*HEADER    METAL BINDING PROTEIN                   15-OCT-03   1R6P              
*TITLE     NMR STRUCTURE OF THE N-TERMINAL DOMAIN OF TROUT CARDIAC               
*TITLE    2 TROPONIN C AT 7 C                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TROPONIN C;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN (RESIDUES 1-89);                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ONCORHYNCHUS MYKISS;                            
*SOURCE   3 ORGANISM_COMMON: RAINBOW TROUT;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 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 1R6P    0                                                
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assign (resid 29 and name HA) (resid 29 and name HN) 	 2.406 0.706 0.706
assign (resid 29 and name HG*) (resid 29 and name HN) 	 2.655 0.955 1.855
assign (resid 29 and name HB*) (resid 29 and name HN) 	 2.655 0.955 1.355
assign (resid 28 and name HB) (resid 29 and name HN) 	 3.063 1.363 1.763
assign ((resid 28 and name HG12) or (resid 28 and name HG11)) (resid 29 and name HN) 	 3.019 1.319 2.219
assign (resid 28 and name HD1*) (resid 29 and name HN) 	 3.093 1.393 1.793
assign ((resid 29 and name HG2) or (resid 29 and name HG1)) (resid 30 and name HN) 	 2.794 1.094 1.094
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assign (resid 30 and name HA) (resid 30 and name HN) 	 2.406 0.706 0.706
assign (resid 29 and name HA) (resid 30 and name HN) 	 2.441 0.741 1.141
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 30 and name HN) 	 2.533 0.833 1.233
assign ((resid 29 and name HB1) or (resid 29 and name HB2)) (resid 30 and name HN) 	 2.794 1.094 1.094
assign (resid 28 and name HD1*) (resid 30 and name HN) 	 3.260 1.560 2.340
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assign (resid 30 and name HN) (resid 31 and name HN) 	 2.475 0.775 0.775
assign (resid 30 and name HA) (resid 31 and name HN) 	 2.420 0.720 0.920
assign (resid 31 and name HA) (resid 31 and name HN) 	 2.407 0.707 0.707
assign (resid 29 and name HA) (resid 31 and name HN) 	 2.654 0.954 1.554
assign (resid 30 and name HB2) (resid 31 and name HN) 	 2.911 1.211 1.811
assign (resid 30 and name HB1) (resid 31 and name HN) 	 2.911 1.211 1.811
assign ((resid 29 and name HB1) or (resid 29 and name HB2)) (resid 31 and name HN) 	 2.852 1.152 2.348
assign (resid 28 and name HB) (resid 31 and name HN) 	 2.987 1.287 2.487
assign (resid 31 and name HB*) (resid 31 and name HN) 	 2.203 0.503 0.803
assign (resid 28 and name HD1*) (resid 31 and name HN) 	 3.176 1.476 1.476
assign (resid 33 and name HN) (resid 32 and name HN) 	 2.536 0.836 0.836
assign (resid 31 and name HA) (resid 32 and name HN) 	 2.188 0.488 0.488
assign (resid 32 and name HA) (resid 32 and name HN) 	 2.415 0.715 0.715
assign ((resid 32 and name HG1) or (resid 32 and name HG2)) (resid 32 and name HN) 	 2.661 0.961 0.961
assign (resid 31 and name HB*) (resid 32 and name HN) 	 2.425 0.725 0.725
assign (resid 32 and name HN) (resid 33 and name HN) 	 2.536 0.836 0.836
assign (resid 34 and name HN) (resid 33 and name HN) 	 2.831 1.131 1.131
assign (resid 33 and name HA) (resid 33 and name HN) 	 2.406 0.706 0.706
assign (resid 31 and name HA) (resid 33 and name HN) 	 2.965 1.265 1.265
assign (resid 32 and name HA) (resid 33 and name HN) 	 2.459 0.759 1.059
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assign (resid 33 and name HB1) (resid 33 and name HN) 	 2.637 0.937 1.337
assign (resid 31 and name HB*) (resid 33 and name HN) 	 2.552 0.852 0.852
assign (resid 33 and name HN) (resid 34 and name HN) 	 2.831 1.131 1.131
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assign (resid 33 and name HA) (resid 34 and name HN) 	 3.038 1.338 1.338
assign (resid 32 and name HA) (resid 34 and name HN) 	 3.350 1.650 1.950
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assign (resid 34 and name HA1) (resid 34 and name HN) 	 2.790 1.090 1.490
assign (resid 33 and name HB2) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 33 and name HB1) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 31 and name HB*) (resid 34 and name HN) 	 3.017 1.317 1.317
assign (resid 28 and name HG2*) (resid 34 and name HN) 	 3.350 1.650 2.150
assign (resid 28 and name HD1*) (resid 34 and name HN) 	 3.350 1.650 1.650
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assign (resid 34 and name HN) (resid 35 and name HN) 	 2.938 1.238 1.238
assign (resid 35 and name HA) (resid 35 and name HN) 	 2.407 0.707 0.707
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assign (resid 34 and name HA1) (resid 35 and name HN) 	 2.492 0.792 1.192
assign ((resid 33 and name HB2) or (resid 33 and name HB1)) (resid 35 and name HN) 	 2.961 1.261 1.461
assign ((resid 35 and name HB2) or (resid 35 and name HB1)) (resid 35 and name HN) 	 2.539 0.839 1.139
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assign (resid 35 and name HB1) (resid 36 and name HN) 	 2.354 0.654 1.654
assign (resid 72 and name HB) (resid 36 and name HN) 	 2.536 0.836 0.836
assign (resid 36 and name HB) (resid 36 and name HN) 	 2.307 0.607 1.407
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assign ((resid 72 and name HG2*) or (resid 72 and name HG1*)) (resid 36 and name HN) 	 2.713 1.013 2.587
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assign ((resid 36 and name HG2*) or (resid 36 and name HD1*)) (resid 36 and name HN) 	 2.755 1.055 1.055
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assign (resid 37 and name HA) (resid 37 and name HN) 	 2.415 0.715 0.715
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assign ((resid 37 and name HB2) or (resid 37 and name HB1)) (resid 38 and name HN) 	 2.577 0.877 1.877
assign (resid 38 and name HA) (resid 38 and name HN) 	 2.407 0.707 0.707
assign ((resid 72 and name HG2*) or (resid 72 and name HG1*)) (resid 38 and name HN) 	 2.695 0.995 1.795
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assign ((resid 36 and name HG2*) or (resid 36 and name HD1*)) (resid 38 and name HN) 	 2.950 1.250 1.450
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assign (resid 37 and name HA) (resid 39 and name HN) 	 2.954 1.254 1.654
assign (resid 38 and name HB) (resid 39 and name HN) 	 2.856 1.156 1.156
assign (resid 39 and name HA) (resid 39 and name HN) 	 2.405 0.705 0.705
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assign ((resid 39 and name HG2) or (resid 39 and name HG1)) (resid 39 and name HN) 	 2.522 0.822 0.822
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assign (resid 40 and name HA) (resid 40 and name HN) 	 2.410 0.710 0.710
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assign (resid 38 and name HA) (resid 40 and name HN) 	 2.461 0.761 1.861
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assign (resid 40 and name HB*) (resid 40 and name HN) 	 2.365 0.665 1.065
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assign ((resid 39 and name HG2) or (resid 39 and name HG1)) (resid 40 and name HN) 	 2.850 1.150 1.550
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assign (resid 40 and name HN) (resid 41 and name HN) 	 2.311 0.611 0.611
assign (resid 40 and name HA) (resid 41 and name HN) 	 2.651 0.951 0.951
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assign (resid 40 and name HB1) (resid 41 and name HN) 	 2.845 1.145 1.745
assign (resid 41 and name HG) (resid 41 and name HN) 	 2.459 0.759 2.159
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assign (resid 41 and name HB1) (resid 41 and name HN) 	 2.366 0.666 1.066
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assign ((resid 40 and name HB1) or (resid 40 and name HB2)) (resid 42 and name HN) 	 3.350 1.650 2.050
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assign ((resid 57 and name HD1*) or (resid 57 and name HD2*)) (resid 42 and name HN) 	 3.046 1.346 1.954
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assign (resid 40 and name HA) (resid 43 and name HN) 	 2.817 1.117 2.117
assign (resid 43 and name HA) (resid 43 and name HN) 	 2.408 0.708 0.708
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assign (resid 42 and name HA1) (resid 43 and name HN) 	 2.700 1.000 1.400
assign (resid 43 and name HB*) (resid 43 and name HN) 	 2.233 0.533 0.933
assign (resid 43 and name HD*) (resid 43 and name HN) 	 2.793 1.093 1.693
assign (resid 43 and name HG2) (resid 43 and name HN) 	 2.833 1.133 1.733
assign (resid 43 and name HG1) (resid 43 and name HN) 	 2.833 1.133 1.733
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assign ((resid 43 and name HG2) or (resid 43 and name HG1)) (resid 44 and name HN) 	 2.818 1.118 1.918
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assign (resid 44 and name HA) (resid 44 and name HN) 	 2.410 0.710 0.710
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assign ((resid 47 and name HB2) or (resid 47 and name HB1)) (resid 47 and name HN) 	 2.233 0.533 0.533
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assign (resid 46 and name HN) (resid 47 and name HN) 	 3.109 1.409 1.891
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assign (resid 48 and name HB1) (resid 49 and name HN) 	 3.350 1.650 1.650
assign ((resid 48 and name HD2*) or (resid 48 and name HD1*)) (resid 49 and name HN) 	 3.350 1.650 1.850
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assign (resid 58 and name HA) (resid 59 and name HN) 	 2.881 1.181 1.181
assign ((resid 59 and name HG2) or (resid 59 and name HG1)) (resid 59 and name HN) 	 2.516 0.816 0.816
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assign (resid 60 and name HA) (resid 60 and name HN) 	 2.404 0.704 0.704
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assign ((resid 60 and name HB1) or (resid 60 and name HB2)) (resid 60 and name HN) 	 2.308 0.608 0.608
assign ((resid 61 and name HG11) or (resid 61 and name HG12)) (resid 60 and name HN) 	 2.923 1.223 1.823
assign (resid 60 and name HA) (resid 61 and name HN) 	 2.426 0.726 1.026
assign (resid 60 and name HN) (resid 61 and name HN) 	 2.520 0.820 0.820
assign (resid 58 and name HA) (resid 61 and name HN) 	 2.586 0.886 0.886
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assign (resid 61 and name HB) (resid 61 and name HN) 	 2.197 0.497 1.297
assign ((resid 61 and name HG12) or (resid 61 and name HG11)) (resid 61 and name HN) 	 2.341 0.641 1.041
assign (resid 61 and name HD1*) (resid 61 and name HN) 	 2.469 0.769 1.569
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assign (resid 62 and name HA) (resid 62 and name HN) 	 2.408 0.708 0.708
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assign (resid 61 and name HB) (resid 62 and name HN) 	 2.376 0.676 1.176
assign ((resid 61 and name HG12) or (resid 61 and name HG11)) (resid 62 and name HN) 	 2.827 1.127 1.727
assign ((resid 61 and name HG2*) or (resid 61 and name HD1*)) (resid 62 and name HN) 	 2.547 0.847 1.747
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assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 63 and name HN) 	 2.739 1.039 2.561
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assign (resid 63 and name HN) (resid 64 and name HN) 	 2.366 0.666 0.666
assign (resid 63 and name HA) (resid 64 and name HN) 	 2.693 0.993 0.993
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assign (resid 67 and name HA) (resid 67 and name HN) 	 2.412 0.712 0.712
assign (resid 66 and name HA) (resid 67 and name HN) 	 2.535 0.835 1.135
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assign ((resid 68 and name HA1) or (resid 68 and name HA2)) (resid 70 and name HN) 	 3.350 1.650 1.650
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assign (resid 71 and name HA) (resid 71 and name HN) 	 2.412 0.712 0.712
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assign (resid 71 and name HB) (resid 71 and name HN) 	 2.535 0.835 1.535
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assign (resid 71 and name HB) (resid 72 and name HN) 	 2.989 1.289 1.289
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assign ((resid 72 and name HG2*) or (resid 72 and name HG1*)) (resid 73 and name HN) 	 2.544 0.844 1.244
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assign (resid 76 and name HA) (resid 76 and name HN) 	 2.409 0.709 0.709
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assign (resid 88 and name HN) (resid 89 and name HN) 	 2.758 1.058 1.058
assign (resid 88 and name HA) (resid 89 and name HN) 	 2.322 0.622 1.322
assign (resid 89 and name HA) (resid 89 and name HN) 	 2.408 0.708 0.708
assign (resid 88 and name HB*) (resid 89 and name HN) 	 2.718 1.018 1.718
assign (resid 2 and name HA) (resid 5 and name HD*) 3.400 1.6 1.6 
assign (resid 2 and name HA) (resid 5 and name HE*) 5.000 3.2 0.0 
assign ((resid 2 and name HB2) or (resid 2 and name HB1)) (resid 5 and name HE*) 5.000 3.2 0.6 
assign ((resid 87 and name HB2) or (resid 87 and name HB1)) (resid 5 and name HD*) 5.000 3.2 0.6 
assign (resid 4 and name HB) (resid 5 and name HD*) 3.400 1.6 2.6 
assign (resid 4 and name HD1*) (resid 5 and name HD*) 5.000 3.2 0.0 
assign ((resid 79 and name HG2*) or (resid 79 and name HG1*)) (resid 5 and name HD*) 3.400 1.6 1.6 
assign (resid 4 and name HD1*) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 4 and name HG1*) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 5 and name HA) (resid 5 and name HD*) 2.800 1.0 2.2 
assign (resid 5 and name HB1) (resid 5 and name HD*) 2.800 1.0 0.8 
assign (resid 5 and name HB2) (resid 5 and name HD*) 2.800 1.0 0.8 
assign (resid 5 and name HA) (resid 5 and name HE*) 3.400 1.6 1.7 
assign (resid 5 and name HB*) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 2 and name HB*) (resid 5 and name HD*) 3.400 1.6 2.4 
assign ((resid 16 and name HG2) or (resid 16 and name HG1)) (resid 20 and name HE*) 5.000 3.2 0.0 
assign ((resid 19 and name HB1) or (resid 19 and name HB2)) (resid 20 and name HD*) 5.000 3.2 0.0 
assign ((resid 19 and name HG1) or (resid 19 and name HG2)) (resid 20 and name HD*) 5.000 3.2 0.0 
assign ((resid 19 and name HB1) or (resid 19 and name HB2)) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HA) (resid 20 and name HD*) 2.800 1.0 0.6 
assign (resid 20 and name HB1) (resid 20 and name HD*) 2.800 1.0 0.0 
assign (resid 20 and name HB2) (resid 20 and name HD*) 2.800 1.0 0.0 
assign (resid 20 and name HA) (resid 20 and name HE*) 3.400 1.6 1.6 
assign (resid 20 and name HB1) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB2) (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 0.6 
assign ((resid 20 and name HB1) or (resid 20 and name HB2)) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HA) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HB1) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HB2) (resid 24 and name HD*) 3.400 1.6 1.6 
assign ((resid 24 and name HB2) or (resid 24 and name HB1)) (resid 24 and name HE*) 3.400 1.6 1.6 
assign (resid 21 and name HB*) (resid 74 and name HZ) 3.400 1.6 0.0 
assign (resid 24 and name HA) (resid 27 and name HD*) 2.800 1.0 0.8 
assign ((resid 26 and name HG11) or (resid 26 and name HG12)) (resid 27 and name HE*) 5.000 3.2 0.5 
assign (resid 27 and name HA) (resid 27 and name HD*) 2.800 1.0 0.0 
assign (resid 27 and name HB1) (resid 27 and name HD*) 3.400 1.6 0.0 
assign ((resid 74 and name HB1) or (resid 74 and name HB2)) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 27 and name HB2) (resid 27 and name HD*) 2.800 1.0 0.6 
assign (resid 27 and name HA) (resid 27 and name HE*) 5.000 3.2 0.0 
assign ((resid 28 and name HG11) or (resid 28 and name HG12)) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 24 and name HE*) 2.800 1.0 0.3 
assign (resid 28 and name HG2*) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 24 and name HE*) 2.800 1.0 0.3 
assign (resid 28 and name HG2*) (resid 24 and name HD*) 5.000 3.2 0.3 
assign (resid 35 and name HA) (resid 24 and name HZ) 3.400 1.6 0.0 
assign ((resid 35 and name HB2) or (resid 35 and name HB1)) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) (resid 27 and name HD*) 5.000 3.2 0.3 
assign ((resid 43 and name HB1) or (resid 43 and name HB2)) (resid 27 and name HD*) 5.000 3.2 0.0 
assign (resid 43 and name HB*) (resid 27 and name HD*) 3.400 1.6 1.6 
assign ((resid 44 and name HG1*) or (resid 44 and name HG2*)) (resid 20 and name HD*) 5.000 3.2 0.4
assign (resid 44 and name HA) (resid 27 and name HE*) 5.000 3.2 0.0 
assign ((resid 44 and name HG1*) or (resid 44 and name HG2*)) (resid 27 and name HD*) 3.400 1.6 0.4 
assign ((resid 44 and name HG2*) or (resid 44 and name HG1*)) (resid 27 and name HE*) 5.000 3.2 0.0 
assign (resid 47 and name HB*) (resid 27 and name HE*) 5.000 3.2 0.0 
assign ((resid 47 and name HG1) or (resid 47 and name HG2)) (resid 27 and name HE*) 5.000 3.2 0.0 
assign ((resid 48 and name HD2*) or (resid 48 and name HD1*)) (resid 20 and name HD*) 5.000 3.2 0.0 
assign ((resid 48 and name HD2*) or (resid 48 and name HD1*)) (resid 20 and name HE*) 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 73 and name HA) (resid 24 and name HZ) 2.800 1.0 0.0 
assign ((resid 73 and name HB2) or (resid 73 and name HB1)) (resid 24 and name HZ) 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 18 and name HA) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 20 and name HB1) (resid 74 and name HE*) 3.400 1.6 0.0 
assign (resid 20 and name HB2) (resid 74 and name HE*) 3.400 1.6 0.0 
assign (resid 20 and name HB1) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 20 and name HB2) (resid 74 and name HZ) 3.400 1.6 1.6 
assign (resid 21 and name HA) (resid 74 and name HD*) 5.000 3.2 0.0 
assign ((resid 21 and name HB1) or (resid 21 and name HB2)) (resid 74 and name HD*) 5.000 3.2 0.3 
assign ((resid 21 and name HG1) or (resid 21 and name HG2)) (resid 74 and name HD*) 5.000 3.2 1.0 
assign (resid 21 and name HA) (resid 74 and name HE*) 2.800 1.0 0.0 
assign (resid 21 and name HB1) (resid 74 and name HE*) 2.800 1.0 1.6 
assign (resid 21 and name HB2) (resid 74 and name HE*) 3.400 1.6 1.0 
assign ((resid 17 and name HG2) or (resid 17 and name HG1)) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 21 and name HA) (resid 74 and name HZ) 3.400 1.6 1.6 
assign ((resid 21 and name HB2) or (resid 21 and name HB1)) (resid 74 and name HZ) 3.400 1.6 0.0 
assign ((resid 78 and name HD2*) or (resid 78 and name HD1*)) (resid 74 and name HZ) 3.400 1.6 0.8 
assign ((resid 21 and name HG1) or (resid 21 and name HG2)) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 24 and name HZ) 5.000 3.2 0.0 
assign ((resid 74 and name HB2) or (resid 74 and name HB1)) (resid 24 and name HD*) 5.000 3.2 0.0 
assign ((resid 74 and name HB2) or (resid 74 and name HB1)) (resid 24 and name HZ) 5.000 3.2 0.0 
assign ((resid 24 and name HB1) or (resid 24 and name HB2)) (resid 74 and name HD*) 3.400 1.6 1.6 
assign (resid 74 and name HD*) (resid 24 and name HZ) 5.000 3.2 0.6
assign ((resid 24 and name HB1) or (resid 24 and name HB2)) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 74 and name HD*) 2.800 1.0 0.6 
assign (resid 74 and name HB1) (resid 74 and name HD*) 2.800 1.0 0.2 
assign (resid 74 and name HB2) (resid 74 and name HD*) 2.800 1.0 0.2 
assign (resid 74 and name HA) (resid 74 and name HE*) 3.400 1.6 1.6 
assign (resid 74 and name HB1) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HB2) (resid 74 and name HE*) 5.000 3.2 0.0 
assign ((resid 77 and name HB1) or (resid 77 and name HB2)) (resid 20 and name HD*) 5.000 3.2 0.0 
assign ((resid 20 and name HB1) or (resid 20 and name HB2)) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) (resid 20 and name HE*) 2.800 1.0 1.6 
assign (resid 20 and name HA) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 77 and name HE*) 3.400 1.6 0.0 
assign ((resid 77 and name HB1) or (resid 77 and name HB2)) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HA) (resid 77 and name HD*) 5.000 3.2 0.0 
assign ((resid 24 and name HB1) or (resid 24 and name HB2)) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HD*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 77 and name HE*) 3.400 1.6 0.4 
assign ((resid 24 and name HB1) or (resid 24 and name HB2)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*)) (resid 77 and name HD*) 5.000 3.2 0.0 
assign ((resid 36 and name HG12) or (resid 36 and name HG11)) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) (resid 77 and name HE*) 5.000 3.2 0.2 
assign ((resid 36 and name HG12) or (resid 36 and name HG11)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 77 and name HD*) 5.000 3.2 0.2 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign ((resid 44 and name HG1*) or (resid 44 and name HG2*)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign ((resid 48 and name HD1*) or (resid 48 and name HD2*)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 77 and name HD*) 5.000 3.2 0.2 
assign (resid 72 and name HG2*) (resid 77 and name HD*) 5.000 3.2 0.2 
assign ((resid 48 and name HD2*) or (residue 48 and name HD1*)) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HB1) (resid 74 and name HD*) 3.400 1.6 0.2 
assign (resid 77 and name HB2) (resid 74 and name HD*) 3.400 1.6 0.2 
assign (resid 74 and name HA) (resid 77 and name HD*) 3.400 1.6 1.6 
assign (resid 74 and name HD*) (resid 77 and name HD*) 2.800 1.0 0.2 
assign (resid 77 and name HD*) (resid 74 and name HE*) 2.800 1.0 0.8 
assign (resid 77 and name HA) (resid 77 and name HD*) 2.800 1.0 0.0 
assign (resid 77 and name HB1) (resid 77 and name HD*) 2.800 1.0 0.6 
assign (resid 77 and name HB2) (resid 77 and name HD*) 2.800 1.0 0.6 
assign (resid 77 and name HA) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HB1) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HB2) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 24 and name HE*) 3.400 1.6 0.3 
assign (resid 78 and name HA) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 78 and name HD1*) (resid 74 and name HD*) 5.000 3.2 0.0 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*)) (resid 74 and name HE*) 3.400 1.6 0.0 
assign (resid 78 and name HD2*) (resid 74 and name HD*) 5.000 3.2 0.0 
assign ((resid 78 and name HD2*) or (resid 78 and name HD1*)) (resid 77 and name HD*) 5.000 3.2 0.0
assign (resid 80 and name HB*) (resid 20 and name HE*) 3.400 1.6 1.1 
assign (resid 80 and name HE*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 81 and name HA) (resid 20 and name HE*) 5.000 3.2 0.0 
assign ((resid 81 and name HB1) or (resid 81 and name HB2)) (resid 20 and name HD*) 2.800 1.0 3.0 
assign (resid 81 and name HB1) (resid 20 and name HE*) 2.800 1.0 2.0 
assign (resid 81 and name HB2) (resid 20 and name HE*) 3.400 1.6 1.4 
assign (resid 81 and name HE*) (resid 20 and name HD*) 5.000 3.2 0.3 
assign (resid 81 and name HE*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 81 and name HG1) (resid 20 and name HE*) 2.800 1.0 2.2 
assign (resid 81 and name HG2) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 82 and name HB) (resid 5 and name HD*) 5.000 3.2 0.0 
assign ((resid 79 and name HG1*) or (resid 79 and name HG2*)) (resid 5 and name HD*) 3.400 1.6 1.6 
assign ((resid 82 and name HG2*) or (resid 82 and name HG1*)) (resid 5 and name HD*) 5.000 3.2 0.2 
assign (resid 83 and name HA) (resid 5 and name HD*) 5.000 3.2 0.0 
assign (resid 83 and name HA) (resid 5 and name HE*) 3.400 1.6 0.1
assign (resid 83 and name HG1) (resid 5 and name HE*) 5.000 3.2 0.4 
assign ((resid 83 and name HG2) or (resid 83 and name HG1)) (resid 5 and name HD*) 5.000 3.2 0.2 
assign (resid 83 and name HG2) (resid 5 and name HE*) 5.000 3.2 0.4 
assign (resid 86 and name HD*) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 2 and name HB1) (resid 2 and name HA) 5.000 3.2 0.0 
assign (resid 2 and name HB2) (resid 2 and name HA) 3.400 1.6 1.6
assign (resid 4 and name HD1*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG11) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG12) (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 5 and name HB*) (resid 5 and name HA) 5.000 3.2 0.0 
assign (resid 6 and name HD*) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 6 and name HG*) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 7 and name HB*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 8 and name HB*) (resid 8 and name HA) 2.800 1.0 0.0 
assign (resid 9 and name HB) (resid 9 and name HA) 3.400 1.6 0.0 
assign (resid 9 and name HG1*) (resid 9 and name HA) 3.400 1.6 0.5 
assign (resid 9 and name HG2*) (resid 9 and name HA) 3.400 1.6 0.3 
assign ((resid 9 and name HG1*) or (resid 9 and name HG2*)) (resid 10 and name HA) 5.000 3.2 0.0 
assign (resid 10 and name HG1) (resid 10 and name HA) 3.400 1.6 1.6 
assign (resid 10 and name HG2) (resid 10 and name HA) 5.000 3.2 0.0 
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) 3.400 1.6 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 12 and name HG) (resid 12 and name HA) 5.000 3.2 0.0 
assign (resid 13 and name HA) (resid 12 and name HA) 3.400 1.6 1.0 
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 16 and name HG*) (resid 16 and name HA) 3.400 1.6 1.6 
assign (resid 17 and name HG*) (resid 14 and name HA) 5.000 3.2 0.0 
assign (resid 18 and name HB1) (resid 18 and name HA) 2.800 1.0 0.6 
assign (resid 18 and name HB2) (resid 18 and name HA) 3.400 1.6 0.0 
assign (resid 19 and name HG*) (resid 19 and name HA) 2.800 1.0 0.0 
assign (resid 20 and name HB*) (resid 20 and name HA) 5.000 3.2 0.0 
assign (resid 21 and name HB*) (resid 18 and name HA) 5.000 3.2 0.0 
assign (resid 21 and name HD*) (resid 21 and name HA) 5.000 3.2 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 25 and name HB*) (resid 22 and name HA) 5.000 3.2 0.0 
assign (resid 25 and name HB*) (resid 25 and name HA) 3.400 1.6 0.0 
assign (resid 26 and name HB) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HD1*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HG11) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HG12) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HG2*) (resid 26 and name HA) 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 HG2*) (resid 25 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HB) (resid 28 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HA) 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 HG1*) (resid 28 and name HA) 5.000 3.2 0.0 
assign (resid 30 and name HB1) (resid 30 and name HA) 5.000 3.2 0.0 
assign (resid 30 and name HB2) (resid 30 and name HA) 3.400 1.6 1.6 
assign (resid 31 and name HB*) (resid 28 and name HA) 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 33 and name HB*) (resid 33 and name HA) 3.400 1.6 0.0
assign (resid 35 and name HB1) (resid 35 and name HA) 5.000 3.2 0.0 
assign (resid 35 and name HB2) (resid 35 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 36 and name HG2*) (resid 36 and name HA) 5.000 3.2 0.0 
assign (resid 37 and name HB1) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 37 and name HB2) (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 HA) 5.000 3.2 0.0 
assign (resid 38 and name HG2*) (resid 38 and name HB) 3.400 1.6 0.0 
assign (resid 39 and name HB*) (resid 39 and name HA) 2.800 1.0 2.2 
assign (resid 39 and name HD*) (resid 39 and name HA) 5.000 3.2 0.0 
assign ((resid 41 and name HD1*) or (resid 41 and name HD2*)) (resid 41 and name HA) 5.000 3.2 0.0 
assign (resid 42 and name HA*) (resid 43 and name HA) 5.000 3.2 0.0 
assign ((resid 44 and name HG1*) or (resid 44 and name HG2*)) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 45 and name HG*) (resid 45 and name HA) 5.000 3.2 0.0 
assign (resid 46 and name HB*) (resid 46 and name HA) 3.400 1.6 0.0 
assign (resid 46 and name HB*) (resid 46 and name HD1) 3.400 1.6 0.4 
assign (resid 46 and name HB*) (resid 46 and name HD2) 3.400 1.6 0.4 
assign (resid 46 and name HG*) (resid 46 and name HA) 5.000 3.2 0.0 
assign (resid 46 and name HG*) (resid 46 and name HD*) 5.000 3.2 0.0 
assign (resid 47 and name HG1) (resid 47 and name HA) 5.000 3.2 0.0 
assign (resid 47 and name HG2) (resid 47 and name HA) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 48 and name HA) 3.400 1.6 0.0 
assign (resid 48 and name HD2*) (resid 48 and name HA) 5.000 3.2 0.0
assign (resid 50 and name HB*) (resid 50 and name HA) 5.000 3.2 0.0 
assign (resid 50 and name HG*) (resid 50 and name HA) 2.800 1.0 1.4 
assign (resid 46 and name HB*) (resid 51 and name HA) 5.000 3.2 0.0 
assign (resid 51 and name HB*) (resid 50 and name HA) 5.000 3.2 0.0 
assign (resid 51 and name HB1) (resid 51 and name HA) 3.400 1.6 0.0 
assign (resid 51 and name HB2) (resid 51 and name HA) 3.400 1.6 0.0 
assign (resid 52 and name HD1) (resid 51 and name HA) 3.400 1.6 0.0 
assign (resid 52 and name HD2) (resid 51 and name HA) 3.400 1.6 0.0 
assign (resid 52 and name HB1) (resid 52 and name HA) 3.400 1.6 0.0 
assign (resid 52 and name HB2) (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 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 HD1) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 54 and name HD*) (resid 53 and name HA) 2.800 1.0 0.0 
assign (resid 54 and name HD2) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 58 and name HB*) (resid 58 and name HA) 3.400 1.6 0.0 
assign (resid 59 and name HG*) (resid 59 and name HA) 3.400 1.6 0.4
assign (resid 61 and name HG1*) (resid 38 and name HB) 3.400 1.6 1.1 
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) 5.000 3.2 0.0 
assign (resid 61 and name HG2*) (resid 61 and name HA) 5.000 3.2 0.0
assign (resid 62 and name HB*) (resid 59 and name HA) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 64 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 37 and name HA) (resid 71 and name HA) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 70 and name HA*) 5.000 3.2 0.0 
assign (resid 71 and name HB) (resid 71 and name HA) 3.400 1.6 0.0 
assign (resid 71 and name HG2*) (resid 71 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 73 and name HB1) (resid 73 and name HA) 3.400 1.6 0.0 
assign (resid 73 and name HB2) (resid 73 and name HA) 3.400 1.6 0.0 
assign (resid 74 and name HB1) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 74 and name HB2) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 75 and name HB1) (resid 75 and name HA) 3.400 1.6 1.6 
assign (resid 75 and name HB2) (resid 75 and name HA) 5.000 3.2 0.0 
assign (resid 76 and name HB*) (resid 76 and name HG*) 3.400 1.6 0.0 
assign (resid 77 and name HB1) (resid 77 and name HA) 5.000 3.2 0.0 
assign (resid 77 and name HB2) (resid 77 and name HA) 5.000 3.2 0.0 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*)) (resid 75 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HG*) (resid 78 and name HA) 3.400 1.6 0.2 
assign (resid 78 and name HD1*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HD2*) (resid 78 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 0.0 
assign (resid 81 and name HB*) (resid 81 and name HA) 5.000 3.2 0.0 
assign ((resid 82 and name HG1*) or (resid 82 and name HG2*)) (resid 5 and name HA) 5.000 3.2 0.4 
assign ((resid 82 and name HG2*) or (resid 82 and name HG1*)) (resid 79 and name HA) 5.000 3.2 0.0 
assign (resid 82 and name HB) (resid 82 and name HA) 2.800 1.0 2.2 
assign (resid 83 and name HB*) (resid 83 and name HA) 3.400 1.6 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 85 and name HB*) (resid 85 and name HG*) 5.000 3.2 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 89 and name HB*) (resid 89 and name HA) 2.800 1.0 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*) (resid 4 and name HG1*) 3.400 1.6 0.0 
assign (resid 4 and name HG1*) (resid 4 and name HB) 2.800 1.0 2.2 
assign (resid 4 and name HG2*) (resid 4 and name HB) 5.000 3.2 0.0 
assign (resid 4 and name HG2*) (resid 4 and name HG1*) 5.000 3.2 0.0 
assign ((resid 12 and name HD2*) or (resid 12 and name HD1*)) (resid 12 and name HB*) 5.000 3.2 0.0 
assign (resid 12 and name HB*) (resid 12 and name HG) 5.000 3.2 0.0 
assign (resid 16 and name HB*) (resid 16 and name HG*) 3.400 1.6 0.0 
assign (resid 21 and name HG1) (resid 21 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HG2) (resid 21 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HG*) (resid 21 and name HB2) 5.000 3.2 0.0 
assign (resid 21 and name HG*) (resid 21 and name HB1) 5.000 3.2 0.0 
assign (resid 26 and name HD1*) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 26 and name HG2*) (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*) (resid 26 and name HG1*) 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 HG11) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HG12) 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 28 and name HG2*) (resid 28 and name HG1*) 2.800 1.0 0.8 
assign (resid 28 and name HD1*) (resid 31 and name HB*) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) (resid 36 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 44 and name HG1*) or (resid 44 and name HG2*)) (resid 44 and name HB) 5.000 3.2 0.0 
assign (resid 45 and name HB*) (resid 45 and name HG*) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 48 and name HB*) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 48 and name HB*) 5.000 3.2 0.0 
assign (resid 50 and name HB*) (resid 50 and name HG*) 3.400 1.6 0.0 
assign ((resid 57 and name HD1*) or (resid 57 and name HD2*)) (resid 57 and name HB*) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 61 and name HB) 2.800 1.0 2.2 
assign (resid 61 and name HG2*) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign ((resid 64 and name HG2*) or (resid 64 and name HG1*)) (resid 64 and name HB) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) (resid 72 and name HG2*) 5.000 3.2 0.0 
assign ((resid 72 and name HG1*) or (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 78 and name HB1) (resid 78 and name HB2) 3.400 1.6 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 81 and name HG*) (resid 81 and name HB*) 5.000 3.2 0.0 
assign ((resid 82 and name HG2*) or (resid 82 and name HG1*)) (resid 82 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 66 and name HN) ((resid 64 and name HG1*) or (resid 64 and name HG2*)) 5.000 3.2 0.7 
assign (resid 29 and name HN) (resid 26 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 79 and name HG1*) or (resid 79 and name HG2*)) (resid 83 and name HN) 	 5.000 3.2 0.0
assign (resid 83 and name HN) (resid 79 and name HA) 	 5.000 3.2 0.0
assign ((resid 50 and name HB1) or (resid 50 and name HB2)) (resid 50 and name HN) 	 5.000 3.2 0.0
assign ((resid 18 and name HB1) or (resid 18 and name HB2)) (resid 15 and name HN) 	 5.000 3.2 0.6
assign (resid 75 and name HA) (resid 78 and name HN) 	 5.000 3.2 0.0
assign (resid 77 and name HA) (resid 79 and name HN) 	 5.000 3.2 0.0
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 17 and name HN) 	 2.427 0.727 2.573
assign (resid 58 and name HA) (resid 60 and name HN) 	 2.427 0.727 2.573
assign (resid 21 and name HD*) (resid 25 and name HN) 	 2.427 0.727 2.573
assign (resid 67 and name HA) (resid 69 and name HN) 	 2.427 0.727 2.673
assign (resid 80 and name HA) (resid 84 and name HN) 	 2.427 0.727 2.773
assign (resid 63 and name HG*) (resid 64 and name HN) 	 2.427 0.727 2.573
assign ((resid 8 and name HB2) or (resid 8 and name HB1)) (resid 11 and name HN) 	 2.467 0.767 2.833
assign ((resid 17 and name HG2) or (resid 17 and name HG1)) (resid 13 and name HN) 	 2.467 0.767 2.933
assign (resid 65 and name HA) (resid 67 and name HN) 	 2.467 0.767 2.533
assign ((resid 65 and name HB1) or (resid 65 and name HB2)) (resid 67 and name HN) 	 2.707 1.007 2.393
assign ((resid 65 and name HB1) or (resid 65 and name HB2)) (resid 68 and name HN) 	 2.707 1.007 2.393
assign ((resid 66 and name HB1) or (resid 66 and name HB2)) (resid 68 and name HN) 	 2.707 1.007 3.093
assign ((resid 54 and name HD1) or (resid 54 and name HD2)) (resid 53 and name HB) 5.000 3.2 0.0 
assign ((resid 52 and name HD1) or (resid 52 and name HD2)) (resid 52 and name HA) 5.000 3.2 0.0 
assign ((resid 59 and name HB1) or (resid 59 and name HB2)) (resid 59 and name HA) 5.000 3.2 0.0 
assign ((resid 35 and name HB1) or (resid 35 and name HB2)) (resid 71 and name HB) 5.000 3.2 0.0 
assign ((resid 17 and name HD1) or (resid 17 and name HD2)) (resid 17 and name HA) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 64 and name HA) 5.000 3.2 0.0 
assign ((resid 82 and name HG1*) or (resid 82 and name HG2*)) (resid 82 and name HA) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 71 and name HB) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 69 and name HB*) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 38 and name HA) 3.400 1.6 0.7 
assign (resid 29 and name HG*) (resid 26 and name HA) 3.400 1.6 1.6 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*)) (resid 20 and name HB1) 3.400 1.6 1.6 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*))(resid 20 and name HB2) 3.400 1.6 1.6 
assign (resid 52 and name HB*) (resid 52 and name HD*) 3.400 1.6 1.6 
assign (resid 45 and name HE*) (resid 45 and name HG*) 3.400 1.6 1.6 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 80 and name HG*) 3.400 1.6 1.6 
assign ((resid 78 and name HD1*) or (resid 78 and name HD2*)) (resid 78 and name HB*) 5.000 3.2 0.0 
assign ((resid 72 and name HG1*) or (resid 72 and name HG2*)) (resid 76 and name HB*) 5.000 3.2 0.0 
assign (resid 17 and name HG*) (resid 17 and name HB*) 5.000 3.2 0.0 
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 12 and name HB*) 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 86 and name HG*) (resid 86 and name HB*) 5.000 3.2 0.0 
assign (resid 78 and name HG) (resid 74 and name HE*) 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 24 and name HE*) (resid 77 and name HN) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 27 and name HD*) 5.000 3.2 0.0
assign (resid 2 and name HD2*) (resid 2 and name HA) 5.000 3.2 0.0 
assign (resid 2 and name HD21) (resid 2 and name HB1) 3.400 1.6 1.6 
assign (resid 2 and name HD21) (resid 2 and name HB2) 3.400 1.6 1.6 
assign (resid 2 and name HD22) (resid 2 and name HB1) 5.000 3.2 0.0 
assign (resid 2 and name HD22) (resid 2 and name HB2) 3.400 1.6 1.6 
assign (resid 11 and name HE21) (resid 7 and name HB*) 5.000 3.2 0.0 
assign (resid 11 and name HE22) (resid 7 and name HB*) 5.000 3.2 0.0 
assign (resid 11 and name HE2*) (resid 8 and name HA) 5.000 3.2 0.0 
assign (resid 11 and name HE21) (resid 11 and name HG*) 3.400 1.6 0.0 
assign (resid 11 and name HE22) (resid 11 and name HG*) 5.000 3.2 0.0 
assign (resid 16 and name HE21) (resid 12 and name HD2*) 5.000 3.2 0.0 
assign (resid 16 and name HE22) (resid 12 and name HD2*) 5.000 3.2 0.0 
assign (resid 16 and name HE21) (resid 16 and name HG1) 2.800 1.0 1.6 
assign (resid 16 and name HE22) (resid 16 and name HG1) 3.400 1.6 0.9 
assign (resid 16 and name HE21) (resid 16 and name HG2) 3.400 1.6 0.9 
assign (resid 16 and name HE22) (resid 16 and name HG2) 3.400 1.6 0.9 
assign (resid 18 and name HD2*) (resid 14 and name HB*) 5.000 3.2 0.0 
assign (resid 18 and name HD2*) (resid 15 and name HA) 5.000 3.2 0.0 
assign (resid 18 and name HD2*) (resid 18 and name HB1) 5.000 3.2 0.0 
assign (resid 18 and name HD2*) (resid 18 and name HB2) 3.400 1.6 1.6 
assign (resid 29 and name HE21) (resid 26 and name HG2*) 5.000 3.2 0.0 
assign (resid 29 and name HE22) (resid 26 and name HG2*) 5.000 3.2 0.0 
assign (resid 29 and name HE21) (resid 29 and name HG*) 5.000 3.2 0.0 
assign (resid 29 and name HE2*) (resid 29 and name HA) 3.400 1.6 1.0 
assign (resid 29 and name HE22) (resid 29 and name HG*) 2.800 1.0 2.2 
assign (resid 50 and name HE2*) (resid 48 and name HB*) 5.000 3.2 0.0 
assign (resid 50 and name HE21) (resid 49 and name HA*) 5.000 3.2 0.0 
assign (resid 50 and name HE22) (resid 49 and name HA*) 5.000 3.2 0.0 
assign (resid 50 and name HE2*) (resid 50 and name HA) 5.000 3.2 0.0 
assign (resid 50 and name HE21) (resid 50 and name HG*) 3.400 1.6 0.5 
assign (resid 50 and name HE22) (resid 50 and name HG*) 3.400 1.6 0.5 
assign (resid 51 and name HD21) (resid 51 and name HB1) 3.400 1.6 1.6 
assign (resid 51 and name HD21) (resid 51 and name HB2) 3.400 1.6 1.6 
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 HE21) (resid 57 and name HD1*) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (resid 57 and name HD1*) 5.000 3.2 0.0 
assign (resid 58 and name HE21) (resid 58 and name HA) 5.000 3.2 0.0 
assign (resid 58 and name HE2*) (resid 58 and name HB*) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (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*) 2.800 1.0 1.0 
assign (resid 58 and name HE21) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 58 and name HE21) (resid 61 and name HG2*) 3.400 1.6 1.6 
assign (resid 58 and name HE22) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign (resid 58 and name HE21) (resid 62 and name HN) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (resid 62 and name HN) 5.000 3.2 0.0 
assign (resid   2 and name    C) (resid   3 and name    N)
       (resid   3 and name   CA) (resid   3 and name    C)  1.0  -58.0   50.0 2
assign (resid   3 and name    C) (resid   4 and name    N)
       (resid   4 and name   CA) (resid   4 and name    C)  1.0  -65.5   30.0 2
assign (resid   7 and name    C) (resid   8 and name    N)
       (resid   8 and name   CA) (resid   8 and name    C)  1.0  -64.5   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  -61.0   20.0 2
assign (resid  11 and name    C) (resid  12 and name    N)
       (resid  12 and name   CA) (resid  12 and name    C)  1.0  -62.0   20.0 2
assign (resid  13 and name    C) (resid  14 and name    N)
       (resid  14 and name   CA) (resid  14 and name    C)  1.0  -51.5   20.0 2
assign (resid  14 and name    C) (resid  15 and name    N)
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assign (resid  15 and name    C) (resid  16 and name    N)
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assign (resid  16 and name    C) (resid  17 and name    N)
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assign (resid  18 and name    C) (resid  19 and name    N)
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assign (resid  20 and name    C) (resid  21 and name    N)
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assign (resid  21 and name    C) (resid  22 and name    N)
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assign (resid  22 and name    C) (resid  23 and name    N)
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assign (resid  28 and name    C) (resid  29 and name    N)
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assign (resid  29 and name    C) (resid  30 and name    N)
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assign (resid  30 and name    C) (resid  31 and name    N)
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assign (resid  32 and name    C) (resid  33 and name    N)
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assign (resid  34 and name    C) (resid  35 and name    N)
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assign (resid  35 and name    C) (resid  36 and name    N)
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assign (resid  36 and name    C) (resid  37 and name    N)
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assign (resid  38 and name    C) (resid  39 and name    N)
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assign (resid  39 and name    C) (resid  40 and name    N)
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assign (resid  40 and name    C) (resid  41 and name    N)
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assign (resid  42 and name    C) (resid  43 and name    N)
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assign (resid  43 and name    C) (resid  44 and name    N)
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assign (resid  44 and name    C) (resid  45 and name    N)
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assign (resid  45 and name    C) (resid  46 and name    N)
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assign (resid  46 and name    C) (resid  47 and name    N)
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assign (resid  49 and name    C) (resid  50 and name    N)
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assign (resid  50 and name    C) (resid  51 and name    N)
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assign (resid  54 and name    C) (resid  55 and name    N)
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assign (resid  55 and name    C) (resid  56 and name    N)
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assign (resid  56 and name    C) (resid  57 and name    N)
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assign (resid  57 and name    C) (resid  58 and name    N)
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assign (resid  59 and name    C) (resid  60 and name    N)
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assign (resid  61 and name    C) (resid  62 and name    N)
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assign (resid  65 and name    C) (resid  66 and name    N)
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assign (resid  66 and name    C) (resid  67 and name    N)
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assign (resid  68 and name    C) (resid  69 and name    N)
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assign (resid  71 and name    C) (resid  72 and name    N)
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assign (resid  72 and name    C) (resid  73 and name    N)
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assign (resid  73 and name    C) (resid  74 and name    N)
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assign (resid  74 and name    C) (resid  75 and name    N)
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assign (resid  75 and name    C) (resid  76 and name    N)
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assign (resid  76 and name    C) (resid  77 and name    N)
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assign (resid  77 and name    C) (resid  78 and name    N)
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assign (resid  79 and name    C) (resid  80 and name    N)
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assign (resid  80 and name    C) (resid  81 and name    N)
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assign (resid  81 and name    C) (resid  82 and name    N)
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assign (resid  84 and name    C) (resid  85 and name    N)
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assign (resid   2 and name N) (resid   2 and name CA)
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assign (resid   3 and name N) (resid   3 and name CA)
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assign (resid   4 and name N) (resid   4 and name CA)
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assign (resid   9 and name N) (resid   9 and name CA)
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assign (resid  10 and name N) (resid  10 and name CA)
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assign (resid  11 and name N) (resid  11 and name CA)
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assign (resid  13 and name N) (resid  13 and name CA)
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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)
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assign (resid  17 and name N) (resid  17 and name CA)
       (resid  17 and name C) (resid  18 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)
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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  30 and name N) (resid  30 and name CA)
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assign (resid  31 and name N) (resid  31 and name CA)
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assign (resid  32 and name N) (resid  32 and name CA)
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assign (resid  43 and name N) (resid  43 and name CA)
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assign (resid  46 and name N) (resid  46 and name CA)
