  254   2HA   GLY  34          1HA       GLY  34  -4.506  13.630  -4.174
  255    H    CYS  35           H        CYS  35  -3.707  11.670  -1.319
  256    HA   CYS  35           HA       CYS  35  -3.331   9.260  -2.891
  257   1HB   CYS  35          2HB       CYS  35  -0.865   9.262  -1.774
  258   2HB   CYS  35          1HB       CYS  35  -1.183   9.798  -3.419
  259    HG   CYS  35           HG       CYS  35  -0.958  11.789  -1.008
  260    H    ILE  36           H        ILE  36  -2.301   7.508  -1.441
  261    HA   ILE  36           HA       ILE  36  -3.588   7.717   1.210
  262    HB   ILE  36           HB       ILE  36  -3.480   5.259   1.267
  263   1HG1  ILE  36          2HG1      ILE  36  -2.926   4.501  -1.345
  264   2HG1  ILE  36          1HG1      ILE  36  -1.695   5.718  -1.012
  265   1HG2  ILE  36          1HG2      ILE  36  -5.293   4.935  -0.150
  266   2HG2  ILE  36          2HG2      ILE  36  -4.593   5.912  -1.440
  267   3HG2  ILE  36          3HG2      ILE  36  -5.286   6.694  -0.021
  268   1HD1  ILE  36          1HD1      ILE  36  -2.293   3.280   0.691
  269   2HD1  ILE  36          2HD1      ILE  36  -1.111   4.526   1.089
  270   3HD1  ILE  36          3HD1      ILE  36  -0.876   3.510  -0.335
  271    H    SER  37           H        SER  37  -2.393   6.308   2.925
  272    HA   SER  37           HA       SER  37   0.362   7.300   3.023
  273   1HB   SER  37          2HB       SER  37  -1.207   7.674   4.948
  274   2HB   SER  37          1HB       SER  37  -1.227   5.932   5.205
  275    HG   SER  37           HG       SER  37   0.632   7.760   5.913
  276    H    THR  38           H        THR  38   2.139   6.025   3.171
  277    HA   THR  38           HA       THR  38   2.184   3.477   2.019
  278    HB   THR  38           HB       THR  38   4.273   4.592   2.089
  279    HG1  THR  38           HG1      THR  38   5.550   3.067   3.017
  280   1HG2  THR  38          1HG2      THR  38   4.842   6.000   3.744
  281   2HG2  THR  38          2HG2      THR  38   4.917   4.661   4.891
  282   3HG2  THR  38          3HG2      THR  38   3.396   5.511   4.630
  283    H    LYS  39           H        LYS  39   1.892   4.444   5.404
  284    HA   LYS  39           HA       LYS  39   2.122   1.860   6.556
  285   1HB   LYS  39          2HB       LYS  39   1.212   4.540   7.440
  286   2HB   LYS  39          1HB       LYS  39   0.560   3.168   8.337
  287   1HG   LYS  39          2HG       LYS  39   3.502   3.670   7.802
  288   2HG   LYS  39          1HG       LYS  39   2.678   3.969   9.334
  289   1HD   LYS  39          2HD       LYS  39   1.920   1.398   8.832
  290   2HD   LYS  39          1HD       LYS  39   3.536   1.415   8.124
  291   1HE   LYS  39          2HE       LYS  39   4.576   1.893  10.159
  292   2HE   LYS  39          1HE       LYS  39   3.122   2.617  10.846
  293   1HZ   LYS  39          1HZ       LYS  39   2.117   0.438  10.973
  294   2HZ   LYS  39          2HZ       LYS  39   3.602   0.437  11.799
  295   3HZ   LYS  39          3HZ       LYS  39   3.483  -0.273  10.259
  296    H    GLU  40           H        GLU  40  -0.573   3.681   5.235
  297    HA   GLU  40           HA       GLU  40  -2.565   1.753   6.095
  298   1HB   GLU  40          2HB       GLU  40  -2.655   4.311   4.517
  299   2HB   GLU  40          1HB       GLU  40  -4.052   3.237   4.584
  300   1HG   GLU  40          2HG       GLU  40  -4.133   3.384   6.999
  301   2HG   GLU  40          1HG       GLU  40  -2.619   4.288   7.038
  302    H    LEU  41           H        LEU  41  -0.297   1.365   3.823
  303    HA   LEU  41           HA       LEU  41  -1.662   0.779   1.432
  304   1HB   LEU  41          2HB       LEU  41   0.894   0.864   1.985
  305   2HB   LEU  41          1HB       LEU  41   0.690  -0.839   2.328