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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  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 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  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  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  72 and name N) (resid  72 and name CA)
       (resid  72 and name C) (resid  73 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  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   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   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   24 and name n )   (resid  24 and name  ca )
       (resid   24 and name cb)   (resid  24 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   29 and name n )   (resid  29 and name  ca )
       (resid   29 and name cb)   (resid  29 and name  cg )  1.0 180 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   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   65 and name n )   (resid  65 and name  ca )
       (resid   65 and name cb)   (resid  65 and name  cg)  1.0 180 50 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   77 and name n )   (resid  77 and name  ca )
       (resid   77 and name cb)   (resid  77 and name  cg )  1.0 180 50 2 
assign (resid   80 and name n )   (resid  80 and name  ca )
       (resid   80 and name cb)   (resid  80 and name  cg )  1.0 180 50 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  -4.518   8.980   9.889
    2   2H    MET   1          2H        MET   1  -4.941  10.448  10.633
    3   3H    MET   1          3H        MET   1  -3.706  10.409   9.467
    4    HA   MET   1           HA       MET   1  -6.574   9.820   8.960
    5   1HB   MET   1          2HB       MET   1  -4.922  12.284   8.828
    6   2HB   MET   1          1HB       MET   1  -5.961  11.985   7.434
    7   1HG   MET   1          2HG       MET   1  -7.926  12.030   8.728
    8   2HG   MET   1          1HG       MET   1  -7.050  11.744  10.233
    9   1HE   MET   1          1HE       MET   1  -6.430  14.399   7.226
   10   2HE   MET   1          2HE       MET   1  -7.557  15.599   7.852
   11   3HE   MET   1          3HE       MET   1  -8.127  13.972   7.489
   12    H    ASN   2           H        ASN   2  -6.482   8.137   7.579
   13    HA   ASN   2           HA       ASN   2  -4.546   8.257   5.339
   14   1HB   ASN   2          2HB       ASN   2  -5.977   5.847   6.493
   15   2HB   ASN   2          1HB       ASN   2  -4.845   5.820   5.141
   16   1HD2  ASN   2          1HD2      ASN   2  -5.027   6.749   8.616
   17   2HD2  ASN   2          2HD2      ASN   2  -3.391   6.433   8.936
   18    H    ASP   3           H        ASP   3  -7.244   9.557   5.626
   19    HA   ASP   3           HA       ASP   3  -8.998   8.156   3.806
   20   1HB   ASP   3          2HB       ASP   3 -10.441  10.130   4.005
   21   2HB   ASP   3          1HB       ASP   3  -9.914   9.582   5.595
   22    H    ILE   4           H        ILE   4  -6.335  10.302   3.443
   23    HA   ILE   4           HA       ILE   4  -7.096  11.666   1.083
   24    HB   ILE   4           HB       ILE   4  -4.671  12.075   0.758
   25   1HG1  ILE   4          2HG1      ILE   4  -3.395  11.185   2.984
   26   2HG1  ILE   4          1HG1      ILE   4  -4.516   9.849   2.728
   27   1HG2  ILE   4          1HG2      ILE   4  -6.005  13.480   2.293
   28   2HG2  ILE   4          2HG2      ILE   4  -4.341  13.319   2.852
   29   3HG2  ILE   4          3HG2      ILE   4  -5.623  12.384   3.621
   30   1HD1  ILE   4          1HD1      ILE   4  -2.987  10.919   0.381
   31   2HD1  ILE   4          2HD1      ILE   4  -3.594   9.289   0.669
   32   3HD1  ILE   4          3HD1      ILE   4  -2.162   9.859   1.524
   33    H    TYR   5           H        TYR   5  -5.707   8.476   1.602
   34    HA   TYR   5           HA       TYR   5  -4.893   7.977  -1.078
   35   1HB   TYR   5          2HB       TYR   5  -5.767   5.951   1.001
   36   2HB   TYR   5          1HB       TYR   5  -4.830   5.616  -0.454
   37    HD1  TYR   5           HD1      TYR   5  -4.699   6.607   2.995
   38    HD2  TYR   5           HD2      TYR   5  -2.545   6.802  -0.720
   39    HE1  TYR   5           HE1      TYR   5  -2.621   7.139   4.230
   40    HE2  TYR   5           HE2      TYR   5  -0.466   7.343   0.522
   41    HH   TYR   5           HH       TYR   5   0.216   6.744   3.306
   42    H    LYS   6           H        LYS   6  -7.928   7.479   0.667
   43    HA   LYS   6           HA       LYS   6  -9.219   6.199  -1.604
   44   1HB   LYS   6          2HB       LYS   6 -10.096   6.965   1.167
   45   2HB   LYS   6          1HB       LYS   6 -11.283   6.516  -0.057
   46   1HG   LYS   6          2HG       LYS   6 -10.648   4.322  -0.063
   47   2HG   LYS   6          1HG       LYS   6  -8.944   4.708   0.171
   48   1HD   LYS   6          2HD       LYS   6 -10.918   5.157   2.401
   49   2HD   LYS   6          1HD       LYS   6 -10.244   3.551   2.120
   50   1HE   LYS   6          2HE       LYS   6  -8.423   5.943   2.303
   51   2HE   LYS   6          1HE       LYS   6  -9.009   5.159   3.769
   52   1HZ   LYS   6          1HZ       LYS   6  -8.162   3.038   2.854
   53   2HZ   LYS   6          2HZ       LYS   6  -6.940   4.178   3.155
   54   3HZ   LYS   6          3HZ       LYS   6  -7.470   3.898   1.565
   55    H    ALA   7           H        ALA   7  -9.067   9.395  -0.134
   56    HA   ALA   7           HA       ALA   7 -11.318  10.537  -1.414
   57   1HB   ALA   7          1HB       ALA   7 -10.394  12.672  -0.792
   58   2HB   ALA   7          2HB       ALA   7  -8.786  11.975  -0.596
   59   3HB   ALA   7          3HB       ALA   7 -10.078  11.542   0.524
   60    H    ALA   8           H        ALA   8  -7.941  10.147  -2.426
   61    HA   ALA   8           HA       ALA   8  -8.158  11.806  -4.753
   62   1HB   ALA   8          1HB       ALA   8  -5.980  11.309  -3.718
   63   2HB   ALA   8          2HB       ALA   8  -6.014  10.817  -5.411
   64   3HB   ALA   8          3HB       ALA   8  -6.173   9.606  -4.137
   65    H    VAL   9           H        VAL   9  -8.351   8.298  -4.184
   66    HA   VAL   9           HA       VAL   9  -8.685   7.604  -6.929
   67    HB   VAL   9           HB       VAL   9  -7.953   6.043  -5.083
   68   1HG1  VAL   9          1HG1      VAL   9  -9.590   6.564  -3.391
   69   2HG1  VAL   9          2HG1      VAL   9  -9.813   4.882  -3.866
   70   3HG1  VAL   9          3HG1      VAL   9 -10.916   6.120  -4.463
   71   1HG2  VAL   9          1HG2      VAL   9 -10.341   5.071  -6.680
   72   2HG2  VAL   9          2HG2      VAL   9  -8.978   4.107  -6.111
   73   3HG2  VAL   9          3HG2      VAL   9  -8.737   5.317  -7.371
   74    H    GLU  10           H        GLU  10 -10.838   8.870  -4.529
   75    HA   GLU  10           HA       GLU  10 -13.264   7.996  -5.846
   76   1HB   GLU  10          2HB       GLU  10 -12.656   9.744  -3.481
   77   2HB   GLU  10          1HB       GLU  10 -14.268   9.746  -4.197
   78   1HG   GLU  10          2HG       GLU  10 -14.482   7.351  -3.854
   79   2HG   GLU  10          1HG       GLU  10 -12.814   7.243  -3.292
   80    H    GLN  11           H        GLN  11 -11.079  10.691  -6.102
   81    HA   GLN  11           HA       GLN  11 -12.943  11.938  -8.030
   82   1HB   GLN  11          2HB       GLN  11 -12.302  14.171  -7.272
   83   2HB   GLN  11          1HB       GLN  11 -13.006  13.257  -5.941
   84   1HG   GLN  11          2HG       GLN  11 -10.393  12.596  -5.628
   85   2HG   GLN  11          1HG       GLN  11 -10.219  14.206  -6.321
   86   1HE2  GLN  11          1HE2      GLN  11  -9.606  15.309  -4.376
   87   2HE2  GLN  11          2HE2      GLN  11 -10.641  15.454  -3.038
   88    H    LEU  12           H        LEU  12 -10.722  10.135  -8.473
   89    HA   LEU  12           HA       LEU  12  -8.452  11.673  -9.373
   90   1HB   LEU  12          2HB       LEU  12  -8.015   9.420 -10.664
   91   2HB   LEU  12          1HB       LEU  12  -7.724   9.560  -8.948
   92    HG   LEU  12           HG       LEU  12  -9.785   8.386  -8.456
   93   1HD1  LEU  12          1HD1      LEU  12 -10.994   7.377 -10.541
   94   2HD1  LEU  12          2HD1      LEU  12 -10.239   8.712 -11.413
   95   3HD1  LEU  12          3HD1      LEU  12 -11.344   9.043 -10.078
   96   1HD2  LEU  12          1HD2      LEU  12  -7.868   6.971  -8.877
   97   2HD2  LEU  12          2HD2      LEU  12  -8.114   7.081 -10.620
   98   3HD2  LEU  12          3HD2      LEU  12  -9.275   6.210  -9.619
   99    H    THR  13           H        THR  13  -7.686  11.299 -11.726
  100    HA   THR  13           HA       THR  13  -9.837  12.277 -13.472
  101    HB   THR  13           HB       THR  13  -7.591  12.404 -15.007
  102    HG1  THR  13           HG1      THR  13  -6.134  11.784 -13.529
  103   1HG2  THR  13          1HG2      THR  13  -9.015  14.257 -13.178
  104   2HG2  THR  13          2HG2      THR  13  -8.718  14.384 -14.913
  105   3HG2  THR  13          3HG2      THR  13  -7.440  14.790 -13.767
  106    H    ASP  14           H        ASP  14  -9.794  11.573 -15.757
  107    HA   ASP  14           HA       ASP  14 -10.070   8.738 -15.961
  108   1HB   ASP  14          2HB       ASP  14 -11.318  10.489 -17.330
  109   2HB   ASP  14          1HB       ASP  14  -9.838  10.674 -18.269
  110    H    GLU  15           H        GLU  15  -7.517  11.036 -16.693
  111    HA   GLU  15           HA       GLU  15  -5.896   9.461 -18.369
  112   1HB   GLU  15          2HB       GLU  15  -5.271  11.683 -16.428
  113   2HB   GLU  15          1HB       GLU  15  -3.999  10.873 -17.343
  114   1HG   GLU  15          2HG       GLU  15  -6.447  12.068 -18.664
  115   2HG   GLU  15          1HG       GLU  15  -4.959  12.981 -18.416
  116    H    GLN  16           H        GLN  16  -6.261   9.539 -14.854
  117    HA   GLN  16           HA       GLN  16  -4.011   7.850 -14.278
  118   1HB   GLN  16          2HB       GLN  16  -6.250   9.040 -12.764
  119   2HB   GLN  16          1HB       GLN  16  -5.688   7.485 -12.149
  120   1HG   GLN  16          2HG       GLN  16  -3.299   8.603 -12.526
  121   2HG   GLN  16          1HG       GLN  16  -4.232  10.088 -12.335
  122   1HE2  GLN  16          1HE2      GLN  16  -5.317  10.448 -10.250
  123   2HE2  GLN  16          2HE2      GLN  16  -4.875   9.556  -8.874
  124    H    LYS  17           H        LYS  17  -7.476   7.335 -14.779
  125    HA   LYS  17           HA       LYS  17  -7.519   4.558 -14.164
  126   1HB   LYS  17          2HB       LYS  17  -9.380   6.143 -15.952
  127   2HB   LYS  17          1HB       LYS  17  -9.696   4.535 -15.305
  128   1HG   LYS  17          2HG       LYS  17  -9.231   7.028 -13.638
  129   2HG   LYS  17          1HG       LYS  17 -10.802   6.294 -13.956
  130   1HD   LYS  17          2HD       LYS  17  -8.942   4.303 -12.984
  131   2HD   LYS  17          1HD       LYS  17  -9.030   5.660 -11.864
  132   1HE   LYS  17          2HE       LYS  17 -11.310   5.359 -11.466
  133   2HE   LYS  17          1HE       LYS  17 -11.568   4.517 -12.994
  134   1HZ   LYS  17          1HZ       LYS  17  -9.932   3.395 -10.789
  135   2HZ   LYS  17          2HZ       LYS  17 -10.516   2.591 -12.167
  136   3HZ   LYS  17          3HZ       LYS  17 -11.592   3.091 -10.952
  137    H    ASN  18           H        ASN  18  -6.307   6.269 -16.894
  138    HA   ASN  18           HA       ASN  18  -6.414   3.831 -18.560
  139   1HB   ASN  18          2HB       ASN  18  -6.191   6.755 -19.223
  140   2HB   ASN  18          1HB       ASN  18  -5.646   5.532 -20.371
  141   1HD2  ASN  18          1HD2      ASN  18  -8.266   7.401 -19.816
  142   2HD2  ASN  18          2HD2      ASN  18  -9.503   6.355 -20.321
  143    H    GLU  19           H        GLU  19  -4.258   6.145 -17.033
  144    HA   GLU  19           HA       GLU  19  -1.859   5.556 -18.366
  145   1HB   GLU  19          2HB       GLU  19  -2.276   7.407 -16.656
  146   2HB   GLU  19          1HB       GLU  19  -2.043   6.177 -15.414
  147   1HG   GLU  19          2HG       GLU  19   0.193   5.684 -16.284
  148   2HG   GLU  19          1HG       GLU  19  -0.037   6.850 -17.588
  149    H    PHE  20           H        PHE  20  -3.095   4.202 -15.300
  150    HA   PHE  20           HA       PHE  20  -1.059   2.160 -15.220
  151   1HB   PHE  20          2HB       PHE  20  -3.451   2.834 -13.544
  152   2HB   PHE  20          1HB       PHE  20  -2.672   1.264 -13.366
  153    HD1  PHE  20           HD1      PHE  20  -2.249   4.912 -12.998
  154    HD2  PHE  20           HD2      PHE  20  -0.411   1.068 -12.481
  155    HE1  PHE  20           HE1      PHE  20  -0.483   5.940 -11.602
  156    HE2  PHE  20           HE2      PHE  20   1.350   2.089 -11.079
  157    HZ   PHE  20           HZ       PHE  20   1.320   4.533 -10.640
  158    H    LYS  21           H        LYS  21  -4.495   2.316 -16.115
  159    HA   LYS  21           HA       LYS  21  -5.033  -0.420 -16.326
  160   1HB   LYS  21          2HB       LYS  21  -6.777   1.287 -16.482
  161   2HB   LYS  21          1HB       LYS  21  -6.129   1.828 -18.026
  162   1HG   LYS  21          2HG       LYS  21  -6.570  -1.041 -18.053
  163   2HG   LYS  21          1HG       LYS  21  -8.048  -0.190 -17.608
  164   1HD   LYS  21          2HD       LYS  21  -7.306   1.389 -19.634
  165   2HD   LYS  21          1HD       LYS  21  -6.500  -0.089 -20.161
  166   1HE   LYS  21          2HE       LYS  21  -9.318  -0.349 -19.223
  167   2HE   LYS  21          1HE       LYS  21  -9.060   0.438 -20.779
  168   1HZ   LYS  21          1HZ       LYS  21  -9.338  -1.971 -20.987
  169   2HZ   LYS  21          2HZ       LYS  21  -7.970  -2.218 -20.011
  170   3HZ   LYS  21          3HZ       LYS  21  -7.812  -1.467 -21.528
  171    H    ALA  22           H        ALA  22  -3.312   1.717 -18.546
  172    HA   ALA  22           HA       ALA  22  -3.340   0.101 -20.852
  173   1HB   ALA  22          1HB       ALA  22  -1.437   1.367 -21.598
  174   2HB   ALA  22          2HB       ALA  22  -1.020   1.819 -19.945
  175   3HB   ALA  22          3HB       ALA  22  -2.473   2.475 -20.697
  176    H    ALA  23           H        ALA  23  -0.850   0.338 -18.302
  177    HA   ALA  23           HA       ALA  23   0.649  -1.918 -19.197
  178   1HB   ALA  23          1HB       ALA  23   1.684  -0.199 -17.791
  179   2HB   ALA  23          2HB       ALA  23   1.763  -1.766 -16.987
  180   3HB   ALA  23          3HB       ALA  23   0.566  -0.576 -16.480
  181    H    PHE  24           H        PHE  24  -1.969  -1.424 -16.896
  182    HA   PHE  24           HA       PHE  24  -1.951  -3.903 -15.584
  183   1HB   PHE  24          2HB       PHE  24  -3.356  -1.823 -15.053
  184   2HB   PHE  24          1HB       PHE  24  -4.465  -2.388 -16.300
  185    HD1  PHE  24           HD1      PHE  24  -5.407  -4.772 -16.086
  186    HD2  PHE  24           HD2      PHE  24  -3.431  -2.726 -12.871
  187    HE1  PHE  24           HE1      PHE  24  -6.437  -6.331 -14.460
  188    HE2  PHE  24           HE2      PHE  24  -4.458  -4.286 -11.248
  189    HZ   PHE  24           HZ       PHE  24  -5.962  -6.085 -12.042
  190    H    ASP  25           H        ASP  25  -3.526  -2.902 -18.620
  191    HA   ASP  25           HA       ASP  25  -4.933  -5.323 -19.072
  192   1HB   ASP  25          2HB       ASP  25  -5.145  -2.966 -20.221
  193   2HB   ASP  25          1HB       ASP  25  -3.981  -3.644 -21.360
  194    H    ILE  26           H        ILE  26  -1.766  -4.187 -20.282
  195    HA   ILE  26           HA       ILE  26  -1.270  -6.471 -21.897
  196    HB   ILE  26           HB       ILE  26   1.110  -5.728 -21.884
  197   1HG1  ILE  26          2HG1      ILE  26   0.083  -3.530 -20.060
  198   2HG1  ILE  26          1HG1      ILE  26   1.097  -4.868 -19.527
  199   1HG2  ILE  26          1HG2      ILE  26   0.697  -3.799 -23.193
  200   2HG2  ILE  26          2HG2      ILE  26  -0.716  -3.350 -22.237
  201   3HG2  ILE  26          3HG2      ILE  26  -0.792  -4.737 -23.323
  202   1HD1  ILE  26          1HD1      ILE  26   1.871  -2.407 -20.832
  203   2HD1  ILE  26          2HD1      ILE  26   2.394  -3.797 -21.785
  204   3HD1  ILE  26          3HD1      ILE  26   2.893  -3.643 -20.100
  205    H    PHE  27           H        PHE  27  -0.477  -5.748 -18.509
  206    HA   PHE  27           HA       PHE  27   1.068  -8.168 -18.174
  207   1HB   PHE  27          2HB       PHE  27  -0.020  -6.185 -16.162
  208   2HB   PHE  27          1HB       PHE  27   0.974  -7.577 -15.732
  209    HD1  PHE  27           HD1      PHE  27   1.211  -4.205 -16.144
  210    HD2  PHE  27           HD2      PHE  27   3.061  -7.785 -17.634
  211    HE1  PHE  27           HE1      PHE  27   3.245  -2.916 -16.729
  212    HE2  PHE  27           HE2      PHE  27   5.092  -6.493 -18.214
  213    HZ   PHE  27           HZ       PHE  27   5.184  -4.057 -17.764
  214    H    ILE  28           H        ILE  28  -2.287  -7.212 -17.691
  215    HA   ILE  28           HA       ILE  28  -2.891  -9.843 -16.513
  216    HB   ILE  28           HB       ILE  28  -3.680  -7.467 -15.617
  217   1HG1  ILE  28          2HG1      ILE  28  -4.128  -9.774 -14.701
  218   2HG1  ILE  28          1HG1      ILE  28  -5.394  -8.589 -14.391
  219   1HG2  ILE  28          1HG2      ILE  28  -4.898  -7.156 -17.927
  220   2HG2  ILE  28          2HG2      ILE  28  -5.674  -6.626 -16.436
  221   3HG2  ILE  28          3HG2      ILE  28  -6.146  -8.152 -17.176
  222   1HD1  ILE  28          1HD1      ILE  28  -6.621  -9.471 -16.395
  223   2HD1  ILE  28          2HD1      ILE  28  -6.432 -10.663 -15.109
  224   3HD1  ILE  28          3HD1      ILE  28  -5.394 -10.730 -16.533
  225    H    GLN  29           H        GLN  29  -2.148  -9.637 -19.242
  226    HA   GLN  29           HA       GLN  29  -4.500  -9.740 -20.911
  227   1HB   GLN  29          2HB       GLN  29  -2.224  -9.005 -21.710
  228   2HB   GLN  29          1HB       GLN  29  -1.700 -10.682 -21.568
  229   1HG   GLN  29          2HG       GLN  29  -2.355 -10.435 -23.837
  230   2HG   GLN  29          1HG       GLN  29  -3.699 -11.270 -23.059
  231   1HE2  GLN  29          1HE2      GLN  29  -2.634  -7.881 -23.758
  232   2HE2  GLN  29          2HE2      GLN  29  -4.200  -7.308 -24.073
  233    H    ASP  30           H        ASP  30  -2.062 -12.123 -19.851
  234    HA   ASP  30           HA       ASP  30  -3.710 -14.338 -20.764
  235   1HB   ASP  30          2HB       ASP  30  -1.014 -14.202 -19.407
  236   2HB   ASP  30          1HB       ASP  30  -1.823 -15.721 -19.793
  237    H    ALA  31           H        ALA  31  -3.845 -12.430 -18.041
  238    HA   ALA  31           HA       ALA  31  -4.476 -14.641 -16.208
  239   1HB   ALA  31          1HB       ALA  31  -3.269 -13.175 -14.923
  240   2HB   ALA  31          2HB       ALA  31  -4.871 -12.478 -14.681
  241   3HB   ALA  31          3HB       ALA  31  -3.768 -11.770 -15.864
  242    H    GLU  32           H        GLU  32  -6.468 -14.707 -15.091
  243    HA   GLU  32           HA       GLU  32  -8.672 -13.149 -16.298
  244   1HB   GLU  32          2HB       GLU  32  -8.573 -16.140 -15.856
  245   2HB   GLU  32          1HB       GLU  32 -10.073 -15.255 -16.133
  246   1HG   GLU  32          2HG       GLU  32  -9.155 -14.399 -18.276
  247   2HG   GLU  32          1HG       GLU  32  -7.687 -15.341 -18.007
  248    H    ASP  33           H        ASP  33  -7.359 -12.566 -13.887
  249    HA   ASP  33           HA       ASP  33  -9.401 -13.297 -11.866
  250   1HB   ASP  33          2HB       ASP  33  -6.499 -12.553 -11.413
  251   2HB   ASP  33          1HB       ASP  33  -7.673 -12.930 -10.153
  252    H    GLY  34           H        GLY  34  -7.334 -10.714 -13.144
  253   1HA   GLY  34          2HA       GLY  34  -8.229  -8.485 -13.443
  254   2HA   GLY  34          1HA       GLY  34  -9.187  -8.723 -11.984
  255    H    CYS  35           H        CYS  35  -5.769  -9.515 -12.474
  256    HA   CYS  35           HA       CYS  35  -4.806  -7.223 -11.002
  257   1HB   CYS  35          2HB       CYS  35  -3.752  -8.656  -9.208
  258   2HB   CYS  35          1HB       CYS  35  -5.501  -8.488  -9.087
  259    HG   CYS  35           HG       CYS  35  -4.057 -11.060 -10.122
  260    H    ILE  36           H        ILE  36  -2.587  -6.949 -11.211
  261    HA   ILE  36           HA       ILE  36  -1.337  -8.588 -13.282
  262    HB   ILE  36           HB       ILE  36   0.378  -6.908 -13.403
  263   1HG1  ILE  36          2HG1      ILE  36  -0.246  -4.899 -11.596
  264   2HG1  ILE  36          1HG1      ILE  36  -0.480  -6.366 -10.644
  265   1HG2  ILE  36          1HG2      ILE  36  -2.276  -5.529 -12.904
  266   2HG2  ILE  36          2HG2      ILE  36  -1.825  -6.338 -14.405
  267   3HG2  ILE  36          3HG2      ILE  36  -0.942  -4.906 -13.874
  268   1HD1  ILE  36          1HD1      ILE  36   2.006  -5.759 -12.275
  269   2HD1  ILE  36          2HD1      ILE  36   1.765  -7.142 -11.207
  270   3HD1  ILE  36          3HD1      ILE  36   1.867  -5.516 -10.533
  271    H    SER  37           H        SER  37   1.119  -9.008 -12.908
  272    HA   SER  37           HA       SER  37   1.302 -10.550 -10.426
  273   1HB   SER  37          2HB       SER  37   2.054 -11.177 -12.969
  274   2HB   SER  37          1HB       SER  37   3.580 -10.604 -12.304
  275    HG   SER  37           HG       SER  37   3.242 -12.066 -10.556
  276    H    THR  38           H        THR  38   2.052  -9.513  -8.705
  277    HA   THR  38           HA       THR  38   3.442  -7.108  -8.595
  278    HB   THR  38           HB       THR  38   4.130  -7.778  -6.307
  279    HG1  THR  38           HG1      THR  38   3.945  -9.809  -5.656
  280   1HG2  THR  38          1HG2      THR  38   1.306  -8.412  -7.175
  281   2HG2  THR  38          2HG2      THR  38   1.915  -6.892  -6.525
  282   3HG2  THR  38          3HG2      THR  38   1.788  -8.308  -5.483
  283    H    LYS  39           H        LYS  39   4.741 -10.421  -8.682
  284    HA   LYS  39           HA       LYS  39   7.474  -9.739  -8.410
  285   1HB   LYS  39          2HB       LYS  39   7.959 -11.961  -9.299
  286   2HB   LYS  39          1HB       LYS  39   6.636 -12.047  -8.139
  287   1HG   LYS  39          2HG       LYS  39   5.256 -11.623 -10.462
  288   2HG   LYS  39          1HG       LYS  39   6.627 -12.560 -11.054
  289   1HD   LYS  39          2HD       LYS  39   5.088 -13.435  -8.611
  290   2HD   LYS  39          1HD       LYS  39   4.542 -13.864 -10.232
  291   1HE   LYS  39          2HE       LYS  39   6.956 -14.709 -10.615
  292   2HE   LYS  39          1HE       LYS  39   7.118 -14.632  -8.861
  293   1HZ   LYS  39          1HZ       LYS  39   5.097 -16.035  -8.718
  294   2HZ   LYS  39          2HZ       LYS  39   6.415 -16.813  -9.457
  295   3HZ   LYS  39          3HZ       LYS  39   5.138 -16.214 -10.404
  296    H    GLU  40           H        GLU  40   5.302  -9.608 -11.151
  297    HA   GLU  40           HA       GLU  40   7.537  -9.125 -13.005
  298   1HB   GLU  40          2HB       GLU  40   4.577  -9.505 -13.516
  299   2HB   GLU  40          1HB       GLU  40   5.787  -9.219 -14.767
  300   1HG   GLU  40          2HG       GLU  40   7.016 -11.262 -13.908
  301   2HG   GLU  40          1HG       GLU  40   5.611 -11.591 -12.893
  302    H    LEU  41           H        LEU  41   6.289  -7.226 -10.843
  303    HA   LEU  41           HA       LEU  41   5.141  -5.067 -12.325
  304   1HB   LEU  41          2HB       LEU  41   4.958  -5.569  -9.800
  305   2HB   LEU  41          1HB       LEU  41   6.501  -4.753  -9.672
  306    HG   LEU  41           HG       LEU  41   4.416  -3.270 -11.157
  307   1HD1  LEU  41          1HD1      LEU  41   4.099  -2.984  -8.249
  308   2HD1  LEU  41          2HD1      LEU  41   3.561  -4.548  -8.865
  309   3HD1  LEU  41          3HD1      LEU  41   2.871  -3.060  -9.514
  310   1HD2  LEU  41          1HD2      LEU  41   6.221  -1.912 -10.768
  311   2HD2  LEU  41          2HD2      LEU  41   6.703  -2.791  -9.317
  312   3HD2  LEU  41          3HD2      LEU  41   5.385  -1.620  -9.243
  313    H    GLY  42           H        GLY  42   8.354  -6.189 -12.029
  314   1HA   GLY  42          2HA       GLY  42   9.866  -3.825 -12.032
  315   2HA   GLY  42          1HA       GLY  42  10.359  -5.342 -12.785
  316    H    LYS  43           H        LYS  43   8.129  -5.502 -14.615
  317    HA   LYS  43           HA       LYS  43   9.143  -3.873 -16.761
  318   1HB   LYS  43          2HB       LYS  43   6.644  -5.592 -16.656
  319   2HB   LYS  43          1HB       LYS  43   7.381  -4.924 -18.112
  320   1HG   LYS  43          2HG       LYS  43   9.030  -6.629 -16.261
  321   2HG   LYS  43          1HG       LYS  43   7.931  -7.394 -17.408
  322   1HD   LYS  43          2HD       LYS  43   9.744  -5.241 -18.425
  323   2HD   LYS  43          1HD       LYS  43  10.444  -6.823 -18.084
  324   1HE   LYS  43          2HE       LYS  43   8.553  -7.819 -19.478
  325   2HE   LYS  43          1HE       LYS  43   8.192  -6.173 -19.996
  326   1HZ   LYS  43          1HZ       LYS  43  10.441  -5.965 -20.829
  327   2HZ   LYS  43          2HZ       LYS  43   9.673  -7.301 -21.543
  328   3HZ   LYS  43          3HZ       LYS  43  10.814  -7.535 -20.306
  329    H    VAL  44           H        VAL  44   6.620  -3.578 -14.398
  330    HA   VAL  44           HA       VAL  44   5.021  -1.645 -15.808
  331    HB   VAL  44           HB       VAL  44   5.106  -2.105 -12.817
  332   1HG1  VAL  44          1HG1      VAL  44   2.817  -1.261 -14.605
  333   2HG1  VAL  44          2HG1      VAL  44   3.892  -0.108 -13.814
  334   3HG1  VAL  44          3HG1      VAL  44   2.897  -1.192 -12.845
  335   1HG2  VAL  44          1HG2      VAL  44   3.707  -3.947 -13.013
  336   2HG2  VAL  44          2HG2      VAL  44   4.718  -4.176 -14.439
  337   3HG2  VAL  44          3HG2      VAL  44   3.113  -3.460 -14.598
  338    H    MET  45           H        MET  45   7.269  -1.512 -13.042
  339    HA   MET  45           HA       MET  45   7.271   1.250 -12.658
  340   1HB   MET  45          2HB       MET  45   8.642  -0.909 -11.557
  341   2HB   MET  45          1HB       MET  45   9.915   0.090 -12.257
  342   1HG   MET  45          2HG       MET  45   9.681   1.076 -10.161
  343   2HG   MET  45          1HG       MET  45   8.575   2.060 -11.119
  344   1HE   MET  45          1HE       MET  45   7.509   2.750  -8.695
  345   2HE   MET  45          2HE       MET  45   5.857   2.142  -8.722
  346   3HE   MET  45          3HE       MET  45   6.585   2.755 -10.204
  347    H    ARG  46           H        ARG  46   9.257  -0.744 -14.836
  348    HA   ARG  46           HA       ARG  46  10.960   1.317 -15.768
  349   1HB   ARG  46          2HB       ARG  46  10.015  -1.236 -17.077
  350   2HB   ARG  46          1HB       ARG  46  11.190  -0.152 -17.823
  351   1HG   ARG  46          2HG       ARG  46  12.636  -0.360 -15.827
  352   2HG   ARG  46          1HG       ARG  46  11.471  -1.476 -15.114
  353   1HD   ARG  46          2HD       ARG  46  13.189  -2.814 -16.132
  354   2HD   ARG  46          1HD       ARG  46  11.760  -2.941 -17.149
  355    HE   ARG  46           HE       ARG  46  13.468  -0.822 -18.036
  356   1HH1  ARG  46          2HH1      ARG  46  13.103  -4.296 -18.003
  357   2HH1  ARG  46          1HH1      ARG  46  13.996  -4.528 -19.466
  358   1HH2  ARG  46          1HH2      ARG  46  14.637  -1.151 -19.951
  359   2HH2  ARG  46          2HH2      ARG  46  14.863  -2.754 -20.568
  360    H    MET  47           H        MET  47   7.742   0.287 -16.752
  361    HA   MET  47           HA       MET  47   7.601   2.017 -19.058
  362   1HB   MET  47          2HB       MET  47   5.560   0.406 -17.530
  363   2HB   MET  47          1HB       MET  47   5.095   1.487 -18.842
  364   1HG   MET  47          2HG       MET  47   7.232  -0.624 -19.185
  365   2HG   MET  47          1HG       MET  47   5.528  -0.957 -19.484
  366   1HE   MET  47          1HE       MET  47   8.703   0.494 -20.364
  367   2HE   MET  47          2HE       MET  47   8.581   1.048 -22.033
  368   3HE   MET  47          3HE       MET  47   8.403  -0.666 -21.665
  369    H    LEU  48           H        LEU  48   6.755   2.241 -15.652
  370    HA   LEU  48           HA       LEU  48   5.163   4.616 -15.853
  371   1HB   LEU  48          2HB       LEU  48   6.379   3.026 -13.653
  372   2HB   LEU  48          1HB       LEU  48   5.962   4.688 -13.307
  373    HG   LEU  48           HG       LEU  48   3.665   4.292 -13.542
  374   1HD1  LEU  48          1HD1      LEU  48   4.558   2.057 -15.311
  375   2HD1  LEU  48          2HD1      LEU  48   3.274   3.237 -15.557
  376   3HD1  LEU  48          3HD1      LEU  48   3.017   1.870 -14.474
  377   1HD2  LEU  48          1HD2      LEU  48   3.405   1.862 -12.453
  378   2HD2  LEU  48          2HD2      LEU  48   4.076   3.213 -11.537
  379   3HD2  LEU  48          3HD2      LEU  48   5.154   2.027 -12.273
  380    H    GLY  49           H        GLY  49   8.588   3.939 -15.493
  381   1HA   GLY  49          2HA       GLY  49   9.980   5.820 -16.458
  382   2HA   GLY  49          1HA       GLY  49   9.137   6.849 -15.311
  383    H    GLN  50           H        GLN  50   9.910   3.683 -14.135
  384    HA   GLN  50           HA       GLN  50  12.375   4.674 -12.844
  385   1HB   GLN  50          2HB       GLN  50  10.163   3.161 -11.431
  386   2HB   GLN  50          1HB       GLN  50  11.680   3.704 -10.714
  387   1HG   GLN  50          2HG       GLN  50  10.801   5.736 -10.309
  388   2HG   GLN  50          1HG       GLN  50  10.402   5.927 -12.016
  389   1HE2  GLN  50          1HE2      GLN  50   8.228   5.412 -12.707
  390   2HE2  GLN  50          2HE2      GLN  50   6.984   5.108 -11.593
  391    H    ASN  51           H        ASN  51  13.969   3.154 -12.531
  392    HA   ASN  51           HA       ASN  51  13.364   0.401 -13.446
  393   1HB   ASN  51          2HB       ASN  51  15.687   0.316 -14.370
  394   2HB   ASN  51          1HB       ASN  51  14.638   1.459 -15.200
  395   1HD2  ASN  51          1HD2      ASN  51  17.385   1.838 -15.451
  396   2HD2  ASN  51          2HD2      ASN  51  17.874   3.192 -14.552
  397    HA   PRO  52           HA       PRO  52  15.303   0.203  -9.252
  398   1HB   PRO  52          2HB       PRO  52  13.283  -1.192  -8.049
  399   2HB   PRO  52          1HB       PRO  52  13.316   0.573  -8.172
  400   1HG   PRO  52          2HG       PRO  52  11.660  -1.383  -9.640
  401   2HG   PRO  52          1HG       PRO  52  11.338   0.318  -9.277
  402   1HD   PRO  52          2HD       PRO  52  12.246  -0.751 -11.757
  403   2HD   PRO  52          1HD       PRO  52  12.122   0.968 -11.317
  404    H    THR  53           H        THR  53  14.897  -2.112  -7.763
  405    HA   THR  53           HA       THR  53  15.959  -4.225  -9.546
  406    HB   THR  53           HB       THR  53  17.323  -4.966  -7.793
  407    HG1  THR  53           HG1      THR  53  16.717  -4.928  -5.767
  408   1HG2  THR  53          1HG2      THR  53  18.060  -2.738  -8.494
  409   2HG2  THR  53          2HG2      THR  53  18.381  -2.985  -6.778
  410   3HG2  THR  53          3HG2      THR  53  17.009  -2.001  -7.284
  411    HA   PRO  54           HA       PRO  54  12.603  -6.870  -8.439
  412   1HB   PRO  54          2HB       PRO  54  13.786  -9.263  -7.814
  413   2HB   PRO  54          1HB       PRO  54  13.618  -8.637  -9.461
  414   1HG   PRO  54          2HG       PRO  54  16.021  -8.728  -7.714
  415   2HG   PRO  54          1HG       PRO  54  15.903  -8.830  -9.478
  416   1HD   PRO  54          2HD       PRO  54  16.666  -6.557  -8.051
  417   2HD   PRO  54          1HD       PRO  54  16.084  -6.555  -9.732
  418    H    GLU  55           H        GLU  55  15.178  -6.653  -6.067
  419    HA   GLU  55           HA       GLU  55  13.598  -7.716  -3.880
  420   1HB   GLU  55          2HB       GLU  55  16.350  -6.591  -4.187
  421   2HB   GLU  55          1HB       GLU  55  15.615  -6.564  -2.585
  422   1HG   GLU  55          2HG       GLU  55  15.600  -9.082  -4.247
  423   2HG   GLU  55          1HG       GLU  55  16.999  -8.659  -3.260
  424    H    GLU  56           H        GLU  56  14.480  -4.558  -5.200
  425    HA   GLU  56           HA       GLU  56  13.402  -3.066  -2.975
  426   1HB   GLU  56          2HB       GLU  56  14.498  -2.345  -5.676
  427   2HB   GLU  56          1HB       GLU  56  13.637  -1.143  -4.715
  428   1HG   GLU  56          2HG       GLU  56  15.184  -1.704  -2.792
  429   2HG   GLU  56          1HG       GLU  56  16.121  -2.684  -3.921
  430    H    LEU  57           H        LEU  57  12.337  -3.747  -6.326
  431    HA   LEU  57           HA       LEU  57   9.972  -2.223  -6.221
  432   1HB   LEU  57          2HB       LEU  57   9.275  -3.366  -8.179
  433   2HB   LEU  57          1HB       LEU  57  10.995  -3.098  -8.300
  434    HG   LEU  57           HG       LEU  57  11.109  -5.582  -7.369
  435   1HD1  LEU  57          1HD1      LEU  57   8.285  -5.184  -8.215
  436   2HD1  LEU  57          2HD1      LEU  57   8.955  -6.318  -7.042
  437   3HD1  LEU  57          3HD1      LEU  57   9.063  -6.667  -8.768
  438   1HD2  LEU  57          1HD2      LEU  57  10.275  -4.999 -10.226
  439   2HD2  LEU  57          2HD2      LEU  57  11.281  -6.335  -9.669
  440   3HD2  LEU  57          3HD2      LEU  57  11.890  -4.682  -9.594
  441    H    GLN  58           H        GLN  58  10.641  -5.549  -5.208
  442    HA   GLN  58           HA       GLN  58   7.952  -6.363  -4.839
  443   1HB   GLN  58          2HB       GLN  58  10.004  -7.863  -4.853
  444   2HB   GLN  58          1HB       GLN  58  10.303  -7.323  -3.201
  445   1HG   GLN  58          2HG       GLN  58   9.049  -9.391  -3.093
  446   2HG   GLN  58          1HG       GLN  58   7.979  -8.079  -2.604
  447   1HE2  GLN  58          1HE2      GLN  58   6.096  -7.708  -3.876
  448   2HE2  GLN  58          2HE2      GLN  58   5.727  -8.594  -5.275
  449    H    GLU  59           H        GLU  59  10.213  -4.603  -2.772
  450    HA   GLU  59           HA       GLU  59   8.773  -4.768  -0.348
  451   1HB   GLU  59          2HB       GLU  59  10.650  -2.622  -1.366
  452   2HB   GLU  59          1HB       GLU  59  10.034  -2.700   0.285
  453   1HG   GLU  59          2HG       GLU  59  11.458  -5.040  -0.988
  454   2HG   GLU  59          1HG       GLU  59  12.339  -3.766  -0.148
  455    H    MET  60           H        MET  60   8.795  -2.180  -2.828
  456    HA   MET  60           HA       MET  60   6.818  -0.597  -1.564
  457   1HB   MET  60          2HB       MET  60   6.606   0.575  -3.716
  458   2HB   MET  60          1HB       MET  60   8.295   0.348  -3.269
  459   1HG   MET  60          2HG       MET  60   8.592  -1.402  -4.846
  460   2HG   MET  60          1HG       MET  60   6.854  -1.607  -5.066
  461   1HE   MET  60          1HE       MET  60   9.880   0.560  -5.359
  462   2HE   MET  60          2HE       MET  60   9.704   1.401  -6.897
  463   3HE   MET  60          3HE       MET  60   9.890  -0.350  -6.876
  464    H    ILE  61           H        ILE  61   6.581  -3.381  -3.671
  465    HA   ILE  61           HA       ILE  61   3.838  -3.012  -4.407
  466    HB   ILE  61           HB       ILE  61   5.548  -5.512  -4.340
  467   1HG1  ILE  61          2HG1      ILE  61   4.564  -4.015  -6.765
  468   2HG1  ILE  61          1HG1      ILE  61   6.038  -3.507  -5.935
  469   1HG2  ILE  61          1HG2      ILE  61   3.566  -6.596  -4.535
  470   2HG2  ILE  61          2HG2      ILE  61   3.486  -5.896  -6.151
  471   3HG2  ILE  61          3HG2      ILE  61   2.679  -5.095  -4.805
  472   1HD1  ILE  61          1HD1      ILE  61   5.583  -6.362  -6.818
  473   2HD1  ILE  61          2HD1      ILE  61   7.099  -5.606  -6.332
  474   3HD1  ILE  61          3HD1      ILE  61   6.344  -5.163  -7.862
  475    H    ASP  62           H        ASP  62   5.461  -5.056  -1.966
  476    HA   ASP  62           HA       ASP  62   3.122  -6.139  -0.824
  477   1HB   ASP  62          2HB       ASP  62   5.936  -5.760   0.139
  478   2HB   ASP  62          1HB       ASP  62   4.693  -6.268   1.283
  479    H    GLU  63           H        GLU  63   4.773  -3.075  -0.336
  480    HA   GLU  63           HA       GLU  63   3.455  -2.304   2.066
  481   1HB   GLU  63          2HB       GLU  63   4.933  -0.811  -0.086
  482   2HB   GLU  63          1HB       GLU  63   4.077   0.064   1.184
  483   1HG   GLU  63          2HG       GLU  63   5.416  -0.873   2.896
  484   2HG   GLU  63          1HG       GLU  63   6.009  -2.160   1.845
  485    H    VAL  64           H        VAL  64   2.826  -1.515  -1.370
  486    HA   VAL  64           HA       VAL  64   0.437  -0.032  -0.784
  487    HB   VAL  64           HB       VAL  64   1.781   0.412  -2.811
  488   1HG1  VAL  64          1HG1      VAL  64   2.417  -1.913  -3.324
  489   2HG1  VAL  64          2HG1      VAL  64   1.654  -1.145  -4.715
  490   3HG1  VAL  64          3HG1      VAL  64   0.741  -2.287  -3.727
  491   1HG2  VAL  64          1HG2      VAL  64  -0.793   0.764  -2.600
  492   2HG2  VAL  64          2HG2      VAL  64  -0.912  -0.593  -3.720
  493   3HG2  VAL  64          3HG2      VAL  64  -0.061   0.876  -4.201
  494    H    ASP  65           H        ASP  65   1.138  -3.402  -1.500
  495    HA   ASP  65           HA       ASP  65  -1.589  -4.128  -2.083
  496   1HB   ASP  65          2HB       ASP  65   0.907  -5.368  -2.358
  497   2HB   ASP  65          1HB       ASP  65   0.066  -6.324  -1.144
  498    H    GLU  66           H        GLU  66  -2.979  -3.647  -0.464
  499    HA   GLU  66           HA       GLU  66  -2.491  -3.740   2.289
  500   1HB   GLU  66          2HB       GLU  66  -4.958  -3.802   2.560
  501   2HB   GLU  66          1HB       GLU  66  -4.430  -2.576   1.410
  502   1HG   GLU  66          2HG       GLU  66  -4.942  -4.116  -0.462
  503   2HG   GLU  66          1HG       GLU  66  -5.486  -5.331   0.694
  504    H    ASP  67           H        ASP  67  -3.661  -6.278   0.119
  505    HA   ASP  67           HA       ASP  67  -3.942  -8.149   2.347
  506   1HB   ASP  67          2HB       ASP  67  -4.577  -9.759   0.435
  507   2HB   ASP  67          1HB       ASP  67  -5.691  -8.448   0.810
  508    H    GLY  68           H        GLY  68  -1.845  -7.582  -0.444
  509   1HA   GLY  68          2HA       GLY  68   0.307  -8.320  -0.861
  510   2HA   GLY  68          1HA       GLY  68   0.325  -9.022   0.755
  511    H    SER  69           H        SER  69  -1.756  -9.588  -2.073
  512    HA   SER  69           HA       SER  69  -1.511 -12.468  -1.711
  513   1HB   SER  69          2HB       SER  69  -3.227 -12.585  -3.496
  514   2HB   SER  69          1HB       SER  69  -3.722 -11.552  -2.158
  515    HG   SER  69           HG       SER  69  -3.919 -10.043  -3.600
  516    H    GLY  70           H        GLY  70   0.501 -10.349  -3.157
  517   1HA   GLY  70          2HA       GLY  70   2.244 -10.706  -4.635
  518   2HA   GLY  70          1HA       GLY  70   1.620 -12.327  -4.927
  519    H    THR  71           H        THR  71  -0.636  -9.730  -5.215
  520    HA   THR  71           HA       THR  71  -0.256  -9.450  -8.102
  521    HB   THR  71           HB       THR  71  -2.513 -10.076  -8.661
  522    HG1  THR  71           HG1      THR  71  -4.027 -10.311  -7.191
  523   1HG2  THR  71          1HG2      THR  71  -2.524 -12.466  -8.028
  524   2HG2  THR  71          2HG2      THR  71  -1.308 -12.140  -6.791
  525   3HG2  THR  71          3HG2      THR  71  -0.908 -11.938  -8.498
  526    H    VAL  72           H        VAL  72  -0.774  -7.443  -8.803
  527    HA   VAL  72           HA       VAL  72  -1.885  -5.582  -6.807
  528    HB   VAL  72           HB       VAL  72  -0.716  -4.759  -9.457
  529   1HG1  VAL  72          1HG1      VAL  72  -0.380  -2.662  -8.354
  530   2HG1  VAL  72          2HG1      VAL  72  -0.709  -3.366  -6.770
  531   3HG1  VAL  72          3HG1      VAL  72  -2.015  -3.178  -7.941
  532   1HG2  VAL  72          1HG2      VAL  72   0.986  -6.173  -8.384
  533   2HG2  VAL  72          2HG2      VAL  72   0.782  -5.289  -6.869
  534   3HG2  VAL  72          3HG2      VAL  72   1.456  -4.474  -8.281
  535    H    ASP  73           H        ASP  73  -3.965  -5.122  -6.925
  536    HA   ASP  73           HA       ASP  73  -5.502  -5.639  -9.347
  537   1HB   ASP  73          2HB       ASP  73  -6.278  -4.553  -6.624
  538   2HB   ASP  73          1HB       ASP  73  -7.420  -4.778  -7.949
  539    H    PHE  74           H        PHE  74  -7.036  -3.823 -10.111
  540    HA   PHE  74           HA       PHE  74  -5.479  -1.630 -10.950
  541   1HB   PHE  74          2HB       PHE  74  -7.664  -2.515 -11.991
  542   2HB   PHE  74          1HB       PHE  74  -8.483  -1.480 -10.819
  543    HD1  PHE  74           HD1      PHE  74  -5.321  -1.079 -12.777
  544    HD2  PHE  74           HD2      PHE  74  -9.240   0.449 -11.922
  545    HE1  PHE  74           HE1      PHE  74  -4.887   0.869 -14.249
  546    HE2  PHE  74           HE2      PHE  74  -8.798   2.406 -13.385
  547    HZ   PHE  74           HZ       PHE  74  -6.620   2.611 -14.549
  548    H    ASP  75           H        ASP  75  -7.552  -2.058  -8.137
  549    HA   ASP  75           HA       ASP  75  -7.649   0.701  -7.384
  550   1HB   ASP  75          2HB       ASP  75  -9.076  -1.350  -6.527
  551   2HB   ASP  75          1HB       ASP  75  -7.778  -1.490  -5.341
  552    H    GLU  76           H        GLU  76  -5.540  -2.038  -6.555
  553    HA   GLU  76           HA       GLU  76  -3.886  -0.548  -4.731
  554   1HB   GLU  76          2HB       GLU  76  -3.232  -3.118  -6.202
  555   2HB   GLU  76          1HB       GLU  76  -2.402  -2.481  -4.783
  556   1HG   GLU  76          2HG       GLU  76  -4.465  -2.701  -3.457
  557   2HG   GLU  76          1HG       GLU  76  -5.323  -3.303  -4.875
  558    H    PHE  77           H        PHE  77  -3.963  -1.118  -8.174
  559    HA   PHE  77           HA       PHE  77  -1.294  -0.403  -8.820
  560   1HB   PHE  77          2HB       PHE  77  -3.351  -1.487 -10.208
  561   2HB   PHE  77          1HB       PHE  77  -3.473   0.173 -10.758
  562    HD1  PHE  77           HD1      PHE  77  -2.976  -0.738 -13.013
  563    HD2  PHE  77           HD2      PHE  77  -0.109  -0.942  -9.814
  564    HE1  PHE  77           HE1      PHE  77  -1.174  -1.145 -14.647
  565    HE2  PHE  77           HE2      PHE  77   1.690  -1.339 -11.462
  566    HZ   PHE  77           HZ       PHE  77   1.157  -1.449 -13.881
  567    H    LEU  78           H        LEU  78  -4.352   1.436  -8.964
  568    HA   LEU  78           HA       LEU  78  -3.097   3.903  -9.694
  569   1HB   LEU  78          2HB       LEU  78  -5.831   3.078  -8.840
  570   2HB   LEU  78          1HB       LEU  78  -5.412   4.780  -8.759
  571    HG   LEU  78           HG       LEU  78  -5.055   4.882 -11.129
  572   1HD1  LEU  78          1HD1      LEU  78  -5.080   2.950 -12.573
  573   2HD1  LEU  78          2HD1      LEU  78  -5.542   1.894 -11.239
  574   3HD1  LEU  78          3HD1      LEU  78  -3.938   2.625 -11.272
  575   1HD2  LEU  78          1HD2      LEU  78  -7.253   4.471 -11.904
  576   2HD2  LEU  78          2HD2      LEU  78  -7.449   4.715 -10.169
  577   3HD2  LEU  78          3HD2      LEU  78  -7.461   3.083 -10.837
  578    H    VAL  79           H        VAL  79  -3.841   2.348  -6.643
  579    HA   VAL  79           HA       VAL  79  -3.722   4.586  -4.931
  580    HB   VAL  79           HB       VAL  79  -3.384   1.638  -4.610
  581   1HG1  VAL  79          1HG1      VAL  79  -1.482   2.478  -3.323
  582   2HG1  VAL  79          2HG1      VAL  79  -2.751   1.929  -2.224
  583   3HG1  VAL  79          3HG1      VAL  79  -2.520   3.656  -2.514
  584   1HG2  VAL  79          1HG2      VAL  79  -5.249   1.871  -3.198
  585   2HG2  VAL  79          2HG2      VAL  79  -5.531   3.107  -4.423
  586   3HG2  VAL  79          3HG2      VAL  79  -4.889   3.561  -2.844
  587    H    MET  80           H        MET  80  -1.193   2.338  -6.036
  588    HA   MET  80           HA       MET  80   1.026   3.252  -4.705
  589   1HB   MET  80          2HB       MET  80   0.564   1.597  -6.904
  590   2HB   MET  80          1HB       MET  80   1.653   2.842  -7.513
  591   1HG   MET  80          2HG       MET  80   3.291   2.369  -5.851
  592   2HG   MET  80          1HG       MET  80   2.155   1.412  -4.899
  593   1HE   MET  80          1HE       MET  80   4.280   0.428  -8.789
  594   2HE   MET  80          2HE       MET  80   3.858   1.995  -8.102
  595   3HE   MET  80          3HE       MET  80   2.650   1.083  -9.003
  596    H    MET  81           H        MET  81  -0.641   4.831  -7.402
  597    HA   MET  81           HA       MET  81   1.389   6.719  -8.041
  598   1HB   MET  81          2HB       MET  81  -0.500   6.291  -9.558
  599   2HB   MET  81          1HB       MET  81  -1.616   6.961  -8.370
  600   1HG   MET  81          2HG       MET  81  -1.146   9.076  -9.000
  601   2HG   MET  81          1HG       MET  81   0.590   8.789  -8.891
  602   1HE   MET  81          1HE       MET  81   1.499   7.135 -12.198
  603   2HE   MET  81          2HE       MET  81   1.469   6.814 -10.466
  604   3HE   MET  81          3HE       MET  81   2.161   8.321 -11.063
  605    H    VAL  82           H        VAL  82  -1.610   7.116  -6.122
  606    HA   VAL  82           HA       VAL  82  -0.949   9.702  -5.155
  607    HB   VAL  82           HB       VAL  82  -2.720   9.305  -3.448
  608   1HG1  VAL  82          1HG1      VAL  82  -3.218   8.672  -6.357
  609   2HG1  VAL  82          2HG1      VAL  82  -3.499  10.187  -5.498
  610   3HG1  VAL  82          3HG1      VAL  82  -4.545   8.798  -5.203
  611   1HG2  VAL  82          1HG2      VAL  82  -2.998   6.590  -4.772
  612   2HG2  VAL  82          2HG2      VAL  82  -3.939   7.215  -3.417
  613   3HG2  VAL  82          3HG2      VAL  82  -2.230   6.839  -3.204
  614    H    ARG  83           H        ARG  83  -0.201   6.465  -4.004
  615    HA   ARG  83           HA       ARG  83   0.604   7.065  -1.371
  616   1HB   ARG  83          2HB       ARG  83   1.559   4.936  -3.299
  617   2HB   ARG  83          1HB       ARG  83   2.082   5.024  -1.617
  618   1HG   ARG  83          2HG       ARG  83  -0.624   5.216  -1.316
  619   2HG   ARG  83          1HG       ARG  83  -0.522   4.184  -2.743
  620   1HD   ARG  83          2HD       ARG  83  -0.368   2.563  -1.116
  621   2HD   ARG  83          1HD       ARG  83   1.338   2.959  -1.282
  622    HE   ARG  83           HE       ARG  83   1.283   3.895   0.847
  623   1HH1  ARG  83          2HH1      ARG  83  -1.970   3.400  -0.331
  624   2HH1  ARG  83          1HH1      ARG  83  -2.709   3.751   1.193
  625   1HH2  ARG  83          1HH2      ARG  83   0.289   4.350   2.835
  626   2HH2  ARG  83          2HH2      ARG  83  -1.436   4.287   2.980
  627    H    CYS  84           H        CYS  84   2.323   7.258  -4.459
  628    HA   CYS  84           HA       CYS  84   4.868   7.915  -3.273
  629   1HB   CYS  84          2HB       CYS  84   3.822   8.037  -6.104
  630   2HB   CYS  84          1HB       CYS  84   5.448   8.559  -5.667
  631    HG   CYS  84           HG       CYS  84   4.427   5.624  -5.288
  632    H    MET  85           H        MET  85   2.225   9.739  -4.793
  633    HA   MET  85           HA       MET  85   3.496  12.272  -4.790
  634   1HB   MET  85          2HB       MET  85   1.142  11.337  -5.792
  635   2HB   MET  85          1HB       MET  85   0.567  12.254  -4.400
  636   1HG   MET  85          2HG       MET  85   0.648  13.935  -5.995
  637   2HG   MET  85          1HG       MET  85   2.266  14.074  -5.308
  638   1HE   MET  85          1HE       MET  85   4.064  14.492  -6.667
  639   2HE   MET  85          2HE       MET  85   2.883  15.397  -7.611
  640   3HE   MET  85          3HE       MET  85   4.075  14.394  -8.433
  641    H    LYS  86           H        LYS  86   1.139  10.844  -2.512
  642    HA   LYS  86           HA       LYS  86   2.278  12.513  -0.368
  643   1HB   LYS  86          2HB       LYS  86   0.235  13.642  -1.303
  644   2HB   LYS  86          1HB       LYS  86  -0.700  12.231  -0.811
  645   1HG   LYS  86          2HG       LYS  86   1.052  13.398   1.279
  646   2HG   LYS  86          1HG       LYS  86  -0.316  14.396   0.784
  647   1HD   LYS  86          2HD       LYS  86  -1.806  12.391   1.124
  648   2HD   LYS  86          1HD       LYS  86  -0.421  11.546   1.816
  649   1HE   LYS  86          2HE       LYS  86  -1.466  14.200   2.846
  650   2HE   LYS  86          1HE       LYS  86  -1.908  12.638   3.531
  651   1HZ   LYS  86          1HZ       LYS  86   0.565  12.254   3.773
  652   2HZ   LYS  86          2HZ       LYS  86  -0.124  13.408   4.813
  653   3HZ   LYS  86          3HZ       LYS  86   0.765  13.908   3.455
  654    H    ASP  87           H        ASP  87   2.460  11.487   1.535
  655    HA   ASP  87           HA       ASP  87   0.793   9.410   2.469
  656   1HB   ASP  87          2HB       ASP  87   2.184   7.451   2.233
  657   2HB   ASP  87          1HB       ASP  87   1.913   8.130   0.633
  658    H    ASP  88           H        ASP  88   4.056  10.800   2.516
  659    HA   ASP  88           HA       ASP  88   4.136  10.392   5.447
  660   1HB   ASP  88          2HB       ASP  88   6.190  10.228   3.340
  661   2HB   ASP  88          1HB       ASP  88   6.680  11.146   4.763
  662    H    SER  89           HN       SER  89   5.290  12.687   2.957
  663    HA   SER  89           HA       SER  89   4.794  14.890   4.873
  664   1HB   SER  89          2HB       SER  89   7.172  14.560   4.093
  665   2HB   SER  89          1HB       SER  89   6.627  14.956   2.466
  666    HG   SER  89           HG       SER  89   7.376  16.642   4.260
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  -1.082  10.421   9.155
    2   2H    MET   1          2H        MET   1  -1.925   8.957   9.334
    3   3H    MET   1          3H        MET   1  -2.139  10.207  10.464
    4    HA   MET   1           HA       MET   1  -4.022  10.052   8.935
    5   1HB   MET   1          2HB       MET   1  -2.243  12.456   9.079
    6   2HB   MET   1          1HB       MET   1  -3.630  12.514   7.991
    7   1HG   MET   1          2HG       MET   1  -5.172  12.322   9.727
    8   2HG   MET   1          1HG       MET   1  -4.019  11.531  10.800
    9   1HE   MET   1          1HE       MET   1  -5.059  13.201  12.672
   10   2HE   MET   1          2HE       MET   1  -3.752  14.270  13.173
   11   3HE   MET   1          3HE       MET   1  -3.402  12.590  12.773
   12    H    ASN   2           H        ASN   2  -4.612   9.339   6.999
   13    HA   ASN   2           HA       ASN   2  -2.851   9.834   4.676
   14   1HB   ASN   2          2HB       ASN   2  -3.348   7.555   3.845
   15   2HB   ASN   2          1HB       ASN   2  -2.474   7.520   5.376
   16   1HD2  ASN   2          1HD2      ASN   2  -3.855   7.155   7.382
   17   2HD2  ASN   2          2HD2      ASN   2  -5.276   6.242   7.227
   18    H    ASP   3           H        ASP   3  -5.127  11.333   5.456
   19    HA   ASP   3           HA       ASP   3  -7.501  10.534   4.118
   20   1HB   ASP   3          2HB       ASP   3  -6.478  13.174   5.133
   21   2HB   ASP   3          1HB       ASP   3  -7.985  13.073   4.224
   22    H    ILE   4           H        ILE   4  -4.618  12.226   3.057
   23    HA   ILE   4           HA       ILE   4  -5.649  13.307   0.650
   24    HB   ILE   4           HB       ILE   4  -3.296  13.481  -0.078
   25   1HG1  ILE   4          2HG1      ILE   4  -1.752  12.743   2.053
   26   2HG1  ILE   4          1HG1      ILE   4  -2.966  11.466   2.070
   27   1HG2  ILE   4          1HG2      ILE   4  -3.628  14.188   2.851
   28   2HG2  ILE   4          2HG2      ILE   4  -4.327  15.117   1.525
   29   3HG2  ILE   4          3HG2      ILE   4  -2.576  14.985   1.680
   30   1HD1  ILE   4          1HD1      ILE   4  -0.838  11.140   0.595
   31   2HD1  ILE   4          2HD1      ILE   4  -1.635  12.258  -0.512
   32   3HD1  ILE   4          3HD1      ILE   4  -2.413  10.731  -0.089
   33    H    TYR   5           H        TYR   5  -4.365  10.132   1.460
   34    HA   TYR   5           HA       TYR   5  -4.022   9.139  -1.173
   35   1HB   TYR   5          2HB       TYR   5  -4.553   7.771   1.468
   36   2HB   TYR   5          1HB       TYR   5  -4.367   6.868  -0.034
   37    HD1  TYR   5           HD1      TYR   5  -2.219   6.601  -1.083
   38    HD2  TYR   5           HD2      TYR   5  -2.674   9.178   2.326
   39    HE1  TYR   5           HE1      TYR   5   0.247   6.771  -0.880
   40    HE2  TYR   5           HE2      TYR   5  -0.211   9.347   2.528
   41    HH   TYR   5           HH       TYR   5   1.852   7.465   1.534
   42    H    LYS   6           H        LYS   6  -6.793   9.272   1.007
   43    HA   LYS   6           HA       LYS   6  -8.513   7.788  -0.811
   44   1HB   LYS   6          2HB       LYS   6  -8.888   9.073   1.878
   45   2HB   LYS   6          1HB       LYS   6 -10.287   8.588   0.921
   46   1HG   LYS   6          2HG       LYS   6  -9.924   6.619   2.076
   47   2HG   LYS   6          1HG       LYS   6  -8.884   6.329   0.681
   48   1HD   LYS   6          2HD       LYS   6  -6.967   7.292   1.983
   49   2HD   LYS   6          1HD       LYS   6  -8.027   7.394   3.389
   50   1HE   LYS   6          2HE       LYS   6  -7.988   4.759   2.041
   51   2HE   LYS   6          1HE       LYS   6  -6.473   5.226   2.812
   52   1HZ   LYS   6          1HZ       LYS   6  -7.919   4.050   4.346
   53   2HZ   LYS   6          2HZ       LYS   6  -9.143   5.206   4.115
   54   3HZ   LYS   6          3HZ       LYS   6  -7.680   5.648   4.859
   55    H    ALA   7           H        ALA   7  -7.749  11.124  -0.104
   56    HA   ALA   7           HA       ALA   7 -10.104  12.277  -1.254
   57   1HB   ALA   7          1HB       ALA   7  -8.825  13.601   0.295
   58   2HB   ALA   7          2HB       ALA   7  -8.721  14.377  -1.285
   59   3HB   ALA   7          3HB       ALA   7  -7.366  13.424  -0.679
   60    H    ALA   8           H        ALA   8  -6.878  11.460  -2.489
   61    HA   ALA   8           HA       ALA   8  -7.218  12.719  -5.038
   62   1HB   ALA   8          1HB       ALA   8  -5.214  11.496  -5.701
   63   2HB   ALA   8          2HB       ALA   8  -5.348  10.459  -4.279
   64   3HB   ALA   8          3HB       ALA   8  -4.987  12.176  -4.090
   65    H    VAL   9           H        VAL   9  -7.590   9.381  -3.867
   66    HA   VAL   9           HA       VAL   9  -8.273   8.277  -6.401
   67    HB   VAL   9           HB       VAL   9  -7.473   6.994  -4.369
   68   1HG1  VAL   9          1HG1      VAL   9  -8.992   8.024  -2.727
   69   2HG1  VAL   9          2HG1      VAL   9  -9.186   6.272  -2.758
   70   3HG1  VAL   9          3HG1      VAL   9 -10.375   7.305  -3.549
   71   1HG2  VAL   9          1HG2      VAL   9 -10.070   5.878  -5.426
   72   2HG2  VAL   9          2HG2      VAL   9  -8.573   5.020  -5.060
   73   3HG2  VAL   9          3HG2      VAL   9  -8.667   6.064  -6.478
   74    H    GLU  10           H        GLU  10 -10.065  10.093  -4.047
   75    HA   GLU  10           HA       GLU  10 -12.674   9.240  -4.973
   76   1HB   GLU  10          2HB       GLU  10 -11.653  11.176  -2.941
   77   2HB   GLU  10          1HB       GLU  10 -13.290  11.397  -3.559
   78   1HG   GLU  10          2HG       GLU  10 -12.452   8.646  -2.720
   79   2HG   GLU  10          1HG       GLU  10 -12.828   9.827  -1.465
   80    H    GLN  11           H        GLN  11 -10.327  11.599  -5.931
   81    HA   GLN  11           HA       GLN  11 -12.320  12.802  -7.749
   82   1HB   GLN  11          2HB       GLN  11 -11.347  14.988  -7.461
   83   2HB   GLN  11          1HB       GLN  11 -11.737  14.354  -5.864
   84   1HG   GLN  11          2HG       GLN  11  -9.282  13.480  -5.857
   85   2HG   GLN  11          1HG       GLN  11  -9.032  14.628  -7.170
   86   1HE2  GLN  11          1HE2      GLN  11  -8.075  14.641  -4.244
   87   2HE2  GLN  11          2HE2      GLN  11  -8.553  16.165  -3.667
   88    H    LEU  12           H        LEU  12 -10.381  10.616  -8.164
   89    HA   LEU  12           HA       LEU  12  -8.099  11.500  -9.573
   90   1HB   LEU  12          2HB       LEU  12  -8.403   9.207 -10.781
   91   2HB   LEU  12          1HB       LEU  12  -7.925   9.274  -9.103
   92    HG   LEU  12           HG       LEU  12 -10.043   8.535  -8.361
   93   1HD1  LEU  12          1HD1      LEU  12 -11.601   9.848  -9.561
   94   2HD1  LEU  12          2HD1      LEU  12 -11.917   8.201 -10.106
   95   3HD1  LEU  12          3HD1      LEU  12 -10.987   9.300 -11.123
   96   1HD2  LEU  12          1HD2      LEU  12  -9.347   7.130 -10.955
   97   2HD2  LEU  12          2HD2      LEU  12 -10.430   6.474  -9.726
   98   3HD2  LEU  12          3HD2      LEU  12  -8.727   6.743  -9.349
   99    H    THR  13           H        THR  13  -7.721  11.131 -11.933
  100    HA   THR  13           HA       THR  13  -9.912  12.367 -13.469
  101    HB   THR  13           HB       THR  13  -7.794  12.342 -15.182
  102    HG1  THR  13           HG1      THR  13  -6.204  11.678 -13.935
  103   1HG2  THR  13          1HG2      THR  13  -8.096  14.563 -15.035
  104   2HG2  THR  13          2HG2      THR  13  -7.615  14.594 -13.338
  105   3HG2  THR  13          3HG2      THR  13  -9.282  14.218 -13.775
  106    H    ASP  14           H        ASP  14 -10.076  11.687 -15.779
  107    HA   ASP  14           HA       ASP  14 -10.563   8.868 -15.957
  108   1HB   ASP  14          2HB       ASP  14 -10.673  11.137 -17.941
  109   2HB   ASP  14          1HB       ASP  14 -10.915   9.464 -18.444
  110    H    GLU  15           H        GLU  15  -7.987  11.044 -16.943
  111    HA   GLU  15           HA       GLU  15  -6.610   9.207 -18.654
  112   1HB   GLU  15          2HB       GLU  15  -5.819  11.765 -17.272
  113   2HB   GLU  15          1HB       GLU  15  -4.641  10.804 -18.168
  114   1HG   GLU  15          2HG       GLU  15  -5.637  11.228 -20.210
  115   2HG   GLU  15          1HG       GLU  15  -7.244  11.414 -19.507
  116    H    GLN  16           H        GLN  16  -6.744   9.677 -15.198
  117    HA   GLN  16           HA       GLN  16  -4.273   8.388 -14.552
  118   1HB   GLN  16          2HB       GLN  16  -6.325   9.711 -13.118
  119   2HB   GLN  16          1HB       GLN  16  -6.232   8.075 -12.466
  120   1HG   GLN  16          2HG       GLN  16  -3.886   8.306 -11.997
  121   2HG   GLN  16          1HG       GLN  16  -3.795   9.821 -12.896
  122   1HE2  GLN  16          1HE2      GLN  16  -6.161   8.684 -10.421
  123   2HE2  GLN  16          2HE2      GLN  16  -5.932  10.010  -9.386
  124    H    LYS  17           H        LYS  17  -7.682   7.341 -14.634
  125    HA   LYS  17           HA       LYS  17  -7.329   4.675 -13.849
  126   1HB   LYS  17          2HB       LYS  17  -9.320   5.831 -15.825
  127   2HB   LYS  17          1HB       LYS  17  -9.414   4.210 -15.141
  128   1HG   LYS  17          2HG       LYS  17  -9.446   6.786 -13.538
  129   2HG   LYS  17          1HG       LYS  17 -10.859   5.802 -13.914
  130   1HD   LYS  17          2HD       LYS  17  -9.031   3.986 -12.847
  131   2HD   LYS  17          1HD       LYS  17  -8.851   5.424 -11.843
  132   1HE   LYS  17          2HE       LYS  17 -11.277   5.475 -11.448
  133   2HE   LYS  17          1HE       LYS  17 -11.488   4.071 -12.495
  134   1HZ   LYS  17          1HZ       LYS  17 -10.030   2.820 -10.980
  135   2HZ   LYS  17          2HZ       LYS  17 -11.446   3.368 -10.219
  136   3HZ   LYS  17          3HZ       LYS  17  -9.970   4.162  -9.944
  137    H    ASN  18           H        ASN  18  -7.254   6.151 -17.090
  138    HA   ASN  18           HA       ASN  18  -6.671   3.719 -18.472
  139   1HB   ASN  18          2HB       ASN  18  -6.625   6.628 -19.180
  140   2HB   ASN  18          1HB       ASN  18  -5.822   5.477 -20.250
  141   1HD2  ASN  18          1HD2      ASN  18  -8.989   6.200 -18.729
  142   2HD2  ASN  18          2HD2      ASN  18  -9.907   5.369 -19.890
  143    H    GLU  19           H        GLU  19  -4.683   6.166 -16.921
  144    HA   GLU  19           HA       GLU  19  -2.201   5.713 -18.085
  145   1HB   GLU  19          2HB       GLU  19  -2.772   7.441 -16.310
  146   2HB   GLU  19          1HB       GLU  19  -2.605   6.151 -15.119
  147   1HG   GLU  19          2HG       GLU  19  -0.443   6.959 -15.113
  148   2HG   GLU  19          1HG       GLU  19  -0.304   5.754 -16.392
  149    H    PHE  20           H        PHE  20  -3.631   4.062 -15.266
  150    HA   PHE  20           HA       PHE  20  -1.494   2.075 -15.270
  151   1HB   PHE  20          2HB       PHE  20  -3.789   2.712 -13.453
  152   2HB   PHE  20          1HB       PHE  20  -3.016   1.131 -13.365
  153    HD1  PHE  20           HD1      PHE  20  -2.604   4.735 -12.798
  154    HD2  PHE  20           HD2      PHE  20  -0.652   0.913 -12.712
  155    HE1  PHE  20           HE1      PHE  20  -0.760   5.702 -11.458
  156    HE2  PHE  20           HE2      PHE  20   1.187   1.874 -11.367
  157    HZ   PHE  20           HZ       PHE  20   1.138   4.275 -10.740
  158    H    LYS  21           H        LYS  21  -5.026   2.186 -15.816
  159    HA   LYS  21           HA       LYS  21  -5.536  -0.526 -16.088
  160   1HB   LYS  21          2HB       LYS  21  -7.222   1.367 -16.136
  161   2HB   LYS  21          1HB       LYS  21  -6.828   1.558 -17.840
  162   1HG   LYS  21          2HG       LYS  21  -8.637   0.081 -17.936
  163   2HG   LYS  21          1HG       LYS  21  -7.270  -1.031 -17.943
  164   1HD   LYS  21          2HD       LYS  21  -7.616  -1.696 -15.747
  165   2HD   LYS  21          1HD       LYS  21  -8.422  -0.189 -15.310
  166   1HE   LYS  21          2HE       LYS  21 -10.422  -0.820 -16.479
  167   2HE   LYS  21          1HE       LYS  21  -9.620  -2.201 -17.229
  168   1HZ   LYS  21          1HZ       LYS  21 -11.017  -2.822 -15.325
  169   2HZ   LYS  21          2HZ       LYS  21 -10.045  -1.871 -14.307
  170   3HZ   LYS  21          3HZ       LYS  21  -9.388  -3.230 -15.086
  171    H    ALA  22           H        ALA  22  -4.101   1.670 -18.467
  172    HA   ALA  22           HA       ALA  22  -4.282   0.008 -20.739
  173   1HB   ALA  22          1HB       ALA  22  -2.129   2.003 -19.987
  174   2HB   ALA  22          2HB       ALA  22  -3.578   2.338 -20.937
  175   3HB   ALA  22          3HB       ALA  22  -2.322   1.285 -21.586
  176    H    ALA  23           H        ALA  23  -1.616   0.398 -18.404
  177    HA   ALA  23           HA       ALA  23  -0.044  -1.753 -19.428
  178   1HB   ALA  23          1HB       ALA  23  -0.025  -0.223 -16.826
  179   2HB   ALA  23          2HB       ALA  23   1.136  -0.141 -18.152
  180   3HB   ALA  23          3HB       ALA  23   1.072  -1.571 -17.122
  181    H    PHE  24           H        PHE  24  -2.532  -1.437 -16.966
  182    HA   PHE  24           HA       PHE  24  -2.247  -3.910 -15.661
  183   1HB   PHE  24          2HB       PHE  24  -3.758  -1.929 -15.031
  184   2HB   PHE  24          1HB       PHE  24  -4.906  -2.580 -16.198
  185    HD1  PHE  24           HD1      PHE  24  -5.717  -4.978 -15.914
  186    HD2  PHE  24           HD2      PHE  24  -3.541  -2.881 -12.867
  187    HE1  PHE  24           HE1      PHE  24  -6.508  -6.607 -14.225
  188    HE2  PHE  24           HE2      PHE  24  -4.332  -4.504 -11.180
  189    HZ   PHE  24           HZ       PHE  24  -5.821  -6.361 -11.853
  190    H    ASP  25           H        ASP  25  -4.176  -2.989 -18.512
  191    HA   ASP  25           HA       ASP  25  -5.428  -5.481 -18.927
  192   1HB   ASP  25          2HB       ASP  25  -4.970  -3.038 -20.540
  193   2HB   ASP  25          1HB       ASP  25  -5.326  -4.514 -21.438
  194    H    ILE  26           H        ILE  26  -2.325  -4.227 -20.142
  195    HA   ILE  26           HA       ILE  26  -1.862  -6.520 -21.819
  196    HB   ILE  26           HB       ILE  26   0.447  -5.606 -22.066
  197   1HG1  ILE  26          2HG1      ILE  26  -0.594  -3.366 -20.300
  198   2HG1  ILE  26          1HG1      ILE  26   0.566  -4.583 -19.775
  199   1HG2  ILE  26          1HG2      ILE  26  -1.322  -4.904 -23.584
  200   2HG2  ILE  26          2HG2      ILE  26  -0.302  -3.515 -23.211
  201   3HG2  ILE  26          3HG2      ILE  26  -1.874  -3.689 -22.431
  202   1HD1  ILE  26          1HD1      ILE  26   2.280  -3.617 -20.911
  203   2HD1  ILE  26          2HD1      ILE  26   1.254  -2.182 -20.889
  204   3HD1  ILE  26          3HD1      ILE  26   1.268  -3.234 -22.305
  205    H    PHE  27           H        PHE  27  -0.780  -5.546 -18.566
  206    HA   PHE  27           HA       PHE  27   1.042  -7.722 -18.249
  207   1HB   PHE  27          2HB       PHE  27  -0.294  -5.878 -16.268
  208   2HB   PHE  27          1HB       PHE  27   0.777  -7.185 -15.760
  209    HD1  PHE  27           HD1      PHE  27   2.952  -7.292 -17.560
  210    HD2  PHE  27           HD2      PHE  27   0.792  -3.815 -16.264
  211    HE1  PHE  27           HE1      PHE  27   4.907  -5.874 -18.106
  212    HE2  PHE  27           HE2      PHE  27   2.747  -2.399 -16.815
  213    HZ   PHE  27           HZ       PHE  27   4.807  -3.426 -17.733
  214    H    ILE  28           H        ILE  28  -2.420  -7.332 -17.559
  215    HA   ILE  28           HA       ILE  28  -2.516 -10.012 -16.360
  216    HB   ILE  28           HB       ILE  28  -4.798  -9.559 -15.772
  217   1HG1  ILE  28          2HG1      ILE  28  -5.528  -7.051 -16.481
  218   2HG1  ILE  28          1HG1      ILE  28  -4.543  -7.474 -17.883
  219   1HG2  ILE  28          1HG2      ILE  28  -2.789  -8.317 -14.623
  220   2HG2  ILE  28          2HG2      ILE  28  -4.446  -7.872 -14.213
  221   3HG2  ILE  28          3HG2      ILE  28  -3.520  -6.881 -15.336
  222   1HD1  ILE  28          1HD1      ILE  28  -6.521  -9.489 -16.899
  223   2HD1  ILE  28          2HD1      ILE  28  -5.961  -9.177 -18.543
  224   3HD1  ILE  28          3HD1      ILE  28  -7.131  -8.093 -17.789
  225    H    GLN  29           H        GLN  29  -2.416  -8.923 -19.442
  226    HA   GLN  29           HA       GLN  29  -4.554  -9.977 -20.844
  227   1HB   GLN  29          2HB       GLN  29  -2.805  -8.689 -21.945
  228   2HB   GLN  29          1HB       GLN  29  -1.626  -9.960 -21.622
  229   1HG   GLN  29          2HG       GLN  29  -2.602 -11.437 -23.159
  230   2HG   GLN  29          1HG       GLN  29  -4.149 -10.587 -23.141
  231   1HE2  GLN  29          1HE2      GLN  29  -4.102  -8.306 -24.126
  232   2HE2  GLN  29          2HE2      GLN  29  -3.042  -8.031 -25.422
  233    H    ASP  30           H        ASP  30  -1.676 -11.660 -19.626
  234    HA   ASP  30           HA       ASP  30  -2.793 -14.233 -20.544
  235   1HB   ASP  30          2HB       ASP  30  -0.023 -13.365 -19.737
  236   2HB   ASP  30          1HB       ASP  30  -0.464 -15.071 -19.822
  237    H    ALA  31           H        ALA  31  -3.759 -12.696 -18.161
  238    HA   ALA  31           HA       ALA  31  -2.994 -14.494 -15.960
  239   1HB   ALA  31          1HB       ALA  31  -3.933 -12.893 -14.469
  240   2HB   ALA  31          2HB       ALA  31  -4.772 -12.059 -15.776
  241   3HB   ALA  31          3HB       ALA  31  -3.015 -11.965 -15.654
  242    H    GLU  32           H        GLU  32  -4.679 -15.381 -14.604
  243    HA   GLU  32           HA       GLU  32  -7.204 -15.895 -16.068
  244   1HB   GLU  32          2HB       GLU  32  -7.217 -18.142 -14.953
  245   2HB   GLU  32          1HB       GLU  32  -5.904 -17.927 -16.107
  246   1HG   GLU  32          2HG       GLU  32  -4.350 -18.246 -14.505
  247   2HG   GLU  32          1HG       GLU  32  -5.093 -17.029 -13.467
  248    H    ASP  33           H        ASP  33  -6.700 -13.793 -14.129
  249    HA   ASP  33           HA       ASP  33  -8.816 -14.470 -12.215
  250   1HB   ASP  33          2HB       ASP  33  -6.074 -13.486 -11.402
  251   2HB   ASP  33          1HB       ASP  33  -7.485 -13.437 -10.345
  252    H    GLY  34           H        GLY  34  -6.541 -11.956 -13.308
  253   1HA   GLY  34          2HA       GLY  34  -7.544  -9.965 -14.394
  254   2HA   GLY  34          1HA       GLY  34  -8.728  -9.965 -13.090
  255    H    CYS  35           H        CYS  35  -5.244 -10.546 -12.834
  256    HA   CYS  35           HA       CYS  35  -4.785  -7.929 -11.603
  257   1HB   CYS  35          2HB       CYS  35  -3.957 -10.449 -10.154
  258   2HB   CYS  35          1HB       CYS  35  -3.901  -8.790  -9.562
  259    HG   CYS  35           HG       CYS  35  -6.077 -10.240  -8.725
  260    H    ILE  36           H        ILE  36  -2.581  -7.313 -11.630
  261    HA   ILE  36           HA       ILE  36  -1.015  -8.713 -13.642
  262    HB   ILE  36           HB       ILE  36   0.415  -6.858 -13.720
  263   1HG1  ILE  36          2HG1      ILE  36  -0.132  -5.112 -11.642
  264   2HG1  ILE  36          1HG1      ILE  36  -0.190  -6.687 -10.851
  265   1HG2  ILE  36          1HG2      ILE  36  -1.825  -6.262 -14.502
  266   2HG2  ILE  36          2HG2      ILE  36  -1.060  -4.870 -13.734
  267   3HG2  ILE  36          3HG2      ILE  36  -2.291  -5.789 -12.868
  268   1HD1  ILE  36          1HD1      ILE  36   2.037  -6.676 -12.652
  269   2HD1  ILE  36          2HD1      ILE  36   2.060  -6.801 -10.892
  270   3HD1  ILE  36          3HD1      ILE  36   2.117  -5.217 -11.667
  271    H    SER  37           H        SER  37   1.359  -9.084 -13.235
  272    HA   SER  37           HA       SER  37   1.612 -10.671 -10.801
  273   1HB   SER  37          2HB       SER  37   2.351 -11.538 -13.042
  274   2HB   SER  37          1HB       SER  37   3.627 -10.323 -13.032
  275    HG   SER  37           HG       SER  37   4.709 -11.623 -11.797
  276    H    THR  38           H        THR  38   2.233  -9.671  -9.008
  277    HA   THR  38           HA       THR  38   3.511  -7.195  -8.770
  278    HB   THR  38           HB       THR  38   4.072  -7.879  -6.459
  279    HG1  THR  38           HG1      THR  38   4.495  -9.920  -6.270
  280   1HG2  THR  38          1HG2      THR  38   1.856  -7.095  -6.691
  281   2HG2  THR  38          2HG2      THR  38   1.687  -8.625  -5.830
  282   3HG2  THR  38          3HG2      THR  38   1.346  -8.543  -7.559
  283    H    LYS  39           H        LYS  39   4.830 -10.437  -9.124
  284    HA   LYS  39           HA       LYS  39   7.543  -9.881  -8.539
  285   1HB   LYS  39          2HB       LYS  39   6.504 -11.901 -10.543
  286   2HB   LYS  39          1HB       LYS  39   8.065 -11.929  -9.727
  287   1HG   LYS  39          2HG       LYS  39   7.166 -12.641  -7.731
  288   2HG   LYS  39          1HG       LYS  39   5.636 -11.810  -8.004
  289   1HD   LYS  39          2HD       LYS  39   5.604 -13.645 -10.034
  290   2HD   LYS  39          1HD       LYS  39   6.457 -14.542  -8.778
  291   1HE   LYS  39          2HE       LYS  39   4.249 -15.036  -8.238
  292   2HE   LYS  39          1HE       LYS  39   4.524 -13.615  -7.232
  293   1HZ   LYS  39          1HZ       LYS  39   3.299 -13.593  -9.940
  294   2HZ   LYS  39          2HZ       LYS  39   3.538 -12.238  -8.944
  295   3HZ   LYS  39          3HZ       LYS  39   2.450 -13.457  -8.478
  296    H    GLU  40           H        GLU  40   5.579  -9.455 -11.419
  297    HA   GLU  40           HA       GLU  40   7.894  -8.603 -13.007
  298   1HB   GLU  40          2HB       GLU  40   5.000  -9.107 -13.701
  299   2HB   GLU  40          1HB       GLU  40   6.149  -8.404 -14.839
  300   1HG   GLU  40          2HG       GLU  40   7.554 -10.357 -14.753
  301   2HG   GLU  40          1HG       GLU  40   6.630 -11.031 -13.410
  302    H    LEU  41           H        LEU  41   6.515  -7.003 -10.697
  303    HA   LEU  41           HA       LEU  41   5.240  -4.738 -11.766
  304   1HB   LEU  41          2HB       LEU  41   6.015  -5.548  -9.236
  305   2HB   LEU  41          1HB       LEU  41   6.990  -4.126  -9.513
  306    HG   LEU  41           HG       LEU  41   4.947  -3.522  -8.346
  307   1HD1  LEU  41          1HD1      LEU  41   5.806  -1.894  -9.965
  308   2HD1  LEU  41          2HD1      LEU  41   4.042  -1.850  -9.940
  309   3HD1  LEU  41          3HD1      LEU  41   4.886  -2.668 -11.255
  310   1HD2  LEU  41          1HD2      LEU  41   2.765  -3.782  -9.756
  311   2HD2  LEU  41          2HD2      LEU  41   3.377  -5.187  -8.879
  312   3HD2  LEU  41          3HD2      LEU  41   3.664  -5.036 -10.612
  313    H    GLY  42           H        GLY  42   8.621  -5.648 -11.713
  314   1HA   GLY  42          2HA       GLY  42   9.871  -3.162 -12.023
  315   2HA   GLY  42          1HA       GLY  42  10.484  -4.684 -12.663
  316    H    LYS  43           H        LYS  43   8.417  -5.325 -14.449
  317    HA   LYS  43           HA       LYS  43   9.132  -3.839 -16.752
  318   1HB   LYS  43          2HB       LYS  43   8.111  -6.254 -16.477
  319   2HB   LYS  43          1HB       LYS  43   6.574  -5.399 -16.615
  320   1HG   LYS  43          2HG       LYS  43   6.945  -5.726 -18.843
  321   2HG   LYS  43          1HG       LYS  43   7.893  -4.252 -18.668
  322   1HD   LYS  43          2HD       LYS  43   9.916  -5.376 -18.755
  323   2HD   LYS  43          1HD       LYS  43   9.236  -6.864 -18.096
  324   1HE   LYS  43          2HE       LYS  43   7.868  -6.907 -20.339
  325   2HE   LYS  43          1HE       LYS  43   9.139  -5.829 -20.915
  326   1HZ   LYS  43          1HZ       LYS  43   9.678  -8.137 -21.359
  327   2HZ   LYS  43          2HZ       LYS  43   9.555  -8.512 -19.706
  328   3HZ   LYS  43          3HZ       LYS  43  10.783  -7.473 -20.258
  329    H    VAL  44           H        VAL  44   6.638  -3.450 -14.363
  330    HA   VAL  44           HA       VAL  44   5.045  -1.612 -15.958
  331    HB   VAL  44           HB       VAL  44   4.697  -1.872 -12.996
  332   1HG1  VAL  44          1HG1      VAL  44   3.301  -0.708 -15.117
  333   2HG1  VAL  44          2HG1      VAL  44   2.694  -0.967 -13.481
  334   3HG1  VAL  44          3HG1      VAL  44   2.383  -2.165 -14.737
  335   1HG2  VAL  44          1HG2      VAL  44   3.239  -3.919 -13.497
  336   2HG2  VAL  44          2HG2      VAL  44   4.982  -4.189 -13.526
  337   3HG2  VAL  44          3HG2      VAL  44   4.091  -4.028 -15.037
  338    H    MET  45           H        MET  45   7.192  -1.517 -13.134
  339    HA   MET  45           HA       MET  45   7.014   1.193 -12.490
  340   1HB   MET  45          2HB       MET  45   9.353  -0.716 -12.274
  341   2HB   MET  45          1HB       MET  45   9.351   0.906 -11.583
  342   1HG   MET  45          2HG       MET  45   6.932  -0.573 -10.889
  343   2HG   MET  45          1HG       MET  45   8.391  -1.402 -10.348
  344   1HE   MET  45          1HE       MET  45   6.669   2.334 -10.280
  345   2HE   MET  45          2HE       MET  45   6.262   2.043  -8.590
  346   3HE   MET  45          3HE       MET  45   5.810   0.858  -9.814
  347    H    ARG  46           H        ARG  46   9.083  -0.466 -14.857
  348    HA   ARG  46           HA       ARG  46  10.669   1.734 -15.625
  349   1HB   ARG  46          2HB       ARG  46   9.735  -0.578 -17.347
  350   2HB   ARG  46          1HB       ARG  46  11.069   0.512 -17.721
  351   1HG   ARG  46          2HG       ARG  46  11.363  -0.573 -15.047
  352   2HG   ARG  46          1HG       ARG  46  11.210  -1.870 -16.232
  353   1HD   ARG  46          2HD       ARG  46  12.988  -0.787 -17.598
  354   2HD   ARG  46          1HD       ARG  46  13.172   0.436 -16.347
  355    HE   ARG  46           HE       ARG  46  14.311  -1.122 -15.041
  356   1HH1  ARG  46          2HH1      ARG  46  12.735  -2.705 -17.730
  357   2HH1  ARG  46          1HH1      ARG  46  13.527  -4.220 -17.462
  358   1HH2  ARG  46          1HH2      ARG  46  15.333  -3.119 -14.710
  359   2HH2  ARG  46          2HH2      ARG  46  14.993  -4.455 -15.758
  360    H    MET  47           H        MET  47   7.448   0.711 -16.638
  361    HA   MET  47           HA       MET  47   7.199   2.689 -18.728
  362   1HB   MET  47          2HB       MET  47   5.110   0.990 -17.342
  363   2HB   MET  47          1HB       MET  47   4.819   1.991 -18.763
  364   1HG   MET  47          2HG       MET  47   6.950  -0.156 -18.713
  365   2HG   MET  47          1HG       MET  47   5.291  -0.485 -19.212
  366   1HE   MET  47          1HE       MET  47   7.559  -1.140 -21.185
  367   2HE   MET  47          2HE       MET  47   8.587   0.012 -20.338
  368   3HE   MET  47          3HE       MET  47   8.306   0.199 -22.067
  369    H    LEU  48           H        LEU  48   6.485   2.484 -15.302
  370    HA   LEU  48           HA       LEU  48   4.713   4.724 -15.142
  371   1HB   LEU  48          2HB       LEU  48   6.184   2.992 -13.251
  372   2HB   LEU  48          1HB       LEU  48   5.813   4.600 -12.675
  373    HG   LEU  48           HG       LEU  48   3.420   4.194 -13.029
  374   1HD1  LEU  48          1HD1      LEU  48   4.102   2.446 -14.943
  375   2HD1  LEU  48          2HD1      LEU  48   2.561   2.331 -14.091
  376   3HD1  LEU  48          3HD1      LEU  48   3.913   1.305 -13.612
  377   1HD2  LEU  48          1HD2      LEU  48   4.969   2.105 -11.484
  378   2HD2  LEU  48          2HD2      LEU  48   3.211   2.217 -11.406
  379   3HD2  LEU  48          3HD2      LEU  48   4.206   3.568 -10.862
  380    H    GLY  49           H        GLY  49   8.180   4.273 -15.022
  381   1HA   GLY  49          2HA       GLY  49   9.435   6.281 -15.890
  382   2HA   GLY  49          1HA       GLY  49   8.555   7.195 -14.675
  383    H    GLN  50           H        GLN  50   9.832   3.945 -14.103
  384    HA   GLN  50           HA       GLN  50  12.212   4.929 -12.762
  385   1HB   GLN  50          2HB       GLN  50  11.588   3.891 -10.560
  386   2HB   GLN  50          1HB       GLN  50  10.660   5.334 -10.965
  387   1HG   GLN  50          2HG       GLN  50   9.215   3.205 -12.095
  388   2HG   GLN  50          1HG       GLN  50   9.722   2.623 -10.511
  389   1HE2  GLN  50          1HE2      GLN  50   7.903   5.216 -12.154
  390   2HE2  GLN  50          2HE2      GLN  50   7.065   5.726 -10.770
  391    H    ASN  51           H        ASN  51  13.741   3.344 -12.398
  392    HA   ASN  51           HA       ASN  51  13.009   0.612 -13.288
  393   1HB   ASN  51          2HB       ASN  51  15.447   0.495 -14.101
  394   2HB   ASN  51          1HB       ASN  51  14.320   1.445 -15.066
  395   1HD2  ASN  51          1HD2      ASN  51  14.465   3.834 -14.888
  396   2HD2  ASN  51          2HD2      ASN  51  15.884   4.562 -14.309
  397    HA   PRO  52           HA       PRO  52  14.945   0.350  -9.096
  398   1HB   PRO  52          2HB       PRO  52  12.882  -0.979  -7.894
  399   2HB   PRO  52          1HB       PRO  52  12.972   0.784  -8.019
  400   1HG   PRO  52          2HG       PRO  52  11.254  -1.120  -9.484
  401   2HG   PRO  52          1HG       PRO  52  10.988   0.593  -9.125
  402   1HD   PRO  52          2HD       PRO  52  11.864  -0.512 -11.602
  403   2HD   PRO  52          1HD       PRO  52  11.793   1.211 -11.168
  404    H    THR  53           H        THR  53  14.464  -1.933  -7.601
  405    HA   THR  53           HA       THR  53  15.466  -4.095  -9.357
  406    HB   THR  53           HB       THR  53  16.798  -4.854  -7.595
  407    HG1  THR  53           HG1      THR  53  16.317  -4.044  -5.394
  408   1HG2  THR  53          1HG2      THR  53  17.942  -2.945  -6.634
  409   2HG2  THR  53          2HG2      THR  53  16.554  -1.908  -6.964
  410   3HG2  THR  53          3HG2      THR  53  17.499  -2.570  -8.300
  411    HA   PRO  54           HA       PRO  54  12.028  -6.640  -8.264
  412   1HB   PRO  54          2HB       PRO  54  13.127  -9.048  -7.550
  413   2HB   PRO  54          1HB       PRO  54  13.023  -8.458  -9.216
  414   1HG   PRO  54          2HG       PRO  54  15.372  -8.567  -7.394
  415   2HG   PRO  54          1HG       PRO  54  15.302  -8.708  -9.159
  416   1HD   PRO  54          2HD       PRO  54  16.082  -6.422  -7.762
  417   2HD   PRO  54          1HD       PRO  54  15.554  -6.446  -9.459
  418    H    GLU  55           H        GLU  55  14.545  -6.487  -5.801
  419    HA   GLU  55           HA       GLU  55  12.780  -7.409  -3.684
  420   1HB   GLU  55          2HB       GLU  55  14.639  -6.855  -2.161
  421   2HB   GLU  55          1HB       GLU  55  15.177  -7.881  -3.487
  422   1HG   GLU  55          2HG       GLU  55  16.203  -6.041  -4.621
  423   2HG   GLU  55          1HG       GLU  55  15.420  -4.865  -3.566
  424    H    GLU  56           H        GLU  56  13.876  -4.365  -5.064
  425    HA   GLU  56           HA       GLU  56  12.924  -2.683  -2.951
  426   1HB   GLU  56          2HB       GLU  56  13.779  -2.214  -5.794
  427   2HB   GLU  56          1HB       GLU  56  13.027  -0.920  -4.861
  428   1HG   GLU  56          2HG       GLU  56  15.332  -2.492  -3.716
  429   2HG   GLU  56          1HG       GLU  56  15.622  -1.133  -4.802
  430    H    LEU  57           H        LEU  57  11.607  -3.568  -6.165
  431    HA   LEU  57           HA       LEU  57   9.217  -2.084  -5.918
  432   1HB   LEU  57          2HB       LEU  57   8.335  -3.545  -7.690
  433   2HB   LEU  57          1HB       LEU  57   9.890  -2.855  -8.077
  434    HG   LEU  57           HG       LEU  57  10.730  -5.217  -7.119
  435   1HD1  LEU  57          1HD1      LEU  57   8.467  -6.025  -6.577
  436   2HD1  LEU  57          2HD1      LEU  57   9.162  -6.987  -7.881
  437   3HD1  LEU  57          3HD1      LEU  57   7.960  -5.750  -8.243
  438   1HD2  LEU  57          1HD2      LEU  57   9.572  -4.755  -9.887
  439   2HD2  LEU  57          2HD2      LEU  57  10.771  -5.979  -9.472
  440   3HD2  LEU  57          3HD2      LEU  57  11.182  -4.268  -9.359
  441    H    GLN  58           H        GLN  58  10.104  -5.334  -4.848
  442    HA   GLN  58           HA       GLN  58   7.525  -6.294  -4.246
  443   1HB   GLN  58          2HB       GLN  58   9.727  -7.601  -4.242
  444   2HB   GLN  58          1HB       GLN  58   9.978  -6.957  -2.620
  445   1HG   GLN  58          2HG       GLN  58   8.908  -9.106  -2.381
  446   2HG   GLN  58          1HG       GLN  58   7.706  -7.874  -1.998
  447   1HE2  GLN  58          1HE2      GLN  58   5.850  -7.706  -3.374
  448   2HE2  GLN  58          2HE2      GLN  58   5.586  -8.740  -4.693
  449    H    GLU  59           H        GLU  59   9.662  -4.120  -2.482
  450    HA   GLU  59           HA       GLU  59   8.341  -4.240   0.034
  451   1HB   GLU  59          2HB       GLU  59  10.171  -2.232  -1.262
  452   2HB   GLU  59          1HB       GLU  59   9.402  -1.883   0.286
  453   1HG   GLU  59          2HG       GLU  59  10.534  -3.600   1.391
  454   2HG   GLU  59          1HG       GLU  59  10.827  -4.501  -0.097
  455    H    MET  60           H        MET  60   8.060  -1.915  -2.677
  456    HA   MET  60           HA       MET  60   5.967  -0.416  -1.451
  457   1HB   MET  60          2HB       MET  60   5.622   0.599  -3.666
  458   2HB   MET  60          1HB       MET  60   7.328   0.574  -3.230
  459   1HG   MET  60          2HG       MET  60   7.775  -1.262  -4.689
  460   2HG   MET  60          1HG       MET  60   6.058  -1.596  -4.911
  461   1HE   MET  60          1HE       MET  60   8.369   2.079  -6.249
  462   2HE   MET  60          2HE       MET  60   9.121   0.511  -6.529
  463   3HE   MET  60          3HE       MET  60   8.660   0.980  -4.895
  464    H    ILE  61           H        ILE  61   6.034  -3.296  -3.432
  465    HA   ILE  61           HA       ILE  61   3.260  -3.314  -4.130
  466    HB   ILE  61           HB       ILE  61   5.313  -5.540  -3.990
  467   1HG1  ILE  61          2HG1      ILE  61   4.018  -4.329  -6.433
  468   2HG1  ILE  61          1HG1      ILE  61   5.443  -3.595  -5.700
  469   1HG2  ILE  61          1HG2      ILE  61   2.724  -5.773  -5.492
  470   2HG2  ILE  61          2HG2      ILE  61   2.725  -6.099  -3.760
  471   3HG2  ILE  61          3HG2      ILE  61   3.753  -7.045  -4.833
  472   1HD1  ILE  61          1HD1      ILE  61   6.481  -5.028  -7.180
  473   2HD1  ILE  61          2HD1      ILE  61   5.174  -6.209  -7.115
  474   3HD1  ILE  61          3HD1      ILE  61   6.335  -6.105  -5.792
  475    H    ASP  62           H        ASP  62   5.180  -4.887  -1.576
  476    HA   ASP  62           HA       ASP  62   3.104  -6.291  -0.313
  477   1HB   ASP  62          2HB       ASP  62   5.594  -6.460   0.179
  478   2HB   ASP  62          1HB       ASP  62   5.418  -4.992   1.138
  479    H    GLU  63           H        GLU  63   4.157  -2.930  -0.010
  480    HA   GLU  63           HA       GLU  63   2.495  -2.265   2.216
  481   1HB   GLU  63          2HB       GLU  63   3.837  -0.559   0.112
  482   2HB   GLU  63          1HB       GLU  63   2.926   0.111   1.465
  483   1HG   GLU  63          2HG       GLU  63   5.124  -1.895   1.946
  484   2HG   GLU  63          1HG       GLU  63   5.499  -0.185   1.735
  485    H    VAL  64           H        VAL  64   2.125  -1.748  -1.310
  486    HA   VAL  64           HA       VAL  64  -0.461  -0.535  -1.045
  487    HB   VAL  64           HB       VAL  64   1.038  -0.087  -2.971
  488   1HG1  VAL  64          1HG1      VAL  64   1.327  -1.731  -4.721
  489   2HG1  VAL  64          2HG1      VAL  64   0.267  -2.869  -3.890
  490   3HG1  VAL  64          3HG1      VAL  64   1.836  -2.456  -3.197
  491   1HG2  VAL  64          1HG2      VAL  64  -1.660  -0.170  -2.949
  492   2HG2  VAL  64          2HG2      VAL  64  -1.349  -1.342  -4.228
  493   3HG2  VAL  64          3HG2      VAL  64  -0.737   0.307  -4.374
  494    H    ASP  65           H        ASP  65   0.673  -3.839  -1.549
  495    HA   ASP  65           HA       ASP  65  -1.962  -4.873  -2.162
  496   1HB   ASP  65          2HB       ASP  65   0.649  -5.835  -2.478
  497   2HB   ASP  65          1HB       ASP  65  -0.054  -6.867  -1.238
  498    H    GLU  66           H        GLU  66  -3.366  -4.535  -0.520
  499    HA   GLU  66           HA       GLU  66  -2.771  -4.667   2.242
  500   1HB   GLU  66          2HB       GLU  66  -5.465  -5.195   0.964
  501   2HB   GLU  66          1HB       GLU  66  -5.158  -4.652   2.613
  502   1HG   GLU  66          2HG       GLU  66  -4.017  -2.610   1.591
  503   2HG   GLU  66          1HG       GLU  66  -4.696  -3.124   0.045
  504    H    ASP  67           H        ASP  67  -4.186  -7.051   0.026
  505    HA   ASP  67           HA       ASP  67  -4.335  -9.101   2.061
  506   1HB   ASP  67          2HB       ASP  67  -4.919 -10.585   0.073
  507   2HB   ASP  67          1HB       ASP  67  -6.020  -9.249   0.396
  508    H    GLY  68           H        GLY  68  -2.160  -8.295  -0.610
  509   1HA   GLY  68          2HA       GLY  68   0.022  -8.946  -1.003
  510   2HA   GLY  68          1HA       GLY  68   0.005  -9.774   0.554
  511    H    SER  69           H        SER  69  -1.979 -10.167  -2.372
  512    HA   SER  69           HA       SER  69  -1.759 -13.052  -2.221
  513   1HB   SER  69          2HB       SER  69  -3.234 -12.995  -4.237
  514   2HB   SER  69          1HB       SER  69  -3.891 -12.115  -2.861
  515    HG   SER  69           HG       SER  69  -3.046 -11.209  -5.320
  516    H    GLY  70           H        GLY  70   0.234 -10.695  -3.553
  517   1HA   GLY  70          2HA       GLY  70   2.170 -11.013  -4.810
  518   2HA   GLY  70          1HA       GLY  70   1.632 -12.650  -5.189
  519    H    THR  71           H        THR  71  -0.733 -10.206  -5.601
  520    HA   THR  71           HA       THR  71  -0.129  -9.784  -8.433
  521    HB   THR  71           HB       THR  71  -2.329 -10.480  -9.169
  522    HG1  THR  71           HG1      THR  71  -3.778 -10.243  -7.654
  523   1HG2  THR  71          1HG2      THR  71  -1.093 -12.571  -7.352
  524   2HG2  THR  71          2HG2      THR  71  -0.628 -12.249  -9.024
  525   3HG2  THR  71          3HG2      THR  71  -2.228 -12.900  -8.663
  526    H    VAL  72           H        VAL  72  -0.553  -7.736  -9.004
  527    HA   VAL  72           HA       VAL  72  -1.753  -5.968  -7.025
  528    HB   VAL  72           HB       VAL  72  -0.759  -5.172  -9.763
  529   1HG1  VAL  72          1HG1      VAL  72  -0.518  -2.997  -8.756
  530   2HG1  VAL  72          2HG1      VAL  72  -0.849  -3.644  -7.150
  531   3HG1  VAL  72          3HG1      VAL  72  -2.134  -3.580  -8.356
  532   1HG2  VAL  72          1HG2      VAL  72   1.084  -6.347  -8.744
  533   2HG2  VAL  72          2HG2      VAL  72   0.774  -5.584  -7.182
  534   3HG2  VAL  72          3HG2      VAL  72   1.385  -4.620  -8.526
  535    H    ASP  73           H        ASP  73  -3.797  -5.380  -7.010
  536    HA   ASP  73           HA       ASP  73  -5.538  -6.038  -9.269
  537   1HB   ASP  73          2HB       ASP  73  -6.412  -4.609  -6.756
  538   2HB   ASP  73          1HB       ASP  73  -7.367  -5.633  -7.824
  539    H    PHE  74           H        PHE  74  -7.096  -4.287 -10.027
  540    HA   PHE  74           HA       PHE  74  -5.657  -2.078 -10.985
  541   1HB   PHE  74          2HB       PHE  74  -7.830  -2.990 -11.932
  542   2HB   PHE  74          1HB       PHE  74  -8.660  -2.091 -10.660
  543    HD1  PHE  74           HD1      PHE  74  -5.643  -1.303 -12.734
  544    HD2  PHE  74           HD2      PHE  74  -9.650  -0.207 -11.637
  545    HE1  PHE  74           HE1      PHE  74  -5.458   0.768 -14.089
  546    HE2  PHE  74           HE2      PHE  74  -9.457   1.866 -12.986
  547    HZ   PHE  74           HZ       PHE  74  -7.362   2.349 -14.210
  548    H    ASP  75           H        ASP  75  -7.601  -2.462  -8.066
  549    HA   ASP  75           HA       ASP  75  -7.708   0.297  -7.349
  550   1HB   ASP  75          2HB       ASP  75  -7.895  -2.207  -5.653
  551   2HB   ASP  75          1HB       ASP  75  -8.185  -0.577  -5.044
  552    H    GLU  76           H        GLU  76  -5.493  -2.366  -6.561
  553    HA   GLU  76           HA       GLU  76  -3.793  -0.810  -4.846
  554   1HB   GLU  76          2HB       GLU  76  -3.152  -3.387  -6.311
  555   2HB   GLU  76          1HB       GLU  76  -2.276  -2.720  -4.934
  556   1HG   GLU  76          2HG       GLU  76  -4.218  -3.001  -3.492
  557   2HG   GLU  76          1HG       GLU  76  -5.206  -3.508  -4.860
  558    H    PHE  77           H        PHE  77  -3.970  -1.470  -8.275
  559    HA   PHE  77           HA       PHE  77  -1.365  -0.702  -9.054
  560   1HB   PHE  77          2HB       PHE  77  -3.453  -1.797 -10.357
  561   2HB   PHE  77          1HB       PHE  77  -3.674  -0.125 -10.846
  562    HD1  PHE  77           HD1      PHE  77  -3.290  -0.879 -13.158
  563    HD2  PHE  77           HD2      PHE  77  -0.216  -1.200 -10.157
  564    HE1  PHE  77           HE1      PHE  77  -1.582  -1.164 -14.920
  565    HE2  PHE  77           HE2      PHE  77   1.481  -1.478 -11.934
  566    HZ   PHE  77           HZ       PHE  77   0.797  -1.464 -14.319
  567    H    LEU  78           H        LEU  78  -4.429   1.113  -8.943
  568    HA   LEU  78           HA       LEU  78  -3.279   3.598  -9.763
  569   1HB   LEU  78          2HB       LEU  78  -5.905   2.735  -8.647
  570   2HB   LEU  78          1HB       LEU  78  -5.500   4.441  -8.603
  571    HG   LEU  78           HG       LEU  78  -5.440   4.582 -10.979
  572   1HD1  LEU  78          1HD1      LEU  78  -4.203   2.395 -11.277
  573   2HD1  LEU  78          2HD1      LEU  78  -5.474   2.690 -12.463
  574   3HD1  LEU  78          3HD1      LEU  78  -5.759   1.575 -11.126
  575   1HD2  LEU  78          1HD2      LEU  78  -7.697   4.602 -10.276
  576   2HD2  LEU  78          2HD2      LEU  78  -7.691   2.874  -9.923
  577   3HD2  LEU  78          3HD2      LEU  78  -7.670   3.433 -11.596
  578    H    VAL  79           H        VAL  79  -3.740   2.033  -6.652
  579    HA   VAL  79           HA       VAL  79  -3.476   4.264  -4.952
  580    HB   VAL  79           HB       VAL  79  -3.046   1.320  -4.674
  581   1HG1  VAL  79          1HG1      VAL  79  -2.247   1.655  -2.330
  582   2HG1  VAL  79          2HG1      VAL  79  -2.043   3.373  -2.677
  583   3HG1  VAL  79          3HG1      VAL  79  -1.072   2.176  -3.540
  584   1HG2  VAL  79          1HG2      VAL  79  -4.466   3.219  -2.809
  585   2HG2  VAL  79          2HG2      VAL  79  -4.783   1.507  -3.090
  586   3HG2  VAL  79          3HG2      VAL  79  -5.218   2.697  -4.316
  587    H    MET  80           H        MET  80  -1.026   2.050  -6.283
  588    HA   MET  80           HA       MET  80   1.287   2.996  -5.146
  589   1HB   MET  80          2HB       MET  80   0.674   1.312  -7.273
  590   2HB   MET  80          1HB       MET  80   1.667   2.572  -8.003
  591   1HG   MET  80          2HG       MET  80   3.301   2.238  -6.082
  592   2HG   MET  80          1HG       MET  80   2.369   0.804  -5.649
  593   1HE   MET  80          1HE       MET  80   2.032  -1.033  -6.661
  594   2HE   MET  80          2HE       MET  80   3.693  -1.619  -6.618
  595   3HE   MET  80          3HE       MET  80   2.765  -1.732  -8.111
  596    H    MET  81           H        MET  81  -0.692   4.649  -7.539
  597    HA   MET  81           HA       MET  81   1.229   6.475  -8.529
  598   1HB   MET  81          2HB       MET  81  -0.994   6.162  -9.573
  599   2HB   MET  81          1HB       MET  81  -1.749   6.909  -8.167
  600   1HG   MET  81          2HG       MET  81  -1.394   8.946  -9.051
  601   2HG   MET  81          1HG       MET  81   0.342   8.645  -9.054
  602   1HE   MET  81          1HE       MET  81   1.753   8.280 -11.185
  603   2HE   MET  81          2HE       MET  81   1.158   7.170 -12.416
  604   3HE   MET  81          3HE       MET  81   1.172   6.675 -10.725
  605    H    VAL  82           H        VAL  82  -1.259   6.965  -6.001
  606    HA   VAL  82           HA       VAL  82  -0.249   9.471  -5.129
  607    HB   VAL  82           HB       VAL  82  -1.625   9.066  -3.072
  608   1HG1  VAL  82          1HG1      VAL  82  -2.591  10.084  -5.099
  609   2HG1  VAL  82          2HG1      VAL  82  -3.779   9.077  -4.272
  610   3HG1  VAL  82          3HG1      VAL  82  -2.975   8.479  -5.724
  611   1HG2  VAL  82          1HG2      VAL  82  -2.936   7.058  -2.874
  612   2HG2  VAL  82          2HG2      VAL  82  -1.267   6.550  -3.131
  613   3HG2  VAL  82          3HG2      VAL  82  -2.421   6.494  -4.465
  614    H    ARG  83           H        ARG  83   0.547   6.156  -4.299
  615    HA   ARG  83           HA       ARG  83   1.934   6.584  -1.881
  616   1HB   ARG  83          2HB       ARG  83   2.393   4.520  -4.053
  617   2HB   ARG  83          1HB       ARG  83   3.170   4.485  -2.472
  618   1HG   ARG  83          2HG       ARG  83   0.561   4.785  -1.740
  619   2HG   ARG  83          1HG       ARG  83   0.381   3.838  -3.217
  620   1HD   ARG  83          2HD       ARG  83   1.813   2.105  -2.380
  621   2HD   ARG  83          1HD       ARG  83   2.312   3.090  -1.010
  622    HE   ARG  83           HE       ARG  83  -0.110   1.531  -1.225
  623   1HH1  ARG  83          2HH1      ARG  83   1.402   4.301   0.278
  624   2HH1  ARG  83          1HH1      ARG  83   0.355   4.280   1.655
  625   1HH2  ARG  83          1HH2      ARG  83  -1.467   1.526   0.592
  626   2HH2  ARG  83          2HH2      ARG  83  -1.264   2.716   1.834
  627    H    CYS  84           H        CYS  84   2.927   6.826  -5.267
  628    HA   CYS  84           HA       CYS  84   5.705   7.287  -4.745
  629   1HB   CYS  84          2HB       CYS  84   3.929   7.660  -7.144
  630   2HB   CYS  84          1HB       CYS  84   5.580   8.278  -7.146
  631    HG   CYS  84           HG       CYS  84   5.502   5.751  -8.026
  632    H    MET  85           H        MET  85   2.909   9.400  -5.360
  633    HA   MET  85           HA       MET  85   4.311  11.856  -5.404
  634   1HB   MET  85          2HB       MET  85   1.458  11.076  -4.920
  635   2HB   MET  85          1HB       MET  85   1.969  12.728  -4.574