  306    HG   LEU  41           HG       LEU  41   1.519  -0.328   0.024
  307   1HD1  LEU  41          1HD1      LEU  41  -0.122  -2.302   0.836
  308   2HD1  LEU  41          2HD1      LEU  41   0.443  -2.165  -0.827
  309   3HD1  LEU  41          3HD1      LEU  41  -1.154  -1.563  -0.387
  310   1HD2  LEU  41          1HD2      LEU  41  -1.257   0.469  -0.746
  311   2HD2  LEU  41          2HD2      LEU  41   0.277   0.875  -1.513
  312   3HD2  LEU  41          3HD2      LEU  41  -0.213   1.700  -0.034
  313    H    GLY  42           H        GLY  42  -0.973  -1.229   4.288
  314   1HA   GLY  42          2HA       GLY  42  -1.936  -3.686   3.283
  315   2HA   GLY  42          1HA       GLY  42  -1.842  -3.248   4.985
  316    H    LYS  43           H        LYS  43  -3.632  -0.817   4.220
  317    HA   LYS  43           HA       LYS  43  -6.140  -2.142   4.820
  318   1HB   LYS  43          2HB       LYS  43  -5.245   0.135   5.742
  319   2HB   LYS  43          1HB       LYS  43  -5.881   0.791   4.234
  320   1HG   LYS  43          2HG       LYS  43  -7.740   0.983   5.604
  321   2HG   LYS  43          1HG       LYS  43  -8.028  -0.604   4.894
  322   1HD   LYS  43          2HD       LYS  43  -7.490  -1.726   6.843
  323   2HD   LYS  43          1HD       LYS  43  -6.395  -0.459   7.397
  324   1HE   LYS  43          2HE       LYS  43  -8.409   1.017   7.749
  325   2HE   LYS  43          1HE       LYS  43  -9.424  -0.380   7.397
  326   1HZ   LYS  43          1HZ       LYS  43  -9.074  -0.098   9.775
  327   2HZ   LYS  43          2HZ       LYS  43  -7.394  -0.227   9.560
  328   3HZ   LYS  43          3HZ       LYS  43  -8.400  -1.556   9.232
  329    H    VAL  44           H        VAL  44  -4.763  -0.235   2.137
  330    HA   VAL  44           HA       VAL  44  -7.134  -0.218   0.564
  331    HB   VAL  44           HB       VAL  44  -5.597   0.346  -1.344
  332   1HG1  VAL  44          1HG1      VAL  44  -6.423   2.230  -0.243
  333   2HG1  VAL  44          2HG1      VAL  44  -4.681   2.461  -0.102
  334   3HG1  VAL  44          3HG1      VAL  44  -5.600   1.834   1.266
  335   1HG2  VAL  44          1HG2      VAL  44  -3.639  -0.963  -0.446
  336   2HG2  VAL  44          2HG2      VAL  44  -3.451   0.279   0.794
  337   3HG2  VAL  44          3HG2      VAL  44  -3.241   0.692  -0.908
  338    H    MET  45           H        MET  45  -4.441  -2.481   0.852
  339    HA   MET  45           HA       MET  45  -5.014  -4.060  -1.432
  340   1HB   MET  45          2HB       MET  45  -3.797  -5.070   1.149
  341   2HB   MET  45          1HB       MET  45  -3.607  -5.750  -0.466
  342   1HG   MET  45          2HG       MET  45  -2.817  -2.904  -0.156
  343   2HG   MET  45          1HG       MET  45  -1.788  -4.087   0.648
  344   1HE   MET  45          1HE       MET  45  -2.685  -3.352  -3.697
  345   2HE   MET  45          2HE       MET  45  -3.607  -2.934  -2.253
  346   3HE   MET  45          3HE       MET  45  -3.788  -4.532  -2.974
  347    H    ARG  46           H        ARG  46  -6.264  -4.050   1.853
  348    HA   ARG  46           HA       ARG  46  -7.603  -6.532   1.837
  349   1HB   ARG  46          2HB       ARG  46  -7.798  -4.022   3.410
  350   2HB   ARG  46          1HB       ARG  46  -9.218  -5.066   3.426
  351   1HG   ARG  46          2HG       ARG  46  -6.688  -6.531   3.750
  352   2HG   ARG  46          1HG       ARG  46  -7.005  -5.378   5.047
  353   1HD   ARG  46          2HD       ARG  46  -8.059  -7.391   5.742
  354   2HD   ARG  46          1HD       ARG  46  -9.362  -6.363   5.155
  355    HE   ARG  46           HE       ARG  46  -8.319  -8.087   3.097
  356   1HH1  ARG  46          2HH1      ARG  46 -10.452  -7.922   5.859