  636   1HG   MET  85          2HG       MET  85   3.069  12.584  -6.961
  637   2HG   MET  85          1HG       MET  85   1.909  11.278  -7.203
  638   1HE   MET  85          1HE       MET  85   1.983  15.378  -7.599
  639   2HE   MET  85          2HE       MET  85   2.757  14.604  -6.219
  640   3HE   MET  85          3HE       MET  85   1.285  15.543  -5.983
  641    H    LYS  86           H        LYS  86   2.456  10.316  -2.761
  642    HA   LYS  86           HA       LYS  86   2.755  10.343  -0.482
  643   1HB   LYS  86          2HB       LYS  86   5.344  10.619  -1.407
  644   2HB   LYS  86          1HB       LYS  86   5.152  12.021  -0.355
  645   1HG   LYS  86          2HG       LYS  86   5.791  10.441   1.210
  646   2HG   LYS  86          1HG       LYS  86   4.041  10.226   1.261
  647   1HD   LYS  86          2HD       LYS  86   4.110   8.250   0.016
  648   2HD   LYS  86          1HD       LYS  86   5.668   8.645  -0.710
  649   1HE   LYS  86          2HE       LYS  86   6.366   7.082   0.841
  650   2HE   LYS  86          1HE       LYS  86   6.469   8.536   1.833
  651   1HZ   LYS  86          1HZ       LYS  86   5.285   6.792   2.990
  652   2HZ   LYS  86          2HZ       LYS  86   4.166   6.661   1.719
  653   3HZ   LYS  86          3HZ       LYS  86   4.233   8.079   2.654
  654    H    ASP  87           H        ASP  87   2.489  11.743   1.328
  655    HA   ASP  87           HA       ASP  87   1.298  14.304   0.579
  656   1HB   ASP  87          2HB       ASP  87   0.519  14.357   2.946
  657   2HB   ASP  87          1HB       ASP  87  -0.002  12.918   2.078
  658    H    ASP  88           H        ASP  88   4.084  13.067   2.341
  659    HA   ASP  88           HA       ASP  88   4.822  15.402   3.734
  660   1HB   ASP  88          2HB       ASP  88   5.824  13.123   4.076
  661   2HB   ASP  88          1HB       ASP  88   6.712  13.342   2.569
  662    H    SER  89           HN       SER  89   6.060  14.172   0.608
  663    HA   SER  89           HA       SER  89   7.011  16.900  -0.014
  664   1HB   SER  89          2HB       SER  89   7.761  14.249  -1.273
  665   2HB   SER  89          1HB       SER  89   8.408  15.820  -1.741
  666    HG   SER  89           HG       SER  89   9.457  15.965   0.154
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  -7.075   8.705  11.558
    2   2H    MET   1          2H        MET   1  -5.437   8.686  11.109
    3   3H    MET   1          3H        MET   1  -6.576   7.800  10.214
    4    HA   MET   1           HA       MET   1  -7.661   9.839   9.510
    5   1HB   MET   1          2HB       MET   1  -5.576  11.005  11.345
    6   2HB   MET   1          1HB       MET   1  -6.197  11.958   9.998
    7   1HG   MET   1          2HG       MET   1  -8.450  11.802  10.821
    8   2HG   MET   1          1HG       MET   1  -7.992  10.599  12.027
    9   1HE   MET   1          1HE       MET   1  -6.841  10.723  13.776
   10   2HE   MET   1          2HE       MET   1  -7.024  12.046  14.925
   11   3HE   MET   1          3HE       MET   1  -5.529  11.887  14.009
   12    H    ASN   2           H        ASN   2  -6.859   8.461   7.762
   13    HA   ASN   2           HA       ASN   2  -4.812   9.805   6.218
   14   1HB   ASN   2          2HB       ASN   2  -3.527   7.622   5.855
   15   2HB   ASN   2          1HB       ASN   2  -3.273   8.437   7.396
   16   1HD2  ASN   2          1HD2      ASN   2  -4.819   5.632   5.863
   17   2HD2  ASN   2          2HD2      ASN   2  -5.139   4.804   7.310
   18    H    ASP   3           H        ASP   3  -7.510   9.525   5.726
   19    HA   ASP   3           HA       ASP   3  -7.842   7.342   3.799
   20   1HB   ASP   3          2HB       ASP   3 -10.173   8.037   3.685
   21   2HB   ASP   3          1HB       ASP   3  -9.685   7.871   5.369
   22    H    ILE   4           H        ILE   4  -6.212  10.062   3.524
   23    HA   ILE   4           HA       ILE   4  -7.401  11.462   1.356
   24    HB   ILE   4           HB       ILE   4  -5.159  12.463   1.034
   25   1HG1  ILE   4          2HG1      ILE   4  -3.599  11.650   3.105
   26   2HG1  ILE   4          1HG1      ILE   4  -4.401  10.129   2.719
   27   1HG2  ILE   4          1HG2      ILE   4  -4.988  12.939   3.737
   28   2HG2  ILE   4          2HG2      ILE   4  -6.648  12.367   3.572
   29   3HG2  ILE   4          3HG2      ILE   4  -6.098  13.759   2.641
   30   1HD1  ILE   4          1HD1      ILE   4  -3.512  10.051   0.562
   31   2HD1  ILE   4          2HD1      ILE   4  -2.180  10.765   1.470
   32   3HD1  ILE   4          3HD1      ILE   4  -3.239  11.792   0.502
   33    H    TYR   5           H        TYR   5  -5.373   8.618   1.533
   34    HA   TYR   5           HA       TYR   5  -4.455   8.534  -1.139
   35   1HB   TYR   5          2HB       TYR   5  -5.018   6.297   0.824
   36   2HB   TYR   5          1HB       TYR   5  -4.229   6.062  -0.736
   37    HD1  TYR   5           HD1      TYR   5  -3.906   7.540   2.630
   38    HD2  TYR   5           HD2      TYR   5  -1.972   6.896  -1.153
   39    HE1  TYR   5           HE1      TYR   5  -1.739   8.217   3.623
   40    HE2  TYR   5           HE2      TYR   5   0.195   7.575  -0.156
   41    HH   TYR   5           HH       TYR   5   0.903   7.581   2.875
   42    H    LYS   6           H        LYS   6  -7.406   7.363   0.411
   43    HA   LYS   6           HA       LYS   6  -8.451   6.165  -2.012
   44   1HB   LYS   6          2HB       LYS   6  -9.521   6.604   0.764
   45   2HB   LYS   6          1HB       LYS   6 -10.601   6.120  -0.544
   46   1HG   LYS   6          2HG       LYS   6  -9.850   4.094   0.503
   47   2HG   LYS   6          1HG       LYS   6  -8.986   4.220  -1.029
   48   1HD   LYS   6          2HD       LYS   6  -6.979   4.908   0.027
   49   2HD   LYS   6          1HD       LYS   6  -7.809   5.303   1.532
   50   1HE   LYS   6          2HE       LYS   6  -6.739   3.236   1.971
   51   2HE   LYS   6          1HE       LYS   6  -8.418   2.805   1.649
   52   1HZ   LYS   6          1HZ       LYS   6  -6.752   1.413   0.469
   53   2HZ   LYS   6          2HZ       LYS   6  -6.286   2.785  -0.416
   54   3HZ   LYS   6          3HZ       LYS   6  -7.863   2.173  -0.561
   55    H    ALA   7           H        ALA   7  -8.603   9.268  -0.415
   56    HA   ALA   7           HA       ALA   7 -10.958  10.258  -1.672
   57   1HB   ALA   7          1HB       ALA   7 -10.175  11.386   0.290
   58   2HB   ALA   7          2HB       ALA   7  -9.997  12.512  -1.057
   59   3HB   ALA   7          3HB       ALA   7  -8.587  11.659  -0.429
   60    H    ALA   8           H        ALA   8  -7.636   9.941  -2.724
   61    HA   ALA   8           HA       ALA   8  -7.926  11.826  -4.917
   62   1HB   ALA   8          1HB       ALA   8  -5.663  11.214  -5.506
   63   2HB   ALA   8          2HB       ALA   8  -5.720   9.815  -4.434
   64   3HB   ALA   8          3HB       ALA   8  -5.741  11.444  -3.759
   65    H    VAL   9           H        VAL   9  -7.746   8.295  -4.522
   66    HA   VAL   9           HA       VAL   9  -7.874   7.675  -7.290
   67    HB   VAL   9           HB       VAL   9  -7.119   6.083  -5.512
   68   1HG1  VAL   9          1HG1      VAL   9  -8.874   6.524  -3.854
   69   2HG1  VAL   9          2HG1      VAL   9  -8.861   4.816  -4.291
   70   3HG1  VAL   9          3HG1      VAL   9 -10.095   5.886  -4.954
   71   1HG2  VAL   9          1HG2      VAL   9  -8.006   5.474  -7.877
   72   2HG2  VAL   9          2HG2      VAL   9  -9.435   4.885  -7.028
   73   3HG2  VAL   9          3HG2      VAL   9  -7.855   4.178  -6.690
   74    H    GLU  10           H        GLU  10 -10.326   8.590  -4.988
   75    HA   GLU  10           HA       GLU  10 -12.522   7.550  -6.551
   76   1HB   GLU  10          2HB       GLU  10 -13.957   8.605  -4.904
   77   2HB   GLU  10          1HB       GLU  10 -12.647   7.760  -4.080
   78   1HG   GLU  10          2HG       GLU  10 -11.547   9.740  -3.505
   79   2HG   GLU  10          1HG       GLU  10 -12.335  10.669  -4.779
   80    H    GLN  11           H        GLN  11 -10.622  10.454  -6.541
   81    HA   GLN  11           HA       GLN  11 -12.503  11.612  -8.507
   82   1HB   GLN  11          2HB       GLN  11 -12.094  13.857  -7.628
   83   2HB   GLN  11          1HB       GLN  11 -12.779  12.823  -6.378
   84   1HG   GLN  11          2HG       GLN  11 -10.194  12.358  -5.872
   85   2HG   GLN  11          1HG       GLN  11 -10.020  13.948  -6.610
   86   1HE2  GLN  11          1HE2      GLN  11  -9.539  15.077  -4.623
   87   2HE2  GLN  11          2HE2      GLN  11 -10.688  15.261  -3.388
   88    H    LEU  12           H        LEU  12 -10.073  10.046  -8.896
   89    HA   LEU  12           HA       LEU  12  -7.931  11.814  -9.632
   90   1HB   LEU  12          2HB       LEU  12  -7.267   9.694 -11.046
   91   2HB   LEU  12          1HB       LEU  12  -7.048   9.746  -9.315
   92    HG   LEU  12           HG       LEU  12  -8.995   8.366  -8.970
   93   1HD1  LEU  12          1HD1      LEU  12 -10.585   9.015 -10.565
   94   2HD1  LEU  12          2HD1      LEU  12 -10.089   7.427 -11.150
   95   3HD1  LEU  12          3HD1      LEU  12  -9.439   8.885 -11.900
   96   1HD2  LEU  12          1HD2      LEU  12  -6.714   7.424  -9.840
   97   2HD2  LEU  12          2HD2      LEU  12  -7.617   7.082 -11.316
   98   3HD2  LEU  12          3HD2      LEU  12  -8.115   6.355  -9.789
   99    H    THR  13           H        THR  13  -7.057  11.586 -12.011
  100    HA   THR  13           HA       THR  13  -9.149  12.688 -13.720
  101    HB   THR  13           HB       THR  13  -6.928  12.678 -15.291
  102    HG1  THR  13           HG1      THR  13  -5.443  11.957 -13.943
  103   1HG2  THR  13          1HG2      THR  13  -6.548  14.995 -13.968
  104   2HG2  THR  13          2HG2      THR  13  -8.159  14.581 -13.380
  105   3HG2  THR  13          3HG2      THR  13  -7.866  14.745 -15.113
  106    H    ASP  14           H        ASP  14  -9.204  12.052 -16.025
  107    HA   ASP  14           HA       ASP  14  -9.712   9.254 -16.299
  108   1HB   ASP  14          2HB       ASP  14  -9.607  11.538 -18.271
  109   2HB   ASP  14          1HB       ASP  14  -9.920   9.878 -18.777
  110    H    GLU  15           H        GLU  15  -7.018  11.377 -17.052
  111    HA   GLU  15           HA       GLU  15  -5.573   9.527 -18.702
  112   1HB   GLU  15          2HB       GLU  15  -4.761  12.013 -17.191
  113   2HB   GLU  15          1HB       GLU  15  -3.608  11.051 -18.117
  114   1HG   GLU  15          2HG       GLU  15  -4.450  11.732 -20.125
  115   2HG   GLU  15          1HG       GLU  15  -6.115  11.730 -19.542
  116    H    GLN  16           H        GLN  16  -5.830  10.111 -15.256
  117    HA   GLN  16           HA       GLN  16  -3.508   8.629 -14.468
  118   1HB   GLN  16          2HB       GLN  16  -4.480  10.294 -12.965
  119   2HB   GLN  16          1HB       GLN  16  -5.998   9.399 -12.915
  120   1HG   GLN  16          2HG       GLN  16  -5.203   7.924 -11.392
  121   2HG   GLN  16          1HG       GLN  16  -3.663   7.751 -12.234
  122   1HE2  GLN  16          1HE2      GLN  16  -5.344  10.449 -10.489
  123   2HE2  GLN  16          2HE2      GLN  16  -3.982  10.886  -9.579
  124    H    LYS  17           H        LYS  17  -6.977   7.903 -14.746
  125    HA   LYS  17           HA       LYS  17  -6.891   5.257 -13.744
  126   1HB   LYS  17          2HB       LYS  17  -8.775   6.467 -15.789
  127   2HB   LYS  17          1HB       LYS  17  -9.027   4.936 -14.953
  128   1HG   LYS  17          2HG       LYS  17  -9.619   5.949 -12.994
  129   2HG   LYS  17          1HG       LYS  17  -8.455   7.256 -13.202
  130   1HD   LYS  17          2HD       LYS  17 -10.191   8.573 -13.787
  131   2HD   LYS  17          1HD       LYS  17 -10.291   7.637 -15.276
  132   1HE   LYS  17          2HE       LYS  17 -12.083   6.396 -14.541
  133   2HE   LYS  17          1HE       LYS  17 -11.572   6.460 -12.855
  134   1HZ   LYS  17          1HZ       LYS  17 -13.563   7.786 -13.260
  135   2HZ   LYS  17          2HZ       LYS  17 -12.718   8.734 -14.387
  136   3HZ   LYS  17          3HZ       LYS  17 -12.271   8.758 -12.748
  137    H    ASN  18           H        ASN  18  -6.582   6.577 -17.031
  138    HA   ASN  18           HA       ASN  18  -6.246   4.001 -18.271
  139   1HB   ASN  18          2HB       ASN  18  -5.958   6.844 -19.198
  140   2HB   ASN  18          1HB       ASN  18  -5.362   5.519 -20.200
  141   1HD2  ASN  18          1HD2      ASN  18  -8.157   7.322 -19.428
  142   2HD2  ASN  18          2HD2      ASN  18  -9.305   6.278 -20.117
  143    H    GLU  19           H        GLU  19  -4.107   6.368 -16.825
  144    HA   GLU  19           HA       GLU  19  -1.661   5.758 -17.995
  145   1HB   GLU  19          2HB       GLU  19  -2.088   7.550 -16.264
  146   2HB   GLU  19          1HB       GLU  19  -2.053   6.284 -15.039
  147   1HG   GLU  19          2HG       GLU  19   0.172   6.839 -14.987
  148   2HG   GLU  19          1HG       GLU  19   0.237   5.691 -16.324
  149    H    PHE  20           H        PHE  20  -3.180   4.224 -15.157
  150    HA   PHE  20           HA       PHE  20  -1.146   2.135 -15.127
  151   1HB   PHE  20          2HB       PHE  20  -3.407   2.914 -13.325
  152   2HB   PHE  20          1HB       PHE  20  -2.723   1.293 -13.216
  153    HD1  PHE  20           HD1      PHE  20  -2.116   4.874 -12.701
  154    HD2  PHE  20           HD2      PHE  20  -0.376   0.954 -12.565
  155    HE1  PHE  20           HE1      PHE  20  -0.212   5.762 -11.386
  156    HE2  PHE  20           HE2      PHE  20   1.523   1.833 -11.246
  157    HZ   PHE  20           HZ       PHE  20   1.610   4.242 -10.656
  158    H    LYS  21           H        LYS  21  -4.676   2.403 -15.652
  159    HA   LYS  21           HA       LYS  21  -5.265  -0.298 -15.935
  160   1HB   LYS  21          2HB       LYS  21  -6.944   1.571 -15.910
  161   2HB   LYS  21          1HB       LYS  21  -6.546   1.868 -17.601
  162   1HG   LYS  21          2HG       LYS  21  -6.968  -0.949 -17.248
  163   2HG   LYS  21          1HG       LYS  21  -8.328  -0.091 -16.530
  164   1HD   LYS  21          2HD       LYS  21  -8.623  -0.657 -18.966
  165   2HD   LYS  21          1HD       LYS  21  -8.792   1.058 -18.599
  166   1HE   LYS  21          2HE       LYS  21  -6.448   1.425 -19.323
  167   2HE   LYS  21          1HE       LYS  21  -6.310  -0.289 -19.710
  168   1HZ   LYS  21          1HZ       LYS  21  -8.262   1.591 -20.927
  169   2HZ   LYS  21          2HZ       LYS  21  -8.076  -0.053 -21.320
  170   3HZ   LYS  21          3HZ       LYS  21  -6.831   1.052 -21.661
  171    H    ALA  22           H        ALA  22  -3.914   1.920 -18.363
  172    HA   ALA  22           HA       ALA  22  -4.178   0.320 -20.642
  173   1HB   ALA  22          1HB       ALA  22  -1.894   2.157 -19.880
  174   2HB   ALA  22          2HB       ALA  22  -3.333   2.605 -20.796
  175   3HB   ALA  22          3HB       ALA  22  -2.154   1.495 -21.494
  176    H    ALA  23           H        ALA  23  -1.496   0.448 -18.313
  177    HA   ALA  23           HA       ALA  23  -0.069  -1.761 -19.447
  178   1HB   ALA  23          1HB       ALA  23   1.502  -1.348 -17.834
  179   2HB   ALA  23          2HB       ALA  23   0.295  -1.100 -16.572
  180   3HB   ALA  23          3HB       ALA  23   0.645   0.188 -17.725
  181    H    PHE  24           H        PHE  24  -2.463  -1.327 -16.908
  182    HA   PHE  24           HA       PHE  24  -2.320  -3.859 -15.684
  183   1HB   PHE  24          2HB       PHE  24  -3.650  -1.757 -14.962
  184   2HB   PHE  24          1HB       PHE  24  -4.907  -2.352 -16.044
  185    HD1  PHE  24           HD1      PHE  24  -5.826  -4.699 -15.689
  186    HD2  PHE  24           HD2      PHE  24  -3.321  -2.724 -12.820
  187    HE1  PHE  24           HE1      PHE  24  -6.570  -6.289 -13.939
  188    HE2  PHE  24           HE2      PHE  24  -4.064  -4.306 -11.073
  189    HZ   PHE  24           HZ       PHE  24  -5.691  -6.087 -11.630
  190    H    ASP  25           H        ASP  25  -4.364  -2.690 -18.374
  191    HA   ASP  25           HA       ASP  25  -5.806  -5.064 -18.802
  192   1HB   ASP  25          2HB       ASP  25  -6.095  -2.672 -19.826
  193   2HB   ASP  25          1HB       ASP  25  -5.047  -3.294 -21.101
  194    H    ILE  26           H        ILE  26  -2.646  -4.062 -20.092
  195    HA   ILE  26           HA       ILE  26  -2.478  -6.344 -21.857
  196    HB   ILE  26           HB       ILE  26  -0.138  -5.587 -22.262
  197   1HG1  ILE  26          2HG1      ILE  26  -0.886  -3.335 -20.365
  198   2HG1  ILE  26          1HG1      ILE  26   0.243  -4.633 -19.981
  199   1HG2  ILE  26          1HG2      ILE  26  -0.786  -3.661 -23.519
  200   2HG2  ILE  26          2HG2      ILE  26  -2.094  -3.283 -22.398
  201   3HG2  ILE  26          3HG2      ILE  26  -2.216  -4.692 -23.450
  202   1HD1  ILE  26          1HD1      ILE  26   1.908  -3.559 -21.041
  203   2HD1  ILE  26          2HD1      ILE  26   0.817  -2.193 -21.283
  204   3HD1  ILE  26          3HD1      ILE  26   0.947  -3.449 -22.516
  205    H    PHE  27           H        PHE  27  -1.100  -5.503 -18.679
  206    HA   PHE  27           HA       PHE  27   0.583  -7.804 -18.529
  207   1HB   PHE  27          2HB       PHE  27  -0.477  -5.940 -16.404
  208   2HB   PHE  27          1HB       PHE  27   0.589  -7.296 -16.039
  209    HD1  PHE  27           HD1      PHE  27   2.501  -7.384 -18.197
  210    HD2  PHE  27           HD2      PHE  27   0.750  -3.952 -16.299
  211    HE1  PHE  27           HE1      PHE  27   4.448  -6.013 -18.879
  212    HE2  PHE  27           HE2      PHE  27   2.697  -2.583 -16.985
  213    HZ   PHE  27           HZ       PHE  27   4.548  -3.611 -18.272
  214    H    ILE  28           H        ILE  28  -2.770  -7.178 -17.542
  215    HA   ILE  28           HA       ILE  28  -2.972  -9.872 -16.391
  216    HB   ILE  28           HB       ILE  28  -5.148  -9.261 -15.598
  217   1HG1  ILE  28          2HG1      ILE  28  -5.737  -6.686 -16.250
  218   2HG1  ILE  28          1HG1      ILE  28  -4.945  -7.210 -17.736
  219   1HG2  ILE  28          1HG2      ILE  28  -2.974  -8.172 -14.613
  220   2HG2  ILE  28          2HG2      ILE  28  -4.556  -7.609 -14.072
  221   3HG2  ILE  28          3HG2      ILE  28  -3.652  -6.681 -15.267
  222   1HD1  ILE  28          1HD1      ILE  28  -6.568  -8.782 -18.213
  223   2HD1  ILE  28          2HD1      ILE  28  -7.554  -7.599 -17.352
  224   3HD1  ILE  28          3HD1      ILE  28  -6.970  -9.038 -16.515
  225    H    GLN  29           H        GLN  29  -2.964  -8.805 -19.448
  226    HA   GLN  29           HA       GLN  29  -5.269  -9.543 -20.752
  227   1HB   GLN  29          2HB       GLN  29  -3.295  -8.579 -21.873
  228   2HB   GLN  29          1HB       GLN  29  -2.430 -10.098 -21.651
  229   1HG   GLN  29          2HG       GLN  29  -3.262 -10.275 -23.841
  230   2HG   GLN  29          1HG       GLN  29  -4.443 -11.172 -22.888
  231   1HE2  GLN  29          1HE2      GLN  29  -3.875  -7.772 -23.997
  232   2HE2  GLN  29          2HE2      GLN  29  -5.514  -7.447 -24.289
  233    H    ASP  30           H        ASP  30  -2.641 -11.661 -19.672
  234    HA   ASP  30           HA       ASP  30  -4.221 -14.033 -20.434
  235   1HB   ASP  30          2HB       ASP  30  -2.105 -15.292 -20.068
  236   2HB   ASP  30          1HB       ASP  30  -1.952 -14.041 -21.299
  237    H    ALA  31           H        ALA  31  -4.739 -12.326 -18.018
  238    HA   ALA  31           HA       ALA  31  -4.105 -14.197 -15.838
  239   1HB   ALA  31          1HB       ALA  31  -4.783 -12.432 -14.325
  240   2HB   ALA  31          2HB       ALA  31  -5.364 -11.450 -15.670
  241   3HB   ALA  31          3HB       ALA  31  -3.638 -11.771 -15.492
  242    H    GLU  32           H        GLU  32  -5.706 -15.007 -14.474
  243    HA   GLU  32           HA       GLU  32  -8.447 -14.984 -15.601
  244   1HB   GLU  32          2HB       GLU  32  -6.977 -17.238 -14.209
  245   2HB   GLU  32          1HB       GLU  32  -8.687 -17.277 -14.639
  246   1HG   GLU  32          2HG       GLU  32  -8.261 -17.438 -16.905
  247   2HG   GLU  32          1HG       GLU  32  -6.727 -16.575 -16.785
  248    H    ASP  33           H        ASP  33  -7.682 -13.020 -13.825
  249    HA   ASP  33           HA       ASP  33  -9.481 -13.543 -11.603
  250   1HB   ASP  33          2HB       ASP  33  -7.077 -14.291 -10.952
  251   2HB   ASP  33          1HB       ASP  33  -6.739 -12.562 -10.870
  252    H    GLY  34           H        GLY  34  -7.061 -11.287 -12.923
  253   1HA   GLY  34          2HA       GLY  34  -7.869  -9.127 -13.783
  254   2HA   GLY  34          1HA       GLY  34  -8.953  -9.066 -12.396
  255    H    CYS  35           H        CYS  35  -5.542 -10.025 -12.490
  256    HA   CYS  35           HA       CYS  35  -4.703  -7.571 -11.125
  257   1HB   CYS  35          2HB       CYS  35  -4.069 -10.278  -9.930
  258   2HB   CYS  35          1HB       CYS  35  -3.720  -8.690  -9.248
  259    HG   CYS  35           HG       CYS  35  -6.344  -8.362  -8.948
  260    H    ILE  36           H        ILE  36  -2.505  -7.120 -11.410
  261    HA   ILE  36           HA       ILE  36  -1.213  -8.657 -13.529
  262    HB   ILE  36           HB       ILE  36   0.333  -6.891 -13.765
  263   1HG1  ILE  36          2HG1      ILE  36  -0.055  -5.030 -11.734
  264   2HG1  ILE  36          1HG1      ILE  36  -0.100  -6.573 -10.882
  265   1HG2  ILE  36          1HG2      ILE  36  -2.353  -5.787 -12.920
  266   2HG2  ILE  36          2HG2      ILE  36  -1.792  -6.138 -14.554
  267   3HG2  ILE  36          3HG2      ILE  36  -1.095  -4.792 -13.653
  268   1HD1  ILE  36          1HD1      ILE  36   2.148  -6.704 -11.028
  269   2HD1  ILE  36          2HD1      ILE  36   2.187  -5.187 -11.926
  270   3HD1  ILE  36          3HD1      ILE  36   2.021  -6.716 -12.787
  271    H    SER  37           H        SER  37   1.188  -9.114 -13.276
  272    HA   SER  37           HA       SER  37   1.533 -10.657 -10.832
  273   1HB   SER  37          2HB       SER  37   2.197 -11.648 -12.985
  274   2HB   SER  37          1HB       SER  37   3.354 -10.345 -13.235
  275    HG   SER  37           HG       SER  37   3.407 -12.494 -11.440
  276    H    THR  38           H        THR  38   2.110  -9.506  -9.087
  277    HA   THR  38           HA       THR  38   3.518  -7.068  -9.060
  278    HB   THR  38           HB       THR  38   2.234  -7.847  -7.122
  279    HG1  THR  38           HG1      THR  38   4.995  -7.620  -6.531
  280   1HG2  THR  38          1HG2      THR  38   4.411  -9.727  -6.329
  281   2HG2  THR  38          2HG2      THR  38   3.223 -10.287  -7.504
  282   3HG2  THR  38          3HG2      THR  38   2.699  -9.748  -5.908
  283    H    LYS  39           H        LYS  39   4.637 -10.398  -9.118
  284    HA   LYS  39           HA       LYS  39   7.378  -9.858  -8.487
  285   1HB   LYS  39          2HB       LYS  39   6.385 -12.187 -10.140
  286   2HB   LYS  39          1HB       LYS  39   7.826 -12.110  -9.130
  287   1HG   LYS  39          2HG       LYS  39   4.936 -12.207  -8.235
  288   2HG   LYS  39          1HG       LYS  39   6.218 -13.365  -7.883
  289   1HD   LYS  39          2HD       LYS  39   7.390 -11.712  -6.520
  290   2HD   LYS  39          1HD       LYS  39   6.196 -10.484  -6.940
  291   1HE   LYS  39          2HE       LYS  39   5.599 -11.331  -4.765
  292   2HE   LYS  39          1HE       LYS  39   4.431 -11.981  -5.915
  293   1HZ   LYS  39          1HZ       LYS  39   5.399 -13.608  -4.284
  294   2HZ   LYS  39          2HZ       LYS  39   6.874 -13.457  -5.114
  295   3HZ   LYS  39          3HZ       LYS  39   5.501 -14.060  -5.915
  296    H    GLU  40           H        GLU  40   5.430  -9.718 -11.374
  297    HA   GLU  40           HA       GLU  40   7.823  -9.260 -13.042
  298   1HB   GLU  40          2HB       GLU  40   4.959  -9.747 -13.908
  299   2HB   GLU  40          1HB       GLU  40   6.362  -9.623 -14.967
  300   1HG   GLU  40          2HG       GLU  40   6.051 -11.711 -12.788
  301   2HG   GLU  40          1HG       GLU  40   5.693 -11.993 -14.491
  302    H    LEU  41           H        LEU  41   6.549  -7.299 -11.111
  303    HA   LEU  41           HA       LEU  41   5.227  -5.303 -12.665
  304   1HB   LEU  41          2HB       LEU  41   5.494  -5.701 -10.016
  305   2HB   LEU  41          1HB       LEU  41   6.710  -4.466 -10.249
  306    HG   LEU  41           HG       LEU  41   4.081  -3.899 -11.488
  307   1HD1  LEU  41          1HD1      LEU  41   3.678  -5.059  -9.193
  308   2HD1  LEU  41          2HD1      LEU  41   2.888  -3.513  -9.501
  309   3HD1  LEU  41          3HD1      LEU  41   4.342  -3.576  -8.506
  310   1HD2  LEU  41          1HD2      LEU  41   6.305  -2.453 -11.064
  311   2HD2  LEU  41          2HD2      LEU  41   5.476  -2.110  -9.546
  312   3HD2  LEU  41          3HD2      LEU  41   4.703  -1.715 -11.081
  313    H    GLY  42           H        GLY  42   8.475  -6.275 -12.650
  314   1HA   GLY  42          2HA       GLY  42   9.907  -3.870 -12.833
  315   2HA   GLY  42          1HA       GLY  42  10.370  -5.383 -13.607
  316    H    LYS  43           H        LYS  43   8.070  -5.684 -15.262
  317    HA   LYS  43           HA       LYS  43   8.803  -4.082 -17.507
  318   1HB   LYS  43          2HB       LYS  43   7.736  -6.462 -17.418
  319   2HB   LYS  43          1HB       LYS  43   6.209  -5.586 -17.315
  320   1HG   LYS  43          2HG       LYS  43   6.485  -5.872 -19.619
  321   2HG   LYS  43          1HG       LYS  43   7.110  -4.246 -19.356
  322   1HD   LYS  43          2HD       LYS  43   8.790  -5.231 -20.669
  323   2HD   LYS  43          1HD       LYS  43   9.408  -5.447 -19.032
  324   1HE   LYS  43          2HE       LYS  43   9.652  -7.610 -19.813
  325   2HE   LYS  43          1HE       LYS  43   8.006  -7.713 -19.192
  326   1HZ   LYS  43          1HZ       LYS  43   8.788  -7.162 -22.005
  327   2HZ   LYS  43          2HZ       LYS  43   7.191  -7.179 -21.422
  328   3HZ   LYS  43          3HZ       LYS  43   8.117  -8.604 -21.414
  329    H    VAL  44           H        VAL  44   6.580  -3.677 -14.905
  330    HA   VAL  44           HA       VAL  44   4.872  -1.756 -16.252
  331    HB   VAL  44           HB       VAL  44   5.001  -2.234 -13.276
  332   1HG1  VAL  44          1HG1      VAL  44   3.652  -0.354 -14.443
  333   2HG1  VAL  44          2HG1      VAL  44   2.819  -1.364 -13.263
  334   3HG1  VAL  44          3HG1      VAL  44   2.593  -1.654 -14.987
  335   1HG2  VAL  44          1HG2      VAL  44   3.014  -3.740 -14.891
  336   2HG2  VAL  44          2HG2      VAL  44   3.854  -4.213 -13.418
  337   3HG2  VAL  44          3HG2      VAL  44   4.676  -4.325 -14.973
  338    H    MET  45           H        MET  45   7.224  -1.739 -13.576
  339    HA   MET  45           HA       MET  45   7.244   0.981 -13.007
  340   1HB   MET  45          2HB       MET  45   8.840  -1.287 -12.335
  341   2HB   MET  45          1HB       MET  45   9.925   0.021 -12.800
  342   1HG   MET  45          2HG       MET  45   9.576   0.998 -10.807
  343   2HG   MET  45          1HG       MET  45   7.867   1.173 -11.207
  344   1HE   MET  45          1HE       MET  45   8.766   1.195  -8.582
  345   2HE   MET  45          2HE       MET  45   8.310  -0.154  -7.544
  346   3HE   MET  45          3HE       MET  45   7.066   0.728  -8.423
  347    H    ARG  46           H        ARG  46   9.160  -0.807 -15.427
  348    HA   ARG  46           HA       ARG  46  10.727   1.374 -16.307
  349   1HB   ARG  46          2HB       ARG  46  11.111   0.075 -18.361
  350   2HB   ARG  46          1HB       ARG  46  11.277  -0.935 -16.928
  351   1HG   ARG  46          2HG       ARG  46   8.992  -1.789 -17.247
  352   2HG   ARG  46          1HG       ARG  46   8.796  -0.759 -18.665
  353   1HD   ARG  46          2HD       ARG  46  11.036  -2.770 -18.454
  354   2HD   ARG  46          1HD       ARG  46   9.455  -3.206 -19.092
  355    HE   ARG  46           HE       ARG  46  11.467  -1.588 -20.405
  356   1HH1  ARG  46          2HH1      ARG  46   8.070  -2.387 -20.202
  357   2HH1  ARG  46          1HH1      ARG  46   7.727  -1.878 -21.820
  358   1HH2  ARG  46          1HH2      ARG  46  10.990  -0.926 -22.519
  359   2HH2  ARG  46          2HH2      ARG  46   9.373  -1.053 -23.128
  360    H    MET  47           H        MET  47   7.467   0.345 -17.158
  361    HA   MET  47           HA       MET  47   7.195   2.194 -19.364
  362   1HB   MET  47          2HB       MET  47   5.299   0.389 -17.880
  363   2HB   MET  47          1HB       MET  47   4.699   1.583 -19.031
  364   1HG   MET  47          2HG       MET  47   6.925  -0.284 -19.814
  365   2HG   MET  47          1HG       MET  47   5.247  -0.823 -19.890
  366   1HE   MET  47          1HE       MET  47   8.010   1.122 -20.918
  367   2HE   MET  47          2HE       MET  47   7.576   2.167 -22.268
  368   3HE   MET  47          3HE       MET  47   7.789   0.439 -22.534
  369    H    LEU  48           H        LEU  48   6.648   2.257 -15.913
  370    HA   LEU  48           HA       LEU  48   4.903   4.546 -15.889
  371   1HB   LEU  48          2HB       LEU  48   6.332   2.898 -13.881
  372   2HB   LEU  48          1HB       LEU  48   5.956   4.540 -13.413
  373    HG   LEU  48           HG       LEU  48   3.622   4.152 -13.538
  374   1HD1  LEU  48          1HD1      LEU  48   3.006   3.001 -15.411
  375   2HD1  LEU  48          2HD1      LEU  48   3.079   1.601 -14.342
  376   3HD1  LEU  48          3HD1      LEU  48   4.449   1.989 -15.383
  377   1HD2  LEU  48          1HD2      LEU  48   3.555   1.700 -12.391
  378   2HD2  LEU  48          2HD2      LEU  48   4.111   3.140 -11.537
  379   3HD2  LEU  48          3HD2      LEU  48   5.283   2.039 -12.262
  380    H    GLY  49           H        GLY  49   8.345   3.998 -15.910
  381   1HA   GLY  49          2HA       GLY  49   9.749   5.804 -16.787
  382   2HA   GLY  49          1HA       GLY  49   8.798   6.926 -15.821
  383    H    GLN  50           H        GLN  50   9.967   3.769 -14.715
  384    HA   GLN  50           HA       GLN  50  12.200   4.913 -13.256
  385   1HB   GLN  50          2HB       GLN  50  11.334   4.176 -11.020
  386   2HB   GLN  50          1HB       GLN  50  10.465   5.547 -11.706
  387   1HG   GLN  50          2HG       GLN  50   9.112   3.309 -12.703
  388   2HG   GLN  50          1HG       GLN  50   9.479   2.888 -11.032
  389   1HE2  GLN  50          1HE2      GLN  50   8.107   5.609 -12.970
  390   2HE2  GLN  50          2HE2      GLN  50   7.034   6.116 -11.757
  391    H    ASN  51           H        ASN  51  13.669   3.384 -12.569
  392    HA   ASN  51           HA       ASN  51  12.946   0.549 -13.001
  393   1HB   ASN  51          2HB       ASN  51  14.355   1.661 -14.879
  394   2HB   ASN  51          1HB       ASN  51  15.676   1.597 -13.714
  395   1HD2  ASN  51          1HD2      ASN  51  16.937  -0.154 -14.450
  396   2HD2  ASN  51          2HD2      ASN  51  16.325  -1.711 -14.738
  397    HA   PRO  52           HA       PRO  52  14.903   0.988  -8.871
  398   1HB   PRO  52          2HB       PRO  52  12.972  -0.411  -7.531
  399   2HB   PRO  52          1HB       PRO  52  12.864   1.319  -7.880
  400   1HG   PRO  52          2HG       PRO  52  11.413  -0.940  -9.108
  401   2HG   PRO  52          1HG       PRO  52  10.945   0.762  -8.977
  402   1HD   PRO  52          2HD       PRO  52  12.005  -0.541 -11.279
  403   2HD   PRO  52          1HD       PRO  52  11.729   1.204 -11.072
  404    H    THR  53           H        THR  53  14.630  -1.154  -7.102
  405    HA   THR  53           HA       THR  53  16.051  -3.313  -8.532
  406    HB   THR  53           HB       THR  53  17.184  -3.779  -6.536
  407    HG1  THR  53           HG1      THR  53  16.323  -2.899  -4.507
  408   1HG2  THR  53          1HG2      THR  53  17.625  -1.433  -7.399
  409   2HG2  THR  53          2HG2      THR  53  18.046  -1.719  -5.709
  410   3HG2  THR  53          3HG2      THR  53  16.562  -0.859  -6.115
  411    HA   PRO  54           HA       PRO  54  12.838  -6.214  -7.661
  412   1HB   PRO  54          2HB       PRO  54  14.101  -8.395  -6.584
  413   2HB   PRO  54          1HB       PRO  54  14.176  -7.950  -8.296
  414   1HG   PRO  54          2HG       PRO  54  16.230  -7.637  -6.175
  415   2HG   PRO  54          1HG       PRO  54  16.433  -7.881  -7.917
  416   1HD   PRO  54          2HD       PRO  54  16.701  -5.438  -6.574
  417   2HD   PRO  54          1HD       PRO  54  16.487  -5.626  -8.329
  418    H    GLU  55           H        GLU  55  14.958  -5.571  -4.914
  419    HA   GLU  55           HA       GLU  55  13.029  -6.529  -2.960
  420   1HB   GLU  55          2HB       GLU  55  14.603  -5.665  -1.273
  421   2HB   GLU  55          1HB       GLU  55  15.417  -6.713  -2.432
  422   1HG   GLU  55          2HG       GLU  55  16.419  -4.874  -3.558
  423   2HG   GLU  55          1HG       GLU  55  15.344  -3.711  -2.780
  424    H    GLU  56           H        GLU  56  13.908  -3.513  -4.521
  425    HA   GLU  56           HA       GLU  56  12.550  -1.798  -2.659
  426   1HB   GLU  56          2HB       GLU  56  13.805  -1.456  -5.351
  427   2HB   GLU  56          1HB       GLU  56  12.683  -0.222  -4.778
  428   1HG   GLU  56          2HG       GLU  56  14.803  -1.181  -2.896
  429   2HG   GLU  56          1HG       GLU  56  15.279  -0.091  -4.198
  430    H    LEU  57           H        LEU  57  11.774  -3.027  -5.931
  431    HA   LEU  57           HA       LEU  57   9.243  -1.816  -6.136
  432   1HB   LEU  57          2HB       LEU  57   8.802  -3.287  -7.937
  433   2HB   LEU  57          1HB       LEU  57  10.496  -2.871  -8.015
  434    HG   LEU  57           HG       LEU  57  10.722  -5.179  -6.671
  435   1HD1  LEU  57          1HD1      LEU  57   9.005  -6.708  -7.977
  436   2HD1  LEU  57          2HD1      LEU  57   8.040  -5.234  -8.023
  437   3HD1  LEU  57          3HD1      LEU  57   8.518  -5.926  -6.474
  438   1HD2  LEU  57          1HD2      LEU  57  11.746  -4.572  -8.862
  439   2HD2  LEU  57          2HD2      LEU  57  10.233  -4.996  -9.661
  440   3HD2  LEU  57          3HD2      LEU  57  11.171  -6.239  -8.835
  441    H    GLN  58           H        GLN  58  10.247  -4.925  -4.751
  442    HA   GLN  58           HA       GLN  58   7.641  -5.941  -4.265
  443   1HB   GLN  58          2HB       GLN  58  10.384  -6.623  -3.430
  444   2HB   GLN  58          1HB       GLN  58   9.136  -7.052  -2.261
  445   1HG   GLN  58          2HG       GLN  58   8.909  -7.740  -5.198
  446   2HG   GLN  58          1HG       GLN  58   9.663  -8.823  -4.029
  447   1HE2  GLN  58          1HE2      GLN  58   6.663  -7.924  -5.398
  448   2HE2  GLN  58          2HE2      GLN  58   5.650  -8.695  -4.275
  449    H    GLU  59           H        GLU  59   9.772  -3.802  -2.431
  450    HA   GLU  59           HA       GLU  59   8.277  -3.822  -0.007
  451   1HB   GLU  59          2HB       GLU  59  10.454  -2.167  -1.162
  452   2HB   GLU  59          1HB       GLU  59   9.460  -1.397   0.076
  453   1HG   GLU  59          2HG       GLU  59  10.556  -4.171   0.507
  454   2HG   GLU  59          1HG       GLU  59  11.553  -2.753   0.832
  455    H    MET  60           H        MET  60   8.043  -1.952  -2.995
  456    HA   MET  60           HA       MET  60   6.202  -0.001  -1.974
  457   1HB   MET  60          2HB       MET  60   6.640  -0.829  -4.854
  458   2HB   MET  60          1HB       MET  60   5.872   0.655  -4.292
  459   1HG   MET  60          2HG       MET  60   8.160   0.964  -2.992
  460   2HG   MET  60          1HG       MET  60   8.764  -0.117  -4.246
  461   1HE   MET  60          1HE       MET  60  10.293   1.149  -5.318
  462   2HE   MET  60          2HE       MET  60  10.217   2.630  -4.368
  463   3HE   MET  60          3HE       MET  60  10.119   2.713  -6.125
  464    H    ILE  61           H        ILE  61   5.897  -2.974  -3.862
  465    HA   ILE  61           HA       ILE  61   3.058  -2.860  -4.128
  466    HB   ILE  61           HB       ILE  61   4.856  -5.295  -4.259
  467   1HG1  ILE  61          2HG1      ILE  61   3.811  -4.095  -6.746
  468   2HG1  ILE  61          1HG1      ILE  61   4.956  -3.064  -5.883
  469   1HG2  ILE  61          1HG2      ILE  61   2.885  -6.382  -4.429
  470   2HG2  ILE  61          2HG2      ILE  61   2.656  -5.559  -5.972
  471   3HG2  ILE  61          3HG2      ILE  61   1.982  -4.869  -4.495
  472   1HD1  ILE  61          1HD1      ILE  61   5.425  -5.576  -7.332
  473   2HD1  ILE  61          2HD1      ILE  61   6.163  -5.540  -5.731
  474   3HD1  ILE  61          3HD1      ILE  61   6.557  -4.292  -6.913
  475    H    ASP  62           H        ASP  62   5.222  -4.627  -1.921
  476    HA   ASP  62           HA       ASP  62   3.340  -6.057  -0.457
  477   1HB   ASP  62          2HB       ASP  62   5.838  -6.228  -0.227
  478   2HB   ASP  62          1HB       ASP  62   5.799  -4.738   0.714
  479    H    GLU  63           H        GLU  63   4.300  -2.662  -0.152
  480    HA   GLU  63           HA       GLU  63   2.891  -2.150   2.278
  481   1HB   GLU  63          2HB       GLU  63   4.003  -0.376   0.112
  482   2HB   GLU  63          1HB       GLU  63   3.080   0.284   1.462
  483   1HG   GLU  63          2HG       GLU  63   5.345  -1.611   2.013
  484   2HG   GLU  63          1HG       GLU  63   5.697   0.078   1.652
  485    H    VAL  64           H        VAL  64   2.112  -1.436  -1.144
  486    HA   VAL  64           HA       VAL  64  -0.483  -0.392  -0.556
  487    HB   VAL  64           HB       VAL  64   0.714   0.224  -2.613
  488   1HG1  VAL  64          1HG1      VAL  64   0.211  -2.654  -3.431
  489   2HG1  VAL  64          2HG1      VAL  64   1.785  -1.942  -3.080
  490   3HG1  VAL  64          3HG1      VAL  64   0.861  -1.391  -4.476
  491   1HG2  VAL  64          1HG2      VAL  64  -1.704  -1.287  -3.543
  492   2HG2  VAL  64          2HG2      VAL  64  -1.196   0.355  -3.936
  493   3HG2  VAL  64          3HG2      VAL  64  -1.903   0.002  -2.359
  494    H    ASP  65           H        ASP  65   0.713  -3.615  -1.369
  495    HA   ASP  65           HA       ASP  65  -1.872  -4.774  -1.819
  496   1HB   ASP  65          2HB       ASP  65   0.735  -5.621  -2.219
  497   2HB   ASP  65          1HB       ASP  65   0.192  -6.629  -0.881
  498    H    GLU  66           H        GLU  66  -3.343  -4.785  -0.252
  499    HA   GLU  66           HA       GLU  66  -2.678  -4.836   2.550
  500   1HB   GLU  66          2HB       GLU  66  -5.387  -5.355   1.301
  501   2HB   GLU  66          1HB       GLU  66  -5.052  -4.822   2.948
  502   1HG   GLU  66          2HG       GLU  66  -4.168  -2.704   2.131
  503   2HG   GLU  66          1HG       GLU  66  -4.349  -3.240   0.462
  504    H    ASP  67           H        ASP  67  -3.939  -7.154   0.203
  505    HA   ASP  67           HA       ASP  67  -4.108  -9.287   2.170
  506   1HB   ASP  67          2HB       ASP  67  -4.684 -10.689   0.114
  507   2HB   ASP  67          1HB       ASP  67  -5.810  -9.399   0.527
  508    H    GLY  68           H        GLY  68  -1.998  -8.380  -0.532
  509   1HA   GLY  68          2HA       GLY  68   0.180  -9.002  -0.995
  510   2HA   GLY  68          1HA       GLY  68   0.218  -9.843   0.553
  511    H    SER  69           H        SER  69  -1.807 -10.212  -2.347
  512    HA   SER  69           HA       SER  69  -1.550 -13.107  -2.220
  513   1HB   SER  69          2HB       SER  69  -3.170 -13.068  -4.108
  514   2HB   SER  69          1HB       SER  69  -3.737 -12.181  -2.696
  515    HG   SER  69           HG       SER  69  -3.875 -10.521  -3.971
  516    H    GLY  70           H        GLY  70   0.629 -11.007  -3.337
  517   1HA   GLY  70          2HA       GLY  70   2.382 -11.236  -4.821
  518   2HA   GLY  70          1HA       GLY  70   1.780 -12.847  -5.198
  519    H    THR  71           H        THR  71  -0.294 -10.058  -5.464
  520    HA   THR  71           HA       THR  71   0.111  -9.722  -8.327
  521    HB   THR  71           HB       THR  71  -2.117 -10.298  -9.000
  522    HG1  THR  71           HG1      THR  71  -2.628 -10.796  -6.251
  523   1HG2  THR  71          1HG2      THR  71  -0.593 -12.222  -8.790
  524   2HG2  THR  71          2HG2      THR  71  -2.254 -12.695  -8.431
  525   3HG2  THR  71          3HG2      THR  71  -1.104 -12.446  -7.117
  526    H    VAL  72           H        VAL  72  -0.483  -7.689  -9.000
  527    HA   VAL  72           HA       VAL  72  -1.448  -5.879  -6.896
  528    HB   VAL  72           HB       VAL  72  -0.476  -5.090  -9.641
  529   1HG1  VAL  72          1HG1      VAL  72  -0.371  -2.922  -8.780
  530   2HG1  VAL  72          2HG1      VAL  72  -0.290  -3.482  -7.109
  531   3HG1  VAL  72          3HG1      VAL  72  -1.817  -3.551  -7.989
  532   1HG2  VAL  72          1HG2      VAL  72   1.432  -6.157  -8.805
  533   2HG2  VAL  72          2HG2      VAL  72   1.031  -5.774  -7.130
  534   3HG2  VAL  72          3HG2      VAL  72   1.645  -4.513  -8.201
  535    H    ASP  73           H        ASP  73  -3.475  -5.287  -6.809
  536    HA   ASP  73           HA       ASP  73  -5.329  -5.846  -8.987
  537   1HB   ASP  73          2HB       ASP  73  -5.756  -4.557  -6.269
  538   2HB   ASP  73          1HB       ASP  73  -7.038  -4.964  -7.408
  539    H    PHE  74           H        PHE  74  -6.846  -4.047  -9.709
  540    HA   PHE  74           HA       PHE  74  -5.372  -1.879 -10.737
  541   1HB   PHE  74          2HB       PHE  74  -7.588  -2.755 -11.620
  542   2HB   PHE  74          1HB       PHE  74  -8.364  -1.832 -10.333
  543    HD1  PHE  74           HD1      PHE  74  -5.393  -1.096 -12.492
  544    HD2  PHE  74           HD2      PHE  74  -9.355   0.047 -11.303
  545    HE1  PHE  74           HE1      PHE  74  -5.221   0.951 -13.880
  546    HE2  PHE  74           HE2      PHE  74  -9.181   2.097 -12.685
  547    HZ   PHE  74           HZ       PHE  74  -7.116   2.548 -13.976
  548    H    ASP  75           H        ASP  75  -7.255  -2.228  -7.773
  549    HA   ASP  75           HA       ASP  75  -7.267   0.537  -7.049
  550   1HB   ASP  75          2HB       ASP  75  -8.717  -1.338  -6.051
  551   2HB   ASP  75          1HB       ASP  75  -7.302  -1.759  -5.086
  552    H    GLU  76           H        GLU  76  -5.147  -2.217  -6.297
  553    HA   GLU  76           HA       GLU  76  -3.345  -0.752  -4.620
  554   1HB   GLU  76          2HB       GLU  76  -2.838  -3.310  -6.169
  555   2HB   GLU  76          1HB       GLU  76  -1.890  -2.706  -4.811
  556   1HG   GLU  76          2HG       GLU  76  -3.735  -2.999  -3.289
  557   2HG   GLU  76          1HG       GLU  76  -4.850  -3.327  -4.610
  558    H    PHE  77           H        PHE  77  -3.690  -1.240  -8.046
  559    HA   PHE  77           HA       PHE  77  -1.066  -0.528  -8.881
  560   1HB   PHE  77          2HB       PHE  77  -3.230  -1.587 -10.123
  561   2HB   PHE  77          1HB       PHE  77  -3.386   0.085 -10.634
  562    HD1  PHE  77           HD1      PHE  77  -3.058  -0.695 -12.943
  563    HD2  PHE  77           HD2      PHE  77   0.015  -1.157  -9.966
  564    HE1  PHE  77           HE1      PHE  77  -1.385  -1.090 -14.717
  565    HE2  PHE  77           HE2      PHE  77   1.681  -1.544 -11.754
  566    HZ   PHE  77           HZ       PHE  77   0.977  -1.517 -14.131
  567    H    LEU  78           H        LEU  78  -4.136   1.287  -8.822
  568    HA   LEU  78           HA       LEU  78  -2.970   3.782  -9.571
  569   1HB   LEU  78          2HB       LEU  78  -5.619   2.894  -8.535
  570   2HB   LEU  78          1HB       LEU  78  -5.225   4.599  -8.446
  571    HG   LEU  78           HG       LEU  78  -5.142   4.808 -10.806
  572   1HD1  LEU  78          1HD1      LEU  78  -5.303   1.790 -11.027
  573   2HD1  LEU  78          2HD1      LEU  78  -3.803   2.708 -11.163
  574   3HD1  LEU  78          3HD1      LEU  78  -5.089   2.942 -12.345
  575   1HD2  LEU  78          1HD2      LEU  78  -7.333   4.086 -11.486
  576   2HD2  LEU  78          2HD2      LEU  78  -7.425   4.432  -9.760
  577   3HD2  LEU  78          3HD2      LEU  78  -7.323   2.763 -10.318
  578    H    VAL  79           H        VAL  79  -3.554   2.195  -6.487
  579    HA   VAL  79           HA       VAL  79  -3.268   4.439  -4.787
  580    HB   VAL  79           HB       VAL  79  -3.022   1.474  -4.447
  581   1HG1  VAL  79          1HG1      VAL  79  -2.413   1.839  -2.046
  582   2HG1  VAL  79          2HG1      VAL  79  -2.095   3.534  -2.422
  583   3HG1  VAL  79          3HG1      VAL  79  -1.118   2.265  -3.167
  584   1HG2  VAL  79          1HG2      VAL  79  -5.166   2.903  -4.299
  585   2HG2  VAL  79          2HG2      VAL  79  -4.517   3.495  -2.770
  586   3HG2  VAL  79          3HG2      VAL  79  -4.857   1.777  -2.978
  587    H    MET  80           H        MET  80  -0.906   2.012  -5.896
  588    HA   MET  80           HA       MET  80   1.395   2.791  -4.655
  589   1HB   MET  80          2HB       MET  80   0.774   1.189  -6.855
  590   2HB   MET  80          1HB       MET  80   1.929   2.365  -7.480
  591   1HG   MET  80          2HG       MET  80   3.601   1.722  -5.965
  592   2HG   MET  80          1HG       MET  80   2.441   0.998  -4.851
  593   1HE   MET  80          1HE       MET  80   3.892  -0.643  -8.872
  594   2HE   MET  80          2HE       MET  80   4.921   0.289  -7.788
  595   3HE   MET  80          3HE       MET  80   3.477   1.030  -8.474
  596    H    MET  81           H        MET  81  -0.214   4.487  -7.319
  597    HA   MET  81           HA       MET  81   1.926   6.267  -7.933
  598   1HB   MET  81          2HB       MET  81   0.077   5.931  -9.500
  599   2HB   MET  81          1HB       MET  81  -1.058   6.610  -8.336
  600   1HG   MET  81          2HG       MET  81  -0.288   8.231 -10.122
  601   2HG   MET  81          1HG       MET  81  -0.020   8.780  -8.468
  602   1HE   MET  81          1HE       MET  81   3.054   7.200 -11.477
  603   2HE   MET  81          2HE       MET  81   1.304   7.299 -11.646
  604   3HE   MET  81          3HE       MET  81   2.013   6.063 -10.610
  605    H    VAL  82           H        VAL  82  -1.103   6.837  -6.096
  606    HA   VAL  82           HA       VAL  82  -0.356   9.386  -5.121
  607    HB   VAL  82           HB       VAL  82  -2.134   9.059  -3.418
  608   1HG1  VAL  82          1HG1      VAL  82  -2.693   9.832  -5.693
  609   2HG1  VAL  82          2HG1      VAL  82  -3.985   8.831  -5.031
  610   3HG1  VAL  82          3HG1      VAL  82  -2.868   8.157  -6.219
  611   1HG2  VAL  82          1HG2      VAL  82  -1.665   6.576  -3.150
  612   2HG2  VAL  82          2HG2      VAL  82  -2.510   6.330  -4.678
  613   3HG2  VAL  82          3HG2      VAL  82  -3.372   7.001  -3.292
  614    H    ARG  83           H        ARG  83   0.344   6.146  -3.999
  615    HA   ARG  83           HA       ARG  83   1.113   6.626  -1.353
  616   1HB   ARG  83          2HB       ARG  83   2.019   4.624  -3.412
  617   2HB   ARG  83          1HB       ARG  83   2.762   4.677  -1.813
  618   1HG   ARG  83          2HG       ARG  83  -0.131   4.803  -1.602
  619   2HG   ARG  83          1HG       ARG  83   0.367   3.379  -2.515
  620   1HD   ARG  83          2HD       ARG  83   0.282   2.849  -0.127
  621   2HD   ARG  83          1HD       ARG  83   1.943   2.780  -0.703
  622    HE   ARG  83           HE       ARG  83   1.236   5.359   0.391
  623   1HH1  ARG  83          2HH1      ARG  83   2.295   2.118   1.152
  624   2HH1  ARG  83          1HH1      ARG  83   3.080   2.585   2.621
  625   1HH2  ARG  83          1HH2      ARG  83   2.274   5.949   2.316
  626   2HH2  ARG  83          2HH2      ARG  83   3.069   4.750   3.281
  627    H    CYS  84           H        CYS  84   2.881   7.059  -4.384
  628    HA   CYS  84           HA       CYS  84   5.422   7.648  -3.242
  629   1HB   CYS  84          2HB       CYS  84   4.206   8.408  -5.909
  630   2HB   CYS  84          1HB       CYS  84   5.877   8.751  -5.462
  631    HG   CYS  84           HG       CYS  84   4.720   5.860  -5.770
  632    H    MET  85           H        MET  85   2.680   9.670  -4.246
  633    HA   MET  85           HA       MET  85   3.886  12.182  -3.689
  634   1HB   MET  85          2HB       MET  85   1.777  11.753  -5.063
  635   2HB   MET  85          1HB       MET  85   0.927  11.593  -3.527
  636   1HG   MET  85          2HG       MET  85   2.047  13.889  -2.957
  637   2HG   MET  85          1HG       MET  85   2.261  14.022  -4.702
  638   1HE   MET  85          1HE       MET  85   0.885  13.916  -6.292
  639   2HE   MET  85          2HE       MET  85  -0.356  15.163  -6.205
  640   3HE   MET  85          3HE       MET  85  -0.826  13.467  -6.281
  641    H    LYS  86           H        LYS  86   1.741  10.065  -1.778
  642    HA   LYS  86           HA       LYS  86   1.454   9.848   0.494
  643   1HB   LYS  86          2HB       LYS  86   4.070  10.469   0.355
  644   2HB   LYS  86          1HB       LYS  86   3.487  11.906   1.194
  645   1HG   LYS  86          2HG       LYS  86   3.747  10.600   3.050
  646   2HG   LYS  86          1HG       LYS  86   2.166   9.978   2.579
  647   1HD   LYS  86          2HD       LYS  86   3.141   8.091   1.465
  648   2HD   LYS  86          1HD       LYS  86   4.760   8.778   1.585
  649   1HE   LYS  86          2HE       LYS  86   4.061   8.759   4.208
  650   2HE   LYS  86          1HE       LYS  86   3.151   7.361   3.636
  651   1HZ   LYS  86          1HZ       LYS  86   5.220   6.530   2.626
  652   2HZ   LYS  86          2HZ       LYS  86   5.328   6.673   4.316
  653   3HZ   LYS  86          3HZ       LYS  86   6.066   7.830   3.313
  654    H    ASP  87           H        ASP  87   0.547  11.018   2.327
  655    HA   ASP  87           HA       ASP  87  -1.254  13.049   1.563
  656   1HB   ASP  87          2HB       ASP  87  -1.663  11.561   3.486
  657   2HB   ASP  87          1HB       ASP  87  -0.326  12.316   4.353
  658    H    ASP  88           H        ASP  88   1.877  13.182   3.228
  659    HA   ASP  88           HA       ASP  88   3.376  14.889   3.530
  660   1HB   ASP  88          2HB       ASP  88   2.680  15.395   1.097
  661   2HB   ASP  88          1HB       ASP  88   1.680  16.672   1.790
  662    H    SER  89           HN       SER  89   3.215  15.438   5.613
  663    HA   SER  89           HA       SER  89   2.704  16.652   7.488
  664   1HB   SER  89          2HB       SER  89   2.802  18.510   5.576
  665   2HB   SER  89          1HB       SER  89   1.089  18.639   5.960
  666    HG   SER  89           HG       SER  89   2.393  20.003   7.270
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -7.400   0.266   8.857
    2   2H    MET   1          2H        MET   1  -6.214   0.377   7.646
    3   3H    MET   1          3H        MET   1  -7.804   0.889   7.332
    4    HA   MET   1           HA       MET   1  -7.586   2.673   8.943
    5   1HB   MET   1          2HB       MET   1  -4.996   1.253   9.411
    6   2HB   MET   1          1HB       MET   1  -5.005   3.011   9.561
    7   1HG   MET   1          2HG       MET   1  -7.130   1.363  10.916
    8   2HG   MET   1          1HG       MET   1  -5.551   1.576  11.672
    9   1HE   MET   1          1HE       MET   1  -7.979   2.044  12.862
   10   2HE   MET   1          2HE       MET   1  -8.692   3.651  12.975
   11   3HE   MET   1          3HE       MET   1  -7.227   3.280  13.879
   12    H    ASN   2           H        ASN   2  -6.340   4.710   8.459
   13    HA   ASN   2           HA       ASN   2  -5.590   6.282   6.973
   14   1HB   ASN   2          2HB       ASN   2  -4.062   3.863   6.199
   15   2HB   ASN   2          1HB       ASN   2  -4.143   5.152   4.999
   16   1HD2  ASN   2          1HD2      ASN   2  -3.863   5.126   8.606
   17   2HD2  ASN   2          2HD2      ASN   2  -2.533   6.178   8.647
   18    H    ASP   3           H        ASP   3  -7.613   6.814   6.252
   19    HA   ASP   3           HA       ASP   3  -8.586   5.497   3.796
   20   1HB   ASP   3          2HB       ASP   3  -9.899   7.147   5.931
   21   2HB   ASP   3          1HB       ASP   3 -10.634   7.037   4.331
   22    H    ILE   4           H        ILE   4  -6.383   7.672   4.168
   23    HA   ILE   4           HA       ILE   4  -7.464   9.931   2.707
   24    HB   ILE   4           HB       ILE   4  -5.167  10.814   2.771
   25   1HG1  ILE   4          2HG1      ILE   4  -3.685   9.227   4.407
   26   2HG1  ILE   4          1HG1      ILE   4  -4.581   7.994   3.522
   27   1HG2  ILE   4          1HG2      ILE   4  -6.120   9.630   5.397
   28   2HG2  ILE   4          2HG2      ILE   4  -6.627  11.172   4.709
   29   3HG2  ILE   4          3HG2      ILE   4  -4.960  10.950   5.241
   30   1HD1  ILE   4          1HD1      ILE   4  -3.727   8.700   1.435
   31   2HD1  ILE   4          2HD1      ILE   4  -2.336   8.797   2.515
   32   3HD1  ILE   4          3HD1      ILE   4  -3.215  10.261   2.076
   33    H    TYR   5           H        TYR   5  -5.714   6.994   2.005
   34    HA   TYR   5           HA       TYR   5  -4.759   7.694  -0.587
   35   1HB   TYR   5          2HB       TYR   5  -5.424   4.949   0.514
   36   2HB   TYR   5          1HB       TYR   5  -4.454   5.282  -0.920
   37    HD1  TYR   5           HD1      TYR   5  -4.513   5.192   2.731
   38    HD2  TYR   5           HD2      TYR   5  -2.245   6.442  -0.703
   39    HE1  TYR   5           HE1      TYR   5  -2.497   5.442   4.145
   40    HE2  TYR   5           HE2      TYR   5  -0.235   6.693   0.720
   41    HH   TYR   5           HH       TYR   5  -0.114   7.116   3.669
   42    H    LYS   6           H        LYS   6  -7.776   6.361   0.650
   43    HA   LYS   6           HA       LYS   6  -8.900   5.678  -1.897
   44   1HB   LYS   6          2HB       LYS   6  -9.594   5.111   0.680
   45   2HB   LYS   6          1HB       LYS   6 -10.769   6.365   0.285
   46   1HG   LYS   6          2HG       LYS   6 -11.807   4.337  -0.384
   47   2HG   LYS   6          1HG       LYS   6 -11.200   5.044  -1.881
   48   1HD   LYS   6          2HD       LYS   6 -10.511   2.784  -2.001
   49   2HD   LYS   6          1HD       LYS   6  -9.070   3.638  -1.453
   50   1HE   LYS   6          2HE       LYS   6 -10.156   3.116   0.945
   51   2HE   LYS   6          1HE       LYS   6 -10.851   1.770   0.042
   52   1HZ   LYS   6          1HZ       LYS   6  -8.694   1.231   1.045
   53   2HZ   LYS   6          2HZ       LYS   6  -7.960   2.448   0.115
   54   3HZ   LYS   6          3HZ       LYS   6  -8.662   1.101  -0.647
   55    H    ALA   7           H        ALA   7  -8.863   8.563   0.123
   56    HA   ALA   7           HA       ALA   7 -10.875   9.980  -1.354
   57   1HB   ALA   7          1HB       ALA   7 -10.498  10.706   0.887
   58   2HB   ALA   7          2HB       ALA   7  -9.884  11.992  -0.152
   59   3HB   ALA   7          3HB       ALA   7  -8.763  10.868   0.616
   60    H    ALA   8           H        ALA   8  -7.458   9.435  -1.748
   61    HA   ALA   8           HA       ALA   8  -7.083  11.660  -3.586
   62   1HB   ALA   8          1HB       ALA   8  -5.265  10.852  -2.057
   63   2HB   ALA   8          2HB       ALA   8  -4.800  10.894  -3.758
   64   3HB   ALA   8          3HB       ALA   8  -5.212   9.358  -2.993
   65    H    VAL   9           H        VAL   9  -7.295   8.115  -3.750
   66    HA   VAL   9           HA       VAL   9  -6.789   7.867  -6.516
   67    HB   VAL   9           HB       VAL   9  -6.749   5.966  -4.898
   68   1HG1  VAL   9          1HG1      VAL   9  -9.765   6.219  -5.098
   69   2HG1  VAL   9          2HG1      VAL   9  -8.790   6.468  -3.650
   70   3HG1  VAL   9          3HG1      VAL   9  -8.908   4.862  -4.366
   71   1HG2  VAL   9          1HG2      VAL   9  -7.266   4.408  -6.538
   72   2HG2  VAL   9          2HG2      VAL   9  -7.166   5.873  -7.514
   73   3HG2  VAL   9          3HG2      VAL   9  -8.739   5.249  -7.022
   74    H    GLU  10           H        GLU  10  -9.693   8.779  -4.764
   75    HA   GLU  10           HA       GLU  10 -11.485   8.335  -6.969
   76   1HB   GLU  10          2HB       GLU  10 -13.139   9.508  -5.613
   77   2HB   GLU  10          1HB       GLU  10 -12.269   8.331  -4.630
   78   1HG   GLU  10          2HG       GLU  10 -11.155   9.949  -3.422
   79   2HG   GLU  10          1HG       GLU  10 -11.196  11.119  -4.739
   80    H    GLN  11           H        GLN  11  -9.232  10.830  -6.160
   81    HA   GLN  11           HA       GLN  11 -10.617  12.899  -7.684
   82   1HB   GLN  11          2HB       GLN  11  -7.747  13.142  -6.855
   83   2HB   GLN  11          1HB       GLN  11  -8.987  14.389  -6.965
   84   1HG   GLN  11          2HG       GLN  11 -10.166  13.204  -5.042
   85   2HG   GLN  11          1HG       GLN  11  -8.696  12.248  -4.857
   86   1HE2  GLN  11          1HE2      GLN  11  -8.121  13.198  -2.786
   87   2HE2  GLN  11          2HE2      GLN  11  -7.619  14.814  -2.653
   88    H    LEU  12           H        LEU  12  -8.371  10.380  -8.253
   89    HA   LEU  12           HA       LEU  12  -6.708  11.196 -10.256
   90   1HB   LEU  12          2HB       LEU  12  -8.267   8.621 -10.159
   91   2HB   LEU  12          1HB       LEU  12  -6.907   8.918 -11.214
   92    HG   LEU  12           HG       LEU  12  -6.944   8.502  -8.245
   93   1HD1  LEU  12          1HD1      LEU  12  -4.723   7.325  -9.459
   94   2HD1  LEU  12          2HD1      LEU  12  -6.015   7.145 -10.649
   95   3HD1  LEU  12          3HD1      LEU  12  -6.224   6.511  -9.016
   96   1HD2  LEU  12          1HD2      LEU  12  -4.923  10.042  -9.877
   97   2HD2  LEU  12          2HD2      LEU  12  -4.444   9.175  -8.418
   98   3HD2  LEU  12          3HD2      LEU  12  -5.636  10.472  -8.320
   99    H    THR  13           H        THR  13  -6.765  11.572 -12.404
  100    HA   THR  13           HA       THR  13  -9.341  12.240 -13.585
  101    HB   THR  13           HB       THR  13  -7.513  12.567 -15.602
  102    HG1  THR  13           HG1      THR  13  -5.597  12.870 -14.817
  103   1HG2  THR  13          1HG2      THR  13  -7.337  14.962 -14.335
  104   2HG2  THR  13          2HG2      THR  13  -8.743  14.269 -13.527
  105   3HG2  THR  13          3HG2      THR  13  -8.734  14.448 -15.282
  106    H    ASP  14           H        ASP  14  -9.541  11.629 -16.011
  107    HA   ASP  14           HA       ASP  14  -9.765   8.767 -16.147
  108   1HB   ASP  14          2HB       ASP  14 -10.144  10.901 -18.266
  109   2HB   ASP  14          1HB       ASP  14 -10.509   9.189 -18.497
  110    H    GLU  15           H        GLU  15  -7.497  11.188 -17.270
  111    HA   GLU  15           HA       GLU  15  -6.091   9.519 -19.117
  112   1HB   GLU  15          2HB       GLU  15  -4.470  11.270 -19.224
  113   2HB   GLU  15          1HB       GLU  15  -6.042  12.050 -19.054
  114   1HG   GLU  15          2HG       GLU  15  -5.444  11.865 -16.460
  115   2HG   GLU  15          1HG       GLU  15  -3.797  11.860 -17.091
  116    H    GLN  16           H        GLN  16  -5.801  10.148 -15.656
  117    HA   GLN  16           HA       GLN  16  -3.287   8.776 -15.364
  118   1HB   GLN  16          2HB       GLN  16  -4.513  10.541 -13.777
  119   2HB   GLN  16          1HB       GLN  16  -5.151   9.068 -13.049
  120   1HG   GLN  16          2HG       GLN  16  -2.211   9.690 -13.491
  121   2HG   GLN  16          1HG       GLN  16  -3.052   9.744 -11.943
  122   1HE2  GLN  16          1HE2      GLN  16  -4.477   7.468 -11.764
  123   2HE2  GLN  16          2HE2      GLN  16  -3.511   6.091 -11.974
  124    H    LYS  17           H        LYS  17  -6.680   8.000 -14.542
  125    HA   LYS  17           HA       LYS  17  -6.305   5.388 -13.625
  126   1HB   LYS  17          2HB       LYS  17  -8.619   6.701 -15.053
  127   2HB   LYS  17          1HB       LYS  17  -8.686   5.020 -14.523
  128   1HG   LYS  17          2HG       LYS  17  -8.754   5.578 -12.296
  129   2HG   LYS  17          1HG       LYS  17  -7.754   7.013 -12.517
  130   1HD   LYS  17          2HD       LYS  17  -9.801   8.019 -12.125
  131   2HD   LYS  17          1HD       LYS  17  -9.873   7.862 -13.880
  132   1HE   LYS  17          2HE       LYS  17 -11.386   6.105 -13.801
  133   2HE   LYS  17          1HE       LYS  17 -10.856   5.583 -12.202
  134   1HZ   LYS  17          1HZ       LYS  17 -11.931   7.467 -11.219
  135   2HZ   LYS  17          2HZ       LYS  17 -13.057   6.658 -12.200
  136   3HZ   LYS  17          3HZ       LYS  17 -12.338   8.100 -12.739
  137    H    ASN  18           H        ASN  18  -6.689   6.619 -16.935
  138    HA   ASN  18           HA       ASN  18  -6.750   4.073 -18.225
  139   1HB   ASN  18          2HB       ASN  18  -6.263   6.891 -19.135
  140   2HB   ASN  18          1HB       ASN  18  -5.926   5.550 -20.228
  141   1HD2  ASN  18          1HD2      ASN  18  -7.757   6.231 -21.608
  142   2HD2  ASN  18          2HD2      ASN  18  -9.355   5.919 -21.128
  143    H    GLU  19           H        GLU  19  -4.167   6.247 -17.214
  144    HA   GLU  19           HA       GLU  19  -2.000   5.261 -18.660
  145   1HB   GLU  19          2HB       GLU  19  -1.945   7.236 -17.116
  146   2HB   GLU  19          1HB       GLU  19  -1.937   6.117 -15.753
  147   1HG   GLU  19          2HG       GLU  19   0.153   5.117 -16.551
  148   2HG   GLU  19          1HG       GLU  19   0.141   6.175 -17.963
  149    H    PHE  20           H        PHE  20  -3.218   4.162 -15.482
  150    HA   PHE  20           HA       PHE  20  -1.389   1.933 -15.380
  151   1HB   PHE  20          2HB       PHE  20  -3.699   2.850 -13.692
  152   2HB   PHE  20          1HB       PHE  20  -3.004   1.244 -13.461
  153    HD1  PHE  20           HD1      PHE  20  -2.388   4.875 -13.224
  154    HD2  PHE  20           HD2      PHE  20  -0.728   0.964 -12.631
  155    HE1  PHE  20           HE1      PHE  20  -0.553   5.862 -11.891
  156    HE2  PHE  20           HE2      PHE  20   1.108   1.940 -11.291
  157    HZ   PHE  20           HZ       PHE  20   1.203   4.394 -10.921
  158    H    LYS  21           H        LYS  21  -4.879   2.343 -15.980
  159    HA   LYS  21           HA       LYS  21  -5.654  -0.310 -16.206
  160   1HB   LYS  21          2HB       LYS  21  -7.214   1.607 -16.275
  161   2HB   LYS  21          1HB       LYS  21  -6.655   1.988 -17.902
  162   1HG   LYS  21          2HG       LYS  21  -7.483  -0.824 -17.505
  163   2HG   LYS  21          1HG       LYS  21  -8.783   0.357 -17.351
  164   1HD   LYS  21          2HD       LYS  21  -6.914   0.684 -19.654
  165   2HD   LYS  21          1HD       LYS  21  -8.063  -0.651 -19.730
  166   1HE   LYS  21          2HE       LYS  21  -9.086   2.036 -18.904
  167   2HE   LYS  21          1HE       LYS  21  -8.720   1.776 -20.608
  168   1HZ   LYS  21          1HZ       LYS  21 -10.132  -0.221 -20.526
  169   2HZ   LYS  21          2HZ       LYS  21 -10.994   1.202 -20.184
  170   3HZ   LYS  21          3HZ       LYS  21 -10.549   0.151 -18.925
  171    H    ALA  22           H        ALA  22  -3.988   1.702 -18.601
  172    HA   ALA  22           HA       ALA  22  -4.275   0.003 -20.840
  173   1HB   ALA  22          1HB       ALA  22  -2.295   1.152 -21.741
  174   2HB   ALA  22          2HB       ALA  22  -1.964   1.835 -20.150
  175   3HB   ALA  22          3HB       ALA  22  -3.420   2.306 -21.026
  176    H    ALA  23           H        ALA  23  -1.586   0.296 -18.514
  177    HA   ALA  23           HA       ALA  23  -0.135  -1.960 -19.474
  178   1HB   ALA  23          1HB       ALA  23   1.304  -1.635 -17.635
  179   2HB   ALA  23          2HB       ALA  23   0.028  -0.920 -16.648
  180   3HB   ALA  23          3HB       ALA  23   0.713  -0.014 -17.997
  181    H    PHE  24           H        PHE  24  -2.637  -1.481 -17.058
  182    HA   PHE  24           HA       PHE  24  -2.471  -3.970 -15.733
  183   1HB   PHE  24          2HB       PHE  24  -3.827  -1.865 -15.091
  184   2HB   PHE  24          1HB       PHE  24  -5.055  -2.482 -16.195
  185    HD1  PHE  24           HD1      PHE  24  -6.019  -4.793 -15.803
  186    HD2  PHE  24           HD2      PHE  24  -3.525  -2.807 -12.932
  187    HE1  PHE  24           HE1      PHE  24  -6.818  -6.338 -14.040
  188    HE2  PHE  24           HE2      PHE  24  -4.321  -4.347 -11.170
  189    HZ   PHE  24           HZ       PHE  24  -5.974  -6.109 -11.719
  190    H    ASP  25           H        ASP  25  -4.390  -2.892 -18.529
  191    HA   ASP  25           HA       ASP  25  -5.848  -5.265 -18.936
  192   1HB   ASP  25          2HB       ASP  25  -5.606  -2.770 -20.227
  193   2HB   ASP  25          1HB       ASP  25  -5.261  -3.992 -21.451
  194    H    ILE  26           H        ILE  26  -2.690  -4.256 -20.237
  195    HA   ILE  26           HA       ILE  26  -2.429  -6.563 -21.927
  196    HB   ILE  26           HB       ILE  26  -0.070  -5.830 -22.216
  197   1HG1  ILE  26          2HG1      ILE  26  -0.869  -3.614 -20.297
  198   2HG1  ILE  26          1HG1      ILE  26   0.253  -4.919 -19.919
  199   1HG2  ILE  26          1HG2      ILE  26  -0.628  -3.936 -23.516
  200   2HG2  ILE  26          2HG2      ILE  26  -1.905  -3.441 -22.406
  201   3HG2  ILE  26          3HG2      ILE  26  -2.131  -4.856 -23.435
  202   1HD1  ILE  26          1HD1      ILE  26   1.298  -3.949 -22.268
  203   2HD1  ILE  26          2HD1      ILE  26   1.848  -3.484 -20.657
  204   3HD1  ILE  26          3HD1      ILE  26   0.677  -2.480 -21.513
  205    H    PHE  27           H        PHE  27  -1.214  -5.728 -18.684
  206    HA   PHE  27           HA       PHE  27   0.416  -8.065 -18.441
  207   1HB   PHE  27          2HB       PHE  27  -0.672  -6.146 -16.374
  208   2HB   PHE  27          1HB       PHE  27   0.379  -7.504 -15.972
  209    HD1  PHE  27           HD1      PHE  27   2.226  -7.550 -18.302
  210    HD2  PHE  27           HD2      PHE  27   0.679  -4.231 -16.053
  211    HE1  PHE  27           HE1      PHE  27   4.189  -6.192 -18.954
  212    HE2  PHE  27           HE2      PHE  27   2.646  -2.875 -16.715
  213    HZ   PHE  27           HZ       PHE  27   4.401  -3.855 -18.161
  214    H    ILE  28           H        ILE  28  -2.969  -7.358 -17.658
  215    HA   ILE  28           HA       ILE  28  -3.256 -10.031 -16.457
  216    HB   ILE  28           HB       ILE  28  -5.427  -9.367 -15.700
  217   1HG1  ILE  28          2HG1      ILE  28  -5.963  -6.789 -16.345
  218   2HG1  ILE  28          1HG1      ILE  28  -5.133  -7.296 -17.817
  219   1HG2  ILE  28          1HG2      ILE  28  -3.800  -6.856 -15.362
  220   2HG2  ILE  28          2HG2      ILE  28  -3.282  -8.375 -14.634
  221   3HG2  ILE  28          3HG2      ILE  28  -4.837  -7.669 -14.190
  222   1HD1  ILE  28          1HD1      ILE  28  -7.218  -9.116 -16.682
  223   2HD1  ILE  28          2HD1      ILE  28  -6.754  -8.852 -18.364
  224   3HD1  ILE  28          3HD1      ILE  28  -7.753  -7.662 -17.526
  225    H    GLN  29           H        GLN  29  -3.224  -8.898 -19.520
  226    HA   GLN  29           HA       GLN  29  -5.540  -9.673 -20.810
  227   1HB   GLN  29          2HB       GLN  29  -3.685  -8.597 -21.982
  228   2HB   GLN  29          1HB       GLN  29  -2.687 -10.033 -21.761
  229   1HG   GLN  29          2HG       GLN  29  -3.958 -11.308 -23.261
  230   2HG   GLN  29          1HG       GLN  29  -5.363 -10.251 -23.121
  231   1HE2  GLN  29          1HE2      GLN  29  -5.088  -7.993 -24.089
  232   2HE2  GLN  29          2HE2      GLN  29  -4.069  -7.823 -25.435
  233    H    ASP  30           H        ASP  30  -2.819 -11.719 -19.804
  234    HA   ASP  30           HA       ASP  30  -4.294 -14.117 -20.677
  235   1HB   ASP  30          2HB       ASP  30  -1.690 -13.512 -21.066
  236   2HB   ASP  30          1HB       ASP  30  -1.569 -14.388 -19.540
  237    H    ALA  31           H        ALA  31  -4.667 -12.393 -18.103
  238    HA   ALA  31           HA       ALA  31  -4.216 -14.478 -16.080
  239   1HB   ALA  31          1HB       ALA  31  -4.961 -12.640 -14.490
  240   2HB   ALA  31          2HB       ALA  31  -4.909 -11.545 -15.871
  241   3HB   ALA  31          3HB       ALA  31  -3.438 -12.353 -15.331
  242    H    GLU  32           H        GLU  32  -5.892 -15.197 -14.739
  243    HA   GLU  32           HA       GLU  32  -8.565 -15.048 -15.981
  244   1HB   GLU  32          2HB       GLU  32  -7.207 -17.093 -14.246
  245   2HB   GLU  32          1HB       GLU  32  -8.965 -17.054 -14.383
  246   1HG   GLU  32          2HG       GLU  32  -7.211 -17.046 -16.839
  247   2HG   GLU  32          1HG       GLU  32  -7.665 -18.556 -16.046
  248    H    ASP  33           H        ASP  33  -6.809 -14.276 -13.061
  249    HA   ASP  33           HA       ASP  33  -9.170 -13.946 -11.420
  250   1HB   ASP  33          2HB       ASP  33  -6.253 -13.289 -11.012
  251   2HB   ASP  33          1HB       ASP  33  -7.493 -12.866  -9.831
  252    H    GLY  34           H        GLY  34  -7.059 -11.865 -13.340
  253   1HA   GLY  34          2HA       GLY  34  -7.782  -9.808 -14.296
  254   2HA   GLY  34          1HA       GLY  34  -9.001  -9.674 -13.031
  255    H    CYS  35           H        CYS  35  -5.518 -10.321 -12.814
  256    HA   CYS  35           HA       CYS  35  -4.975  -7.702 -11.660
  257   1HB   CYS  35          2HB       CYS  35  -3.854  -8.822  -9.653
  258   2HB   CYS  35          1HB       CYS  35  -5.615  -8.768  -9.632
  259    HG   CYS  35           HG       CYS  35  -4.258 -11.353 -10.715
  260    H    ILE  36           H        ILE  36  -2.720  -7.237 -11.542
  261    HA   ILE  36           HA       ILE  36  -1.166  -8.789 -13.470
  262    HB   ILE  36           HB       ILE  36   0.368  -6.973 -13.542
  263   1HG1  ILE  36          2HG1      ILE  36  -0.375  -5.030 -11.740
  264   2HG1  ILE  36          1HG1      ILE  36  -0.616  -6.504 -10.802
  265   1HG2  ILE  36          1HG2      ILE  36  -1.056  -5.061 -14.034
  266   2HG2  ILE  36          2HG2      ILE  36  -2.363  -5.744 -13.069
  267   3HG2  ILE  36          3HG2      ILE  36  -1.867  -6.533 -14.566
  268   1HD1  ILE  36          1HD1      ILE  36   1.717  -5.534 -10.648
  269   2HD1  ILE  36          2HD1      ILE  36   1.916  -5.919 -12.358
  270   3HD1  ILE  36          3HD1      ILE  36   1.655  -7.213 -11.187
  271    H    SER  37           H        SER  37   1.216  -9.142 -12.924
  272    HA   SER  37           HA       SER  37   1.315 -10.532 -10.348
  273   1HB   SER  37          2HB       SER  37   2.196 -11.286 -12.814
  274   2HB   SER  37          1HB       SER  37   3.677 -10.648 -12.110
  275    HG   SER  37           HG       SER  37   2.136 -12.844 -11.385
  276    H    THR  38           H        THR  38   2.091  -9.521  -8.636
  277    HA   THR  38           HA       THR  38   3.410  -7.048  -8.582
  278    HB   THR  38           HB       THR  38   4.035  -7.614  -6.257
  279    HG1  THR  38           HG1      THR  38   4.267  -9.621  -5.750
  280   1HG2  THR  38          1HG2      THR  38   1.827  -6.811  -6.435
  281   2HG2  THR  38          2HG2      THR  38   1.650  -8.310  -5.526
  282   3HG2  THR  38          3HG2      THR  38   1.268  -8.271  -7.247
  283    H    LYS  39           H        LYS  39   4.704 -10.350  -8.639
  284    HA   LYS  39           HA       LYS  39   7.439  -9.661  -8.305
  285   1HB   LYS  39          2HB       LYS  39   7.926 -11.900  -9.219
  286   2HB   LYS  39          1HB       LYS  39   6.660 -11.965  -7.995
  287   1HG   LYS  39          2HG       LYS  39   5.278 -11.528 -10.389
  288   2HG   LYS  39          1HG       LYS  39   6.533 -12.690 -10.815
  289   1HD   LYS  39          2HD       LYS  39   4.788 -13.033  -8.370
  290   2HD   LYS  39          1HD       LYS  39   4.328 -13.667  -9.948
  291   1HE   LYS  39          2HE       LYS  39   5.981 -15.271  -9.946
  292   2HE   LYS  39          1HE       LYS  39   7.083 -14.285  -8.985
  293   1HZ   LYS  39          1HZ       LYS  39   6.268 -16.124  -7.685
  294   2HZ   LYS  39          2HZ       LYS  39   4.656 -15.683  -7.993
  295   3HZ   LYS  39          3HZ       LYS  39   5.652 -14.675  -7.054
  296    H    GLU  40           H        GLU  40   5.279  -9.545 -11.039
  297    HA   GLU  40           HA       GLU  40   7.511  -9.067 -12.899
  298   1HB   GLU  40          2HB       GLU  40   4.561  -9.544 -13.391
  299   2HB   GLU  40          1HB       GLU  40   5.732  -9.181 -14.657
  300   1HG   GLU  40          2HG       GLU  40   6.344 -11.418 -12.761
  301   2HG   GLU  40          1HG       GLU  40   5.145 -11.697 -14.024
  302    H    LEU  41           H        LEU  41   6.188  -7.185 -10.756
  303    HA   LEU  41           HA       LEU  41   4.916  -5.060 -12.101
  304   1HB   LEU  41          2HB       LEU  41   5.251  -5.552  -9.546
  305   2HB   LEU  41          1HB       LEU  41   6.691  -4.581  -9.738
  306    HG   LEU  41           HG       LEU  41   4.602  -3.406  -8.867
  307   1HD1  LEU  41          1HD1      LEU  41   6.705  -2.467 -10.276
  308   2HD1  LEU  41          2HD1      LEU  41   5.406  -1.431  -9.687
  309   3HD1  LEU  41          3HD1      LEU  41   5.394  -1.994 -11.357
  310   1HD2  LEU  41          1HD2      LEU  41   3.718  -3.129 -11.707
  311   2HD2  LEU  41          2HD2      LEU  41   2.769  -3.042 -10.223
  312   3HD2  LEU  41          3HD2      LEU  41   3.274  -4.608 -10.858
  313    H    GLY  42           H        GLY  42   8.257  -6.026 -11.999
  314   1HA   GLY  42          2HA       GLY  42   9.622  -3.640 -12.431
  315   2HA   GLY  42          1HA       GLY  42  10.117  -5.201 -13.075
  316    H    LYS  43           H        LYS  43   7.721  -5.592 -14.685
  317    HA   LYS  43           HA       LYS  43   8.523  -4.297 -17.093
  318   1HB   LYS  43          2HB       LYS  43   5.927  -5.727 -16.453
  319   2HB   LYS  43          1HB       LYS  43   6.485  -5.290 -18.068
  320   1HG   LYS  43          2HG       LYS  43   8.360  -6.774 -17.921
  321   2HG   LYS  43          1HG       LYS  43   8.103  -7.032 -16.195
  322   1HD   LYS  43          2HD       LYS  43   7.002  -8.904 -16.895
  323   2HD   LYS  43          1HD       LYS  43   5.674  -7.779 -17.174
  324   1HE   LYS  43          2HE       LYS  43   6.503  -7.454 -19.514
  325   2HE   LYS  43          1HE       LYS  43   7.721  -8.695 -19.215
  326   1HZ   LYS  43          1HZ       LYS  43   5.894 -10.235 -18.667
  327   2HZ   LYS  43          2HZ       LYS  43   5.832  -9.683 -20.272
  328   3HZ   LYS  43          3HZ       LYS  43   4.774  -9.039 -19.110
  329    H    VAL  44           H        VAL  44   6.234  -3.517 -14.588
  330    HA   VAL  44           HA       VAL  44   4.976  -1.386 -16.152
  331    HB   VAL  44           HB       VAL  44   4.353  -1.641 -13.265
  332   1HG1  VAL  44          1HG1      VAL  44   2.222  -1.838 -15.268
  333   2HG1  VAL  44          2HG1      VAL  44   3.255  -0.427 -15.495
  334   3HG1  VAL  44          3HG1      VAL  44   2.430  -0.678 -13.956
  335   1HG2  VAL  44          1HG2      VAL  44   2.701  -3.586 -14.303
  336   2HG2  VAL  44          2HG2      VAL  44   4.146  -3.907 -13.345
  337   3HG2  VAL  44          3HG2      VAL  44   4.231  -3.948 -15.104
  338    H    MET  45           H        MET  45   7.137  -1.892 -13.418
  339    HA   MET  45           HA       MET  45   7.320   0.701 -12.408
  340   1HB   MET  45          2HB       MET  45   8.423  -0.856 -11.090
  341   2HB   MET  45          1HB       MET  45   9.132  -1.682 -12.474
  342   1HG   MET  45          2HG       MET  45  10.021   1.117 -12.091
  343   2HG   MET  45          1HG       MET  45  10.517  -0.011 -10.831
  344   1HE   MET  45          1HE       MET  45  12.899  -2.103 -11.763
  345   2HE   MET  45          2HE       MET  45  11.600  -2.954 -12.595
  346   3HE   MET  45          3HE       MET  45  11.260  -2.090 -11.098
  347    H    ARG  46           H        ARG  46   9.042  -0.846 -15.103
  348    HA   ARG  46           HA       ARG  46  10.653   1.461 -15.703
  349   1HB   ARG  46          2HB       ARG  46  11.208   0.254 -17.788
  350   2HB   ARG  46          1HB       ARG  46  11.407  -0.759 -16.360
  351   1HG   ARG  46          2HG       ARG  46   9.837  -2.220 -17.058
  352   2HG   ARG  46          1HG       ARG  46   8.703  -0.930 -17.448
  353   1HD   ARG  46          2HD       ARG  46   9.766  -0.559 -19.591
  354   2HD   ARG  46          1HD       ARG  46  11.053  -1.694 -19.197
  355    HE   ARG  46           HE       ARG  46   8.395  -2.350 -20.129
  356   1HH1  ARG  46          2HH1      ARG  46  11.176  -3.472 -18.332
  357   2HH1  ARG  46          1HH1      ARG  46  10.816  -5.146 -18.581
  358   1HH2  ARG  46          1HH2      ARG  46   7.948  -4.551 -20.441
  359   2HH2  ARG  46          2HH2      ARG  46   8.996  -5.756 -19.772
  360    H    MET  47           H        MET  47   7.472   0.348 -16.616
  361    HA   MET  47           HA       MET  47   7.180   2.114 -18.882
  362   1HB   MET  47          2HB       MET  47   5.301   0.335 -17.341
  363   2HB   MET  47          1HB       MET  47   4.694   1.468 -18.548
  364   1HG   MET  47          2HG       MET  47   6.928  -0.471 -19.168
  365   2HG   MET  47          1HG       MET  47   5.232  -0.912 -19.365
  366   1HE   MET  47          1HE       MET  47   8.041  -0.258 -21.270
  367   2HE   MET  47          2HE       MET  47   8.182   1.303 -20.465
  368   3HE   MET  47          3HE       MET  47   7.883   1.239 -22.200
  369    H    LEU  48           H        LEU  48   6.487   2.245 -15.439
  370    HA   LEU  48           HA       LEU  48   4.783   4.557 -15.541
  371   1HB   LEU  48          2HB       LEU  48   6.098   2.938 -13.435
  372   2HB   LEU  48          1HB       LEU  48   5.727   4.596 -13.021
  373    HG   LEU  48           HG       LEU  48   3.387   4.236 -13.281
  374   1HD1  LEU  48          1HD1      LEU  48   4.296   2.020 -14.991
  375   2HD1  LEU  48          2HD1      LEU  48   2.809   2.961 -15.070
  376   3HD1  LEU  48          3HD1      LEU  48   2.932   1.601 -13.954
  377   1HD2  LEU  48          1HD2      LEU  48   2.996   2.265 -11.785
  378   2HD2  LEU  48          2HD2      LEU  48   4.282   3.324 -11.203
  379   3HD2  LEU  48          3HD2      LEU  48   4.685   1.807 -12.007
  380    H    GLY  49           H        GLY  49   8.220   3.972 -15.334
  381   1HA   GLY  49          2HA       GLY  49   9.663   5.772 -16.220
  382   2HA   GLY  49          1HA       GLY  49   8.701   6.898 -15.270
  383    H    GLN  50           H        GLN  50   9.672   3.752 -14.023
  384    HA   GLN  50           HA       GLN  50  11.650   5.082 -12.263
  385   1HB   GLN  50          2HB       GLN  50   9.819   2.822 -11.422
  386   2HB   GLN  50          1HB       GLN  50  10.935   3.723 -10.401
  387   1HG   GLN  50          2HG       GLN  50   8.559   4.944 -11.842
  388   2HG   GLN  50          1HG       GLN  50   8.563   4.471 -10.144
  389   1HE2  GLN  50          1HE2      GLN  50   8.640   7.208 -11.814
  390   2HE2  GLN  50          2HE2      GLN  50   9.761   8.119 -10.923
  391    H    ASN  51           H        ASN  51  13.234   3.556 -11.313
  392    HA   ASN  51           HA       ASN  51  13.595   0.994 -12.636
  393   1HB   ASN  51          2HB       ASN  51  14.568   2.867 -14.153
  394   2HB   ASN  51          1HB       ASN  51  15.848   2.969 -12.944
  395   1HD2  ASN  51          1HD2      ASN  51  17.581   1.580 -13.320
  396   2HD2  ASN  51          2HD2      ASN  51  17.498   0.144 -14.221
  397    HA   PRO  52           HA       PRO  52  15.482   1.427  -8.388
  398   1HB   PRO  52          2HB       PRO  52  13.596   0.027  -6.985
  399   2HB   PRO  52          1HB       PRO  52  13.505   1.768  -7.284
  400   1HG   PRO  52          2HG       PRO  52  11.926  -0.421  -8.466
  401   2HG   PRO  52          1HG       PRO  52  11.532   1.297  -8.311
  402   1HD   PRO  52          2HD       PRO  52  12.474  -0.059 -10.651
  403   2HD   PRO  52          1HD       PRO  52  12.187   1.685 -10.456
  404    H    THR  53           H        THR  53  15.227  -0.775  -6.665
  405    HA   THR  53           HA       THR  53  16.630  -2.875  -8.182
  406    HB   THR  53           HB       THR  53  17.698  -3.462  -6.183
  407    HG1  THR  53           HG1      THR  53  16.702  -3.487  -4.324
  408   1HG2  THR  53          1HG2      THR  53  18.589  -1.480  -5.274
  409   2HG2  THR  53          2HG2      THR  53  17.083  -0.594  -5.508
  410   3HG2  THR  53          3HG2      THR  53  18.081  -1.018  -6.899
  411    HA   PRO  54           HA       PRO  54  13.395  -5.839  -7.594
  412   1HB   PRO  54          2HB       PRO  54  14.595  -8.059  -6.528
  413   2HB   PRO  54          1HB       PRO  54  14.775  -7.548  -8.214
  414   1HG   PRO  54          2HG       PRO  54  16.691  -7.310  -5.957
  415   2HG   PRO  54          1HG       PRO  54  17.004  -7.500  -7.688
  416   1HD   PRO  54          2HD       PRO  54  17.191  -5.102  -6.260
  417   2HD   PRO  54          1HD       PRO  54  17.073  -5.233  -8.030
  418    H    GLU  55           H        GLU  55  15.304  -5.209  -4.722
  419    HA   GLU  55           HA       GLU  55  13.349  -6.304  -2.879
  420   1HB   GLU  55          2HB       GLU  55  15.878  -4.689  -2.519
  421   2HB   GLU  55          1HB       GLU  55  14.813  -5.086  -1.170
  422   1HG   GLU  55          2HG       GLU  55  15.335  -7.327  -1.231
  423   2HG   GLU  55          1HG       GLU  55  15.603  -7.325  -2.974
  424    H    GLU  56           H        GLU  56  14.245  -3.173  -4.242
  425    HA   GLU  56           HA       GLU  56  12.581  -1.601  -2.515
  426   1HB   GLU  56          2HB       GLU  56  14.593  -0.799  -3.895
  427   2HB   GLU  56          1HB       GLU  56  13.492  -0.787  -5.272
  428   1HG   GLU  56          2HG       GLU  56  12.171   0.917  -4.375
  429   2HG   GLU  56          1HG       GLU  56  12.679   0.576  -2.721
  430    H    LEU  57           H        LEU  57  12.203  -2.933  -5.809
  431    HA   LEU  57           HA       LEU  57   9.701  -1.738  -6.353
  432   1HB   LEU  57          2HB       LEU  57   9.557  -3.120  -8.212
  433   2HB   LEU  57          1HB       LEU  57  11.275  -2.910  -7.985
  434    HG   LEU  57           HG       LEU  57  11.060  -5.202  -6.678
  435   1HD1  LEU  57          1HD1      LEU  57   8.492  -4.918  -8.169
  436   2HD1  LEU  57          2HD1      LEU  57   8.835  -5.813  -6.688
  437   3HD1  LEU  57          3HD1      LEU  57   9.289  -6.490  -8.252
  438   1HD2  LEU  57          1HD2      LEU  57  10.838  -5.139  -9.699
  439   2HD2  LEU  57          2HD2      LEU  57  11.699  -6.321  -8.712
  440   3HD2  LEU  57          3HD2      LEU  57  12.298  -4.666  -8.830
  441    H    GLN  58           H        GLN  58  10.568  -4.797  -4.769
  442    HA   GLN  58           HA       GLN  58   7.861  -5.722  -4.546
  443   1HB   GLN  58          2HB       GLN  58  10.491  -6.677  -3.764
  444   2HB   GLN  58          1HB       GLN  58   9.306  -6.932  -2.483
  445   1HG   GLN  58          2HG       GLN  58   8.909  -7.742  -5.381
  446   2HG   GLN  58          1HG       GLN  58   9.405  -8.840  -4.093
  447   1HE2  GLN  58          1HE2      GLN  58   6.673  -7.635  -5.714
  448   2HE2  GLN  58          2HE2      GLN  58   5.498  -8.058  -4.563
  449    H    GLU  59           H        GLU  59   9.889  -3.583  -2.671
  450    HA   GLU  59           HA       GLU  59   8.424  -3.703  -0.226
  451   1HB   GLU  59          2HB       GLU  59  10.536  -1.973  -1.379
  452   2HB   GLU  59          1HB       GLU  59   9.515  -1.226  -0.150
  453   1HG   GLU  59          2HG       GLU  59   9.942  -3.298   1.277
  454   2HG   GLU  59          1HG       GLU  59  11.188  -3.733   0.108
  455    H    MET  60           H        MET  60   8.304  -1.503  -3.038
  456    HA   MET  60           HA       MET  60   6.236   0.144  -1.962
  457   1HB   MET  60          2HB       MET  60   6.011   1.049  -4.243
  458   2HB   MET  60          1HB       MET  60   7.698   0.987  -3.737
  459   1HG   MET  60          2HG       MET  60   8.156  -0.891  -5.106
  460   2HG   MET  60          1HG       MET  60   6.447  -1.263  -5.315
  461   1HE   MET  60          1HE       MET  60   9.370   0.866  -5.924
  462   2HE   MET  60          2HE       MET  60   9.116   1.659  -7.476
  463   3HE   MET  60          3HE       MET  60   9.327  -0.088  -7.413
  464    H    ILE  61           H        ILE  61   6.253  -2.834  -3.804
  465    HA   ILE  61           HA       ILE  61   3.461  -2.754  -4.513
  466    HB   ILE  61           HB       ILE  61   5.434  -5.054  -4.454
  467   1HG1  ILE  61          2HG1      ILE  61   4.261  -3.776  -6.910
  468   2HG1  ILE  61          1HG1      ILE  61   5.628  -3.006  -6.100
  469   1HG2  ILE  61          1HG2      ILE  61   3.436  -5.745  -6.201
  470   2HG2  ILE  61          2HG2      ILE  61   2.524  -4.919  -4.937
  471   3HG2  ILE  61          3HG2      ILE  61   3.535  -6.307  -4.532
  472   1HD1  ILE  61          1HD1      ILE  61   6.701  -4.421  -7.621
  473   2HD1  ILE  61          2HD1      ILE  61   5.491  -5.690  -7.440
  474   3HD1  ILE  61          3HD1      ILE  61   6.671  -5.409  -6.162
  475    H    ASP  62           H        ASP  62   5.401  -4.458  -2.057
  476    HA   ASP  62           HA       ASP  62   3.291  -5.853  -0.817
  477   1HB   ASP  62          2HB       ASP  62   5.795  -6.175  -0.443
  478   2HB   ASP  62          1HB       ASP  62   5.713  -4.783   0.638
  479    H    GLU  63           H        GLU  63   4.478  -2.556  -0.425
  480    HA   GLU  63           HA       GLU  63   3.023  -1.929   1.945
  481   1HB   GLU  63          2HB       GLU  63   4.543  -0.412  -0.106
  482   2HB   GLU  63          1HB       GLU  63   3.330   0.493   0.799
  483   1HG   GLU  63          2HG       GLU  63   5.266  -1.301   2.249
  484   2HG   GLU  63          1HG       GLU  63   5.754   0.323   1.764
  485    H    VAL  64           H        VAL  64   2.372  -1.323  -1.518
  486    HA   VAL  64           HA       VAL  64  -0.168  -0.091  -1.034
  487    HB   VAL  64           HB       VAL  64   1.117   0.392  -3.074
  488   1HG1  VAL  64          1HG1      VAL  64   0.448  -2.463  -3.851
  489   2HG1  VAL  64          2HG1      VAL  64   2.054  -1.867  -3.434
  490   3HG1  VAL  64          3HG1      VAL  64   1.241  -1.272  -4.880
  491   1HG2  VAL  64          1HG2      VAL  64  -1.536   0.270  -2.862
  492   2HG2  VAL  64          2HG2      VAL  64  -1.337  -0.989  -4.081
  493   3HG2  VAL  64          3HG2      VAL  64  -0.759   0.648  -4.399
  494    H    ASP  65           H        ASP  65   0.876  -3.405  -1.673
  495    HA   ASP  65           HA       ASP  65  -1.810  -4.393  -2.083
  496   1HB   ASP  65          2HB       ASP  65   0.747  -5.390  -2.599
  497   2HB   ASP  65          1HB       ASP  65   0.136  -6.416  -1.304
  498    H    GLU  66           H        GLU  66  -3.079  -3.999  -0.353
  499    HA   GLU  66           HA       GLU  66  -2.336  -4.138   2.360
  500   1HB   GLU  66          2HB       GLU  66  -5.111  -4.687   1.292
  501   2HB   GLU  66          1HB       GLU  66  -4.675  -4.062   2.881
  502   1HG   GLU  66          2HG       GLU  66  -3.570  -2.109   1.590
  503   2HG   GLU  66          1HG       GLU  66  -4.511  -2.672   0.210
  504    H    ASP  67           H        ASP  67  -3.773  -6.570   0.214
  505    HA   ASP  67           HA       ASP  67  -3.861  -8.569   2.313
  506   1HB   ASP  67          2HB       ASP  67  -4.599 -10.099   0.466
  507   2HB   ASP  67          1HB       ASP  67  -5.619  -8.679   0.682
  508    H    GLY  68           H        GLY  68  -1.847  -7.869  -0.519
  509   1HA   GLY  68          2HA       GLY  68   0.329  -8.514  -0.981
  510   2HA   GLY  68          1HA       GLY  68   0.388  -9.286   0.601
  511    H    SER  69           H        SER  69  -1.731  -9.801  -2.210
  512    HA   SER  69           HA       SER  69  -1.441 -12.682  -1.972
  513   1HB   SER  69          2HB       SER  69  -3.046 -12.728  -3.883
  514   2HB   SER  69          1HB       SER  69  -3.635 -11.814  -2.500
  515    HG   SER  69           HG       SER  69  -3.734 -10.146  -3.766
  516    H    GLY  70           H        GLY  70   0.533 -10.421  -3.390
  517   1HA   GLY  70          2HA       GLY  70   2.343 -10.741  -4.805
  518   2HA   GLY  70          1HA       GLY  70   1.777 -12.382  -5.114
  519    H    THR  71           H        THR  71  -0.602  -9.925  -5.433
  520    HA   THR  71           HA       THR  71  -0.173  -9.582  -8.310
  521    HB   THR  71           HB       THR  71  -2.394 -10.295  -8.910
  522    HG1  THR  71           HG1      THR  71  -3.913 -10.448  -7.471
  523   1HG2  THR  71          1HG2      THR  71  -0.725 -12.092  -8.752
  524   2HG2  THR  71          2HG2      THR  71  -2.319 -12.691  -8.288
  525   3HG2  THR  71          3HG2      THR  71  -1.119 -12.322  -7.046
  526    H    VAL  72           H        VAL  72  -0.872  -7.628  -9.048
  527    HA   VAL  72           HA       VAL  72  -2.001  -5.805  -7.029
  528    HB   VAL  72           HB       VAL  72  -0.910  -5.006  -9.724
  529   1HG1  VAL  72          1HG1      VAL  72  -0.624  -2.845  -8.625
  530   2HG1  VAL  72          2HG1      VAL  72  -1.154  -3.528  -7.088
  531   3HG1  VAL  72          3HG1      VAL  72  -2.292  -3.385  -8.428
  532   1HG2  VAL  72          1HG2      VAL  72   0.572  -5.362  -7.100
  533   2HG2  VAL  72          2HG2      VAL  72   1.222  -4.512  -8.503
  534   3HG2  VAL  72          3HG2      VAL  72   0.871  -6.239  -8.602
  535    H    ASP  73           H        ASP  73  -4.041  -5.193  -7.123
  536    HA   ASP  73           HA       ASP  73  -5.661  -5.857  -9.478
  537   1HB   ASP  73          2HB       ASP  73  -6.356  -4.874  -6.698
  538   2HB   ASP  73          1HB       ASP  73  -7.551  -5.028  -7.988
  539    H    PHE  74           H        PHE  74  -7.266  -4.102 -10.193
  540    HA   PHE  74           HA       PHE  74  -5.821  -1.859 -11.069
  541   1HB   PHE  74          2HB       PHE  74  -7.974  -2.794 -12.074
  542   2HB   PHE  74          1HB       PHE  74  -8.827  -1.869 -10.837
  543    HD1  PHE  74           HD1      PHE  74  -5.734  -1.127 -12.809
  544    HD2  PHE  74           HD2      PHE  74  -9.771   0.006 -11.887
  545    HE1  PHE  74           HE1      PHE  74  -5.476   0.918 -14.181
  546    HE2  PHE  74           HE2      PHE  74  -9.509   2.054 -13.257
  547    HZ   PHE  74           HZ       PHE  74  -7.364   2.509 -14.406
  548    H    ASP  75           H        ASP  75  -7.767  -2.341  -8.179
  549    HA   ASP  75           HA       ASP  75  -7.948   0.412  -7.427
  550   1HB   ASP  75          2HB       ASP  75  -8.356  -2.205  -6.024
  551   2HB   ASP  75          1HB       ASP  75  -8.199  -0.737  -5.059
  552    H    GLU  76           H        GLU  76  -5.712  -2.234  -6.633
  553    HA   GLU  76           HA       GLU  76  -4.056  -0.657  -4.891
  554   1HB   GLU  76          2HB       GLU  76  -3.352  -3.228  -6.334
  555   2HB   GLU  76          1HB       GLU  76  -2.532  -2.551  -4.927
  556   1HG   GLU  76          2HG       GLU  76  -4.536  -2.845  -3.564
  557   2HG   GLU  76          1HG       GLU  76  -5.446  -3.400  -4.967
  558    H    PHE  77           H        PHE  77  -4.180  -1.319  -8.320
  559    HA   PHE  77           HA       PHE  77  -1.564  -0.552  -9.062
  560   1HB   PHE  77          2HB       PHE  77  -3.635  -1.653 -10.387
  561   2HB   PHE  77          1HB       PHE  77  -3.825   0.011 -10.911
  562    HD1  PHE  77           HD1      PHE  77  -3.382  -0.793 -13.198
  563    HD2  PHE  77           HD2      PHE  77  -0.401  -1.087 -10.107
  564    HE1  PHE  77           HE1      PHE  77  -1.630  -1.142 -14.904
  565    HE2  PHE  77           HE2      PHE  77   1.341  -1.427 -11.828
  566    HZ   PHE  77           HZ       PHE  77   0.724  -1.460 -14.228
  567    H    LEU  78           H        LEU  78  -4.634   1.277  -9.180
  568    HA   LEU  78           HA       LEU  78  -3.420   3.746  -9.926
  569   1HB   LEU  78          2HB       LEU  78  -6.114   2.892  -9.000
  570   2HB   LEU  78          1HB       LEU  78  -5.713   4.595  -8.872
  571    HG   LEU  78           HG       LEU  78  -5.536   4.838 -11.216
  572   1HD1  LEU  78          1HD1      LEU  78  -5.419   2.980 -12.783
  573   2HD1  LEU  78          2HD1      LEU  78  -5.614   1.820 -11.468
  574   3HD1  LEU  78          3HD1      LEU  78  -4.148   2.793 -11.575
  575   1HD2  LEU  78          1HD2      LEU  78  -7.656   3.804 -12.075
  576   2HD2  LEU  78          2HD2      LEU  78  -7.852   4.618 -10.523
  577   3HD2  LEU  78          3HD2      LEU  78  -7.743   2.858 -10.589
  578    H    VAL  79           H        VAL  79  -4.141   2.234  -6.838
  579    HA   VAL  79           HA       VAL  79  -3.893   4.496  -5.161
  580    HB   VAL  79           HB       VAL  79  -3.774   1.542  -4.813
  581   1HG1  VAL  79          1HG1      VAL  79  -3.022   1.754  -2.466
  582   2HG1  VAL  79          2HG1      VAL  79  -2.681   3.463  -2.735
  583   3HG1  VAL  79          3HG1      VAL  79  -1.755   2.232  -3.598
  584   1HG2  VAL  79          1HG2      VAL  79  -5.050   3.637  -3.052
  585   2HG2  VAL  79          2HG2      VAL  79  -5.535   1.956  -3.285
  586   3HG2  VAL  79          3HG2      VAL  79  -5.791   3.136  -4.572
  587    H    MET  80           H        MET  80  -1.518   2.130  -6.321
  588    HA   MET  80           HA       MET  80   0.766   2.871  -4.987
  589   1HB   MET  80          2HB       MET  80   0.192   1.255  -7.171
  590   2HB   MET  80          1HB       MET  80   1.316   2.450  -7.819
  591   1HG   MET  80          2HG       MET  80   2.594   1.934  -5.528
  592   2HG   MET  80          1HG       MET  80   1.746   0.397  -5.694
  593   1HE   MET  80          1HE       MET  80   1.496  -0.132  -8.749
  594   2HE   MET  80          2HE       MET  80   1.953  -1.238  -7.456
  595   3HE   MET  80          3HE       MET  80   2.938  -1.144  -8.914
  596    H    MET  81           H        MET  81  -0.895   4.702  -7.490
  597    HA   MET  81           HA       MET  81   1.247   6.380  -8.288
  598   1HB   MET  81          2HB       MET  81  -0.851   6.301  -9.558
  599   2HB   MET  81          1HB       MET  81  -1.722   6.993  -8.190
  600   1HG   MET  81          2HG       MET  81  -1.213   9.051  -8.947
  601   2HG   MET  81          1HG       MET  81   0.493   8.699  -8.686
  602   1HE   MET  81          1HE       MET  81   2.124   7.731 -10.487
  603   2HE   MET  81          2HE       MET  81   1.577   7.059 -12.022
  604   3HE   MET  81          3HE       MET  81   1.041   6.332 -10.510
  605    H    VAL  82           H        VAL  82  -1.371   6.951  -5.919
  606    HA   VAL  82           HA       VAL  82  -0.226   9.367  -4.911
  607    HB   VAL  82           HB       VAL  82  -1.839   9.074  -3.019
  608   1HG1  VAL  82          1HG1      VAL  82  -2.692   8.901  -5.900
  609   2HG1  VAL  82          2HG1      VAL  82  -2.700  10.300  -4.828
  610   3HG1  VAL  82          3HG1      VAL  82  -3.896   9.022  -4.617
  611   1HG2  VAL  82          1HG2      VAL  82  -1.757   6.543  -3.082
  612   2HG2  VAL  82          2HG2      VAL  82  -2.740   6.616  -4.546
  613   3HG2  VAL  82          3HG2      VAL  82  -3.383   7.221  -3.019
  614    H    ARG  83           H        ARG  83   0.190   5.978  -4.152
  615    HA   ARG  83           HA       ARG  83   1.408   6.282  -1.592
  616   1HB   ARG  83          2HB       ARG  83   1.706   4.070  -3.643
  617   2HB   ARG  83          1HB       ARG  83   2.287   3.992  -1.980
  618   1HG   ARG  83          2HG       ARG  83  -0.292   4.742  -1.553
  619   2HG   ARG  83          1HG       ARG  83  -0.479   3.791  -3.025
  620   1HD   ARG  83          2HD       ARG  83  -0.487   1.979  -1.687
  621   2HD   ARG  83          1HD       ARG  83   1.241   2.242  -1.506
  622    HE   ARG  83           HE       ARG  83  -0.851   3.057   0.412
  623   1HH1  ARG  83          2HH1      ARG  83   2.536   2.722  -0.421