  357   2HH1  ARG  46          1HH1      ARG  46 -11.477  -9.199   5.299
  358   1HH2  ARG  46          1HH2      ARG  46  -9.677  -9.755   2.383
  359   2HH2  ARG  46          2HH2      ARG  46 -11.041 -10.235   3.337
  360    H    MET  47           H        MET  47  -8.604  -3.309   0.748
  361    HA   MET  47           HA       MET  47 -11.285  -4.099   0.065
  362   1HB   MET  47          2HB       MET  47  -9.603  -1.660  -0.359
  363   2HB   MET  47          1HB       MET  47 -11.049  -1.874  -1.345
  364   1HG   MET  47          2HG       MET  47 -12.061  -0.850   0.433
  365   2HG   MET  47          1HG       MET  47 -12.068  -2.488   1.084
  366   1HE   MET  47          1HE       MET  47 -10.949  -1.523   4.415
  367   2HE   MET  47          2HE       MET  47 -11.543  -2.813   3.373
  368   3HE   MET  47          3HE       MET  47 -12.390  -1.269   3.421
  369    H    LEU  48           H        LEU  48  -8.216  -3.790  -1.670
  370    HA   LEU  48           HA       LEU  48  -9.228  -4.130  -4.298
  371   1HB   LEU  48          2HB       LEU  48  -6.850  -3.433  -3.366
  372   2HB   LEU  48          1HB       LEU  48  -6.528  -5.143  -3.543
  373    HG   LEU  48           HG       LEU  48  -7.234  -4.910  -5.970
  374   1HD1  LEU  48          1HD1      LEU  48  -6.871  -1.953  -5.423
  375   2HD1  LEU  48          2HD1      LEU  48  -8.456  -2.718  -5.533
  376   3HD1  LEU  48          3HD1      LEU  48  -7.381  -2.715  -6.929
  377   1HD2  LEU  48          1HD2      LEU  48  -4.840  -3.659  -4.685
  378   2HD2  LEU  48          2HD2      LEU  48  -5.060  -3.433  -6.420
  379   3HD2  LEU  48          3HD2      LEU  48  -4.934  -5.060  -5.753
  380    H    GLY  49           H        GLY  49  -7.852  -6.450  -1.966
  381   1HA   GLY  49          2HA       GLY  49  -9.243  -8.616  -1.974
  382   2HA   GLY  49          1HA       GLY  49  -8.778  -8.683  -3.670
  383    H    GLN  50           H        GLN  50  -7.002  -7.856  -0.684
  384    HA   GLN  50           HA       GLN  50  -5.312 -10.210  -0.900
  385   1HB   GLN  50          2HB       GLN  50  -4.425  -7.552  -1.840
  386   2HB   GLN  50          1HB       GLN  50  -3.319  -8.355  -0.726
  387   1HG   GLN  50          2HG       GLN  50  -3.767 -10.454  -2.257
  388   2HG   GLN  50          1HG       GLN  50  -4.241  -9.238  -3.444
  389   1HE2  GLN  50          1HE2      GLN  50  -2.576  -7.855  -4.323
  390   2HE2  GLN  50          2HE2      GLN  50  -0.929  -8.118  -4.013
  391    H    ASN  51           H        ASN  51  -3.898 -10.462   0.944
  392    HA   ASN  51           HA       ASN  51  -4.301  -8.598   3.171
  393   1HB   ASN  51          2HB       ASN  51  -6.041 -10.598   3.099
  394   2HB   ASN  51          1HB       ASN  51  -4.691 -11.499   3.787
  395   1HD2  ASN  51          1HD2      ASN  51  -3.693 -10.523   5.824
  396   2HD2  ASN  51          2HD2      ASN  51  -4.701  -9.637   6.862
  397    HA   PRO  52           HA       PRO  52  -0.033 -10.349   3.056
  398   1HB   PRO  52          2HB       PRO  52   1.253  -7.945   2.860
  399   2HB   PRO  52          1HB       PRO  52   0.670  -8.857   1.462
  400   1HG   PRO  52          2HG       PRO  52  -0.401  -6.388   2.674
  401   2HG   PRO  52          1HG       PRO  52  -0.562  -6.989   1.018
  402   1HD   PRO  52          2HD       PRO  52  -2.522  -7.134   3.086
  403   2HD   PRO  52          1HD       PRO  52  -2.599  -7.907   1.486
  404    H    THR  53           H        THR  53   1.983  -9.114   4.350
  405    HA   THR  53           HA       THR  53   0.969  -8.769   7.107
  406    HB   THR  53           HB       THR  53   3.031  -9.605   7.897
  407    HG1  THR  53           HG1      THR  53   4.815  -9.851   6.401
  408   1HG2  THR  53          1HG2      THR  53   3.443 -11.675   6.609
  409   2HG2  THR  53          2HG2      THR  53   2.470 -11.028   5.289
  410   3HG2  THR  53          3HG2      THR  53   1.722 -11.379   6.848
  411    HA   PRO  54           HA       PRO  54   2.423  -4.617   7.265
  412   1HB   PRO  54          2HB       PRO  54   3.805  -4.471   9.629
  413   2HB   PRO  54          1HB       PRO  54   2.039  -4.533   9.512
  414   1HG   PRO  54          2HG       PRO  54   3.961  -6.685  10.252
  415   2HG   PRO  54          1HG       PRO  54   2.309  -6.401  10.825
  416   1HD   PRO  54          2HD       PRO  54   3.012  -8.314   8.937
  417   2HD   PRO  54          1HD       PRO  54   1.379  -7.633   9.117
  418    H    GLU  55           H        GLU  55   4.910  -7.060   7.768
  419    HA   GLU  55           HA       GLU  55   7.090  -5.237   7.122
  420   1HB   GLU  55          2HB       GLU  55   8.513  -7.271   7.254
  421   2HB   GLU  55          1HB       GLU  55   7.564  -7.013   8.713
  422   1HG   GLU  55          2HG       GLU  55   5.967  -8.701   8.059
  423   2HG   GLU  55          1HG       GLU  55   6.702  -8.851   6.464
  424    H    GLU  56           H        GLU  56   5.097  -7.647   5.535
  425    HA   GLU  56           HA       GLU  56   6.694  -7.922   3.178
  426   1HB   GLU  56          2HB       GLU  56   4.904  -9.541   4.026
  427   2HB   GLU  56          1HB       GLU  56   3.722  -8.417   3.357
  428   1HG   GLU  56          2HG       GLU  56   5.380  -8.626   1.234
  429   2HG   GLU  56          1HG       GLU  56   5.632 -10.216   1.956
  430    H    LEU  57           H        LEU  57   3.597  -6.197   3.796
  431    HA   LEU  57           HA       LEU  57   3.452  -4.962   1.271
  432   1HB   LEU  57          2HB       LEU  57   1.844  -3.445   2.254
  433   2HB   LEU  57          1HB       LEU  57   1.539  -5.087   2.768
  434    HG   LEU  57           HG       LEU  57   3.026  -4.249   4.858
  435   1HD1  LEU  57          1HD1      LEU  57   1.772  -1.804   3.611
  436   2HD1  LEU  57          2HD1      LEU  57   3.408  -1.999   4.239
  437   3HD1  LEU  57          3HD1      LEU  57   2.043  -1.902   5.350
  438   1HD2  LEU  57          1HD2      LEU  57   0.637  -5.189   4.705
  439   2HD2  LEU  57          2HD2      LEU  57   0.104  -3.511   4.631
  440   3HD2  LEU  57          3HD2      LEU  57   0.971  -4.098   6.049
  441    H    GLN  58           H        GLN  58   5.103  -3.986   4.236
  442    HA   GLN  58           HA       GLN  58   5.655  -1.315   3.642
  443   1HB   GLN  58          2HB       GLN  58   6.173  -2.579   5.804
  444   2HB   GLN  58          1HB       GLN  58   7.643  -3.128   5.004
  445   1HG   GLN  58          2HG       GLN  58   8.202  -1.134   6.245
  446   2HG   GLN  58          1HG       GLN  58   8.188  -0.703   4.536
  447   1HE2  GLN  58          1HE2      GLN  58   6.388   0.625   3.746
  448   2HE2  GLN  58          2HE2      GLN  58   5.372   1.451   4.826
  449    H    GLU  59           H        GLU  59   7.625  -4.197   2.881
  450    HA   GLU  59           HA       GLU  59   9.684  -2.836   1.508
  451   1HB   GLU  59          2HB       GLU  59   8.677  -5.678   1.338
  452   2HB   GLU  59          1HB       GLU  59  10.041  -5.103   0.380
  453   1HG   GLU  59          2HG       GLU  59  10.009  -4.599   3.343
  454   2HG   GLU  59          1HG       GLU  59  10.474  -6.190   2.740
  455    H    MET  60           H        MET  60   6.587  -4.155   0.400
  456    HA   MET  60           HA       MET  60   7.018  -3.811  -2.380
  457   1HB   MET  60          2HB       MET  60   4.472  -3.888  -0.746
  458   2HB   MET  60          1HB       MET  60   4.493  -3.816  -2.508
  459   1HG   MET  60          2HG       MET  60   5.639  -5.920  -2.665