  624   2HH1  ARG  83          1HH1      ARG  83   3.078   2.959   1.203
  625   1HH2  ARG  83          1HH2      ARG  83  -0.101   3.370   2.523
  626   2HH2  ARG  83          2HH2      ARG  83   1.597   3.326   2.861
  627    H    CYS  84           H        CYS  84   2.583   6.480  -4.898
  628    HA   CYS  84           HA       CYS  84   5.381   6.399  -4.214
  629   1HB   CYS  84          2HB       CYS  84   3.831   7.022  -6.712
  630   2HB   CYS  84          1HB       CYS  84   5.553   7.393  -6.620
  631    HG   CYS  84           HG       CYS  84   4.411   4.640  -7.016
  632    H    MET  85           H        MET  85   2.971   8.936  -4.826
  633    HA   MET  85           HA       MET  85   4.915  11.079  -4.657
  634   1HB   MET  85          2HB       MET  85   2.611  11.061  -5.906
  635   2HB   MET  85          1HB       MET  85   1.960  11.502  -4.328
  636   1HG   MET  85          2HG       MET  85   3.550  13.409  -4.225
  637   2HG   MET  85          1HG       MET  85   4.135  12.986  -5.835
  638   1HE   MET  85          1HE       MET  85  -0.064  14.021  -4.575
  639   2HE   MET  85          2HE       MET  85   1.127  15.219  -4.073
  640   3HE   MET  85          3HE       MET  85   1.340  13.530  -3.618
  641    H    LYS  86           H        LYS  86   2.101  10.153  -2.652
  642    HA   LYS  86           HA       LYS  86   3.357  11.490  -0.341
  643   1HB   LYS  86          2HB       LYS  86   0.835  11.791  -1.198
  644   2HB   LYS  86          1HB       LYS  86   0.598  10.373  -0.175
  645   1HG   LYS  86          2HG       LYS  86   2.215  12.013   1.380
  646   2HG   LYS  86          1HG       LYS  86   1.124  13.151   0.591
  647   1HD   LYS  86          2HD       LYS  86  -0.771  12.233   1.569
  648   2HD   LYS  86          1HD       LYS  86  -0.026  10.646   1.768
  649   1HE   LYS  86          2HE       LYS  86   1.564  11.827   3.439
  650   2HE   LYS  86          1HE       LYS  86   0.375  13.128   3.434
  651   1HZ   LYS  86          1HZ       LYS  86  -1.323  11.536   4.076
  652   2HZ   LYS  86          2HZ       LYS  86  -0.053  11.542   5.205
  653   3HZ   LYS  86          3HZ       LYS  86  -0.182  10.281   4.074
  654    H    ASP  87           H        ASP  87   3.691  10.396   1.593
  655    HA   ASP  87           HA       ASP  87   4.136   8.627   2.988
  656   1HB   ASP  87          2HB       ASP  87   1.678   8.059   2.336
  657   2HB   ASP  87          1HB       ASP  87   2.403   6.828   1.305
  658    H    ASP  88           H        ASP  88   5.978   9.188   1.075
  659    HA   ASP  88           HA       ASP  88   6.850   6.555   0.039
  660   1HB   ASP  88          2HB       ASP  88   6.532   8.688  -1.483
  661   2HB   ASP  88          1HB       ASP  88   8.108   9.132  -0.829
  662    H    SER  89           HN       SER  89   7.992   9.518   1.653
  663    HA   SER  89           HA       SER  89  10.608   8.517   2.222
  664   1HB   SER  89          2HB       SER  89   9.810  10.977   2.193
  665   2HB   SER  89          1HB       SER  89   9.229  10.665   3.827
  666    HG   SER  89           HG       SER  89  11.215  10.756   4.492
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  -3.380   2.837   3.763
    2   2H    MET   1          2H        MET   1  -4.807   2.059   4.259
    3   3H    MET   1          3H        MET   1  -3.356   1.184   4.144
    4    HA   MET   1           HA       MET   1  -3.752   1.604   6.438
    5   1HB   MET   1          2HB       MET   1  -1.426   2.182   5.162
    6   2HB   MET   1          1HB       MET   1  -1.760   3.742   5.913
    7   1HG   MET   1          2HG       MET   1  -0.537   2.604   7.570
    8   2HG   MET   1          1HG       MET   1  -2.212   2.361   8.069
    9   1HE   MET   1          1HE       MET   1   0.421   1.001   8.781
   10   2HE   MET   1          2HE       MET   1   1.142   0.470   7.264
   11   3HE   MET   1          3HE       MET   1   0.521  -0.724   8.401
   12    H    ASN   2           H        ASN   2  -3.368   4.754   4.773
   13    HA   ASN   2           HA       ASN   2  -5.034   6.019   6.843
   14   1HB   ASN   2          2HB       ASN   2  -2.691   6.867   5.772
   15   2HB   ASN   2          1HB       ASN   2  -3.837   7.681   4.707
   16   1HD2  ASN   2          1HD2      ASN   2  -2.992   7.268   8.170
   17   2HD2  ASN   2          2HD2      ASN   2  -3.690   8.733   8.671
   18    H    ASP   3           H        ASP   3  -6.648   7.605   6.169
   19    HA   ASP   3           HA       ASP   3  -8.375   6.539   4.120
   20   1HB   ASP   3          2HB       ASP   3  -8.610   8.986   5.884
   21   2HB   ASP   3          1HB       ASP   3  -9.862   8.453   4.763
   22    H    ILE   4           H        ILE   4  -5.936   8.989   4.242
   23    HA   ILE   4           HA       ILE   4  -6.849  10.747   2.240
   24    HB   ILE   4           HB       ILE   4  -4.465  11.391   1.967
   25   1HG1  ILE   4          2HG1      ILE   4  -3.089  10.111   3.950
   26   2HG1  ILE   4          1HG1      ILE   4  -4.109   8.799   3.363
   27   1HG2  ILE   4          1HG2      ILE   4  -5.397  11.009   4.828
   28   2HG2  ILE   4          2HG2      ILE   4  -5.810  12.363   3.776
   29   3HG2  ILE   4          3HG2      ILE   4  -4.144  12.136   4.307
   30   1HD1  ILE   4          1HD1      ILE   4  -3.235   8.939   1.172
   31   2HD1  ILE   4          2HD1      ILE   4  -1.822   9.134   2.207
   32   3HD1  ILE   4          3HD1      ILE   4  -2.561  10.545   1.452
   33    H    TYR   5           H        TYR   5  -5.164   7.659   2.018
   34    HA   TYR   5           HA       TYR   5  -4.461   7.810  -0.734
   35   1HB   TYR   5          2HB       TYR   5  -5.067   5.340   0.920
   36   2HB   TYR   5          1HB       TYR   5  -4.247   5.360  -0.639
   37    HD1  TYR   5           HD1      TYR   5  -2.071   6.793  -0.816
   38    HD2  TYR   5           HD2      TYR   5  -3.843   5.571   2.902
   39    HE1  TYR   5           HE1      TYR   5   0.091   7.165   0.338
   40    HE2  TYR   5           HE2      TYR   5  -1.683   5.945   4.055
   41    HH   TYR   5           HH       TYR   5   1.008   5.941   2.955
   42    H    LYS   6           H        LYS   6  -7.319   6.616   0.980
   43    HA   LYS   6           HA       LYS   6  -8.654   5.670  -1.387
   44   1HB   LYS   6          2HB       LYS   6  -9.012   5.210   1.276
   45   2HB   LYS   6          1HB       LYS   6 -10.321   6.346   0.952
   46   1HG   LYS   6          2HG       LYS   6 -11.318   4.287   0.446
   47   2HG   LYS   6          1HG       LYS   6 -10.775   4.839  -1.137
   48   1HD   LYS   6          2HD       LYS   6  -9.958   2.654  -1.112
   49   2HD   LYS   6          1HD       LYS   6  -8.564   3.551  -0.509
   50   1HE   LYS   6          2HE       LYS   6  -8.956   2.904   1.721
   51   2HE   LYS   6          1HE       LYS   6 -10.631   2.464   1.396
   52   1HZ   LYS   6          1HZ       LYS   6  -8.289   1.047   0.248
   53   2HZ   LYS   6          2HZ       LYS   6  -9.920   0.582   0.143
   54   3HZ   LYS   6          3HZ       LYS   6  -9.116   0.541   1.639
   55    H    ALA   7           H        ALA   7  -8.519   8.712   0.358
   56    HA   ALA   7           HA       ALA   7 -10.863   9.888  -0.760
   57   1HB   ALA   7          1HB       ALA   7  -8.375  11.143   0.418
   58   2HB   ALA   7          2HB       ALA   7  -9.896  10.826   1.252
   59   3HB   ALA   7          3HB       ALA   7  -9.827  12.041  -0.026
   60    H    ALA   8           H        ALA   8  -7.600   9.449  -1.925
   61    HA   ALA   8           HA       ALA   8  -7.859  11.433  -4.037
   62   1HB   ALA   8          1HB       ALA   8  -5.666  10.939  -2.942
   63   2HB   ALA   8          2HB       ALA   8  -5.632  10.754  -4.695
   64   3HB   ALA   8          3HB       ALA   8  -5.720   9.328  -3.660
   65    H    VAL   9           H        VAL   9  -7.795   7.883  -3.761
   66    HA   VAL   9           HA       VAL   9  -8.001   7.360  -6.538
   67    HB   VAL   9           HB       VAL   9  -7.319   5.687  -4.782
   68   1HG1  VAL   9          1HG1      VAL   9 -10.313   5.559  -4.308
   69   2HG1  VAL   9          2HG1      VAL   9  -9.116   6.159  -3.163
   70   3HG1  VAL   9          3HG1      VAL   9  -9.116   4.458  -3.624
   71   1HG2  VAL   9          1HG2      VAL   9  -8.241   3.812  -5.979
   72   2HG2  VAL   9          2HG2      VAL   9  -8.033   5.117  -7.147
   73   3HG2  VAL   9          3HG2      VAL   9  -9.635   4.757  -6.501
   74    H    GLU  10           H        GLU  10 -10.366   8.311  -4.163
   75    HA   GLU  10           HA       GLU  10 -12.641   7.465  -5.739
   76   1HB   GLU  10          2HB       GLU  10 -13.992   8.443  -4.013
   77   2HB   GLU  10          1HB       GLU  10 -12.671   7.573  -3.239
   78   1HG   GLU  10          2HG       GLU  10 -11.547   9.540  -2.643
   79   2HG   GLU  10          1HG       GLU  10 -12.389  10.507  -3.851
   80    H    GLN  11           H        GLN  11 -10.509  10.132  -5.835
   81    HA   GLN  11           HA       GLN  11 -12.508  11.656  -7.404
   82   1HB   GLN  11          2HB       GLN  11 -11.570  13.745  -6.593
   83   2HB   GLN  11          1HB       GLN  11 -12.083  12.754  -5.227
   84   1HG   GLN  11          2HG       GLN  11  -9.768  12.001  -4.881
   85   2HG   GLN  11          1HG       GLN  11  -9.240  12.948  -6.271
   86   1HE2  GLN  11          1HE2      GLN  11 -10.832  13.334  -3.064
   87   2HE2  GLN  11          2HE2      GLN  11 -10.256  14.910  -2.807
   88    H    LEU  12           H        LEU  12 -10.227   9.742  -8.128
   89    HA   LEU  12           HA       LEU  12  -8.206  11.317  -9.408
   90   1HB   LEU  12          2HB       LEU  12  -7.662   9.210 -10.597
   91   2HB   LEU  12          1HB       LEU  12  -7.704   9.048  -8.856
   92    HG   LEU  12           HG       LEU  12 -10.239   8.304  -9.450
   93   1HD1  LEU  12          1HD1      LEU  12 -10.100   8.438 -11.816
   94   2HD1  LEU  12          2HD1      LEU  12  -9.932   6.724 -11.444
   95   3HD1  LEU  12          3HD1      LEU  12  -8.507   7.684 -11.843
   96   1HD2  LEU  12          1HD2      LEU  12  -8.582   7.071  -8.102
   97   2HD2  LEU  12          2HD2      LEU  12  -7.776   6.541  -9.577
   98   3HD2  LEU  12          3HD2      LEU  12  -9.414   5.997  -9.223
   99    H    THR  13           H        THR  13  -7.847  10.906 -11.885
  100    HA   THR  13           HA       THR  13 -10.327  11.747 -13.253
  101    HB   THR  13           HB       THR  13  -8.322  12.217 -15.055
  102    HG1  THR  13           HG1      THR  13  -6.585  11.964 -13.869
  103   1HG2  THR  13          1HG2      THR  13  -8.425  14.600 -13.838
  104   2HG2  THR  13          2HG2      THR  13  -9.791  13.828 -13.033
  105   3HG2  THR  13          3HG2      THR  13  -9.767  13.967 -14.791
  106    H    ASP  14           H        ASP  14 -10.435  11.137 -15.592
  107    HA   ASP  14           HA       ASP  14 -10.378   8.292 -15.858
  108   1HB   ASP  14          2HB       ASP  14 -11.069  10.579 -17.669
  109   2HB   ASP  14          1HB       ASP  14 -10.829   8.974 -18.363
  110    H    GLU  15           H        GLU  15  -8.289  10.934 -16.898
  111    HA   GLU  15           HA       GLU  15  -6.661   9.414 -18.687
  112   1HB   GLU  15          2HB       GLU  15  -6.433  12.062 -17.328
  113   2HB   GLU  15          1HB       GLU  15  -4.953  11.331 -17.952
  114   1HG   GLU  15          2HG       GLU  15  -7.412  11.443 -19.683
  115   2HG   GLU  15          1HG       GLU  15  -6.379  12.865 -19.530
  116    H    GLN  16           H        GLN  16  -6.704   9.883 -15.224
  117    HA   GLN  16           HA       GLN  16  -4.095   8.840 -14.669
  118   1HB   GLN  16          2HB       GLN  16  -5.686  10.253 -13.139
  119   2HB   GLN  16          1HB       GLN  16  -6.383   8.689 -12.722
  120   1HG   GLN  16          2HG       GLN  16  -3.645   8.231 -12.567
  121   2HG   GLN  16          1HG       GLN  16  -3.825   9.859 -11.914
  122   1HE2  GLN  16          1HE2      GLN  16  -5.748   6.797 -11.685
  123   2HE2  GLN  16          2HE2      GLN  16  -5.912   6.868  -9.998
  124    H    LYS  17           H        LYS  17  -7.362   7.516 -14.895
  125    HA   LYS  17           HA       LYS  17  -6.770   4.884 -13.986
  126   1HB   LYS  17          2HB       LYS  17  -8.957   5.891 -15.828
  127   2HB   LYS  17          1HB       LYS  17  -8.883   4.259 -15.166
  128   1HG   LYS  17          2HG       LYS  17  -9.360   4.960 -13.011
  129   2HG   LYS  17          1HG       LYS  17  -8.702   6.573 -13.281
  130   1HD   LYS  17          2HD       LYS  17 -10.890   7.187 -13.447
  131   2HD   LYS  17          1HD       LYS  17 -10.753   6.549 -15.085
  132   1HE   LYS  17          2HE       LYS  17 -12.590   5.347 -14.354
  133   2HE   LYS  17          1HE       LYS  17 -11.302   4.249 -13.860
  134   1HZ   LYS  17          1HZ       LYS  17 -12.522   6.324 -12.118
  135   2HZ   LYS  17          2HZ       LYS  17 -11.355   5.178 -11.658
  136   3HZ   LYS  17          3HZ       LYS  17 -12.920   4.676 -12.085
  137    H    ASN  18           H        ASN  18  -6.973   6.363 -17.217
  138    HA   ASN  18           HA       ASN  18  -6.420   4.002 -18.687
  139   1HB   ASN  18          2HB       ASN  18  -6.233   6.935 -19.321
  140   2HB   ASN  18          1HB       ASN  18  -5.650   5.731 -20.471
  141   1HD2  ASN  18          1HD2      ASN  18  -8.447   7.387 -19.432
  142   2HD2  ASN  18          2HD2      ASN  18  -9.600   6.389 -20.178
  143    H    GLU  19           H        GLU  19  -4.307   6.408 -17.211
  144    HA   GLU  19           HA       GLU  19  -1.892   5.827 -18.477
  145   1HB   GLU  19          2HB       GLU  19  -2.297   7.664 -16.789
  146   2HB   GLU  19          1HB       GLU  19  -2.171   6.437 -15.527
  147   1HG   GLU  19          2HG       GLU  19   0.083   5.812 -16.494
  148   2HG   GLU  19          1HG       GLU  19  -0.041   7.238 -17.525
  149    H    PHE  20           H        PHE  20  -3.238   4.359 -15.512
  150    HA   PHE  20           HA       PHE  20  -1.155   2.330 -15.467
  151   1HB   PHE  20          2HB       PHE  20  -3.440   3.072 -13.679
  152   2HB   PHE  20          1HB       PHE  20  -2.711   1.474 -13.534
  153    HD1  PHE  20           HD1      PHE  20  -2.154   5.100 -13.172
  154    HD2  PHE  20           HD2      PHE  20  -0.396   1.201 -12.792
  155    HE1  PHE  20           HE1      PHE  20  -0.284   6.066 -11.872
  156    HE2  PHE  20           HE2      PHE  20   1.467   2.161 -11.481
  157    HZ   PHE  20           HZ       PHE  20   1.530   4.601 -11.023
  158    H    LYS  21           H        LYS  21  -4.665   2.482 -16.092
  159    HA   LYS  21           HA       LYS  21  -5.228  -0.236 -16.282
  160   1HB   LYS  21          2HB       LYS  21  -6.936   1.557 -16.367
  161   2HB   LYS  21          1HB       LYS  21  -6.416   1.947 -18.005
  162   1HG   LYS  21          2HG       LYS  21  -6.999  -0.914 -17.562
  163   2HG   LYS  21          1HG       LYS  21  -8.396   0.147 -17.392
  164   1HD   LYS  21          2HD       LYS  21  -6.558   0.492 -19.746
  165   2HD   LYS  21          1HD       LYS  21  -7.765  -0.794 -19.765
  166   1HE   LYS  21          2HE       LYS  21  -9.467   1.018 -19.106
  167   2HE   LYS  21          1HE       LYS  21  -8.220   2.185 -19.543
  168   1HZ   LYS  21          1HZ       LYS  21  -9.692   1.720 -21.401
  169   2HZ   LYS  21          2HZ       LYS  21  -9.307   0.067 -21.322
  170   3HZ   LYS  21          3HZ       LYS  21  -8.114   1.202 -21.744
  171    H    ALA  22           H        ALA  22  -3.641   1.860 -18.638
  172    HA   ALA  22           HA       ALA  22  -3.840   0.221 -20.915
  173   1HB   ALA  22          1HB       ALA  22  -1.596   1.338 -21.533
  174   2HB   ALA  22          2HB       ALA  22  -1.775   2.228 -20.020
  175   3HB   ALA  22          3HB       ALA  22  -2.989   2.393 -21.289
  176    H    ALA  23           H        ALA  23  -1.180   0.436 -18.538
  177    HA   ALA  23           HA       ALA  23   0.213  -1.853 -19.537
  178   1HB   ALA  23          1HB       ALA  23   1.337  -0.077 -18.219
  179   2HB   ALA  23          2HB       ALA  23   1.568  -1.673 -17.507
  180   3HB   ALA  23          3HB       ALA  23   0.400  -0.555 -16.804
  181    H    PHE  24           H        PHE  24  -2.258  -1.308 -17.100
  182    HA   PHE  24           HA       PHE  24  -2.130  -3.790 -15.754
  183   1HB   PHE  24          2HB       PHE  24  -3.458  -1.656 -15.134
  184   2HB   PHE  24          1HB       PHE  24  -4.696  -2.275 -16.224
  185    HD1  PHE  24           HD1      PHE  24  -5.673  -4.581 -15.793
  186    HD2  PHE  24           HD2      PHE  24  -3.174  -2.557 -12.954
  187    HE1  PHE  24           HE1      PHE  24  -6.488  -6.084 -13.998
  188    HE2  PHE  24           HE2      PHE  24  -3.989  -4.051 -11.162
  189    HZ   PHE  24           HZ       PHE  24  -5.650  -5.816 -11.680
  190    H    ASP  25           H        ASP  25  -3.994  -2.717 -18.592
  191    HA   ASP  25           HA       ASP  25  -5.499  -5.079 -18.957
  192   1HB   ASP  25          2HB       ASP  25  -5.712  -2.712 -20.072
  193   2HB   ASP  25          1HB       ASP  25  -4.652  -3.409 -21.297
  194    H    ILE  26           H        ILE  26  -2.312  -4.135 -20.227
  195    HA   ILE  26           HA       ILE  26  -2.098  -6.437 -21.934
  196    HB   ILE  26           HB       ILE  26   0.297  -5.765 -22.175
  197   1HG1  ILE  26          2HG1      ILE  26  -0.525  -3.514 -20.308
  198   2HG1  ILE  26          1HG1      ILE  26   0.593  -4.813 -19.901
  199   1HG2  ILE  26          1HG2      ILE  26  -1.616  -4.828 -23.545
  200   2HG2  ILE  26          2HG2      ILE  26  -0.198  -3.784 -23.449
  201   3HG2  ILE  26          3HG2      ILE  26  -1.618  -3.435 -22.463
  202   1HD1  ILE  26          1HD1      ILE  26   2.183  -3.359 -20.623
  203   2HD1  ILE  26          2HD1      ILE  26   1.024  -2.401 -21.545
  204   3HD1  ILE  26          3HD1      ILE  26   1.685  -3.887 -22.231
  205    H    PHE  27           H        PHE  27  -0.872  -5.642 -18.684
  206    HA   PHE  27           HA       PHE  27   0.684  -8.034 -18.443
  207   1HB   PHE  27          2HB       PHE  27  -0.322  -6.070 -16.377
  208   2HB   PHE  27          1HB       PHE  27   0.682  -7.464 -15.977
  209    HD1  PHE  27           HD1      PHE  27   1.024  -4.152 -16.219
  210    HD2  PHE  27           HD2      PHE  27   2.583  -7.644 -18.174
  211    HE1  PHE  27           HE1      PHE  27   3.037  -2.876 -16.901
  212    HE2  PHE  27           HE2      PHE  27   4.595  -6.368 -18.849
  213    HZ   PHE  27           HZ       PHE  27   4.823  -3.983 -18.214
  214    H    ILE  28           H        ILE  28  -2.668  -7.202 -17.620
  215    HA   ILE  28           HA       ILE  28  -3.041  -9.871 -16.431
  216    HB   ILE  28           HB       ILE  28  -5.170  -9.132 -15.630
  217   1HG1  ILE  28          2HG1      ILE  28  -5.614  -6.529 -16.283
  218   2HG1  ILE  28          1HG1      ILE  28  -4.858  -7.096 -17.770
  219   1HG2  ILE  28          1HG2      ILE  28  -4.510  -7.436 -14.143
  220   2HG2  ILE  28          2HG2      ILE  28  -3.455  -6.674 -15.333
  221   3HG2  ILE  28          3HG2      ILE  28  -2.988  -8.204 -14.593
  222   1HD1  ILE  28          1HD1      ILE  28  -7.011  -8.764 -16.515
  223   2HD1  ILE  28          2HD1      ILE  28  -6.551  -8.624 -18.213
  224   3HD1  ILE  28          3HD1      ILE  28  -7.468  -7.331 -17.438
  225    H    GLN  29           H        GLN  29  -3.015  -8.709 -19.486
  226    HA   GLN  29           HA       GLN  29  -5.360  -9.355 -20.770
  227   1HB   GLN  29          2HB       GLN  29  -3.408  -8.418 -21.927
  228   2HB   GLN  29          1HB       GLN  29  -2.548  -9.944 -21.729
  229   1HG   GLN  29          2HG       GLN  29  -3.923 -11.070 -23.246
  230   2HG   GLN  29          1HG       GLN  29  -5.240  -9.909 -23.067
  231   1HE2  GLN  29          1HE2      GLN  29  -4.750  -7.633 -23.950
  232   2HE2  GLN  29          2HE2      GLN  29  -3.756  -7.522 -25.321
  233    H    ASP  30           H        ASP  30  -2.767 -11.568 -19.794
  234    HA   ASP  30           HA       ASP  30  -4.497 -13.863 -20.496
  235   1HB   ASP  30          2HB       ASP  30  -2.373 -15.203 -20.371
  236   2HB   ASP  30          1HB       ASP  30  -2.388 -13.993 -21.650
  237    H    ALA  31           H        ALA  31  -4.816 -12.291 -18.047
  238    HA   ALA  31           HA       ALA  31  -3.845 -14.128 -15.964
  239   1HB   ALA  31          1HB       ALA  31  -5.300 -11.496 -15.624
  240   2HB   ALA  31          2HB       ALA  31  -3.545 -11.670 -15.628
  241   3HB   ALA  31          3HB       ALA  31  -4.504 -12.440 -14.365
  242    H    GLU  32           H        GLU  32  -5.233 -15.108 -14.503
  243    HA   GLU  32           HA       GLU  32  -8.025 -15.379 -15.446
  244   1HB   GLU  32          2HB       GLU  32  -8.017 -17.564 -14.234
  245   2HB   GLU  32          1HB       GLU  32  -6.854 -17.496 -15.556
  246   1HG   GLU  32          2HG       GLU  32  -5.051 -17.594 -14.151
  247   2HG   GLU  32          1HG       GLU  32  -5.836 -16.623 -12.906
  248    H    ASP  33           H        ASP  33  -7.408 -13.169 -13.907
  249    HA   ASP  33           HA       ASP  33  -9.167 -13.568 -11.647
  250   1HB   ASP  33          2HB       ASP  33  -6.722 -14.153 -10.919
  251   2HB   ASP  33          1HB       ASP  33  -6.491 -12.405 -10.945
  252    H    GLY  34           H        GLY  34  -6.794 -11.359 -13.124
  253   1HA   GLY  34          2HA       GLY  34  -7.596  -9.310 -14.190
  254   2HA   GLY  34          1HA       GLY  34  -8.786  -9.177 -12.897
  255    H    CYS  35           H        CYS  35  -5.346  -9.997 -12.643
  256    HA   CYS  35           HA       CYS  35  -4.706  -7.400 -11.449
  257   1HB   CYS  35          2HB       CYS  35  -4.170  -9.998  -9.986
  258   2HB   CYS  35          1HB       CYS  35  -3.754  -8.376  -9.439
  259    HG   CYS  35           HG       CYS  35  -6.275  -7.865  -9.100
  260    H    ILE  36           H        ILE  36  -2.504  -6.891 -11.579
  261    HA   ILE  36           HA       ILE  36  -1.019  -8.467 -13.518
  262    HB   ILE  36           HB       ILE  36   0.511  -6.686 -13.672
  263   1HG1  ILE  36          2HG1      ILE  36   0.046  -4.798 -11.718
  264   2HG1  ILE  36          1HG1      ILE  36  -0.149  -6.307 -10.824
  265   1HG2  ILE  36          1HG2      ILE  36  -1.741  -6.074 -14.482
  266   2HG2  ILE  36          2HG2      ILE  36  -0.868  -4.667 -13.877
  267   3HG2  ILE  36          3HG2      ILE  36  -2.128  -5.412 -12.894
  268   1HD1  ILE  36          1HD1      ILE  36   2.283  -5.068 -11.662
  269   2HD1  ILE  36          2HD1      ILE  36   2.120  -6.579 -12.555
  270   3HD1  ILE  36          3HD1      ILE  36   2.086  -6.590 -10.792
  271    H    SER  37           H        SER  37   1.313  -8.989 -13.097
  272    HA   SER  37           HA       SER  37   1.479 -10.451 -10.584
  273   1HB   SER  37          2HB       SER  37   2.264 -11.203 -13.001
  274   2HB   SER  37          1HB       SER  37   3.743 -10.370 -12.534
  275    HG   SER  37           HG       SER  37   3.671 -12.621 -11.940
  276    H    THR  38           H        THR  38   2.122  -9.390  -8.832
  277    HA   THR  38           HA       THR  38   3.485  -6.962  -8.687
  278    HB   THR  38           HB       THR  38   4.032  -7.586  -6.347
  279    HG1  THR  38           HG1      THR  38   4.010  -9.599  -5.754
  280   1HG2  THR  38          1HG2      THR  38   1.622  -8.171  -5.684
  281   2HG2  THR  38          2HG2      THR  38   1.271  -8.182  -7.411
  282   3HG2  THR  38          3HG2      THR  38   1.847  -6.707  -6.639
  283    H    LYS  39           H        LYS  39   4.775 -10.274  -8.609
  284    HA   LYS  39           HA       LYS  39   7.495  -9.596  -8.219
  285   1HB   LYS  39          2HB       LYS  39   8.003 -11.854  -8.997
  286   2HB   LYS  39          1HB       LYS  39   6.605 -11.893  -7.922
  287   1HG   LYS  39          2HG       LYS  39   5.190 -11.693 -10.087
  288   2HG   LYS  39          1HG       LYS  39   6.669 -12.159 -10.928
  289   1HD   LYS  39          2HD       LYS  39   6.030 -13.840  -8.590
  290   2HD   LYS  39          1HD       LYS  39   4.847 -13.933  -9.895
  291   1HE   LYS  39          2HE       LYS  39   6.281 -15.449 -10.797
  292   2HE   LYS  39          1HE       LYS  39   7.202 -14.031 -11.297
  293   1HZ   LYS  39          1HZ       LYS  39   8.563 -15.664 -10.109
  294   2HZ   LYS  39          2HZ       LYS  39   7.578 -15.489  -8.735
  295   3HZ   LYS  39          3HZ       LYS  39   8.505 -14.178  -9.294
  296    H    GLU  40           H        GLU  40   5.457  -9.550 -11.063
  297    HA   GLU  40           HA       GLU  40   7.800  -9.090 -12.794
  298   1HB   GLU  40          2HB       GLU  40   4.917  -9.588 -13.576
  299   2HB   GLU  40          1HB       GLU  40   6.288  -9.459 -14.674
  300   1HG   GLU  40          2HG       GLU  40   7.324 -11.394 -13.303
  301   2HG   GLU  40          1HG       GLU  40   5.695 -11.634 -12.671
  302    H    LEU  41           H        LEU  41   6.552  -7.100 -10.856
  303    HA   LEU  41           HA       LEU  41   5.224  -5.135 -12.464
  304   1HB   LEU  41          2HB       LEU  41   5.448  -5.473  -9.796
  305   2HB   LEU  41          1HB       LEU  41   6.659  -4.235 -10.044
  306    HG   LEU  41           HG       LEU  41   4.061  -3.712 -11.354
  307   1HD1  LEU  41          1HD1      LEU  41   4.284  -3.478  -8.347
  308   2HD1  LEU  41          2HD1      LEU  41   3.472  -4.826  -9.142
  309   3HD1  LEU  41          3HD1      LEU  41   2.864  -3.183  -9.350
  310   1HD2  LEU  41          1HD2      LEU  41   4.512  -1.473 -10.256
  311   2HD2  LEU  41          2HD2      LEU  41   5.775  -2.015 -11.361
  312   3HD2  LEU  41          3HD2      LEU  41   6.005  -2.163  -9.619
  313    H    GLY  42           H        GLY  42   8.455  -6.131 -12.361
  314   1HA   GLY  42          2HA       GLY  42   9.898  -3.729 -12.614
  315   2HA   GLY  42          1HA       GLY  42  10.381  -5.284 -13.289
  316    H    LYS  43           H        LYS  43   8.040  -5.639 -14.941
  317    HA   LYS  43           HA       LYS  43   8.848  -4.195 -17.282
  318   1HB   LYS  43          2HB       LYS  43   6.355  -5.854 -16.796
  319   2HB   LYS  43          1HB       LYS  43   6.931  -5.302 -18.368
  320   1HG   LYS  43          2HG       LYS  43   8.733  -6.909 -16.565
  321   2HG   LYS  43          1HG       LYS  43   7.552  -7.715 -17.596
  322   1HD   LYS  43          2HD       LYS  43   8.537  -6.845 -19.583
  323   2HD   LYS  43          1HD       LYS  43   9.499  -5.675 -18.680
  324   1HE   LYS  43          2HE       LYS  43  10.678  -7.623 -17.582
  325   2HE   LYS  43          1HE       LYS  43   9.840  -8.683 -18.715
  326   1HZ   LYS  43          1HZ       LYS  43  12.078  -8.018 -19.462
  327   2HZ   LYS  43          2HZ       LYS  43  11.561  -6.400 -19.518
  328   3HZ   LYS  43          3HZ       LYS  43  10.858  -7.557 -20.544
  329    H    VAL  44           H        VAL  44   6.590  -3.626 -14.730
  330    HA   VAL  44           HA       VAL  44   4.986  -1.684 -16.173
  331    HB   VAL  44           HB       VAL  44   5.067  -2.050 -13.177
  332   1HG1  VAL  44          1HG1      VAL  44   2.741  -1.377 -14.983
  333   2HG1  VAL  44          2HG1      VAL  44   3.832  -0.139 -14.360
  334   3HG1  VAL  44          3HG1      VAL  44   2.885  -1.120 -13.244
  335   1HG2  VAL  44          1HG2      VAL  44   3.050  -3.525 -14.808
  336   2HG2  VAL  44          2HG2      VAL  44   3.765  -3.950 -13.255
  337   3HG2  VAL  44          3HG2      VAL  44   4.677  -4.203 -14.742
  338    H    MET  45           H        MET  45   7.385  -1.718 -13.553
  339    HA   MET  45           HA       MET  45   7.534   1.029 -13.056
  340   1HB   MET  45          2HB       MET  45   9.604  -1.158 -12.797
  341   2HB   MET  45          1HB       MET  45   9.912   0.506 -12.296
  342   1HG   MET  45          2HG       MET  45   7.588  -1.168 -11.300
  343   2HG   MET  45          1HG       MET  45   9.105  -0.960 -10.426
  344   1HE   MET  45          1HE       MET  45  10.019   1.623  -9.695
  345   2HE   MET  45          2HE       MET  45   9.299   0.360  -8.701
  346   3HE   MET  45          3HE       MET  45   8.794   2.034  -8.487
  347    H    ARG  46           H        ARG  46   9.353  -0.975 -15.384
  348    HA   ARG  46           HA       ARG  46  11.033   1.085 -16.354
  349   1HB   ARG  46          2HB       ARG  46  11.384  -0.339 -18.327
  350   2HB   ARG  46          1HB       ARG  46  11.474  -1.283 -16.841
  351   1HG   ARG  46          2HG       ARG  46   9.302  -2.205 -17.176
  352   2HG   ARG  46          1HG       ARG  46   8.917  -1.037 -18.437
  353   1HD   ARG  46          2HD       ARG  46  10.814  -2.021 -19.789
  354   2HD   ARG  46          1HD       ARG  46  10.920  -3.298 -18.581
  355    HE   ARG  46           HE       ARG  46   8.250  -3.161 -19.436
  356   1HH1  ARG  46          2HH1      ARG  46  11.408  -3.909 -20.720
  357   2HH1  ARG  46          1HH1      ARG  46  10.804  -5.023 -21.898
  358   1HH2  ARG  46          1HH2      ARG  46   7.478  -4.627 -20.986
  359   2HH2  ARG  46          2HH2      ARG  46   8.585  -5.429 -22.049
  360    H    MET  47           H        MET  47   7.728   0.180 -17.147
  361    HA   MET  47           HA       MET  47   7.539   1.885 -19.470
  362   1HB   MET  47          2HB       MET  47   5.552   0.321 -17.834
  363   2HB   MET  47          1HB       MET  47   5.017   1.454 -19.075
  364   1HG   MET  47          2HG       MET  47   7.078  -0.677 -19.658
  365   2HG   MET  47          1HG       MET  47   5.349  -0.995 -19.801
  366   1HE   MET  47          1HE       MET  47   8.156   1.267 -22.469
  367   2HE   MET  47          2HE       MET  47   8.140  -0.471 -22.179
  368   3HE   MET  47          3HE       MET  47   8.412   0.636 -20.836
  369    H    LEU  48           H        LEU  48   6.878   2.152 -16.029
  370    HA   LEU  48           HA       LEU  48   5.423   4.638 -16.217
  371   1HB   LEU  48          2HB       LEU  48   6.452   2.902 -14.032
  372   2HB   LEU  48          1HB       LEU  48   6.150   4.582 -13.652
  373    HG   LEU  48           HG       LEU  48   3.836   4.367 -13.980
  374   1HD1  LEU  48          1HD1      LEU  48   4.620   2.067 -15.730
  375   2HD1  LEU  48          2HD1      LEU  48   3.474   3.369 -16.040
  376   3HD1  LEU  48          3HD1      LEU  48   3.026   2.034 -14.976
  377   1HD2  LEU  48          1HD2      LEU  48   3.317   2.018 -12.896
  378   2HD2  LEU  48          2HD2      LEU  48   4.193   3.236 -11.967
  379   3HD2  LEU  48          3HD2      LEU  48   5.073   1.920 -12.745
  380    H    GLY  49           H        GLY  49   8.762   3.667 -15.826
  381   1HA   GLY  49          2HA       GLY  49  10.443   5.304 -16.606
  382   2HA   GLY  49          1HA       GLY  49   9.562   6.520 -15.690
  383    H    GLN  50           H        GLN  50  10.144   3.264 -14.479
  384    HA   GLN  50           HA       GLN  50  12.197   4.295 -12.618
  385   1HB   GLN  50          2HB       GLN  50  10.022   2.372 -11.779
  386   2HB   GLN  50          1HB       GLN  50  11.182   3.209 -10.750
  387   1HG   GLN  50          2HG       GLN  50   9.107   4.648 -12.428
  388   2HG   GLN  50          1HG       GLN  50   8.846   4.196 -10.744
  389   1HE2  GLN  50          1HE2      GLN  50   9.391   6.908 -12.303
  390   2HE2  GLN  50          2HE2      GLN  50  10.538   7.666 -11.307
  391    H    ASN  51           H        ASN  51  13.548   2.614 -11.679
  392    HA   ASN  51           HA       ASN  51  13.455  -0.049 -12.845
  393   1HB   ASN  51          2HB       ASN  51  14.681   1.533 -14.489
  394   2HB   ASN  51          1HB       ASN  51  15.979   1.537 -13.296
  395   1HD2  ASN  51          1HD2      ASN  51  17.483  -0.126 -13.546
  396   2HD2  ASN  51          2HD2      ASN  51  17.186  -1.589 -14.353
  397    HA   PRO  52           HA       PRO  52  15.402   0.230  -8.642
  398   1HB   PRO  52          2HB       PRO  52  13.446  -1.102  -7.275
  399   2HB   PRO  52          1HB       PRO  52  13.425   0.643  -7.566
  400   1HG   PRO  52          2HG       PRO  52  11.786  -1.480  -8.789
  401   2HG   PRO  52          1HG       PRO  52  11.447   0.247  -8.618
  402   1HD   PRO  52          2HD       PRO  52  12.363  -1.107 -10.968
  403   2HD   PRO  52          1HD       PRO  52  12.154   0.646 -10.749
  404    H    THR  53           H        THR  53  15.094  -1.932  -6.932
  405    HA   THR  53           HA       THR  53  16.306  -4.142  -8.472
  406    HB   THR  53           HB       THR  53  17.509  -4.723  -6.552
  407    HG1  THR  53           HG1      THR  53  16.652  -4.668  -4.635
  408   1HG2  THR  53          1HG2      THR  53  18.056  -2.387  -7.363
  409   2HG2  THR  53          2HG2      THR  53  18.520  -2.736  -5.698
  410   3HG2  THR  53          3HG2      THR  53  17.075  -1.781  -6.030
  411    HA   PRO  54           HA       PRO  54  12.957  -6.855  -7.501
  412   1HB   PRO  54          2HB       PRO  54  14.086  -9.113  -6.436
  413   2HB   PRO  54          1HB       PRO  54  14.166  -8.677  -8.151
  414   1HG   PRO  54          2HG       PRO  54  16.268  -8.500  -6.062
  415   2HG   PRO  54          1HG       PRO  54  16.426  -8.759  -7.804
  416   1HD   PRO  54          2HD       PRO  54  16.877  -6.335  -6.469
  417   2HD   PRO  54          1HD       PRO  54  16.633  -6.513  -8.222
  418    H    GLU  55           H        GLU  55  15.140  -6.299  -4.805
  419    HA   GLU  55           HA       GLU  55  13.241  -7.157  -2.779
  420   1HB   GLU  55          2HB       GLU  55  15.893  -5.707  -2.595
  421   2HB   GLU  55          1HB       GLU  55  14.924  -6.174  -1.197
  422   1HG   GLU  55          2HG       GLU  55  14.965  -8.554  -2.325
  423   2HG   GLU  55          1HG       GLU  55  16.389  -7.922  -3.151
  424    H    GLU  56           H        GLU  56  14.316  -4.172  -4.303
  425    HA   GLU  56           HA       GLU  56  12.956  -2.401  -2.493
  426   1HB   GLU  56          2HB       GLU  56  14.949  -2.022  -4.264
  427   2HB   GLU  56          1HB       GLU  56  13.584  -1.490  -5.245
  428   1HG   GLU  56          2HG       GLU  56  12.941  -0.199  -2.997
  429   2HG   GLU  56          1HG       GLU  56  14.680  -0.317  -2.723
  430    H    LEU  57           H        LEU  57  12.213  -3.845  -5.656
  431    HA   LEU  57           HA       LEU  57   9.818  -2.327  -6.048
  432   1HB   LEU  57          2HB       LEU  57   9.432  -3.658  -7.944
  433   2HB   LEU  57          1HB       LEU  57  11.158  -3.417  -7.867
  434    HG   LEU  57           HG       LEU  57  11.132  -5.769  -6.673
  435   1HD1  LEU  57          1HD1      LEU  57   8.396  -5.466  -7.790
  436   2HD1  LEU  57          2HD1      LEU  57   8.963  -6.481  -6.464
  437   3HD1  LEU  57          3HD1      LEU  57   9.200  -6.998  -8.134
  438   1HD2  LEU  57          1HD2      LEU  57  11.444  -6.809  -8.869
  439   2HD2  LEU  57          2HD2      LEU  57  12.161  -5.198  -8.877
  440   3HD2  LEU  57          3HD2      LEU  57  10.599  -5.472  -9.648
  441    H    GLN  58           H        GLN  58  10.564  -5.406  -4.494
  442    HA   GLN  58           HA       GLN  58   7.846  -6.298  -4.336
  443   1HB   GLN  58          2HB       GLN  58   9.897  -7.777  -4.152
  444   2HB   GLN  58          1HB       GLN  58  10.107  -7.143  -2.519
  445   1HG   GLN  58          2HG       GLN  58   8.853  -9.230  -2.402
  446   2HG   GLN  58          1HG       GLN  58   7.786  -7.894  -1.973
  447   1HE2  GLN  58          1HE2      GLN  58   5.951  -7.511  -3.321
  448   2HE2  GLN  58          2HE2      GLN  58   5.599  -8.440  -4.697
  449    H    GLU  59           H        GLU  59  10.035  -4.669  -2.027
  450    HA   GLU  59           HA       GLU  59   8.269  -4.659   0.167
  451   1HB   GLU  59          2HB       GLU  59   9.664  -2.844   1.072
  452   2HB   GLU  59          1HB       GLU  59  10.645  -4.157   0.423
  453   1HG   GLU  59          2HG       GLU  59  11.035  -2.904  -1.632
  454   2HG   GLU  59          1HG       GLU  59   9.969  -1.612  -1.082
  455    H    MET  60           H        MET  60   8.551  -2.416  -2.570
  456    HA   MET  60           HA       MET  60   6.747  -0.483  -1.432
  457   1HB   MET  60          2HB       MET  60   6.772   0.583  -3.638
  458   2HB   MET  60          1HB       MET  60   8.410   0.200  -3.113
  459   1HG   MET  60          2HG       MET  60   8.624  -1.568  -4.633
  460   2HG   MET  60          1HG       MET  60   6.881  -1.762  -4.805
  461   1HE   MET  60          1HE       MET  60   7.246  -2.152  -6.975
  462   2HE   MET  60          2HE       MET  60   7.565  -1.016  -8.283
  463   3HE   MET  60          3HE       MET  60   6.003  -0.995  -7.471
  464    H    ILE  61           H        ILE  61   6.433  -3.335  -3.433
  465    HA   ILE  61           HA       ILE  61   3.749  -2.852  -4.312
  466    HB   ILE  61           HB       ILE  61   5.412  -5.374  -4.121
  467   1HG1  ILE  61          2HG1      ILE  61   4.372  -3.979  -6.583
  468   2HG1  ILE  61          1HG1      ILE  61   5.870  -3.463  -5.809
  469   1HG2  ILE  61          1HG2      ILE  61   3.532  -6.584  -4.401
  470   2HG2  ILE  61          2HG2      ILE  61   3.222  -5.708  -5.899
  471   3HG2  ILE  61          3HG2      ILE  61   2.553  -5.118  -4.380
  472   1HD1  ILE  61          1HD1      ILE  61   5.243  -6.196  -6.947
  473   2HD1  ILE  61          2HD1      ILE  61   6.666  -5.857  -5.963
  474   3HD1  ILE  61          3HD1      ILE  61   6.460  -5.056  -7.520
  475    H    ASP  62           H        ASP  62   5.185  -4.832  -1.726
  476    HA   ASP  62           HA       ASP  62   2.841  -5.886  -0.632
  477   1HB   ASP  62          2HB       ASP  62   5.559  -5.283   0.467
  478   2HB   ASP  62          1HB       ASP  62   4.270  -5.721   1.589
  479    H    GLU  63           H        GLU  63   4.372  -2.736  -0.128
  480    HA   GLU  63           HA       GLU  63   2.791  -1.854   2.049
  481   1HB   GLU  63          2HB       GLU  63   4.398  -0.462  -0.070
  482   2HB   GLU  63          1HB       GLU  63   3.365   0.478   1.007
  483   1HG   GLU  63          2HG       GLU  63   4.495  -0.466   2.963
  484   2HG   GLU  63          1HG       GLU  63   5.488  -1.485   1.922
  485    H    VAL  64           H        VAL  64   2.416  -1.327  -1.469
  486    HA   VAL  64           HA       VAL  64  -0.089   0.057  -1.161
  487    HB   VAL  64           HB       VAL  64   1.413   0.519  -3.060
  488   1HG1  VAL  64          1HG1      VAL  64   1.525  -1.117  -4.927
  489   2HG1  VAL  64          2HG1      VAL  64   0.671  -2.291  -3.925
  490   3HG1  VAL  64          3HG1      VAL  64   2.276  -1.731  -3.456
  491   1HG2  VAL  64          1HG2      VAL  64  -0.320   0.958  -4.515
  492   2HG2  VAL  64          2HG2      VAL  64  -1.263   0.542  -3.084
  493   3HG2  VAL  64          3HG2      VAL  64  -1.008  -0.658  -4.351
  494    H    ASP  65           H        ASP  65   0.849  -3.289  -1.558
  495    HA   ASP  65           HA       ASP  65  -1.751  -4.201  -2.415
  496   1HB   ASP  65          2HB       ASP  65   0.808  -5.322  -2.351
  497   2HB   ASP  65          1HB       ASP  65  -0.102  -6.241  -1.156
  498    H    GLU  66           H        GLU  66  -3.311  -3.647  -0.989
  499    HA   GLU  66           HA       GLU  66  -3.142  -3.600   1.807
  500   1HB   GLU  66          2HB       GLU  66  -5.618  -3.686   1.784
  501   2HB   GLU  66          1HB       GLU  66  -4.976  -2.516   0.634
  502   1HG   GLU  66          2HG       GLU  66  -5.321  -4.052  -1.212
  503   2HG   GLU  66          1HG       GLU  66  -5.779  -5.345  -0.105
  504    H    ASP  67           H        ASP  67  -3.875  -6.260  -0.379
  505    HA   ASP  67           HA       ASP  67  -4.395  -8.042   1.902
  506   1HB   ASP  67          2HB       ASP  67  -4.928  -9.706  -0.008
  507   2HB   ASP  67          1HB       ASP  67  -6.068  -8.401   0.304
  508    H    GLY  68           H        GLY  68  -2.122  -7.529  -0.747
  509   1HA   GLY  68          2HA       GLY  68   0.037  -8.315  -1.034
  510   2HA   GLY  68          1HA       GLY  68  -0.062  -9.020   0.578
  511    H    SER  69           H        SER  69  -1.980  -9.532  -2.371
  512    HA   SER  69           HA       SER  69  -1.875 -12.415  -1.999
  513   1HB   SER  69          2HB       SER  69  -3.390 -12.434  -3.996
  514   2HB   SER  69          1HB       SER  69  -3.997 -11.480  -2.647
  515    HG   SER  69           HG       SER  69  -4.197 -10.210  -4.440
  516    H    GLY  70           H        GLY  70   0.234 -10.281  -3.421
  517   1HA   GLY  70          2HA       GLY  70   2.118 -10.774  -4.706
  518   2HA   GLY  70          1HA       GLY  70   1.438 -12.362  -5.053
  519    H    THR  71           H        THR  71  -0.756  -9.775  -5.481
  520    HA   THR  71           HA       THR  71  -0.134  -9.398  -8.313
  521    HB   THR  71           HB       THR  71  -2.335 -10.020  -9.071
  522    HG1  THR  71           HG1      THR  71  -3.957 -10.455  -7.717
  523   1HG2  THR  71          1HG2      THR  71  -1.261 -12.127  -7.172
  524   2HG2  THR  71          2HG2      THR  71  -0.743 -11.877  -8.840
  525   3HG2  THR  71          3HG2      THR  71  -2.383 -12.429  -8.499
  526    H    VAL  72           H        VAL  72  -0.574  -7.357  -8.963
  527    HA   VAL  72           HA       VAL  72  -1.655  -5.530  -6.962
  528    HB   VAL  72           HB       VAL  72  -0.666  -4.797  -9.719
  529   1HG1  VAL  72          1HG1      VAL  72  -2.003  -3.187  -8.204
  530   2HG1  VAL  72          2HG1      VAL  72  -0.459  -2.611  -8.829
  531   3HG1  VAL  72          3HG1      VAL  72  -0.576  -3.186  -7.166
  532   1HG2  VAL  72          1HG2      VAL  72   1.506  -4.313  -8.542
  533   2HG2  VAL  72          2HG2      VAL  72   1.128  -6.033  -8.648
  534   3HG2  VAL  72          3HG2      VAL  72   0.875  -5.165  -7.132
  535    H    ASP  73           H        ASP  73  -3.670  -4.883  -6.915
  536    HA   ASP  73           HA       ASP  73  -5.511  -5.541  -9.078
  537   1HB   ASP  73          2HB       ASP  73  -5.940  -4.150  -6.410
  538   2HB   ASP  73          1HB       ASP  73  -7.225  -4.548  -7.550
  539    H    PHE  74           H        PHE  74  -6.932  -3.819  -9.997
  540    HA   PHE  74           HA       PHE  74  -5.445  -1.685 -11.047
  541   1HB   PHE  74          2HB       PHE  74  -7.596  -2.630 -11.989
  542   2HB   PHE  74          1HB       PHE  74  -8.454  -1.680 -10.778
  543    HD1  PHE  74           HD1      PHE  74  -5.379  -0.895 -12.761
  544    HD2  PHE  74           HD2      PHE  74  -9.479   0.071 -11.938
  545    HE1  PHE  74           HE1      PHE  74  -5.205   1.099 -14.223
  546    HE2  PHE  74           HE2      PHE  74  -9.304   2.067 -13.395
  547    HZ   PHE  74           HZ       PHE  74  -7.169   2.581 -14.540
  548    H    ASP  75           H        ASP  75  -7.354  -1.927  -8.109
  549    HA   ASP  75           HA       ASP  75  -7.455   0.882  -7.535
  550   1HB   ASP  75          2HB       ASP  75  -7.707  -1.527  -5.707
  551   2HB   ASP  75          1HB       ASP  75  -8.025   0.139  -5.223
  552    H    GLU  76           H        GLU  76  -5.337  -1.810  -6.561
  553    HA   GLU  76           HA       GLU  76  -3.614  -0.245  -4.894
  554   1HB   GLU  76          2HB       GLU  76  -3.014  -2.862  -6.309
  555   2HB   GLU  76          1HB       GLU  76  -2.111  -2.177  -4.958
  556   1HG   GLU  76          2HG       GLU  76  -4.037  -2.395  -3.487
  557   2HG   GLU  76          1HG       GLU  76  -5.055  -2.908  -4.830
  558    H    PHE  77           H        PHE  77  -3.778  -0.965  -8.309
  559    HA   PHE  77           HA       PHE  77  -1.159  -0.208  -9.092
  560   1HB   PHE  77          2HB       PHE  77  -3.241  -1.369 -10.363
  561   2HB   PHE  77          1HB       PHE  77  -3.453   0.279 -10.928
  562    HD1  PHE  77           HD1      PHE  77  -3.034  -0.512 -13.208
  563    HD2  PHE  77           HD2      PHE  77  -0.024  -0.841 -10.145
  564    HE1  PHE  77           HE1      PHE  77  -1.301  -0.898 -14.933
  565    HE2  PHE  77           HE2      PHE  77   1.694  -1.215 -11.880
  566    HZ   PHE  77           HZ       PHE  77   1.056  -1.248 -14.276
  567    H    LEU  78           H        LEU  78  -4.260   1.543  -9.119
  568    HA   LEU  78           HA       LEU  78  -3.122   4.039  -9.945
  569   1HB   LEU  78          2HB       LEU  78  -5.790   3.122  -8.981
  570   2HB   LEU  78          1HB       LEU  78  -5.435   4.840  -8.936
  571    HG   LEU  78           HG       LEU  78  -5.203   4.939 -11.312
  572   1HD1  LEU  78          1HD1      LEU  78  -5.468   1.924 -11.380
  573   2HD1  LEU  78          2HD1      LEU  78  -3.936   2.785 -11.519
  574   3HD1  LEU  78          3HD1      LEU  78  -5.178   2.995 -12.751
  575   1HD2  LEU  78          1HD2      LEU  78  -7.543   4.608 -10.249
  576   2HD2  LEU  78          2HD2      LEU  78  -7.471   2.986 -10.937
  577   3HD2  LEU  78          3HD2      LEU  78  -7.400   4.395 -11.994
  578    H    VAL  79           H        VAL  79  -3.685   2.495  -6.851
  579    HA   VAL  79           HA       VAL  79  -3.587   4.759  -5.167
  580    HB   VAL  79           HB       VAL  79  -3.188   1.828  -4.835
  581   1HG1  VAL  79          1HG1      VAL  79  -2.209   3.853  -2.799
  582   2HG1  VAL  79          2HG1      VAL  79  -1.218   2.671  -3.658
  583   3HG1  VAL  79          3HG1      VAL  79  -2.425   2.129  -2.490
  584   1HG2  VAL  79          1HG2      VAL  79  -4.608   3.785  -3.030
  585   2HG2  VAL  79          2HG2      VAL  79  -4.949   2.072  -3.276
  586   3HG2  VAL  79          3HG2      VAL  79  -5.336   3.239  -4.540
  587    H    MET  80           H        MET  80  -1.026   2.610  -6.379
  588    HA   MET  80           HA       MET  80   1.197   3.621  -5.099
  589   1HB   MET  80          2HB       MET  80   0.750   1.882  -7.227
  590   2HB   MET  80          1HB       MET  80   1.762   3.153  -7.913
  591   1HG   MET  80          2HG       MET  80   3.218   2.880  -5.800
  592   2HG   MET  80          1HG       MET  80   2.347   1.367  -5.552
  593   1HE   MET  80          1HE       MET  80   1.938  -0.298  -7.342
  594   2HE   MET  80          2HE       MET  80   3.365  -0.860  -6.476
  595   3HE   MET  80          3HE       MET  80   3.311  -0.968  -8.234
  596    H    MET  81           H        MET  81  -0.643   5.116  -7.714
  597    HA   MET  81           HA       MET  81   1.290   7.031  -8.531
  598   1HB   MET  81          2HB       MET  81  -0.719   6.550  -9.874
  599   2HB   MET  81          1HB       MET  81  -1.736   7.223  -8.601
  600   1HG   MET  81          2HG       MET  81  -1.442   9.287  -9.447
  601   2HG   MET  81          1HG       MET  81   0.299   9.143  -9.213
  602   1HE   MET  81          1HE       MET  81   2.042   8.746 -11.647
  603   2HE   MET  81          2HE       MET  81   1.465   7.163 -12.160
  604   3HE   MET  81          3HE       MET  81   1.575   7.539 -10.442
  605    H    VAL  82           H        VAL  82  -1.531   7.375  -6.353
  606    HA   VAL  82           HA       VAL  82  -0.819   9.983  -5.445
  607    HB   VAL  82           HB       VAL  82  -2.478   9.594  -3.646
  608   1HG1  VAL  82          1HG1      VAL  82  -4.406   8.972  -5.264
  609   2HG1  VAL  82          2HG1      VAL  82  -3.150   8.887  -6.499
  610   3HG1  VAL  82          3HG1      VAL  82  -3.443  10.400  -5.639
  611   1HG2  VAL  82          1HG2      VAL  82  -3.616   7.494  -3.416
  612   2HG2  VAL  82          2HG2      VAL  82  -1.891   7.125  -3.415
  613   3HG2  VAL  82          3HG2      VAL  82  -2.851   6.848  -4.869
  614    H    ARG  83           H        ARG  83   0.013   6.740  -4.411
  615    HA   ARG  83           HA       ARG  83   0.979   7.227  -1.825
  616   1HB   ARG  83          2HB       ARG  83   1.765   5.231  -3.946
  617   2HB   ARG  83          1HB       ARG  83   2.576   5.279  -2.382
  618   1HG   ARG  83          2HG       ARG  83  -0.373   5.335  -2.230