  460   2HG   MET  60          1HG       MET  60   5.951  -5.949  -0.930
  461   1HE   MET  60          1HE       MET  60   3.254  -8.685  -2.299
  462   2HE   MET  60          2HE       MET  60   4.971  -8.294  -2.322
  463   3HE   MET  60          3HE       MET  60   3.901  -7.600  -3.538
  464    H    ILE  61           H        ILE  61   5.558  -1.691   0.085
  465    HA   ILE  61           HA       ILE  61   4.704   0.387  -1.577
  466    HB   ILE  61           HB       ILE  61   5.755   0.479   1.256
  467   1HG1  ILE  61          2HG1      ILE  61   2.897   0.876   0.586
  468   2HG1  ILE  61          1HG1      ILE  61   3.523  -0.751   0.328
  469   1HG2  ILE  61          1HG2      ILE  61   4.179   2.634   1.100
  470   2HG2  ILE  61          2HG2      ILE  61   4.716   2.586  -0.579
  471   3HG2  ILE  61          3HG2      ILE  61   5.901   2.704   0.723
  472   1HD1  ILE  61          1HD1      ILE  61   4.275  -0.904   2.607
  473   2HD1  ILE  61          2HD1      ILE  61   2.603  -0.348   2.645
  474   3HD1  ILE  61          3HD1      ILE  61   3.919   0.796   2.897
  475    H    ASP  62           H        ASP  62   7.609   0.606   0.484
  476    HA   ASP  62           HA       ASP  62   8.826   2.769  -0.680
  477   1HB   ASP  62          2HB       ASP  62   9.583   1.317   1.338
  478   2HB   ASP  62          1HB       ASP  62  10.508   0.414   0.138
  479    H    GLU  63           H        GLU  63   8.903  -0.583  -1.847
  480    HA   GLU  63           HA       GLU  63  10.901  -0.254  -3.824
  481   1HB   GLU  63          2HB       GLU  63   8.674  -2.216  -3.404
  482   2HB   GLU  63          1HB       GLU  63   9.552  -2.216  -4.934
  483   1HG   GLU  63          2HG       GLU  63  11.247  -2.080  -2.506
  484   2HG   GLU  63          1HG       GLU  63  10.369  -3.592  -2.730
  485    H    VAL  64           H        VAL  64   7.342   0.016  -4.026
  486    HA   VAL  64           HA       VAL  64   7.458   0.812  -6.816
  487    HB   VAL  64           HB       VAL  64   5.042   1.024  -6.697
  488   1HG1  VAL  64          1HG1      VAL  64   5.934  -1.413  -5.140
  489   2HG1  VAL  64          2HG1      VAL  64   6.098  -1.236  -6.886
  490   3HG1  VAL  64          3HG1      VAL  64   4.497  -1.268  -6.150
  491   1HG2  VAL  64          1HG2      VAL  64   5.014   2.027  -4.381
  492   2HG2  VAL  64          2HG2      VAL  64   5.283   0.405  -3.739
  493   3HG2  VAL  64          3HG2      VAL  64   3.809   0.764  -4.636
  494    H    ASP  65           H        ASP  65   7.444   2.429  -3.729
  495    HA   ASP  65           HA       ASP  65   6.297   4.880  -4.326
  496   1HB   ASP  65          2HB       ASP  65   7.600   3.870  -2.158
  497   2HB   ASP  65          1HB       ASP  65   8.782   5.038  -2.742
  498    H    GLU  66           H        GLU  66   6.644   5.925  -6.146
  499    HA   GLU  66           HA       GLU  66   8.798   5.906  -7.842
  500   1HB   GLU  66          2HB       GLU  66   6.763   8.034  -7.255
  501   2HB   GLU  66          1HB       GLU  66   8.050   8.328  -8.426
  502   1HG   GLU  66          2HG       GLU  66   6.511   5.767  -8.634
  503   2HG   GLU  66          1HG       GLU  66   5.734   7.253  -9.178
  504    H    ASP  67           H        ASP  67   8.328   8.189  -5.137
  505    HA   ASP  67           HA       ASP  67  11.173   8.958  -5.433
  506   1HB   ASP  67          2HB       ASP  67  10.665  11.135  -4.666
  507   2HB   ASP  67          1HB       ASP  67   9.391  10.746  -5.817
  508    H    GLY  68           H        GLY  68   8.719   7.814  -3.203
  509   1HA   GLY  68          2HA       GLY  68   9.091   6.693  -1.174
  510   2HA   GLY  68          1HA       GLY  68  10.774   7.210  -1.220
  511    H    SER  69           H        SER  69   7.709   9.020  -1.377
  512    HA   SER  69           HA       SER  69   8.713  11.015   0.477
  513   1HB   SER  69          2HB       SER  69   6.354  11.975   0.088
  514   2HB   SER  69          1HB       SER  69   7.453  11.936  -1.284
  515    HG   SER  69           HG       SER  69   6.105  10.646  -2.240
  516    H    GLY  70           H        GLY  70   6.058   8.649   0.406
  517   1HA   GLY  70          2HA       GLY  70   5.934   7.575   2.792
  518   2HA   GLY  70          1HA       GLY  70   5.421   9.208   3.214
  519    H    THR  71           H        THR  71   4.128   9.541   0.531
  520    HA   THR  71           HA       THR  71   1.666   8.028   1.127
  521    HB   THR  71           HB       THR  71   0.452   9.735  -0.082
  522    HG1  THR  71           HG1      THR  71   2.961  10.984  -0.532
  523   1HG2  THR  71          1HG2      THR  71   1.061  11.744   1.295
  524   2HG2  THR  71          2HG2      THR  71   2.496  10.874   1.838
  525   3HG2  THR  71          3HG2      THR  71   0.891  10.262   2.237
  526    H    VAL  72           H        VAL  72   0.531   7.004  -0.547
  527    HA   VAL  72           HA       VAL  72   2.228   6.297  -2.851
  528    HB   VAL  72           HB       VAL  72  -0.098   4.865  -1.563
  529   1HG1  VAL  72          1HG1      VAL  72   1.128   3.226  -3.520
  530   2HG1  VAL  72          2HG1      VAL  72   0.823   4.773  -4.309
  531   3HG1  VAL  72          3HG1      VAL  72  -0.505   3.890  -3.558
  532   1HG2  VAL  72          1HG2      VAL  72   1.571   3.150  -1.103
  533   2HG2  VAL  72          2HG2      VAL  72   2.177   4.695  -0.506
  534   3HG2  VAL  72          3HG2      VAL  72   2.787   4.037  -2.025
  535    H    ASP  73           H        ASP  73   1.800   7.270  -4.676
  536    HA   ASP  73           HA       ASP  73  -0.775   8.538  -5.158
  537   1HB   ASP  73          2HB       ASP  73   1.622   8.355  -7.004
  538   2HB   ASP  73          1HB       ASP  73   0.255   9.459  -7.147
  539    H    PHE  74           H        PHE  74  -1.677   8.195  -7.468
  540    HA   PHE  74           HA       PHE  74  -2.574   5.548  -7.679
  541   1HB   PHE  74          2HB       PHE  74  -3.624   7.684  -8.650
  542   2HB   PHE  74          1HB       PHE  74  -2.537   7.447 -10.018
  543    HD1  PHE  74           HD1      PHE  74  -4.133   6.905 -11.701
  544    HD2  PHE  74           HD2      PHE  74  -4.085   4.736  -7.997
  545    HE1  PHE  74           HE1      PHE  74  -5.702   5.240 -12.657
  546    HE2  PHE  74           HE2      PHE  74  -5.655   3.072  -8.950
  547    HZ   PHE  74           HZ       PHE  74  -6.464   3.321 -11.283
  548    H    ASP  75           H        ASP  75   0.223   7.100  -9.115
  549    HA   ASP  75           HA       ASP  75   0.714   5.194 -11.165
  550   1HB   ASP  75          2HB       ASP  75   2.275   7.364  -9.851
  551   2HB   ASP  75          1HB       ASP  75   3.189   6.118 -10.699
  552    H    GLU  76           H        GLU  76   2.292   5.592  -7.974
  553    HA   GLU  76           HA       GLU  76   3.635   3.065  -8.177
  554   1HB   GLU  76          2HB       GLU  76   4.194   3.452  -5.759
  555   2HB   GLU  76          1HB       GLU  76   4.684   4.736  -6.853
  556   1HG   GLU  76          2HG       GLU  76   2.365   5.800  -6.231
  557   2HG   GLU  76          1HG       GLU  76   2.478   4.731  -4.833
  558    H    PHE  77           H        PHE  77   0.464   3.932  -7.424
  559    HA   PHE  77           HA       PHE  77  -0.139   1.839  -5.535
  560   1HB   PHE  77          2HB       PHE  77  -1.437   3.942  -5.619
  561   2HB   PHE  77          1HB       PHE  77  -1.979   3.539  -7.245
  562    HD1  PHE  77           HD1      PHE  77  -2.162   2.573  -3.667
  563    HD2  PHE  77           HD2      PHE  77  -3.702   1.902  -7.627