  619   2HG   ARG  83          1HG       ARG  83   0.300   3.845  -2.895
  620   1HD   ARG  83          2HD       ARG  83   1.873   3.789  -0.911
  621   2HD   ARG  83          1HD       ARG  83   0.952   5.124  -0.227
  622    HE   ARG  83           HE       ARG  83  -0.757   2.940  -0.941
  623   1HH1  ARG  83          2HH1      ARG  83   1.531   4.049   1.452
  624   2HH1  ARG  83          1HH1      ARG  83   0.846   3.102   2.727
  625   1HH2  ARG  83          1HH2      ARG  83  -1.638   1.707   0.744
  626   2HH2  ARG  83          2HH2      ARG  83  -0.944   1.779   2.329
  627    H    CYS  84           H        CYS  84   2.525   7.597  -4.991
  628    HA   CYS  84           HA       CYS  84   5.127   8.233  -4.013
  629   1HB   CYS  84          2HB       CYS  84   3.739   8.700  -6.649
  630   2HB   CYS  84          1HB       CYS  84   5.369   9.297  -6.342
  631    HG   CYS  84           HG       CYS  84   4.579   6.275  -6.414
  632    H    MET  85           H        MET  85   2.279  10.172  -4.837
  633    HA   MET  85           HA       MET  85   3.530  12.720  -4.584
  634   1HB   MET  85          2HB       MET  85   0.668  11.787  -4.535
  635   2HB   MET  85          1HB       MET  85   1.077  13.467  -4.187
  636   1HG   MET  85          2HG       MET  85   2.324  13.559  -6.358
  637   2HG   MET  85          1HG       MET  85   1.749  11.931  -6.713
  638   1HE   MET  85          1HE       MET  85  -0.452  12.840  -9.071
  639   2HE   MET  85          2HE       MET  85   1.272  12.852  -8.711
  640   3HE   MET  85          3HE       MET  85   0.433  14.370  -9.017
  641    H    LYS  86           H        LYS  86   1.345  10.946  -2.362
  642    HA   LYS  86           HA       LYS  86   2.749  12.195  -0.091
  643   1HB   LYS  86          2HB       LYS  86   0.633  13.481  -0.641
  644   2HB   LYS  86          1HB       LYS  86  -0.266  12.026  -0.212
  645   1HG   LYS  86          2HG       LYS  86   1.767  12.823   1.776
  646   2HG   LYS  86          1HG       LYS  86   0.456  13.984   1.572
  647   1HD   LYS  86          2HD       LYS  86  -1.208  12.343   2.088
  648   2HD   LYS  86          1HD       LYS  86  -0.041  11.025   1.967
  649   1HE   LYS  86          2HE       LYS  86   0.081  11.237   4.233
  650   2HE   LYS  86          1HE       LYS  86   1.144  12.594   3.866
  651   1HZ   LYS  86          1HZ       LYS  86  -0.754  14.073   3.942
  652   2HZ   LYS  86          2HZ       LYS  86  -0.618  13.218   5.404
  653   3HZ   LYS  86          3HZ       LYS  86  -1.795  12.772   4.261
  654    H    ASP  87           H        ASP  87   3.302  10.747   1.374
  655    HA   ASP  87           HA       ASP  87   1.588   8.576   2.157
  656   1HB   ASP  87          2HB       ASP  87   2.970   6.721   1.483
  657   2HB   ASP  87          1HB       ASP  87   2.611   7.678   0.050
  658    H    ASP  88           H        ASP  88   2.866  10.806   3.433
  659    HA   ASP  88           HA       ASP  88   3.950  11.319   5.379
  660   1HB   ASP  88          2HB       ASP  88   2.665   9.164   6.070
  661   2HB   ASP  88          1HB       ASP  88   4.251   8.397   6.000
  662    H    SER  89           HN       SER  89   5.759  12.129   4.319
  663    HA   SER  89           HA       SER  89   8.026  10.356   3.804
  664   1HB   SER  89          2HB       SER  89   9.129  12.520   3.052
  665   2HB   SER  89          1HB       SER  89   7.725  12.012   2.119
  666    HG   SER  89           HG       SER  89   6.769  13.779   2.716
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1  -8.347   3.396   7.289
    2   2H    MET   1          2H        MET   1  -7.514   2.411   8.390
    3   3H    MET   1          3H        MET   1  -6.657   3.273   7.204
    4    HA   MET   1           HA       MET   1  -8.315   4.668   9.215
    5   1HB   MET   1          2HB       MET   1  -6.275   4.933  10.590
    6   2HB   MET   1          1HB       MET   1  -6.741   3.239  10.454
    7   1HG   MET   1          2HG       MET   1  -4.891   4.202   8.349
    8   2HG   MET   1          1HG       MET   1  -4.216   4.159   9.977
    9   1HE   MET   1          1HE       MET   1  -4.863   2.063  11.598
   10   2HE   MET   1          2HE       MET   1  -3.214   2.191  10.992
   11   3HE   MET   1          3HE       MET   1  -4.013   0.621  11.028
   12    H    ASN   2           H        ASN   2  -7.662   5.071   6.313
   13    HA   ASN   2           HA       ASN   2  -6.742   7.821   6.543
   14   1HB   ASN   2          2HB       ASN   2  -5.114   5.672   5.274
   15   2HB   ASN   2          1HB       ASN   2  -5.192   7.231   4.453
   16   1HD2  ASN   2          1HD2      ASN   2  -4.590   9.187   5.825
   17   2HD2  ASN   2          2HD2      ASN   2  -3.454   8.975   7.068
   18    H    ASP   3           H        ASP   3  -7.918   9.061   5.239
   19    HA   ASP   3           HA       ASP   3  -9.474   7.766   3.092
   20   1HB   ASP   3          2HB       ASP   3  -9.913  10.184   4.802
   21   2HB   ASP   3          1HB       ASP   3 -10.675  10.103   3.214
   22    H    ILE   4           H        ILE   4  -6.649   9.520   3.414
   23    HA   ILE   4           HA       ILE   4  -6.916  11.372   1.254
   24    HB   ILE   4           HB       ILE   4  -4.459  11.575   1.372
   25   1HG1  ILE   4          2HG1      ILE   4  -3.611  10.181   3.547
   26   2HG1  ILE   4          1HG1      ILE   4  -4.783   9.037   2.893
   27   1HG2  ILE   4          1HG2      ILE   4  -5.758  11.469   4.110
   28   2HG2  ILE   4          2HG2      ILE   4  -5.940  12.796   2.962
   29   3HG2  ILE   4          3HG2      ILE   4  -4.357  12.436   3.652
   30   1HD1  ILE   4          1HD1      ILE   4  -2.797  10.337   1.051
   31   2HD1  ILE   4          2HD1      ILE   4  -3.619   8.785   0.885
   32   3HD1  ILE   4          3HD1      ILE   4  -2.299   8.967   2.041
   33    H    TYR   5           H        TYR   5  -5.992   8.001   1.480
   34    HA   TYR   5           HA       TYR   5  -4.810   7.778  -1.118
   35   1HB   TYR   5          2HB       TYR   5  -6.096   5.626   0.590
   36   2HB   TYR   5          1HB       TYR   5  -5.062   5.350  -0.811
   37    HD1  TYR   5           HD1      TYR   5  -2.651   5.985  -0.742
   38    HD2  TYR   5           HD2      TYR   5  -5.178   6.273   2.719
   39    HE1  TYR   5           HE1      TYR   5  -0.650   6.166   0.705
   40    HE2  TYR   5           HE2      TYR   5  -3.176   6.455   4.167
   41    HH   TYR   5           HH       TYR   5  -0.342   5.541   3.512
   42    H    LYS   6           H        LYS   6  -8.066   7.345   0.182
   43    HA   LYS   6           HA       LYS   6  -9.155   6.510  -2.386
   44   1HB   LYS   6          2HB       LYS   6 -10.195   6.783   0.390
   45   2HB   LYS   6          1HB       LYS   6 -11.357   6.919  -0.929
   46   1HG   LYS   6          2HG       LYS   6 -10.805   4.754  -1.773
   47   2HG   LYS   6          1HG       LYS   6  -9.368   4.647  -0.756
   48   1HD   LYS   6          2HD       LYS   6 -11.894   5.097   0.713
   49   2HD   LYS   6          1HD       LYS   6 -11.781   3.541  -0.107
   50   1HE   LYS   6          2HE       LYS   6  -9.987   2.835   1.173
   51   2HE   LYS   6          1HE       LYS   6  -9.411   4.477   1.461
   52   1HZ   LYS   6          1HZ       LYS   6 -11.888   3.328   2.632
   53   2HZ   LYS   6          2HZ       LYS   6 -11.217   4.853   2.973
   54   3HZ   LYS   6          3HZ       LYS   6 -10.401   3.437   3.441
   55    H    ALA   7           H        ALA   7  -8.594   9.479  -0.724
   56    HA   ALA   7           HA       ALA   7 -10.727  11.013  -1.844
   57   1HB   ALA   7          1HB       ALA   7  -9.663  11.872   0.118
   58   2HB   ALA   7          2HB       ALA   7  -9.264  12.974  -1.200
   59   3HB   ALA   7          3HB       ALA   7  -8.072  11.802  -0.639
   60    H    ALA   8           H        ALA   8  -7.545  10.069  -2.986
   61    HA   ALA   8           HA       ALA   8  -7.535  12.015  -5.148
   62   1HB   ALA   8          1HB       ALA   8  -5.426  11.047  -5.782
   63   2HB   ALA   8          2HB       ALA   8  -5.722   9.623  -4.784
   64   3HB   ALA   8          3HB       ALA   8  -5.436  11.190  -4.024
   65    H    VAL   9           H        VAL   9  -8.008   8.511  -4.785
   66    HA   VAL   9           HA       VAL   9  -8.291   7.945  -7.551
   67    HB   VAL   9           HB       VAL   9  -7.847   6.237  -5.756
   68   1HG1  VAL   9          1HG1      VAL   9 -10.837   6.439  -5.295
   69   2HG1  VAL   9          2HG1      VAL   9  -9.618   7.075  -4.191
   70   3HG1  VAL   9          3HG1      VAL   9  -9.714   5.342  -4.492
   71   1HG2  VAL   9          1HG2      VAL   9  -8.932   4.499  -6.950
   72   2HG2  VAL   9          2HG2      VAL   9  -8.741   5.789  -8.136
   73   3HG2  VAL   9          3HG2      VAL   9 -10.304   5.528  -7.364
   74    H    GLU  10           H        GLU  10 -10.500   9.286  -5.204
   75    HA   GLU  10           HA       GLU  10 -12.868   8.703  -6.755
   76   1HB   GLU  10          2HB       GLU  10 -14.068   9.959  -5.072
   77   2HB   GLU  10          1HB       GLU  10 -12.912   8.896  -4.272
   78   1HG   GLU  10          2HG       GLU  10 -11.490  10.652  -3.688
   79   2HG   GLU  10          1HG       GLU  10 -12.102  11.708  -4.958
   80    H    GLN  11           H        GLN  11 -10.452  11.187  -6.754
   81    HA   GLN  11           HA       GLN  11 -12.121  12.718  -8.655
   82   1HB   GLN  11          2HB       GLN  11 -11.288  14.828  -7.758
   83   2HB   GLN  11          1HB       GLN  11 -12.096  13.910  -6.488
   84   1HG   GLN  11          2HG       GLN  11  -9.728  12.989  -5.944
   85   2HG   GLN  11          1HG       GLN  11  -9.141  14.350  -6.899
   86   1HE2  GLN  11          1HE2      GLN  11 -11.571  13.786  -4.269
   87   2HE2  GLN  11          2HE2      GLN  11 -11.180  15.203  -3.421
   88    H    LEU  12           H        LEU  12  -9.996  10.721  -9.080
   89    HA   LEU  12           HA       LEU  12  -7.639  12.168  -9.930
   90   1HB   LEU  12          2HB       LEU  12  -7.214   9.902 -11.159
   91   2HB   LEU  12          1HB       LEU  12  -7.031  10.023  -9.426
   92    HG   LEU  12           HG       LEU  12  -9.147   8.908  -9.072
   93   1HD1  LEU  12          1HD1      LEU  12 -10.572   9.674 -10.788
   94   2HD1  LEU  12          2HD1      LEU  12 -10.304   7.980 -11.202
   95   3HD1  LEU  12          3HD1      LEU  12  -9.421   9.246 -12.055
   96   1HD2  LEU  12          1HD2      LEU  12  -7.408   7.576 -11.167
   97   2HD2  LEU  12          2HD2      LEU  12  -8.650   6.732 -10.240
   98   3HD2  LEU  12          3HD2      LEU  12  -7.259   7.434  -9.415
   99    H    THR  13           H        THR  13  -6.845  11.755 -12.266
  100    HA   THR  13           HA       THR  13  -8.924  12.793 -14.054
  101    HB   THR  13           HB       THR  13  -6.665  12.730 -15.578
  102    HG1  THR  13           HG1      THR  13  -5.247  12.071 -14.086
  103   1HG2  THR  13          1HG2      THR  13  -6.364  15.134 -14.421
  104   2HG2  THR  13          2HG2      THR  13  -7.962  14.725 -13.799
  105   3HG2  THR  13          3HG2      THR  13  -7.679  14.776 -15.539
  106    H    ASP  14           H        ASP  14  -8.892  12.021 -16.335
  107    HA   ASP  14           HA       ASP  14  -9.353   9.199 -16.439
  108   1HB   ASP  14          2HB       ASP  14  -9.310  11.396 -18.498
  109   2HB   ASP  14          1HB       ASP  14  -9.456   9.705 -18.982
  110    H    GLU  15           H        GLU  15  -6.697  11.333 -17.269
  111    HA   GLU  15           HA       GLU  15  -5.161   9.521 -18.828
  112   1HB   GLU  15          2HB       GLU  15  -4.359  11.904 -17.144
  113   2HB   GLU  15          1HB       GLU  15  -3.233  11.010 -18.167
  114   1HG   GLU  15          2HG       GLU  15  -4.029  11.964 -20.062
  115   2HG   GLU  15          1HG       GLU  15  -5.707  11.752 -19.562
  116    H    GLN  16           H        GLN  16  -5.487  10.055 -15.359
  117    HA   GLN  16           HA       GLN  16  -3.246   8.455 -14.568
  118   1HB   GLN  16          2HB       GLN  16  -5.477   9.853 -13.233
  119   2HB   GLN  16          1HB       GLN  16  -4.904   8.406 -12.401
  120   1HG   GLN  16          2HG       GLN  16  -2.701   9.250 -12.205
  121   2HG   GLN  16          1HG       GLN  16  -2.982  10.496 -13.423
  122   1HE2  GLN  16          1HE2      GLN  16  -4.855   9.553 -10.475
  123   2HE2  GLN  16          2HE2      GLN  16  -4.868  11.117  -9.816
  124    H    LYS  17           H        LYS  17  -6.743   7.897 -14.858
  125    HA   LYS  17           HA       LYS  17  -6.803   5.253 -13.871
  126   1HB   LYS  17          2HB       LYS  17  -8.578   6.684 -15.860
  127   2HB   LYS  17          1HB       LYS  17  -8.907   5.056 -15.270
  128   1HG   LYS  17          2HG       LYS  17  -9.408   5.778 -13.129
  129   2HG   LYS  17          1HG       LYS  17  -8.367   7.196 -13.250
  130   1HD   LYS  17          2HD       LYS  17 -10.609   8.026 -13.314
  131   2HD   LYS  17          1HD       LYS  17 -10.017   8.103 -14.972
  132   1HE   LYS  17          2HE       LYS  17 -11.042   5.641 -15.068
  133   2HE   LYS  17          1HE       LYS  17 -12.052   6.275 -13.769
  134   1HZ   LYS  17          1HZ       LYS  17 -11.684   7.560 -16.422
  135   2HZ   LYS  17          2HZ       LYS  17 -12.709   8.097 -15.178
  136   3HZ   LYS  17          3HZ       LYS  17 -13.027   6.628 -15.970
  137    H    ASN  18           H        ASN  18  -6.287   6.557 -17.132
  138    HA   ASN  18           HA       ASN  18  -6.077   3.942 -18.351
  139   1HB   ASN  18          2HB       ASN  18  -5.696   6.762 -19.312
  140   2HB   ASN  18          1HB       ASN  18  -5.136   5.407 -20.293
  141   1HD2  ASN  18          1HD2      ASN  18  -8.081   6.689 -18.675
  142   2HD2  ASN  18          2HD2      ASN  18  -9.170   5.929 -19.732
  143    H    GLU  19           H        GLU  19  -3.885   6.202 -16.847
  144    HA   GLU  19           HA       GLU  19  -1.445   5.522 -18.021
  145   1HB   GLU  19          2HB       GLU  19  -1.788   7.354 -16.346
  146   2HB   GLU  19          1HB       GLU  19  -1.887   6.125 -15.086
  147   1HG   GLU  19          2HG       GLU  19   0.378   5.352 -15.630
  148   2HG   GLU  19          1HG       GLU  19   0.480   6.530 -16.940
  149    H    PHE  20           H        PHE  20  -3.029   4.056 -15.169
  150    HA   PHE  20           HA       PHE  20  -1.048   1.923 -15.071
  151   1HB   PHE  20          2HB       PHE  20  -3.458   2.624 -13.413
  152   2HB   PHE  20          1HB       PHE  20  -2.634   1.079 -13.226
  153    HD1  PHE  20           HD1      PHE  20  -2.459   4.684 -12.662
  154    HD2  PHE  20           HD2      PHE  20  -0.249   1.002 -12.501
  155    HE1  PHE  20           HE1      PHE  20  -0.753   5.772 -11.229
  156    HE2  PHE  20           HE2      PHE  20   1.446   2.081 -11.056
  157    HZ   PHE  20           HZ       PHE  20   1.200   4.469 -10.424
  158    H    LYS  21           H        LYS  21  -4.528   2.266 -15.777
  159    HA   LYS  21           HA       LYS  21  -5.191  -0.409 -16.142
  160   1HB   LYS  21          2HB       LYS  21  -6.843   1.417 -16.129
  161   2HB   LYS  21          1HB       LYS  21  -6.264   1.947 -17.706
  162   1HG   LYS  21          2HG       LYS  21  -6.966  -0.923 -17.540
  163   2HG   LYS  21          1HG       LYS  21  -8.324   0.183 -17.341
  164   1HD   LYS  21          2HD       LYS  21  -6.426   0.797 -19.550
  165   2HD   LYS  21          1HD       LYS  21  -7.458  -0.617 -19.765
  166   1HE   LYS  21          2HE       LYS  21  -9.437   0.653 -19.630
  167   2HE   LYS  21          1HE       LYS  21  -8.621   2.011 -18.854
  168   1HZ   LYS  21          1HZ       LYS  21  -9.119   2.438 -21.196
  169   2HZ   LYS  21          2HZ       LYS  21  -8.157   1.112 -21.648
  170   3HZ   LYS  21          3HZ       LYS  21  -7.449   2.462 -20.895
  171    H    ALA  22           H        ALA  22  -3.488   1.763 -18.347
  172    HA   ALA  22           HA       ALA  22  -3.701   0.244 -20.715
  173   1HB   ALA  22          1HB       ALA  22  -2.805   2.490 -20.811
  174   2HB   ALA  22          2HB       ALA  22  -1.554   1.376 -21.364
  175   3HB   ALA  22          3HB       ALA  22  -1.477   2.050 -19.736
  176    H    ALA  23           H        ALA  23  -1.053   0.333 -18.325
  177    HA   ALA  23           HA       ALA  23   0.356  -1.905 -19.370
  178   1HB   ALA  23          1HB       ALA  23   0.397  -0.458 -16.723
  179   2HB   ALA  23          2HB       ALA  23   1.636  -0.491 -17.980
  180   3HB   ALA  23          3HB       ALA  23   1.355  -1.916 -16.979
  181    H    PHE  24           H        PHE  24  -2.097  -1.489 -16.872
  182    HA   PHE  24           HA       PHE  24  -2.073  -4.052 -15.738
  183   1HB   PHE  24          2HB       PHE  24  -3.366  -1.942 -14.999
  184   2HB   PHE  24          1HB       PHE  24  -4.602  -2.461 -16.144
  185    HD1  PHE  24           HD1      PHE  24  -5.618  -4.772 -15.897
  186    HD2  PHE  24           HD2      PHE  24  -3.127  -2.993 -12.886
  187    HE1  PHE  24           HE1      PHE  24  -6.473  -6.394 -14.230
  188    HE2  PHE  24           HE2      PHE  24  -3.982  -4.614 -11.222
  189    HZ   PHE  24           HZ       PHE  24  -5.655  -6.313 -11.896
  190    H    ASP  25           H        ASP  25  -3.846  -2.806 -18.564
  191    HA   ASP  25           HA       ASP  25  -5.399  -5.119 -19.052
  192   1HB   ASP  25          2HB       ASP  25  -5.629  -2.734 -20.041
  193   2HB   ASP  25          1HB       ASP  25  -4.474  -3.291 -21.253
  194    H    ILE  26           H        ILE  26  -2.243  -4.101 -20.374
  195    HA   ILE  26           HA       ILE  26  -2.001  -6.362 -22.116
  196    HB   ILE  26           HB       ILE  26   0.380  -5.658 -22.346
  197   1HG1  ILE  26          2HG1      ILE  26  -0.417  -3.467 -20.399
  198   2HG1  ILE  26          1HG1      ILE  26   0.634  -4.822 -19.995
  199   1HG2  ILE  26          1HG2      ILE  26  -0.148  -3.470 -23.376
  200   2HG2  ILE  26          2HG2      ILE  26  -1.691  -3.447 -22.521
  201   3HG2  ILE  26          3HG2      ILE  26  -1.382  -4.673 -23.752
  202   1HD1  ILE  26          1HD1      ILE  26   1.505  -2.404 -20.960
  203   2HD1  ILE  26          2HD1      ILE  26   1.436  -3.376 -22.431
  204   3HD1  ILE  26          3HD1      ILE  26   2.413  -3.912 -21.064
  205    H    PHE  27           H        PHE  27  -0.873  -5.695 -18.819
  206    HA   PHE  27           HA       PHE  27   0.704  -8.110 -18.676
  207   1HB   PHE  27          2HB       PHE  27  -0.197  -6.188 -16.519
  208   2HB   PHE  27          1HB       PHE  27   0.877  -7.559 -16.242
  209    HD1  PHE  27           HD1      PHE  27   2.613  -7.605 -18.570
  210    HD2  PHE  27           HD2      PHE  27   1.087  -4.228 -16.396
  211    HE1  PHE  27           HE1      PHE  27   4.529  -6.239 -19.348
  212    HE2  PHE  27           HE2      PHE  27   3.005  -2.862 -17.184
  213    HZ   PHE  27           HZ       PHE  27   4.723  -3.868 -18.656
  214    H    ILE  28           H        ILE  28  -2.602  -7.213 -17.868
  215    HA   ILE  28           HA       ILE  28  -3.034  -9.852 -16.636
  216    HB   ILE  28           HB       ILE  28  -3.799  -7.498 -15.680
  217   1HG1  ILE  28          2HG1      ILE  28  -4.128  -9.790 -14.708
  218   2HG1  ILE  28          1HG1      ILE  28  -5.414  -8.646 -14.330
  219   1HG2  ILE  28          1HG2      ILE  28  -5.870  -6.692 -16.325
  220   2HG2  ILE  28          2HG2      ILE  28  -6.372  -8.225 -17.034
  221   3HG2  ILE  28          3HG2      ILE  28  -5.208  -7.202 -17.877
  222   1HD1  ILE  28          1HD1      ILE  28  -6.725  -9.601 -16.257
  223   2HD1  ILE  28          2HD1      ILE  28  -6.437 -10.749 -14.948
  224   3HD1  ILE  28          3HD1      ILE  28  -5.476 -10.834 -16.423
  225    H    GLN  29           H        GLN  29  -2.520  -9.738 -19.389
  226    HA   GLN  29           HA       GLN  29  -4.985  -9.868 -20.885
  227   1HB   GLN  29          2HB       GLN  29  -2.745  -9.196 -21.851
  228   2HB   GLN  29          1HB       GLN  29  -2.262 -10.887 -21.721
  229   1HG   GLN  29          2HG       GLN  29  -4.016 -11.583 -23.215
  230   2HG   GLN  29          1HG       GLN  29  -4.741  -9.973 -23.202
  231   1HE2  GLN  29          1HE2      GLN  29  -3.277  -8.166 -24.100
  232   2HE2  GLN  29          2HE2      GLN  29  -2.230  -8.570 -25.374
  233    H    ASP  30           H        ASP  30  -2.488 -12.265 -19.988
  234    HA   ASP  30           HA       ASP  30  -4.284 -14.465 -20.647
  235   1HB   ASP  30          2HB       ASP  30  -1.659 -14.290 -20.970
  236   2HB   ASP  30          1HB       ASP  30  -1.645 -14.907 -19.319
  237    H    ALA  31           H        ALA  31  -4.007 -12.512 -17.968
  238    HA   ALA  31           HA       ALA  31  -4.354 -14.664 -16.006
  239   1HB   ALA  31          1HB       ALA  31  -3.739 -11.752 -15.860
  240   2HB   ALA  31          2HB       ALA  31  -3.036 -13.098 -14.966
  241   3HB   ALA  31          3HB       ALA  31  -4.619 -12.469 -14.510
  242    H    GLU  32           H        GLU  32  -6.180 -14.734 -14.617
  243    HA   GLU  32           HA       GLU  32  -8.584 -13.321 -15.601
  244   1HB   GLU  32          2HB       GLU  32  -8.268 -16.277 -15.072
  245   2HB   GLU  32          1HB       GLU  32  -9.845 -15.489 -15.090
  246   1HG   GLU  32          2HG       GLU  32  -7.901 -15.181 -17.381
  247   2HG   GLU  32          1HG       GLU  32  -9.032 -16.530 -17.305
  248    H    ASP  33           H        ASP  33  -6.934 -12.649 -13.355
  249    HA   ASP  33           HA       ASP  33  -8.824 -13.192 -11.139
  250   1HB   ASP  33          2HB       ASP  33  -5.821 -13.115 -11.145
  251   2HB   ASP  33          1HB       ASP  33  -6.722 -12.745  -9.675
  252    H    GLY  34           H        GLY  34  -7.697 -10.810 -13.188
  253   1HA   GLY  34          2HA       GLY  34  -7.961  -8.523 -13.186
  254   2HA   GLY  34          1HA       GLY  34  -8.880  -8.696 -11.693
  255    H    CYS  35           H        CYS  35  -5.507  -9.584 -12.404
  256    HA   CYS  35           HA       CYS  35  -4.419  -7.382 -10.880
  257   1HB   CYS  35          2HB       CYS  35  -3.285  -8.900  -9.219
  258   2HB   CYS  35          1HB       CYS  35  -5.026  -8.744  -8.998
  259    HG   CYS  35           HG       CYS  35  -5.062 -11.215  -9.164
  260    H    ILE  36           H        ILE  36  -2.222  -7.104 -11.216
  261    HA   ILE  36           HA       ILE  36  -1.089  -8.698 -13.396
  262    HB   ILE  36           HB       ILE  36   0.561  -6.972 -13.643
  263   1HG1  ILE  36          2HG1      ILE  36  -0.033  -4.986 -11.767
  264   2HG1  ILE  36          1HG1      ILE  36  -0.060  -6.478 -10.826
  265   1HG2  ILE  36          1HG2      ILE  36  -0.812  -5.173 -14.268
  266   2HG2  ILE  36          2HG2      ILE  36  -1.916  -5.422 -12.916
  267   3HG2  ILE  36          3HG2      ILE  36  -1.922  -6.543 -14.278
  268   1HD1  ILE  36          1HD1      ILE  36   2.222  -5.087 -11.464
  269   2HD1  ILE  36          2HD1      ILE  36   2.178  -6.302 -12.742
  270   3HD1  ILE  36          3HD1      ILE  36   2.183  -6.802 -11.048
  271    H    SER  37           H        SER  37   1.474  -8.870 -13.135
  272    HA   SER  37           HA       SER  37   1.854 -10.538 -10.760
  273   1HB   SER  37          2HB       SER  37   2.492 -11.303 -13.103
  274   2HB   SER  37          1HB       SER  37   3.805 -10.132 -13.032
  275    HG   SER  37           HG       SER  37   4.794 -11.318 -11.554
  276    H    THR  38           H        THR  38   2.511  -9.504  -8.986
  277    HA   THR  38           HA       THR  38   3.790  -7.019  -8.820
  278    HB   THR  38           HB       THR  38   4.420  -7.662  -6.523
  279    HG1  THR  38           HG1      THR  38   4.769  -9.679  -6.157
  280   1HG2  THR  38          1HG2      THR  38   2.217  -6.919  -6.580
  281   2HG2  THR  38          2HG2      THR  38   2.036  -8.519  -5.863
  282   3HG2  THR  38          3HG2      THR  38   1.682  -8.274  -7.573
  283    H    LYS  39           H        LYS  39   5.094 -10.257  -9.211
  284    HA   LYS  39           HA       LYS  39   7.826  -9.670  -8.717
  285   1HB   LYS  39          2HB       LYS  39   6.846 -11.764 -10.663
  286   2HB   LYS  39          1HB       LYS  39   8.329 -11.778  -9.713
  287   1HG   LYS  39          2HG       LYS  39   5.490 -12.168  -8.744
  288   2HG   LYS  39          1HG       LYS  39   6.850 -13.279  -8.599
  289   1HD   LYS  39          2HD       LYS  39   7.983 -11.685  -7.082
  290   2HD   LYS  39          1HD       LYS  39   6.603 -10.595  -7.210
  291   1HE   LYS  39          2HE       LYS  39   5.132 -12.255  -6.212
  292   2HE   LYS  39          1HE       LYS  39   6.429 -13.451  -6.204
  293   1HZ   LYS  39          1HZ       LYS  39   6.289 -12.521  -4.042
  294   2HZ   LYS  39          2HZ       LYS  39   6.290 -10.932  -4.643
  295   3HZ   LYS  39          3HZ       LYS  39   7.691 -11.889  -4.756
  296    H    GLU  40           H        GLU  40   5.752  -9.321 -11.517
  297    HA   GLU  40           HA       GLU  40   8.030  -8.415 -13.156
  298   1HB   GLU  40          2HB       GLU  40   5.202  -9.183 -13.914
  299   2HB   GLU  40          1HB       GLU  40   6.392  -8.541 -15.046
  300   1HG   GLU  40          2HG       GLU  40   7.926 -10.440 -14.342
  301   2HG   GLU  40          1HG       GLU  40   6.547 -11.129 -13.484
  302    H    LEU  41           H        LEU  41   6.663  -6.843 -10.942
  303    HA   LEU  41           HA       LEU  41   5.042  -4.819 -12.057
  304   1HB   LEU  41          2HB       LEU  41   6.023  -5.385  -9.531
  305   2HB   LEU  41          1HB       LEU  41   6.788  -3.864  -9.931
  306    HG   LEU  41           HG       LEU  41   3.813  -4.242 -10.231
  307   1HD1  LEU  41          1HD1      LEU  41   3.513  -3.415  -7.976
  308   2HD1  LEU  41          2HD1      LEU  41   5.254  -3.236  -7.762
  309   3HD1  LEU  41          3HD1      LEU  41   4.544  -4.844  -7.903
  310   1HD2  LEU  41          1HD2      LEU  41   5.360  -1.748  -9.513
  311   2HD2  LEU  41          2HD2      LEU  41   3.752  -1.876 -10.230
  312   3HD2  LEU  41          3HD2      LEU  41   5.181  -2.256 -11.194
  313    H    GLY  42           H        GLY  42   8.526  -5.280 -12.038
  314   1HA   GLY  42          2HA       GLY  42   9.403  -2.681 -12.630
  315   2HA   GLY  42          1HA       GLY  42  10.218  -4.160 -13.132
  316    H    LYS  43           H        LYS  43   7.924  -5.152 -14.658
  317    HA   LYS  43           HA       LYS  43   8.489  -3.971 -17.190
  318   1HB   LYS  43          2HB       LYS  43   6.190  -5.792 -16.424
  319   2HB   LYS  43          1HB       LYS  43   6.745  -5.452 -18.062
  320   1HG   LYS  43          2HG       LYS  43   8.700  -6.511 -16.041
  321   2HG   LYS  43          1HG       LYS  43   7.579  -7.624 -16.826
  322   1HD   LYS  43          2HD       LYS  43   8.353  -6.581 -19.045
  323   2HD   LYS  43          1HD       LYS  43   9.675  -5.873 -18.117
  324   1HE   LYS  43          2HE       LYS  43  10.603  -7.896 -18.867
  325   2HE   LYS  43          1HE       LYS  43  10.050  -8.303 -17.244
  326   1HZ   LYS  43          1HZ       LYS  43   8.440  -8.743 -19.700
  327   2HZ   LYS  43          2HZ       LYS  43   8.089  -9.290 -18.129
  328   3HZ   LYS  43          3HZ       LYS  43   9.411  -9.933 -18.981
  329    H    VAL  44           H        VAL  44   6.053  -3.400 -14.742
  330    HA   VAL  44           HA       VAL  44   4.477  -1.711 -16.543
  331    HB   VAL  44           HB       VAL  44   2.718  -1.974 -15.137
  332   1HG1  VAL  44          1HG1      VAL  44   4.291  -4.021 -13.599
  333   2HG1  VAL  44          2HG1      VAL  44   3.943  -4.277 -15.307
  334   3HG1  VAL  44          3HG1      VAL  44   2.619  -4.091 -14.157
  335   1HG2  VAL  44          1HG2      VAL  44   4.717  -1.487 -12.941
  336   2HG2  VAL  44          2HG2      VAL  44   3.123  -2.122 -12.553
  337   3HG2  VAL  44          3HG2      VAL  44   3.274  -0.561 -13.358
  338    H    MET  45           H        MET  45   6.646  -1.500 -13.772
  339    HA   MET  45           HA       MET  45   6.316   1.228 -13.151
  340   1HB   MET  45          2HB       MET  45   8.586  -0.716 -12.790
  341   2HB   MET  45          1HB       MET  45   8.782   0.984 -12.367
  342   1HG   MET  45          2HG       MET  45   6.365  -0.486 -11.371
  343   2HG   MET  45          1HG       MET  45   7.912  -0.739 -10.562
  344   1HE   MET  45          1HE       MET  45   8.651   0.195  -8.991
  345   2HE   MET  45          2HE       MET  45   7.339   0.836  -8.005
  346   3HE   MET  45          3HE       MET  45   8.665   1.891  -8.490
  347    H    ARG  46           H        ARG  46   8.425  -0.428 -15.491
  348    HA   ARG  46           HA       ARG  46   9.894   1.847 -16.318
  349   1HB   ARG  46          2HB       ARG  46  10.451   0.573 -18.333
  350   2HB   ARG  46          1HB       ARG  46  10.575  -0.455 -16.908
  351   1HG   ARG  46          2HG       ARG  46   8.259  -1.294 -17.383
  352   2HG   ARG  46          1HG       ARG  46   8.276  -0.368 -18.882
  353   1HD   ARG  46          2HD       ARG  46  10.357  -2.448 -18.176
  354   2HD   ARG  46          1HD       ARG  46   8.929  -2.793 -19.143
  355    HE   ARG  46           HE       ARG  46  10.101  -0.657 -20.413
  356   1HH1  ARG  46          2HH1      ARG  46  11.151  -3.832 -19.408
  357   2HH1  ARG  46          1HH1      ARG  46  12.316  -3.986 -20.678
  358   1HH2  ARG  46          1HH2      ARG  46  11.634  -0.882 -22.071
  359   2HH2  ARG  46          2HH2      ARG  46  12.588  -2.322 -22.183
  360    H    MET  47           H        MET  47   6.751   0.568 -17.265
  361    HA   MET  47           HA       MET  47   6.307   2.255 -19.517
  362   1HB   MET  47          2HB       MET  47   4.723   0.407 -17.866
  363   2HB   MET  47          1HB       MET  47   3.797   1.773 -18.483
  364   1HG   MET  47          2HG       MET  47   3.686  -0.018 -20.111
  365   2HG   MET  47          1HG       MET  47   4.694   1.269 -20.773
  366   1HE   MET  47          1HE       MET  47   7.590   1.059 -20.681
  367   2HE   MET  47          2HE       MET  47   6.399   0.890 -21.968
  368   3HE   MET  47          3HE       MET  47   7.702  -0.288 -21.823
  369    H    LEU  48           H        LEU  48   5.803   2.583 -16.044
  370    HA   LEU  48           HA       LEU  48   4.317   5.036 -16.155
  371   1HB   LEU  48          2HB       LEU  48   5.662   3.433 -14.032
  372   2HB   LEU  48          1HB       LEU  48   5.305   5.109 -13.692
  373    HG   LEU  48           HG       LEU  48   2.930   4.716 -13.993
  374   1HD1  LEU  48          1HD1      LEU  48   3.518   1.793 -14.471
  375   2HD1  LEU  48          2HD1      LEU  48   3.354   2.926 -15.813
  376   3HD1  LEU  48          3HD1      LEU  48   2.002   2.658 -14.714
  377   1HD2  LEU  48          1HD2      LEU  48   4.590   3.277 -12.084
  378   2HD2  LEU  48          2HD2      LEU  48   3.064   2.437 -12.361
  379   3HD2  LEU  48          3HD2      LEU  48   3.063   4.117 -11.820
  380    H    GLY  49           H        GLY  49   7.724   4.152 -15.932
  381   1HA   GLY  49          2HA       GLY  49   9.198   5.880 -17.046
  382   2HA   GLY  49          1HA       GLY  49   8.461   7.023 -15.933
  383    H    GLN  50           H        GLN  50   8.882   4.028 -14.384
  384    HA   GLN  50           HA       GLN  50  11.504   4.865 -13.289
  385   1HB   GLN  50          2HB       GLN  50   9.231   3.601 -11.737
  386   2HB   GLN  50          1HB       GLN  50  10.789   4.113 -11.087
  387   1HG   GLN  50          2HG       GLN  50   9.919   6.160 -10.737
  388   2HG   GLN  50          1HG       GLN  50   9.749   6.341 -12.482
  389   1HE2  GLN  50          1HE2      GLN  50   7.635   6.624 -13.210
  390   2HE2  GLN  50          2HE2      GLN  50   6.246   6.182 -12.340
  391    H    ASN  51           H        ASN  51  12.819   3.137 -12.412
  392    HA   ASN  51           HA       ASN  51  12.066   0.396 -13.089
  393   1HB   ASN  51          2HB       ASN  51  13.269   1.622 -15.090
  394   2HB   ASN  51          1HB       ASN  51  14.719   1.320 -14.134
  395   1HD2  ASN  51          1HD2      ASN  51  13.093  -0.008 -16.638
  396   2HD2  ASN  51          2HD2      ASN  51  13.377  -1.657 -16.350
  397    HA   PRO  52           HA       PRO  52  14.647   0.639  -9.300
  398   1HB   PRO  52          2HB       PRO  52  12.881  -0.695  -7.693
  399   2HB   PRO  52          1HB       PRO  52  12.807   1.047  -7.995
  400   1HG   PRO  52          2HG       PRO  52  11.061  -1.108  -8.999
  401   2HG   PRO  52          1HG       PRO  52  10.718   0.615  -8.793
  402   1HD   PRO  52          2HD       PRO  52  11.353  -0.732 -11.233
  403   2HD   PRO  52          1HD       PRO  52  11.166   1.021 -10.992
  404    H    THR  53           H        THR  53  14.551  -1.533  -7.552
  405    HA   THR  53           HA       THR  53  15.550  -3.741  -9.244
  406    HB   THR  53           HB       THR  53  17.034  -4.309  -7.537
  407    HG1  THR  53           HG1      THR  53  15.728  -2.777  -5.588
  408   1HG2  THR  53          1HG2      THR  53  18.112  -2.296  -6.762
  409   2HG2  THR  53          2HG2      THR  53  16.632  -1.365  -6.986
  410   3HG2  THR  53          3HG2      THR  53  17.497  -1.999  -8.387
  411    HA   PRO  54           HA       PRO  54  12.391  -6.451  -7.776
  412   1HB   PRO  54          2HB       PRO  54  13.681  -8.711  -6.917
  413   2HB   PRO  54          1HB       PRO  54  13.483  -8.264  -8.619
  414   1HG   PRO  54          2HG       PRO  54  15.893  -8.101  -6.897
  415   2HG   PRO  54          1HG       PRO  54  15.769  -8.334  -8.646
  416   1HD   PRO  54          2HD       PRO  54  16.418  -5.926  -7.354
  417   2HD   PRO  54          1HD       PRO  54  15.915  -6.083  -9.052
  418    H    GLU  55           H        GLU  55  14.960  -5.888  -5.443
  419    HA   GLU  55           HA       GLU  55  13.391  -6.783  -3.169
  420   1HB   GLU  55          2HB       GLU  55  15.264  -5.905  -1.808
  421   2HB   GLU  55          1HB       GLU  55  15.818  -7.017  -3.055
  422   1HG   GLU  55          2HG       GLU  55  16.692  -5.275  -4.390
  423   2HG   GLU  55          1HG       GLU  55  15.759  -4.040  -3.546
  424    H    GLU  56           H        GLU  56  14.095  -3.769  -4.844
  425    HA   GLU  56           HA       GLU  56  13.051  -2.048  -2.784
  426   1HB   GLU  56          2HB       GLU  56  13.970  -1.695  -5.604
  427   2HB   GLU  56          1HB       GLU  56  12.937  -0.451  -4.901
  428   1HG   GLU  56          2HG       GLU  56  14.547  -0.478  -2.896
  429   2HG   GLU  56          1HG       GLU  56  15.641  -1.391  -3.935
  430    H    LEU  57           H        LEU  57  11.790  -3.416  -5.824
  431    HA   LEU  57           HA       LEU  57   9.274  -2.067  -5.650
  432   1HB   LEU  57          2HB       LEU  57   8.565  -3.493  -7.450
  433   2HB   LEU  57          1HB       LEU  57  10.169  -2.889  -7.777
  434    HG   LEU  57           HG       LEU  57  10.886  -5.229  -6.736
  435   1HD1  LEU  57          1HD1      LEU  57   7.980  -5.488  -7.378
  436   2HD1  LEU  57          2HD1      LEU  57   8.931  -6.311  -6.143
  437   3HD1  LEU  57          3HD1      LEU  57   9.032  -6.830  -7.825
  438   1HD2  LEU  57          1HD2      LEU  57  10.930  -6.115  -9.027
  439   2HD2  LEU  57          2HD2      LEU  57  11.332  -4.398  -9.041
  440   3HD2  LEU  57          3HD2      LEU  57   9.722  -4.931  -9.525
  441    H    GLN  58           H        GLN  58  10.528  -5.109  -4.408
  442    HA   GLN  58           HA       GLN  58   8.088  -6.402  -3.855
  443   1HB   GLN  58          2HB       GLN  58  10.882  -6.770  -3.126
  444   2HB   GLN  58          1HB       GLN  58   9.798  -7.173  -1.797
  445   1HG   GLN  58          2HG       GLN  58   9.495  -8.219  -4.627
  446   2HG   GLN  58          1HG       GLN  58  10.243  -9.117  -3.306
  447   1HE2  GLN  58          1HE2      GLN  58   7.192  -8.146  -4.702
  448   2HE2  GLN  58          2HE2      GLN  58   6.198  -8.901  -3.554
  449    H    GLU  59           H        GLU  59  10.124  -4.378  -1.704
  450    HA   GLU  59           HA       GLU  59   8.414  -4.443   0.525
  451   1HB   GLU  59          2HB       GLU  59   9.583  -2.417   1.288
  452   2HB   GLU  59          1HB       GLU  59  10.716  -3.620   0.674
  453   1HG   GLU  59          2HG       GLU  59  11.106  -2.422  -1.316
  454   2HG   GLU  59          1HG       GLU  59   9.645  -1.454  -1.128
  455    H    MET  60           H        MET  60   8.302  -2.486  -2.399
  456    HA   MET  60           HA       MET  60   6.402  -0.567  -1.456
  457   1HB   MET  60          2HB       MET  60   6.906  -1.461  -4.307
  458   2HB   MET  60          1HB       MET  60   6.088   0.017  -3.803
  459   1HG   MET  60          2HG       MET  60   8.774  -0.376  -2.635
  460   2HG   MET  60          1HG       MET  60   8.751  -0.133  -4.380
  461   1HE   MET  60          1HE       MET  60   9.520   2.647  -4.794
  462   2HE   MET  60          2HE       MET  60  10.281   1.550  -3.644
  463   3HE   MET  60          3HE       MET  60   9.880   3.194  -3.151
  464    H    ILE  61           H        ILE  61   6.203  -3.614  -3.217
  465    HA   ILE  61           HA       ILE  61   3.398  -3.633  -3.640
  466    HB   ILE  61           HB       ILE  61   5.337  -5.951  -3.395
  467   1HG1  ILE  61          2HG1      ILE  61   4.138  -4.997  -5.965
  468   2HG1  ILE  61          1HG1      ILE  61   5.446  -4.044  -5.262
  469   1HG2  ILE  61          1HG2      ILE  61   2.526  -5.853  -4.542
  470   2HG2  ILE  61          2HG2      ILE  61   2.980  -6.636  -3.028
  471   3HG2  ILE  61          3HG2      ILE  61   3.600  -7.252  -4.559
  472   1HD1  ILE  61          1HD1      ILE  61   5.723  -7.029  -5.517
  473   2HD1  ILE  61          2HD1      ILE  61   6.986  -5.804  -5.418
  474   3HD1  ILE  61          3HD1      ILE  61   6.050  -5.986  -6.901
  475    H    ASP  62           H        ASP  62   5.428  -5.122  -1.108
  476    HA   ASP  62           HA       ASP  62   3.436  -6.369   0.387
  477   1HB   ASP  62          2HB       ASP  62   6.080  -5.152   1.142
  478   2HB   ASP  62          1HB       ASP  62   5.016  -5.818   2.381
  479    H    GLU  63           H        GLU  63   4.347  -2.964   0.274
  480    HA   GLU  63           HA       GLU  63   2.784  -2.191   2.569
  481   1HB   GLU  63          2HB       GLU  63   4.284  -0.734   0.422
  482   2HB   GLU  63          1HB       GLU  63   3.113   0.148   1.401
  483   1HG   GLU  63          2HG       GLU  63   4.258  -0.540   3.451
  484   2HG   GLU  63          1HG       GLU  63   5.394  -1.511   2.514
  485    H    VAL  64           H        VAL  64   2.408  -1.550  -0.943
  486    HA   VAL  64           HA       VAL  64  -0.196  -0.459  -0.718
  487    HB   VAL  64           HB       VAL  64   1.241  -0.023  -2.661
  488   1HG1  VAL  64          1HG1      VAL  64   1.816  -1.660  -4.258
  489   2HG1  VAL  64          2HG1      VAL  64   0.616  -2.802  -3.653
  490   3HG1  VAL  64          3HG1      VAL  64   2.072  -2.471  -2.714
  491   1HG2  VAL  64          1HG2      VAL  64  -1.044  -1.470  -3.900
  492   2HG2  VAL  64          2HG2      VAL  64  -0.533   0.206  -4.096
  493   3HG2  VAL  64          3HG2      VAL  64  -1.448  -0.277  -2.668
  494    H    ASP  65           H        ASP  65   0.912  -3.765  -1.434
  495    HA   ASP  65           HA       ASP  65  -1.724  -4.791  -1.916
  496   1HB   ASP  65          2HB       ASP  65   0.858  -5.750  -2.306
  497   2HB   ASP  65          1HB       ASP  65   0.227  -6.771  -1.016
  498    H    GLU  66           H        GLU  66  -3.126  -4.487  -0.279
  499    HA   GLU  66           HA       GLU  66  -2.534  -4.620   2.479
  500   1HB   GLU  66          2HB       GLU  66  -5.012  -4.854   2.779
  501   2HB   GLU  66          1HB       GLU  66  -4.535  -3.490   1.771
  502   1HG   GLU  66          2HG       GLU  66  -5.183  -4.594  -0.227
  503   2HG   GLU  66          1HG       GLU  66  -5.244  -6.168   0.564
  504    H    ASP  67           H        ASP  67  -3.513  -7.092   0.174
  505    HA   ASP  67           HA       ASP  67  -3.749  -9.097   2.292
  506   1HB   ASP  67          2HB       ASP  67  -4.354 -10.629   0.362
  507   2HB   ASP  67          1HB       ASP  67  -5.467  -9.296   0.656
  508    H    GLY  68           H        GLY  68  -1.637  -8.224  -0.395
  509   1HA   GLY  68          2HA       GLY  68   0.559  -8.808  -0.814
  510   2HA   GLY  68          1HA       GLY  68   0.582  -9.637   0.740
  511    H    SER  69           H        SER  69  -1.401 -10.101  -2.178
  512    HA   SER  69           HA       SER  69  -1.016 -12.977  -2.035
  513   1HB   SER  69          2HB       SER  69  -2.574 -13.012  -3.984
  514   2HB   SER  69          1HB       SER  69  -3.232 -12.177  -2.580
  515    HG   SER  69           HG       SER  69  -3.092 -11.213  -4.951
  516    H    GLY  70           H        GLY  70   0.837 -10.539  -3.352
  517   1HA   GLY  70          2HA       GLY  70   2.704 -10.706  -4.725
  518   2HA   GLY  70          1HA       GLY  70   2.261 -12.375  -5.078
  519    H    THR  71           H        THR  71  -0.190  -9.951  -5.404
  520    HA   THR  71           HA       THR  71   0.251  -9.609  -8.276
  521    HB   THR  71           HB       THR  71  -1.964 -10.365  -8.889
  522    HG1  THR  71           HG1      THR  71  -3.364 -11.180  -7.330
  523   1HG2  THR  71          1HG2      THR  71  -0.208 -12.094  -8.766
  524   2HG2  THR  71          2HG2      THR  71  -1.786 -12.765  -8.355
  525   3HG2  THR  71          3HG2      THR  71  -0.625 -12.397  -7.079
  526    H    VAL  72           H        VAL  72  -0.149  -7.555  -8.821
  527    HA   VAL  72           HA       VAL  72  -1.460  -5.809  -6.876
  528    HB   VAL  72           HB       VAL  72  -0.392  -4.912  -9.544
  529   1HG1  VAL  72          1HG1      VAL  72  -1.757  -3.412  -8.007
  530   2HG1  VAL  72          2HG1      VAL  72  -0.161  -2.799  -8.439
  531   3HG1  VAL  72          3HG1      VAL  72  -0.427  -3.526  -6.855
  532   1HG2  VAL  72          1HG2      VAL  72   1.778  -4.489  -8.396
  533   2HG2  VAL  72          2HG2      VAL  72   1.415  -6.211  -8.515
  534   3HG2  VAL  72          3HG2      VAL  72   1.178  -5.363  -6.987
  535    H    ASP  73           H        ASP  73  -3.572  -5.515  -6.951
  536    HA   ASP  73           HA       ASP  73  -5.121  -6.102  -9.343
  537   1HB   ASP  73          2HB       ASP  73  -5.900  -5.059  -6.602
  538   2HB   ASP  73          1HB       ASP  73  -7.055  -5.351  -7.903
  539    H    PHE  74           H        PHE  74  -6.723  -4.391 -10.143
  540    HA   PHE  74           HA       PHE  74  -5.320  -2.103 -10.967
  541   1HB   PHE  74          2HB       PHE  74  -7.425  -3.079 -12.035
  542   2HB   PHE  74          1HB       PHE  74  -8.331  -2.191 -10.808
  543    HD1  PHE  74           HD1      PHE  74  -5.210  -1.335 -12.686
  544    HD2  PHE  74           HD2      PHE  74  -9.306  -0.340 -11.874
  545    HE1  PHE  74           HE1      PHE  74  -4.973   0.734 -14.023
  546    HE2  PHE  74           HE2      PHE  74  -9.067   1.732 -13.212
  547    HZ   PHE  74           HZ       PHE  74  -6.901   2.268 -14.288
  548    H    ASP  75           H        ASP  75  -7.371  -2.655  -8.161
  549    HA   ASP  75           HA       ASP  75  -7.630   0.074  -7.363
  550   1HB   ASP  75          2HB       ASP  75  -7.754  -2.471  -5.717
  551   2HB   ASP  75          1HB       ASP  75  -8.215  -0.872  -5.135
  552    H    GLU  76           H        GLU  76  -5.340  -2.525  -6.585
  553    HA   GLU  76           HA       GLU  76  -3.778  -0.954  -4.748
  554   1HB   GLU  76          2HB       GLU  76  -3.000  -3.492  -6.211
  555   2HB   GLU  76          1HB       GLU  76  -2.214  -2.821  -4.783
  556   1HG   GLU  76          2HG       GLU  76  -4.247  -3.145  -3.463
  557   2HG   GLU  76          1HG       GLU  76  -5.116  -3.708  -4.889
  558    H    PHE  77           H        PHE  77  -3.762  -1.568  -8.190
  559    HA   PHE  77           HA       PHE  77  -1.142  -0.730  -8.829
  560   1HB   PHE  77          2HB       PHE  77  -3.111  -1.858 -10.257
  561   2HB   PHE  77          1HB       PHE  77  -3.386  -0.187 -10.721
  562    HD1  PHE  77           HD1      PHE  77  -2.860  -0.970 -13.034
  563    HD2  PHE  77           HD2      PHE  77   0.080  -1.027  -9.890
  564    HE1  PHE  77           HE1      PHE  77  -1.053  -1.144 -14.712
  565    HE2  PHE  77           HE2      PHE  77   1.875  -1.191 -11.578
  566    HZ   PHE  77           HZ       PHE  77   1.313  -1.255 -13.992
  567    H    LEU  78           H        LEU  78  -4.249   1.027  -8.936
  568    HA   LEU  78           HA       LEU  78  -3.071   3.557  -9.576
  569   1HB   LEU  78          2HB       LEU  78  -5.776   2.615  -8.738
  570   2HB   LEU  78          1HB       LEU  78  -5.411   4.326  -8.604
  571    HG   LEU  78           HG       LEU  78  -5.104   4.530 -10.969
  572   1HD1  LEU  78          1HD1      LEU  78  -3.862   2.359 -11.223
  573   2HD1  LEU  78          2HD1      LEU  78  -5.052   2.654 -12.489
  574   3HD1  LEU  78          3HD1      LEU  78  -5.416   1.526 -11.183
  575   1HD2  LEU  78          1HD2      LEU  78  -7.445   4.455 -10.261
  576   2HD2  LEU  78          2HD2      LEU  78  -7.443   2.694 -10.370
  577   3HD2  LEU  78          3HD2      LEU  78  -7.278   3.668 -11.831
  578    H    VAL  79           H        VAL  79  -3.885   1.900  -6.578
  579    HA   VAL  79           HA       VAL  79  -3.741   4.091  -4.802
  580    HB   VAL  79           HB       VAL  79  -3.571   1.129  -4.569
  581   1HG1  VAL  79          1HG1      VAL  79  -1.629   1.790  -3.233
  582   2HG1  VAL  79          2HG1      VAL  79  -2.943   1.275  -2.173
  583   3HG1  VAL  79          3HG1      VAL  79  -2.599   2.993  -2.382
  584   1HG2  VAL  79          1HG2      VAL  79  -5.395   1.455  -3.079
  585   2HG2  VAL  79          2HG2      VAL  79  -5.640   2.637  -4.364
  586   3HG2  VAL  79          3HG2      VAL  79  -4.976   3.148  -2.812
  587    H    MET  80           H        MET  80  -1.256   1.812  -5.934
  588    HA   MET  80           HA       MET  80   0.942   2.608  -4.464
  589   1HB   MET  80          2HB       MET  80   0.518   0.986  -6.687
  590   2HB   MET  80          1HB       MET  80   1.651   2.209  -7.261
  591   1HG   MET  80          2HG       MET  80   3.015   1.764  -5.162
  592   2HG   MET  80          1HG       MET  80   1.971   0.372  -4.879
  593   1HE   MET  80          1HE       MET  80   1.366  -1.197  -6.386
  594   2HE   MET  80          2HE       MET  80   2.802  -2.197  -6.175
  595   3HE   MET  80          3HE       MET  80   2.236  -1.810  -7.798
  596    H    MET  81           H        MET  81  -0.639   4.334  -7.078
  597    HA   MET  81           HA       MET  81   1.448   6.116  -7.780
  598   1HB   MET  81          2HB       MET  81  -0.846   5.676  -8.937
  599   2HB   MET  81          1HB       MET  81  -1.453   6.907  -7.831
  600   1HG   MET  81          2HG       MET  81   0.750   8.180  -8.727
  601   2HG   MET  81          1HG       MET  81   0.403   7.181 -10.139
  602   1HE   MET  81          1HE       MET  81  -2.462   6.645  -9.941
  603   2HE   MET  81          2HE       MET  81  -2.018   7.308 -11.512
  604   3HE   MET  81          3HE       MET  81  -3.412   7.957 -10.652
  605    H    VAL  82           H        VAL  82  -1.341   6.555  -5.588
  606    HA   VAL  82           HA       VAL  82  -0.446   9.092  -4.604
  607    HB   VAL  82           HB       VAL  82  -2.207   8.819  -2.892
  608   1HG1  VAL  82          1HG1      VAL  82  -2.860   9.699  -5.053
  609   2HG1  VAL  82          2HG1      VAL  82  -4.118   8.592  -4.504
  610   3HG1  VAL  82          3HG1      VAL  82  -2.961   8.074  -5.730
  611   1HG2  VAL  82          1HG2      VAL  82  -2.785   6.145  -4.187
  612   2HG2  VAL  82          2HG2      VAL  82  -3.522   6.827  -2.735