  564    HE1  PHE  77           HE1      PHE  77  -4.039   1.260  -2.719
  565    HE2  PHE  77           HE2      PHE  77  -5.576   0.586  -6.673
  566    HZ   PHE  77           HZ       PHE  77  -5.743   0.266  -4.219
  567    H    LEU  78           H        LEU  78  -0.330   2.274  -9.049
  568    HA   LEU  78           HA       LEU  78  -1.777  -0.211  -9.467
  569   1HB   LEU  78          2HB       LEU  78  -0.399   1.665 -11.380
  570   2HB   LEU  78          1HB       LEU  78  -1.332   0.267 -11.869
  571    HG   LEU  78           HG       LEU  78  -2.749   2.192 -10.119
  572   1HD1  LEU  78          1HD1      LEU  78  -1.265   3.540 -11.754
  573   2HD1  LEU  78          2HD1      LEU  78  -2.991   3.900 -11.733
  574   3HD1  LEU  78          3HD1      LEU  78  -2.314   2.903 -13.020
  575   1HD2  LEU  78          1HD2      LEU  78  -4.591   1.456 -11.320
  576   2HD2  LEU  78          2HD2      LEU  78  -3.535   0.055 -11.500
  577   3HD2  LEU  78          3HD2      LEU  78  -3.667   1.233 -12.806
  578    H    VAL  79           H        VAL  79   1.567   0.922  -9.888
  579    HA   VAL  79           HA       VAL  79   2.614  -1.358 -11.150
  580    HB   VAL  79           HB       VAL  79   4.814  -0.654 -10.172
  581   1HG1  VAL  79          1HG1      VAL  79   3.208   1.615 -11.376
  582   2HG1  VAL  79          2HG1      VAL  79   3.854   0.265 -12.307
  583   3HG1  VAL  79          3HG1      VAL  79   4.951   1.376 -11.487
  584   1HG2  VAL  79          1HG2      VAL  79   3.125   1.537  -8.937
  585   2HG2  VAL  79          2HG2      VAL  79   4.886   1.468  -8.924
  586   3HG2  VAL  79          3HG2      VAL  79   3.948   0.259  -8.048
  587    H    MET  80           H        MET  80   1.775  -0.783  -7.825
  588    HA   MET  80           HA       MET  80   3.235  -2.530  -6.334
  589   1HB   MET  80          2HB       MET  80   0.393  -1.655  -6.250
  590   2HB   MET  80          1HB       MET  80   0.849  -3.023  -5.236
  591   1HG   MET  80          2HG       MET  80   2.875  -1.478  -4.566
  592   2HG   MET  80          1HG       MET  80   1.818  -0.186  -5.131
  593   1HE   MET  80          1HE       MET  80  -1.331  -0.481  -3.028
  594   2HE   MET  80          2HE       MET  80  -0.829  -0.670  -4.705
  595   3HE   MET  80          3HE       MET  80  -0.275   0.723  -3.779
  596    H    MET  81           H        MET  81   0.649  -3.400  -8.599
  597    HA   MET  81           HA       MET  81   0.608  -6.171  -7.786
  598   1HB   MET  81          2HB       MET  81  -0.712  -4.567  -9.936
  599   2HB   MET  81          1HB       MET  81  -0.685  -6.325 -10.075
  600   1HG   MET  81          2HG       MET  81  -1.385  -5.930  -7.424
  601   2HG   MET  81          1HG       MET  81  -2.231  -4.625  -8.252
  602   1HE   MET  81          1HE       MET  81  -2.069  -8.938  -9.384
  603   2HE   MET  81          2HE       MET  81  -2.646  -8.792  -7.727
  604   3HE   MET  81          3HE       MET  81  -1.126  -8.035  -8.192
  605    H    VAL  82           H        VAL  82   1.891  -4.442 -10.646
  606    HA   VAL  82           HA       VAL  82   2.969  -6.859 -11.782
  607    HB   VAL  82           HB       VAL  82   4.020  -5.342 -13.448
  608   1HG1  VAL  82          1HG1      VAL  82   1.510  -4.197 -13.795
  609   2HG1  VAL  82          2HG1      VAL  82   1.181  -5.641 -12.838
  610   3HG1  VAL  82          3HG1      VAL  82   2.019  -5.780 -14.385
  611   1HG2  VAL  82          1HG2      VAL  82   2.540  -3.107 -12.054
  612   2HG2  VAL  82          2HG2      VAL  82   3.728  -2.988 -13.350
  613   3HG2  VAL  82          3HG2      VAL  82   4.242  -3.435 -11.723
  614    H    ARG  83           H        ARG  83   4.231  -4.415  -9.612
  615    HA   ARG  83           HA       ARG  83   6.997  -4.845 -10.107
  616   1HB   ARG  83          2HB       ARG  83   7.387  -3.728  -7.984
  617   2HB   ARG  83          1HB       ARG  83   6.126  -2.880  -8.875
  618   1HG   ARG  83          2HG       ARG  83   4.743  -3.138  -7.125
  619   2HG   ARG  83          1HG       ARG  83   4.835  -4.886  -7.326
  620   1HD   ARG  83          2HD       ARG  83   7.199  -3.714  -6.032
  621   2HD   ARG  83          1HD       ARG  83   5.714  -3.503  -5.114
  622    HE   ARG  83           HE       ARG  83   5.588  -6.120  -5.708
  623   1HH1  ARG  83          2HH1      ARG  83   8.209  -4.143  -4.506
  624   2HH1  ARG  83          1HH1      ARG  83   8.967  -5.448  -3.659
  625   1HH2  ARG  83          1HH2      ARG  83   6.600  -7.808  -4.590
  626   2HH2  ARG  83          2HH2      ARG  83   8.059  -7.516  -3.706
  627    H    CYS  84           H        CYS  84   4.639  -6.801  -8.545
  628    HA   CYS  84           HA       CYS  84   6.565  -8.234  -6.888
  629   1HB   CYS  84          2HB       CYS  84   4.094  -7.777  -6.287
  630   2HB   CYS  84          1HB       CYS  84   3.724  -9.090  -7.405
  631    HG   CYS  84           HG       CYS  84   4.088 -10.113  -5.004
  632    H    MET  85           H        MET  85   5.332  -8.403 -10.102
  633    HA   MET  85           HA       MET  85   6.129 -11.232 -10.351
  634   1HB   MET  85          2HB       MET  85   4.850 -11.263 -12.421
  635   2HB   MET  85          1HB       MET  85   3.848 -10.653 -11.107
  636   1HG   MET  85          2HG       MET  85   3.885  -8.466 -11.908
  637   2HG   MET  85          1HG       MET  85   5.383  -8.710 -12.806
  638   1HE   MET  85          1HE       MET  85   4.368  -8.100 -15.710
  639   2HE   MET  85          2HE       MET  85   4.177  -7.252 -14.177
  640   3HE   MET  85          3HE       MET  85   2.764  -7.576 -15.178
  641    H    LYS  86           H        LYS  86   8.116  -9.207 -10.107
  642    HA   LYS  86           HA       LYS  86   9.171  -8.727 -12.783
  643   1HB   LYS  86          2HB       LYS  86  11.077  -7.649 -11.561
  644   2HB   LYS  86          1HB       LYS  86   9.508  -6.932 -11.210
  645   1HG   LYS  86          2HG       LYS  86   9.377  -8.105  -9.095
  646   2HG   LYS  86          1HG       LYS  86  10.825  -9.038  -9.472
  647   1HD   LYS  86          2HD       LYS  86  12.248  -7.239  -9.125
  648   2HD   LYS  86          1HD       LYS  86  11.004  -6.048  -9.504
  649   1HE   LYS  86          2HE       LYS  86   9.918  -7.244  -7.300
  650   2HE   LYS  86          1HE       LYS  86  11.638  -7.358  -6.930
  651   1HZ   LYS  86          1HZ       LYS  86  10.183  -4.878  -7.679
  652   2HZ   LYS  86          2HZ       LYS  86  11.846  -4.983  -7.349
  653   3HZ   LYS  86          3HZ       LYS  86  10.713  -5.286  -6.121
  654    H    ASP  87           H        ASP  87   9.865 -10.741  -9.967
  655    HA   ASP  87           HA       ASP  87  11.133 -12.769 -11.493
  656   1HB   ASP  87          2HB       ASP  87  12.891 -10.777 -11.242
  657   2HB   ASP  87          1HB       ASP  87  13.144 -11.532  -9.668
  658    H    ASP  88           H        ASP  88  11.072 -11.199  -8.292
  659    HA   ASP  88           HA       ASP  88  10.654 -12.024  -6.189
  660   1HB   ASP  88          2HB       ASP  88   8.736 -13.139  -7.669
  661   2HB   ASP  88          1HB       ASP  88   9.613 -14.611  -7.256
  662    H    SER  89           HN       SER  89  13.210 -12.266  -6.955
  663    HA   SER  89           HA       SER  89  14.020 -14.983  -6.094
  664   1HB   SER  89          2HB       SER  89  16.240 -14.356  -7.207
  665   2HB   SER  89          1HB       SER  89  14.884 -14.685  -8.279
  666    HG   SER  89           HG       SER  89  16.184 -12.294  -7.688