  613   3HG2  VAL  82          3HG2      VAL  82  -1.839   6.299  -2.705
  614    H    ARG  83           H        ARG  83   0.052   5.760  -3.622
  615    HA   ARG  83           HA       ARG  83   0.911   6.107  -0.981
  616   1HB   ARG  83          2HB       ARG  83   1.937   4.121  -3.030
  617   2HB   ARG  83          1HB       ARG  83   2.190   4.013  -1.288
  618   1HG   ARG  83          2HG       ARG  83  -0.598   4.410  -1.706
  619   2HG   ARG  83          1HG       ARG  83  -0.080   3.145  -2.818
  620   1HD   ARG  83          2HD       ARG  83   0.243   1.665  -1.147
  621   2HD   ARG  83          1HD       ARG  83   1.108   2.844  -0.168
  622    HE   ARG  83           HE       ARG  83  -1.642   3.477  -0.114
  623   1HH1  ARG  83          2HH1      ARG  83   0.575   1.010   0.975
  624   2HH1  ARG  83          1HH1      ARG  83  -0.377   0.587   2.355
  625   1HH2  ARG  83          1HH2      ARG  83  -2.872   2.913   1.704
  626   2HH2  ARG  83          2HH2      ARG  83  -2.324   1.661   2.769
  627    H    CYS  84           H        CYS  84   2.672   6.440  -4.039
  628    HA   CYS  84           HA       CYS  84   5.267   6.804  -2.976
  629   1HB   CYS  84          2HB       CYS  84   4.430   6.552  -5.472
  630   2HB   CYS  84          1HB       CYS  84   4.407   8.314  -5.415
  631    HG   CYS  84           HG       CYS  84   6.980   8.197  -4.700
  632    H    MET  85           H        MET  85   2.592   9.041  -3.550
  633    HA   MET  85           HA       MET  85   4.019  11.435  -2.934
  634   1HB   MET  85          2HB       MET  85   1.759  11.181  -4.169
  635   2HB   MET  85          1HB       MET  85   1.049  11.089  -2.557
  636   1HG   MET  85          2HG       MET  85   1.598  13.282  -2.037
  637   2HG   MET  85          1HG       MET  85   2.969  13.313  -3.146
  638   1HE   MET  85          1HE       MET  85  -0.697  12.319  -3.195
  639   2HE   MET  85          2HE       MET  85  -1.482  13.483  -4.259
  640   3HE   MET  85          3HE       MET  85  -0.866  14.006  -2.693
  641    H    LYS  86           H        LYS  86   1.745   9.407  -1.043
  642    HA   LYS  86           HA       LYS  86   3.127  10.205   1.415
  643   1HB   LYS  86          2HB       LYS  86   1.246  11.860   0.997
  644   2HB   LYS  86          1HB       LYS  86   0.128  10.513   1.208
  645   1HG   LYS  86          2HG       LYS  86   1.861  10.296   3.386
  646   2HG   LYS  86          1HG       LYS  86   1.592  12.032   3.226
  647   1HD   LYS  86          2HD       LYS  86  -0.827  10.346   2.937
  648   2HD   LYS  86          1HD       LYS  86  -0.104  10.360   4.546
  649   1HE   LYS  86          2HE       LYS  86  -0.002  13.003   3.997
  650   2HE   LYS  86          1HE       LYS  86  -1.416  12.564   3.039
  651   1HZ   LYS  86          1HZ       LYS  86  -2.412  11.575   4.985
  652   2HZ   LYS  86          2HZ       LYS  86  -1.994  13.188   5.315
  653   3HZ   LYS  86          3HZ       LYS  86  -1.035  11.920   5.914
  654    H    ASP  87           H        ASP  87   3.683   8.251   2.148
  655    HA   ASP  87           HA       ASP  87   1.703   6.440   3.126
  656   1HB   ASP  87          2HB       ASP  87   1.750   5.895   0.635
  657   2HB   ASP  87          1HB       ASP  87   3.394   5.311   0.888
  658    H    ASP  88           H        ASP  88   3.870   7.838   4.254
  659    HA   ASP  88           HA       ASP  88   5.641   7.569   5.681
  660   1HB   ASP  88          2HB       ASP  88   4.551   4.752   5.644
  661   2HB   ASP  88          1HB       ASP  88   5.925   5.220   6.646
  662    H    SER  89           HN       SER  89   7.398   8.080   4.460
  663    HA   SER  89           HA       SER  89   8.519   6.435   2.436
  664   1HB   SER  89          2HB       SER  89   8.913   8.942   2.813
  665   2HB   SER  89          1HB       SER  89  10.082   8.459   4.039
  666    HG   SER  89           HG       SER  89  11.293   8.485   2.263
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -10.465   6.591   9.318
    2   2H    MET   1          2H        MET   1  -8.933   6.804  10.024
    3   3H    MET   1          3H        MET   1  -9.903   5.485  10.475
    4    HA   MET   1           HA       MET   1  -8.151   4.754   8.997
    5   1HB   MET   1          2HB       MET   1 -10.655   3.932   8.907
    6   2HB   MET   1          1HB       MET   1 -10.651   4.725   7.331
    7   1HG   MET   1          2HG       MET   1  -9.036   3.279   6.458
    8   2HG   MET   1          1HG       MET   1  -8.413   2.852   8.051
    9   1HE   MET   1          1HE       MET   1  -8.253   0.905   6.694
   10   2HE   MET   1          2HE       MET   1  -9.568   0.032   5.912
   11   3HE   MET   1          3HE       MET   1  -9.086  -0.398   7.551
   12    H    ASN   2           H        ASN   2  -7.365   4.735   6.744
   13    HA   ASN   2           HA       ASN   2  -6.864   7.392   5.794
   14   1HB   ASN   2          2HB       ASN   2  -6.176   4.649   4.737
   15   2HB   ASN   2          1HB       ASN   2  -5.773   6.120   3.851
   16   1HD2  ASN   2          1HD2      ASN   2  -4.581   7.844   5.319
   17   2HD2  ASN   2          2HD2      ASN   2  -3.409   7.223   6.377
   18    H    ASP   3           H        ASP   3  -8.673   8.418   5.085
   19    HA   ASP   3           HA       ASP   3 -10.393   7.103   3.101
   20   1HB   ASP   3          2HB       ASP   3 -10.723   9.803   4.431
   21   2HB   ASP   3          1HB       ASP   3 -11.913   8.983   3.420
   22    H    ILE   4           H        ILE   4  -8.211   9.834   3.478
   23    HA   ILE   4           HA       ILE   4  -8.649  11.180   1.080
   24    HB   ILE   4           HB       ILE   4  -6.467  12.160   1.302
   25   1HG1  ILE   4          2HG1      ILE   4  -5.270   9.961   1.737
   26   2HG1  ILE   4          1HG1      ILE   4  -4.724  11.315   2.716
   27   1HG2  ILE   4          1HG2      ILE   4  -6.582  12.998   3.575
   28   2HG2  ILE   4          2HG2      ILE   4  -7.551  11.614   4.077
   29   3HG2  ILE   4          3HG2      ILE   4  -8.220  12.796   2.954
   30   1HD1  ILE   4          1HD1      ILE   4  -6.454  10.448   4.465
   31   2HD1  ILE   4          2HD1      ILE   4  -4.927   9.586   4.288
   32   3HD1  ILE   4          3HD1      ILE   4  -6.391   8.947   3.540
   33    H    TYR   5           H        TYR   5  -6.873   8.207   1.657
   34    HA   TYR   5           HA       TYR   5  -5.405   8.057  -0.746
   35   1HB   TYR   5          2HB       TYR   5  -6.504   5.977   1.133
   36   2HB   TYR   5          1HB       TYR   5  -5.715   5.498  -0.369
   37    HD1  TYR   5           HD1      TYR   5  -3.395   5.220  -0.382
   38    HD2  TYR   5           HD2      TYR   5  -5.190   7.768   2.571
   39    HE1  TYR   5           HE1      TYR   5  -1.181   5.547   0.686
   40    HE2  TYR   5           HE2      TYR   5  -2.984   8.099   3.635
   41    HH   TYR   5           HH       TYR   5  -0.642   6.414   3.567
   42    H    LYS   6           H        LYS   6  -8.658   6.862   0.070
   43    HA   LYS   6           HA       LYS   6  -9.196   5.936  -2.611
   44   1HB   LYS   6          2HB       LYS   6 -11.025   6.332  -0.232
   45   2HB   LYS   6          1HB       LYS   6 -11.505   5.580  -1.753
   46   1HG   LYS   6          2HG       LYS   6  -9.508   3.986  -1.385
   47   2HG   LYS   6          1HG       LYS   6  -9.499   4.585   0.273
   48   1HD   LYS   6          2HD       LYS   6 -12.004   3.502  -1.029
   49   2HD   LYS   6          1HD       LYS   6 -10.876   2.464  -0.158
   50   1HE   LYS   6          2HE       LYS   6 -12.104   4.951   1.060
   51   2HE   LYS   6          1HE       LYS   6 -12.814   3.346   1.229
   52   1HZ   LYS   6          1HZ       LYS   6 -10.209   4.318   2.235
   53   2HZ   LYS   6          2HZ       LYS   6 -10.528   2.658   2.065
   54   3HZ   LYS   6          3HZ       LYS   6 -11.480   3.606   3.104
   55    H    ALA   7           H        ALA   7  -9.673   8.900  -0.817
   56    HA   ALA   7           HA       ALA   7 -11.681  10.039  -2.498
   57   1HB   ALA   7          1HB       ALA   7 -10.919  10.753  -0.106
   58   2HB   ALA   7          2HB       ALA   7 -11.421  11.993  -1.254
   59   3HB   ALA   7          3HB       ALA   7  -9.705  11.701  -0.966
   60    H    ALA   8           H        ALA   8  -8.188   9.824  -2.673
   61    HA   ALA   8           HA       ALA   8  -7.915  11.887  -4.686
   62   1HB   ALA   8          1HB       ALA   8  -6.068  11.427  -3.133
   63   2HB   ALA   8          2HB       ALA   8  -5.571  11.153  -4.803
   64   3HB   ALA   8          3HB       ALA   8  -5.947   9.782  -3.758
   65    H    VAL   9           H        VAL   9  -7.811   8.322  -4.620
   66    HA   VAL   9           HA       VAL   9  -7.270   7.983  -7.382
   67    HB   VAL   9           HB       VAL   9  -6.984   6.208  -5.633
   68   1HG1  VAL   9          1HG1      VAL   9  -8.978   4.859  -5.046
   69   2HG1  VAL   9          2HG1      VAL   9 -10.002   6.021  -5.886
   70   3HG1  VAL   9          3HG1      VAL   9  -9.109   6.511  -4.447
   71   1HG2  VAL   9          1HG2      VAL   9  -7.253   5.878  -8.212
   72   2HG2  VAL   9          2HG2      VAL   9  -8.823   5.191  -7.792
   73   3HG2  VAL   9          3HG2      VAL   9  -7.345   4.464  -7.163
   74    H    GLU  10           H        GLU  10 -10.233   8.653  -5.645
   75    HA   GLU  10           HA       GLU  10 -11.947   7.890  -7.853
   76   1HB   GLU  10          2HB       GLU  10 -13.777   8.638  -6.485
   77   2HB   GLU  10          1HB       GLU  10 -12.663   7.738  -5.457
   78   1HG   GLU  10          2HG       GLU  10 -11.805   9.710  -4.463
   79   2HG   GLU  10          1HG       GLU  10 -12.492  10.744  -5.715
   80    H    GLN  11           H        GLN  11 -10.170  10.730  -6.937
   81    HA   GLN  11           HA       GLN  11 -11.765  12.335  -8.845
   82   1HB   GLN  11          2HB       GLN  11 -11.120  14.318  -7.655
   83   2HB   GLN  11          1HB       GLN  11 -11.736  13.157  -6.480
   84   1HG   GLN  11          2HG       GLN  11  -9.409  12.487  -5.942
   85   2HG   GLN  11          1HG       GLN  11  -8.808  13.680  -7.091
   86   1HE2  GLN  11          1HE2      GLN  11 -11.064  13.561  -4.259
   87   2HE2  GLN  11          2HE2      GLN  11 -10.572  15.060  -3.634
   88    H    LEU  12           H        LEU  12  -9.101  10.561  -9.055
   89    HA   LEU  12           HA       LEU  12  -7.159  12.476  -9.985
   90   1HB   LEU  12          2HB       LEU  12  -6.145  10.339 -11.069
   91   2HB   LEU  12          1HB       LEU  12  -6.083  10.558  -9.338
   92    HG   LEU  12           HG       LEU  12  -7.888   8.977  -9.024
   93   1HD1  LEU  12          1HD1      LEU  12  -8.024   9.047 -12.043
   94   2HD1  LEU  12          2HD1      LEU  12  -9.319   9.369 -10.890
   95   3HD1  LEU  12          3HD1      LEU  12  -8.716   7.726 -11.101
   96   1HD2  LEU  12          1HD2      LEU  12  -6.803   6.964 -10.261
   97   2HD2  LEU  12          2HD2      LEU  12  -5.814   7.861  -9.110
   98   3HD2  LEU  12          3HD2      LEU  12  -5.629   8.147 -10.839
   99    H    THR  13           H        THR  13  -6.214  12.095 -12.302
  100    HA   THR  13           HA       THR  13  -8.362  12.723 -14.157
  101    HB   THR  13           HB       THR  13  -6.129  12.653 -15.713
  102    HG1  THR  13           HG1      THR  13  -4.643  12.200 -14.225
  103   1HG2  THR  13          1HG2      THR  13  -7.234  14.645 -15.822
  104   2HG2  THR  13          2HG2      THR  13  -5.928  15.155 -14.754
  105   3HG2  THR  13          3HG2      THR  13  -7.498  14.720 -14.080
  106    H    ASP  14           H        ASP  14  -8.351  11.755 -16.348
  107    HA   ASP  14           HA       ASP  14  -8.652   8.921 -16.216
  108   1HB   ASP  14          2HB       ASP  14  -9.587  10.847 -17.909
  109   2HB   ASP  14          1HB       ASP  14  -8.314  10.122 -18.893
  110    H    GLU  15           H        GLU  15  -6.095  11.096 -17.253
  111    HA   GLU  15           HA       GLU  15  -4.485   9.220 -18.657
  112   1HB   GLU  15          2HB       GLU  15  -3.930  11.852 -17.311
  113   2HB   GLU  15          1HB       GLU  15  -2.604  10.876 -17.944
  114   1HG   GLU  15          2HG       GLU  15  -3.240  11.179 -20.135
  115   2HG   GLU  15          1HG       GLU  15  -4.953  11.293 -19.733
  116    H    GLN  16           H        GLN  16  -4.762  10.092 -15.245
  117    HA   GLN  16           HA       GLN  16  -2.472   8.679 -14.316
  118   1HB   GLN  16          2HB       GLN  16  -4.518  10.263 -13.158
  119   2HB   GLN  16          1HB       GLN  16  -4.568   8.700 -12.341
  120   1HG   GLN  16          2HG       GLN  16  -1.938   8.998 -12.296
  121   2HG   GLN  16          1HG       GLN  16  -2.346  10.707 -12.457
  122   1HE2  GLN  16          1HE2      GLN  16  -3.902  11.592 -10.767
  123   2HE2  GLN  16          2HE2      GLN  16  -3.882  10.899  -9.217
  124    H    LYS  17           H        LYS  17  -5.909   7.832 -14.624
  125    HA   LYS  17           HA       LYS  17  -5.699   5.207 -13.540
  126   1HB   LYS  17          2HB       LYS  17  -7.719   6.313 -15.512
  127   2HB   LYS  17          1HB       LYS  17  -7.883   4.805 -14.614
  128   1HG   LYS  17          2HG       LYS  17  -8.190   5.895 -12.572
  129   2HG   LYS  17          1HG       LYS  17  -7.382   7.364 -13.122
  130   1HD   LYS  17          2HD       LYS  17  -9.565   8.091 -13.264
  131   2HD   LYS  17          1HD       LYS  17  -9.414   7.370 -14.865
  132   1HE   LYS  17          2HE       LYS  17 -10.154   5.171 -13.552
  133   2HE   LYS  17          1HE       LYS  17 -10.868   6.355 -12.457
  134   1HZ   LYS  17          1HZ       LYS  17 -12.048   7.330 -14.309
  135   2HZ   LYS  17          2HZ       LYS  17 -12.408   5.673 -14.204
  136   3HZ   LYS  17          3HZ       LYS  17 -11.330   6.236 -15.389
  137    H    ASN  18           H        ASN  18  -5.532   6.514 -16.839
  138    HA   ASN  18           HA       ASN  18  -5.330   4.005 -18.168
  139   1HB   ASN  18          2HB       ASN  18  -4.681   6.837 -18.946
  140   2HB   ASN  18          1HB       ASN  18  -4.241   5.495 -20.002
  141   1HD2  ASN  18          1HD2      ASN  18  -6.414   7.677 -20.241
  142   2HD2  ASN  18          2HD2      ASN  18  -7.832   6.800 -20.557
  143    H    GLU  19           H        GLU  19  -2.955   6.133 -16.667
  144    HA   GLU  19           HA       GLU  19  -0.595   5.164 -17.805
  145   1HB   GLU  19          2HB       GLU  19  -0.716   7.105 -16.240
  146   2HB   GLU  19          1HB       GLU  19  -0.977   5.976 -14.910
  147   1HG   GLU  19          2HG       GLU  19   1.179   5.005 -15.167
  148   2HG   GLU  19          1HG       GLU  19   1.411   5.745 -16.750
  149    H    PHE  20           H        PHE  20  -2.389   3.975 -14.966
  150    HA   PHE  20           HA       PHE  20  -0.602   1.704 -14.651
  151   1HB   PHE  20          2HB       PHE  20  -3.055   2.676 -13.208
  152   2HB   PHE  20          1HB       PHE  20  -2.388   1.076 -12.900
  153    HD1  PHE  20           HD1      PHE  20  -2.004   4.645 -12.357
  154    HD2  PHE  20           HD2      PHE  20  -0.005   0.854 -12.108
  155    HE1  PHE  20           HE1      PHE  20  -0.314   5.636 -10.844
  156    HE2  PHE  20           HE2      PHE  20   1.682   1.841 -10.585
  157    HZ   PHE  20           HZ       PHE  20   1.530   4.237  -9.955
  158    H    LYS  21           H        LYS  21  -4.022   2.242 -15.521
  159    HA   LYS  21           HA       LYS  21  -4.820  -0.393 -15.887
  160   1HB   LYS  21          2HB       LYS  21  -6.343   1.558 -15.940
  161   2HB   LYS  21          1HB       LYS  21  -5.715   1.983 -17.532
  162   1HG   LYS  21          2HG       LYS  21  -6.562  -0.827 -17.315
  163   2HG   LYS  21          1HG       LYS  21  -7.875   0.327 -17.071
  164   1HD   LYS  21          2HD       LYS  21  -7.037   1.500 -19.191
  165   2HD   LYS  21          1HD       LYS  21  -6.060   0.058 -19.473
  166   1HE   LYS  21          2HE       LYS  21  -8.497  -1.056 -18.922
  167   2HE   LYS  21          1HE       LYS  21  -8.979   0.436 -19.729
  168   1HZ   LYS  21          1HZ       LYS  21  -8.673  -1.269 -21.358
  169   2HZ   LYS  21          2HZ       LYS  21  -7.119  -1.631 -20.773
  170   3HZ   LYS  21          3HZ       LYS  21  -7.419  -0.141 -21.532
  171    H    ALA  22           H        ALA  22  -2.979   1.679 -18.088
  172    HA   ALA  22           HA       ALA  22  -3.197   0.116 -20.429
  173   1HB   ALA  22          1HB       ALA  22  -2.241   2.338 -20.552
  174   2HB   ALA  22          2HB       ALA  22  -1.021   1.178 -21.076
  175   3HB   ALA  22          3HB       ALA  22  -0.935   1.879 -19.460
  176    H    ALA  23           H        ALA  23  -0.614   0.174 -17.966
  177    HA   ALA  23           HA       ALA  23   0.767  -2.110 -18.953
  178   1HB   ALA  23          1HB       ALA  23   1.948  -2.074 -16.793
  179   2HB   ALA  23          2HB       ALA  23   0.769  -0.922 -16.160
  180   3HB   ALA  23          3HB       ALA  23   1.848  -0.451 -17.475
  181    H    PHE  24           H        PHE  24  -1.786  -1.604 -16.590
  182    HA   PHE  24           HA       PHE  24  -1.841  -4.149 -15.398
  183   1HB   PHE  24          2HB       PHE  24  -3.109  -1.998 -14.734
  184   2HB   PHE  24          1HB       PHE  24  -4.312  -2.498 -15.920
  185    HD1  PHE  24           HD1      PHE  24  -5.286  -4.882 -15.703
  186    HD2  PHE  24           HD2      PHE  24  -3.114  -2.912 -12.568
  187    HE1  PHE  24           HE1      PHE  24  -6.266  -6.440 -14.044
  188    HE2  PHE  24           HE2      PHE  24  -4.094  -4.469 -10.913
  189    HZ   PHE  24           HZ       PHE  24  -5.669  -6.228 -11.653
  190    H    ASP  25           H        ASP  25  -3.513  -2.890 -18.276
  191    HA   ASP  25           HA       ASP  25  -5.065  -5.206 -18.798
  192   1HB   ASP  25          2HB       ASP  25  -5.366  -2.843 -19.750
  193   2HB   ASP  25          1HB       ASP  25  -4.128  -3.289 -20.924
  194    H    ILE  26           H        ILE  26  -1.917  -4.146 -20.113
  195    HA   ILE  26           HA       ILE  26  -1.636  -6.295 -21.940
  196    HB   ILE  26           HB       ILE  26   0.784  -5.707 -21.976
  197   1HG1  ILE  26          2HG1      ILE  26  -0.005  -3.634 -19.904
  198   2HG1  ILE  26          1HG1      ILE  26   0.922  -5.088 -19.544
  199   1HG2  ILE  26          1HG2      ILE  26   0.440  -3.435 -22.861
  200   2HG2  ILE  26          2HG2      ILE  26  -1.128  -3.353 -22.060
  201   3HG2  ILE  26          3HG2      ILE  26  -0.867  -4.504 -23.369
  202   1HD1  ILE  26          1HD1      ILE  26   2.729  -3.783 -19.966
  203   2HD1  ILE  26          2HD1      ILE  26   1.778  -2.589 -20.848
  204   3HD1  ILE  26          3HD1      ILE  26   2.326  -4.056 -21.661
  205    H    PHE  27           H        PHE  27  -0.678  -5.964 -18.538
  206    HA   PHE  27           HA       PHE  27   0.707  -8.510 -18.526
  207   1HB   PHE  27          2HB       PHE  27  -0.104  -6.675 -16.257
  208   2HB   PHE  27          1HB       PHE  27   0.853  -8.143 -16.061
  209    HD1  PHE  27           HD1      PHE  27   2.707  -8.190 -18.251
  210    HD2  PHE  27           HD2      PHE  27   1.269  -4.799 -16.042
  211    HE1  PHE  27           HE1      PHE  27   4.739  -6.923 -18.877
  212    HE2  PHE  27           HE2      PHE  27   3.304  -3.533 -16.672
  213    HZ   PHE  27           HZ       PHE  27   5.038  -4.593 -18.089
  214    H    ILE  28           H        ILE  28  -2.512  -7.326 -17.709
  215    HA   ILE  28           HA       ILE  28  -3.270 -10.016 -16.771
  216    HB   ILE  28           HB       ILE  28  -3.765  -7.715 -15.542
  217   1HG1  ILE  28          2HG1      ILE  28  -4.381 -10.049 -14.847
  218   2HG1  ILE  28          1HG1      ILE  28  -5.526  -8.810 -14.340
  219   1HG2  ILE  28          1HG2      ILE  28  -5.086  -6.966 -17.666
  220   2HG2  ILE  28          2HG2      ILE  28  -5.747  -6.622 -16.069
  221   3HG2  ILE  28          3HG2      ILE  28  -6.372  -7.975 -17.005
  222   1HD1  ILE  28          1HD1      ILE  28  -6.776 -10.698 -15.211
  223   2HD1  ILE  28          2HD1      ILE  28  -5.818 -10.702 -16.689
  224   3HD1  ILE  28          3HD1      ILE  28  -6.920  -9.366 -16.357
  225    H    GLN  29           H        GLN  29  -2.698  -9.630 -19.489
  226    HA   GLN  29           HA       GLN  29  -5.123  -9.267 -21.002
  227   1HB   GLN  29          2HB       GLN  29  -2.735  -8.838 -21.824
  228   2HB   GLN  29          1HB       GLN  29  -2.590 -10.588 -21.978
  229   1HG   GLN  29          2HG       GLN  29  -3.339 -10.010 -24.102
  230   2HG   GLN  29          1HG       GLN  29  -4.859 -10.373 -23.285
  231   1HE2  GLN  29          1HE2      GLN  29  -2.677  -7.572 -23.952
  232   2HE2  GLN  29          2HE2      GLN  29  -3.934  -6.436 -24.056
  233    H    ASP  30           H        ASP  30  -2.966 -12.062 -20.480
  234    HA   ASP  30           HA       ASP  30  -5.058 -13.903 -21.328
  235   1HB   ASP  30          2HB       ASP  30  -2.159 -14.221 -20.574
  236   2HB   ASP  30          1HB       ASP  30  -3.215 -15.620 -20.766
  237    H    ALA  31           H        ALA  31  -4.447 -12.370 -18.434
  238    HA   ALA  31           HA       ALA  31  -4.902 -14.670 -16.704
  239   1HB   ALA  31          1HB       ALA  31  -5.138 -12.624 -15.004
  240   2HB   ALA  31          2HB       ALA  31  -4.266 -11.786 -16.289
  241   3HB   ALA  31          3HB       ALA  31  -3.563 -13.216 -15.533
  242    H    GLU  32           H        GLU  32  -6.711 -14.872 -15.331
  243    HA   GLU  32           HA       GLU  32  -9.127 -13.394 -16.197
  244   1HB   GLU  32          2HB       GLU  32  -8.880 -16.360 -15.639
  245   2HB   GLU  32          1HB       GLU  32 -10.413 -15.512 -15.849
  246   1HG   GLU  32          2HG       GLU  32  -9.717 -14.797 -18.106
  247   2HG   GLU  32          1HG       GLU  32  -8.181 -15.639 -17.901
  248    H    ASP  33           H        ASP  33  -7.465 -12.750 -13.986
  249    HA   ASP  33           HA       ASP  33  -9.243 -13.423 -11.711
  250   1HB   ASP  33          2HB       ASP  33  -6.258 -13.059 -11.836
  251   2HB   ASP  33          1HB       ASP  33  -7.137 -12.802 -10.329
  252    H    GLY  34           H        GLY  34  -7.211 -10.932 -13.220
  253   1HA   GLY  34          2HA       GLY  34  -7.917  -8.665 -13.466
  254   2HA   GLY  34          1HA       GLY  34  -8.942  -8.858 -12.046
  255    H    CYS  35           H        CYS  35  -5.549  -9.820 -12.402
  256    HA   CYS  35           HA       CYS  35  -4.606  -7.592 -10.767
  257   1HB   CYS  35          2HB       CYS  35  -3.846 -10.304  -9.761
  258   2HB   CYS  35          1HB       CYS  35  -3.930  -8.772  -8.896
  259    HG   CYS  35           HG       CYS  35  -5.991 -10.136  -8.116
  260    H    ILE  36           H        ILE  36  -2.405  -7.220 -11.001
  261    HA   ILE  36           HA       ILE  36  -1.128  -8.684 -13.195
  262    HB   ILE  36           HB       ILE  36   0.485  -6.920 -13.288
  263   1HG1  ILE  36          2HG1      ILE  36  -0.143  -5.050 -11.333
  264   2HG1  ILE  36          1HG1      ILE  36  -0.262  -6.582 -10.467
  265   1HG2  ILE  36          1HG2      ILE  36  -0.905  -4.990 -13.670
  266   2HG2  ILE  36          2HG2      ILE  36  -2.141  -5.598 -12.570
  267   3HG2  ILE  36          3HG2      ILE  36  -1.848  -6.416 -14.103
  268   1HD1  ILE  36          1HD1      ILE  36   2.067  -6.575 -12.198
  269   2HD1  ILE  36          2HD1      ILE  36   1.983  -6.820 -10.452
  270   3HD1  ILE  36          3HD1      ILE  36   2.099  -5.188 -11.110
  271    H    SER  37           H        SER  37   1.360  -8.987 -12.865
  272    HA   SER  37           HA       SER  37   1.648 -10.645 -10.469
  273   1HB   SER  37          2HB       SER  37   2.414 -11.084 -13.048
  274   2HB   SER  37          1HB       SER  37   3.910 -10.464 -12.358
  275    HG   SER  37           HG       SER  37   3.416 -12.824 -12.181
  276    H    THR  38           H        THR  38   2.396  -9.708  -8.689
  277    HA   THR  38           HA       THR  38   3.666  -7.228  -8.471
  278    HB   THR  38           HB       THR  38   4.390  -7.974  -6.214
  279    HG1  THR  38           HG1      THR  38   4.785 -10.028  -6.098
  280   1HG2  THR  38          1HG2      THR  38   2.184  -7.154  -6.262
  281   2HG2  THR  38          2HG2      THR  38   2.027  -8.723  -5.471
  282   3HG2  THR  38          3HG2      THR  38   1.594  -8.545  -7.171
  283    H    LYS  39           H        LYS  39   5.020 -10.458  -8.893
  284    HA   LYS  39           HA       LYS  39   7.747  -9.824  -8.508
  285   1HB   LYS  39          2HB       LYS  39   8.166 -11.873  -9.937
  286   2HB   LYS  39          1HB       LYS  39   7.130 -12.136  -8.536
  287   1HG   LYS  39          2HG       LYS  39   5.635 -13.038  -9.970
  288   2HG   LYS  39          1HG       LYS  39   5.339 -11.397 -10.538
  289   1HD   LYS  39          2HD       LYS  39   5.989 -12.199 -12.555
  290   2HD   LYS  39          1HD       LYS  39   7.622 -12.042 -11.911
  291   1HE   LYS  39          2HE       LYS  39   6.215 -14.532 -11.153
  292   2HE   LYS  39          1HE       LYS  39   6.586 -14.378 -12.869
  293   1HZ   LYS  39          1HZ       LYS  39   8.389 -15.428 -11.626
  294   2HZ   LYS  39          2HZ       LYS  39   8.542 -14.040 -10.660
  295   3HZ   LYS  39          3HZ       LYS  39   8.885 -13.964 -12.322
  296    H    GLU  40           H        GLU  40   5.591  -9.403 -11.245
  297    HA   GLU  40           HA       GLU  40   7.824  -8.522 -12.954
  298   1HB   GLU  40          2HB       GLU  40   4.978  -9.331 -13.518
  299   2HB   GLU  40          1HB       GLU  40   5.918  -8.422 -14.700
  300   1HG   GLU  40          2HG       GLU  40   7.279 -10.770 -13.495
  301   2HG   GLU  40          1HG       GLU  40   5.929 -11.129 -14.571
  302    H    LEU  41           H        LEU  41   6.529  -6.990 -10.624
  303    HA   LEU  41           HA       LEU  41   4.985  -4.847 -11.561
  304   1HB   LEU  41          2HB       LEU  41   5.725  -5.530  -9.138
  305   2HB   LEU  41          1HB       LEU  41   7.055  -4.439  -9.437
  306    HG   LEU  41           HG       LEU  41   5.103  -3.463  -8.175
  307   1HD1  LEU  41          1HD1      LEU  41   5.457  -1.368  -9.095
  308   2HD1  LEU  41          2HD1      LEU  41   5.359  -1.961 -10.752
  309   3HD1  LEU  41          3HD1      LEU  41   6.814  -2.247  -9.799
  310   1HD2  LEU  41          1HD2      LEU  41   3.373  -4.656  -9.592
  311   2HD2  LEU  41          2HD2      LEU  41   3.742  -3.514 -10.884
  312   3HD2  LEU  41          3HD2      LEU  41   3.071  -2.935  -9.360
  313    H    GLY  42           H        GLY  42   8.478  -5.381 -11.638
  314   1HA   GLY  42          2HA       GLY  42   9.365  -2.797 -12.266
  315   2HA   GLY  42          1HA       GLY  42  10.172  -4.286 -12.750
  316    H    LYS  43           H        LYS  43   7.960  -5.320 -14.308
  317    HA   LYS  43           HA       LYS  43   8.531  -4.134 -16.829
  318   1HB   LYS  43          2HB       LYS  43   6.287  -6.014 -16.043
  319   2HB   LYS  43          1HB       LYS  43   6.745  -5.614 -17.697
  320   1HG   LYS  43          2HG       LYS  43   8.834  -6.649 -15.803
  321   2HG   LYS  43          1HG       LYS  43   7.718  -7.780 -16.566
  322   1HD   LYS  43          2HD       LYS  43   8.406  -6.358 -18.740
  323   2HD   LYS  43          1HD       LYS  43   9.875  -6.132 -17.792
  324   1HE   LYS  43          2HE       LYS  43   8.711  -8.887 -18.031
  325   2HE   LYS  43          1HE       LYS  43   9.633  -8.229 -19.382
  326   1HZ   LYS  43          1HZ       LYS  43  11.066  -9.442 -17.881
  327   2HZ   LYS  43          2HZ       LYS  43  10.579  -8.470 -16.575
  328   3HZ   LYS  43          3HZ       LYS  43  11.468  -7.795 -17.856
  329    H    VAL  44           H        VAL  44   6.039  -3.568 -14.437
  330    HA   VAL  44           HA       VAL  44   4.398  -2.013 -16.273
  331    HB   VAL  44           HB       VAL  44   2.730  -2.081 -14.721
  332   1HG1  VAL  44          1HG1      VAL  44   2.583  -4.216 -13.966
  333   2HG1  VAL  44          2HG1      VAL  44   4.098  -4.113 -13.072
  334   3HG1  VAL  44          3HG1      VAL  44   4.118  -4.427 -14.804
  335   1HG2  VAL  44          1HG2      VAL  44   4.898  -1.692 -12.658
  336   2HG2  VAL  44          2HG2      VAL  44   3.260  -2.129 -12.187
  337   3HG2  VAL  44          3HG2      VAL  44   3.553  -0.624 -13.054
  338    H    MET  45           H        MET  45   6.654  -1.484 -13.602
  339    HA   MET  45           HA       MET  45   6.257   1.301 -13.321
  340   1HB   MET  45          2HB       MET  45   7.790  -0.561 -12.017
  341   2HB   MET  45          1HB       MET  45   9.013   0.353 -12.898
  342   1HG   MET  45          2HG       MET  45   8.858   1.697 -11.036
  343   2HG   MET  45          1HG       MET  45   7.558   2.415 -11.988
  344   1HE   MET  45          1HE       MET  45   5.510   2.700  -8.923
  345   2HE   MET  45          2HE       MET  45   5.611   3.155 -10.622
  346   3HE   MET  45          3HE       MET  45   7.017   3.354  -9.579
  347    H    ARG  46           H        ARG  46   8.390  -0.623 -15.403
  348    HA   ARG  46           HA       ARG  46   9.889   1.507 -16.507
  349   1HB   ARG  46          2HB       ARG  46   9.123  -1.194 -17.635
  350   2HB   ARG  46          1HB       ARG  46  10.200  -0.070 -18.468
  351   1HG   ARG  46          2HG       ARG  46  11.753  -0.090 -16.602
  352   2HG   ARG  46          1HG       ARG  46  10.647  -1.077 -15.648
  353   1HD   ARG  46          2HD       ARG  46  10.841  -2.892 -17.320
  354   2HD   ARG  46          1HD       ARG  46  11.971  -1.908 -18.243
  355    HE   ARG  46           HE       ARG  46  12.804  -2.291 -15.509
  356   1HH1  ARG  46          2HH1      ARG  46  12.733  -3.709 -18.700
  357   2HH1  ARG  46          1HH1      ARG  46  14.140  -4.679 -18.437
  358   1HH2  ARG  46          1HH2      ARG  46  14.649  -3.571 -15.187
  359   2HH2  ARG  46          2HH2      ARG  46  15.223  -4.602 -16.454
  360    H    MET  47           H        MET  47   6.759   0.119 -17.347
  361    HA   MET  47           HA       MET  47   6.380   1.645 -19.751
  362   1HB   MET  47          2HB       MET  47   4.449   0.168 -17.949
  363   2HB   MET  47          1HB       MET  47   3.956   0.986 -19.431
  364   1HG   MET  47          2HG       MET  47   6.203  -1.028 -19.440
  365   2HG   MET  47          1HG       MET  47   4.521  -1.539 -19.581
  366   1HE   MET  47          1HE       MET  47   7.244  -0.305 -22.805
  367   2HE   MET  47          2HE       MET  47   7.386  -1.334 -21.382
  368   3HE   MET  47          3HE       MET  47   7.497   0.415 -21.209
  369    H    LEU  48           H        LEU  48   5.680   2.114 -16.337
  370    HA   LEU  48           HA       LEU  48   3.965   4.382 -16.606
  371   1HB   LEU  48          2HB       LEU  48   5.451   3.049 -14.409
  372   2HB   LEU  48          1HB       LEU  48   5.021   4.725 -14.164
  373    HG   LEU  48           HG       LEU  48   2.687   4.233 -14.275
  374   1HD1  LEU  48          1HD1      LEU  48   3.030   1.313 -14.702
  375   2HD1  LEU  48          2HD1      LEU  48   3.294   2.336 -16.113
  376   3HD1  LEU  48          3HD1      LEU  48   1.752   2.388 -15.262
  377   1HD2  LEU  48          1HD2      LEU  48   3.058   3.619 -12.123
  378   2HD2  LEU  48          2HD2      LEU  48   4.465   2.646 -12.552
  379   3HD2  LEU  48          3HD2      LEU  48   2.843   1.967 -12.705
  380    H    GLY  49           H        GLY  49   7.444   3.915 -16.427
  381   1HA   GLY  49          2HA       GLY  49   8.676   5.742 -17.673
  382   2HA   GLY  49          1HA       GLY  49   7.846   6.847 -16.588
  383    H    GLN  50           H        GLN  50   8.730   3.935 -15.011
  384    HA   GLN  50           HA       GLN  50  11.265   5.118 -14.043
  385   1HB   GLN  50          2HB       GLN  50   9.192   3.758 -12.300
  386   2HB   GLN  50          1HB       GLN  50  10.722   4.452 -11.766
  387   1HG   GLN  50          2HG       GLN  50   9.768   6.480 -11.576
  388   2HG   GLN  50          1HG       GLN  50   9.284   6.431 -13.271
  389   1HE2  GLN  50          1HE2      GLN  50   7.101   5.779 -13.774
  390   2HE2  GLN  50          2HE2      GLN  50   5.926   5.562 -12.570
  391    H    ASN  51           H        ASN  51  12.914   3.687 -13.639
  392    HA   ASN  51           HA       ASN  51  12.332   0.825 -14.142
  393   1HB   ASN  51          2HB       ASN  51  14.691   0.712 -15.084
  394   2HB   ASN  51          1HB       ASN  51  13.511   1.571 -16.073
  395   1HD2  ASN  51          1HD2      ASN  51  16.586   1.854 -14.580
  396   2HD2  ASN  51          2HD2      ASN  51  16.775   3.530 -14.769
  397    HA   PRO  52           HA       PRO  52  14.416   1.173 -10.042
  398   1HB   PRO  52          2HB       PRO  52  12.528  -0.220  -8.638
  399   2HB   PRO  52          1HB       PRO  52  12.438   1.521  -8.940
  400   1HG   PRO  52          2HG       PRO  52  10.879  -0.679 -10.144
  401   2HG   PRO  52          1HG       PRO  52  10.455   1.028  -9.949
  402   1HD   PRO  52          2HD       PRO  52  11.369  -0.238 -12.335
  403   2HD   PRO  52          1HD       PRO  52  11.141   1.507 -12.073
  404    H    THR  53           H        THR  53  14.196  -1.005  -8.312
  405    HA   THR  53           HA       THR  53  15.406  -3.193  -9.895
  406    HB   THR  53           HB       THR  53  16.788  -3.680  -8.067
  407    HG1  THR  53           HG1      THR  53  16.131  -3.532  -6.068
  408   1HG2  THR  53          1HG2      THR  53  17.305  -1.428  -8.982
  409   2HG2  THR  53          2HG2      THR  53  17.742  -1.581  -7.280
  410   3HG2  THR  53          3HG2      THR  53  16.276  -0.715  -7.740
  411    HA   PRO  54           HA       PRO  54  12.223  -5.965  -8.582
  412   1HB   PRO  54          2HB       PRO  54  13.554  -8.213  -7.751
  413   2HB   PRO  54          1HB       PRO  54  13.372  -7.738  -9.448
  414   1HG   PRO  54          2HG       PRO  54  15.748  -7.529  -7.676
  415   2HG   PRO  54          1HG       PRO  54  15.663  -7.773  -9.427
  416   1HD   PRO  54          2HD       PRO  54  16.249  -5.346  -8.163
  417   2HD   PRO  54          1HD       PRO  54  15.715  -5.516  -9.851
  418    H    GLU  55           H        GLU  55  14.735  -5.323  -6.236
  419    HA   GLU  55           HA       GLU  55  13.256  -6.332  -3.955
  420   1HB   GLU  55          2HB       GLU  55  15.720  -4.569  -4.060
  421   2HB   GLU  55          1HB       GLU  55  15.080  -5.368  -2.625
  422   1HG   GLU  55          2HG       GLU  55  15.403  -7.572  -3.739
  423   2HG   GLU  55          1HG       GLU  55  16.119  -6.744  -5.121
  424    H    GLU  56           H        GLU  56  13.879  -3.224  -5.535
  425    HA   GLU  56           HA       GLU  56  12.735  -1.576  -3.511
  426   1HB   GLU  56          2HB       GLU  56  13.461  -1.199  -6.395
  427   2HB   GLU  56          1HB       GLU  56  12.471   0.017  -5.588
  428   1HG   GLU  56          2HG       GLU  56  14.939  -0.958  -4.197
  429   2HG   GLU  56          1HG       GLU  56  15.123   0.173  -5.537
  430    H    LEU  57           H        LEU  57  11.453  -2.793  -6.622
  431    HA   LEU  57           HA       LEU  57   8.880  -1.680  -6.367
  432   1HB   LEU  57          2HB       LEU  57   8.205  -3.164  -8.108
  433   2HB   LEU  57          1HB       LEU  57   9.816  -2.593  -8.466
  434    HG   LEU  57           HG       LEU  57  10.525  -4.870  -7.308
  435   1HD1  LEU  57          1HD1      LEU  57   8.797  -6.226  -6.795
  436   2HD1  LEU  57          2HD1      LEU  57   8.381  -6.289  -8.508
  437   3HD1  LEU  57          3HD1      LEU  57   7.649  -5.068  -7.469
  438   1HD2  LEU  57          1HD2      LEU  57  10.043  -5.928  -9.692
  439   2HD2  LEU  57          2HD2      LEU  57  11.198  -4.607  -9.519
  440   3HD2  LEU  57          3HD2      LEU  57   9.562  -4.277 -10.086
  441    H    GLN  58           H        GLN  58  10.226  -4.762  -5.222
  442    HA   GLN  58           HA       GLN  58   7.799  -5.979  -4.454
  443   1HB   GLN  58          2HB       GLN  58  10.134  -7.044  -4.574
  444   2HB   GLN  58          1HB       GLN  58  10.391  -6.369  -2.966
  445   1HG   GLN  58          2HG       GLN  58   9.564  -8.637  -2.715
  446   2HG   GLN  58          1HG       GLN  58   8.294  -7.523  -2.209
  447   1HE2  GLN  58          1HE2      GLN  58   6.284  -7.730  -3.255
  448   2HE2  GLN  58          2HE2      GLN  58   6.022  -8.662  -4.649
  449    H    GLU  59           H        GLU  59   9.982  -3.777  -2.719
  450    HA   GLU  59           HA       GLU  59   8.785  -3.874  -0.180
  451   1HB   GLU  59          2HB       GLU  59  10.443  -1.892  -1.659
  452   2HB   GLU  59          1HB       GLU  59   9.543  -1.295  -0.266
  453   1HG   GLU  59          2HG       GLU  59  11.249  -3.786  -0.122
  454   2HG   GLU  59          1HG       GLU  59  11.905  -2.181   0.199
  455    H    MET  60           H        MET  60   8.070  -1.843  -3.003
  456    HA   MET  60           HA       MET  60   5.981  -0.322  -1.850
  457   1HB   MET  60          2HB       MET  60   6.229  -1.104  -4.764
  458   2HB   MET  60          1HB       MET  60   5.370   0.287  -4.105
  459   1HG   MET  60          2HG       MET  60   7.966   0.512  -3.077
  460   2HG   MET  60          1HG       MET  60   8.192   0.007  -4.751
  461   1HE   MET  60          1HE       MET  60   8.358   1.876  -6.643
  462   2HE   MET  60          2HE       MET  60   6.786   2.615  -6.938
  463   3HE   MET  60          3HE       MET  60   6.894   0.883  -6.636
  464    H    ILE  61           H        ILE  61   6.038  -3.400  -3.566
  465    HA   ILE  61           HA       ILE  61   3.261  -3.815  -3.820
  466    HB   ILE  61           HB       ILE  61   5.524  -5.808  -3.535
  467   1HG1  ILE  61          2HG1      ILE  61   5.646  -4.399  -5.545
  468   2HG1  ILE  61          1HG1      ILE  61   5.216  -6.049  -5.984
  469   1HG2  ILE  61          1HG2      ILE  61   3.408  -6.857  -2.868
  470   2HG2  ILE  61          2HG2      ILE  61   3.919  -7.465  -4.440
  471   3HG2  ILE  61          3HG2      ILE  61   2.633  -6.263  -4.337
  472   1HD1  ILE  61          1HD1      ILE  61   3.632  -3.565  -6.205
  473   2HD1  ILE  61          2HD1      ILE  61   2.741  -4.954  -5.588
  474   3HD1  ILE  61          3HD1      ILE  61   3.541  -5.045  -7.157
  475    H    ASP  62           H        ASP  62   5.523  -4.977  -1.303
  476    HA   ASP  62           HA       ASP  62   3.615  -6.248   0.323
  477   1HB   ASP  62          2HB       ASP  62   6.299  -5.020   0.934
  478   2HB   ASP  62          1HB       ASP  62   5.324  -5.791   2.184
  479    H    GLU  63           H        GLU  63   4.582  -2.862   0.126
  480    HA   GLU  63           HA       GLU  63   3.201  -2.075   2.532
  481   1HB   GLU  63          2HB       GLU  63   4.553  -0.583   0.300
  482   2HB   GLU  63          1HB       GLU  63   3.596   0.269   1.512
  483   1HG   GLU  63          2HG       GLU  63   4.990  -0.511   3.297
  484   2HG   GLU  63          1HG       GLU  63   5.797  -1.675   2.246
  485    H    VAL  64           H        VAL  64   2.471  -1.945  -0.957
  486    HA   VAL  64           HA       VAL  64  -0.016  -0.527  -0.492
  487    HB   VAL  64           HB       VAL  64   1.329  -0.160  -2.554
  488   1HG1  VAL  64          1HG1      VAL  64   1.524  -1.802  -4.242
  489   2HG1  VAL  64          2HG1      VAL  64   0.281  -2.822  -3.517
  490   3HG1  VAL  64          3HG1      VAL  64   1.865  -2.682  -2.754
  491   1HG2  VAL  64          1HG2      VAL  64  -0.561   0.326  -3.749
  492   2HG2  VAL  64          2HG2      VAL  64  -1.360  -0.136  -2.247
  493   3HG2  VAL  64          3HG2      VAL  64  -1.222  -1.298  -3.565
  494    H    ASP  65           H        ASP  65   0.941  -3.859  -1.281
  495    HA   ASP  65           HA       ASP  65  -1.742  -4.798  -1.619
  496   1HB   ASP  65          2HB       ASP  65   0.780  -5.849  -2.118
  497   2HB   ASP  65          1HB       ASP  65   0.168  -6.845  -0.801
  498    H    GLU  66           H        GLU  66  -3.106  -4.570   0.024
  499    HA   GLU  66           HA       GLU  66  -2.434  -4.629   2.772
  500   1HB   GLU  66          2HB       GLU  66  -4.890  -4.847   3.149
  501   2HB   GLU  66          1HB       GLU  66  -4.472  -3.537   2.046
  502   1HG   GLU  66          2HG       GLU  66  -5.114  -4.829   0.126
  503   2HG   GLU  66          1HG       GLU  66  -5.241  -6.304   1.083
  504    H    ASP  67           H        ASP  67  -3.469  -7.152   0.539
  505    HA   ASP  67           HA       ASP  67  -3.564  -9.127   2.706
  506   1HB   ASP  67          2HB       ASP  67  -4.285 -10.688   0.820
  507   2HB   ASP  67          1HB       ASP  67  -5.402  -9.390   1.232
  508    H    GLY  68           H        GLY  68  -1.647  -8.266  -0.120
  509   1HA   GLY  68          2HA       GLY  68   0.511  -8.863  -0.694
  510   2HA   GLY  68          1HA       GLY  68   0.637  -9.697   0.852
  511    H    SER  69           H        SER  69  -1.536 -10.126  -1.933
  512    HA   SER  69           HA       SER  69  -1.217 -13.008  -1.808
  513   1HB   SER  69          2HB       SER  69  -2.857 -12.990  -3.699
  514   2HB   SER  69          1HB       SER  69  -3.429 -12.170  -2.250
  515    HG   SER  69           HG       SER  69  -3.555 -10.410  -3.387
  516    H    GLY  70           H        GLY  70   0.718 -10.692  -3.158
  517   1HA   GLY  70          2HA       GLY  70   2.494 -10.922  -4.629
  518   2HA   GLY  70          1HA       GLY  70   1.966 -12.571  -4.957
  519    H    THR  71           H        THR  71  -0.444 -10.121  -5.213
  520    HA   THR  71           HA       THR  71  -0.052  -9.762  -8.090
  521    HB   THR  71           HB       THR  71  -2.254 -10.494  -8.691
  522    HG1  THR  71           HG1      THR  71  -2.669 -10.982  -5.923
  523   1HG2  THR  71          1HG2      THR  71  -1.019 -12.509  -6.790
  524   2HG2  THR  71          2HG2      THR  71  -0.603 -12.300  -8.492
  525   3HG2  THR  71          3HG2      THR  71  -2.206 -12.883  -8.042
  526    H    VAL  72           H        VAL  72  -0.396  -7.694  -8.603
  527    HA   VAL  72           HA       VAL  72  -1.628  -5.944  -6.608
  528    HB   VAL  72           HB       VAL  72  -0.503  -5.030  -9.249
  529   1HG1  VAL  72          1HG1      VAL  72  -1.841  -3.568  -7.557
  530   2HG1  VAL  72          2HG1      VAL  72  -0.315  -2.941  -8.182
  531   3HG1  VAL  72          3HG1      VAL  72  -0.381  -3.652  -6.570
  532   1HG2  VAL  72          1HG2      VAL  72   1.009  -5.624  -6.682
  533   2HG2  VAL  72          2HG2      VAL  72   1.669  -4.722  -8.047
  534   3HG2  VAL  72          3HG2      VAL  72   1.239  -6.423  -8.238
  535    H    ASP  73           H        ASP  73  -3.688  -5.430  -6.684
  536    HA   ASP  73           HA       ASP  73  -5.292  -5.943  -9.060
  537   1HB   ASP  73          2HB       ASP  73  -5.913  -4.942  -6.276
  538   2HB   ASP  73          1HB       ASP  73  -7.119  -4.916  -7.562
  539    H    PHE  74           H        PHE  74  -6.776  -4.137  -9.851
  540    HA   PHE  74           HA       PHE  74  -5.232  -1.956 -10.713
  541   1HB   PHE  74          2HB       PHE  74  -7.408  -2.801 -11.747
  542   2HB   PHE  74          1HB       PHE  74  -8.239  -1.850 -10.517
  543    HD1  PHE  74           HD1      PHE  74  -5.089  -1.193 -12.420
  544    HD2  PHE  74           HD2      PHE  74  -9.120   0.036 -11.608
  545    HE1  PHE  74           HE1      PHE  74  -4.742   0.844 -13.783
  546    HE2  PHE  74           HE2      PHE  74  -8.774   2.077 -12.971
  547    HZ   PHE  74           HZ       PHE  74  -6.584   2.483 -14.060
  548    H    ASP  75           H        ASP  75  -7.384  -2.309  -7.932
  549    HA   ASP  75           HA       ASP  75  -7.395   0.435  -7.158
  550   1HB   ASP  75          2HB       ASP  75  -7.868  -2.120  -5.602
  551   2HB   ASP  75          1HB       ASP  75  -8.012  -0.517  -4.881
  552    H    GLU  76           H        GLU  76  -5.375  -2.359  -6.244
  553    HA   GLU  76           HA       GLU  76  -3.726  -0.909  -4.402
  554   1HB   GLU  76          2HB       GLU  76  -3.057  -3.468  -5.884
  555   2HB   GLU  76          1HB       GLU  76  -2.285  -2.865  -4.419
  556   1HG   GLU  76          2HG       GLU  76  -4.399  -3.087  -3.184
  557   2HG   GLU  76          1HG       GLU  76  -5.214  -3.632  -4.650
  558    H    PHE  77           H        PHE  77  -3.784  -1.306  -7.846
  559    HA   PHE  77           HA       PHE  77  -1.072  -0.677  -8.427
  560   1HB   PHE  77          2HB       PHE  77  -3.146  -1.631  -9.879
  561   2HB   PHE  77          1HB       PHE  77  -3.199   0.054 -10.368
  562    HD1  PHE  77           HD1      PHE  77  -2.714  -0.860 -12.652
  563    HD2  PHE  77           HD2      PHE  77   0.114  -1.156  -9.425
  564    HE1  PHE  77           HE1      PHE  77  -0.894  -1.283 -14.272
  565    HE2  PHE  77           HE2      PHE  77   1.925  -1.570 -11.055
  566    HZ   PHE  77           HZ       PHE  77   1.423  -1.638 -13.481
  567    H    LEU  78           H        LEU  78  -4.059   1.268  -8.669
  568    HA   LEU  78           HA       LEU  78  -2.724   3.730  -9.200
  569   1HB   LEU  78          2HB       LEU  78  -5.456   3.452  -7.976
  570   2HB   LEU  78          1HB       LEU  78  -4.848   4.763  -8.970
  571    HG   LEU  78           HG       LEU  78  -5.703   1.997  -9.819
  572   1HD1  LEU  78          1HD1      LEU  78  -6.532   4.833 -10.409
  573   2HD1  LEU  78          2HD1      LEU  78  -7.521   3.492  -9.830
  574   3HD1  LEU  78          3HD1      LEU  78  -6.956   3.513 -11.501
  575   1HD2  LEU  78          1HD2      LEU  78  -4.942   2.919 -12.152
  576   2HD2  LEU  78          2HD2      LEU  78  -3.738   2.200 -11.081
  577   3HD2  LEU  78          3HD2      LEU  78  -3.879   3.955 -11.199
  578    H    VAL  79           H        VAL  79  -3.681   2.067  -6.269
  579    HA   VAL  79           HA       VAL  79  -3.575   4.196  -4.430
  580    HB   VAL  79           HB       VAL  79  -3.377   1.225  -4.262
  581   1HG1  VAL  79          1HG1      VAL  79  -2.569   3.071  -1.995
  582   2HG1  VAL  79          2HG1      VAL  79  -1.524   1.910  -2.815
  583   3HG1  VAL  79          3HG1      VAL  79  -2.878   1.341  -1.836
  584   1HG2  VAL  79          1HG2      VAL  79  -5.479   2.726  -4.132
  585   2HG2  VAL  79          2HG2      VAL  79  -4.913   3.151  -2.517
  586   3HG2  VAL  79          3HG2      VAL  79  -5.298   1.474  -2.905
  587    H    MET  80           H        MET  80  -1.053   1.928  -5.506
  588    HA   MET  80           HA       MET  80   1.095   2.657  -3.967
  589   1HB   MET  80          2HB       MET  80   0.744   1.159  -6.274
  590   2HB   MET  80          1HB       MET  80   1.860   2.428  -6.778
  591   1HG   MET  80          2HG       MET  80   3.025   1.835  -4.458
  592   2HG   MET  80          1HG       MET  80   2.222   0.287  -4.721
  593   1HE   MET  80          1HE       MET  80   4.208  -1.544  -7.130
  594   2HE   MET  80          2HE       MET  80   2.524  -1.233  -6.717
  595   3HE   MET  80          3HE       MET  80   3.708  -1.475  -5.435
  596    H    MET  81           H        MET  81  -0.319   4.480  -6.649
  597    HA   MET  81           HA       MET  81   1.821   6.350  -6.941
  598   1HB   MET  81          2HB       MET  81   0.017   5.941  -8.650
  599   2HB   MET  81          1HB       MET  81  -1.095   6.820  -7.600
  600   1HG   MET  81          2HG       MET  81  -0.182   8.842  -8.114
  601   2HG   MET  81          1HG       MET  81   1.463   8.208  -8.110
  602   1HE   MET  81          1HE       MET  81   1.886   6.477 -11.435
  603   2HE   MET  81          2HE       MET  81   1.996   6.259  -9.690
  604   3HE   MET  81          3HE       MET  81   2.799   7.630 -10.452
  605    H    VAL  82           H        VAL  82  -1.392   6.696  -5.387
  606    HA   VAL  82           HA       VAL  82  -0.857   9.229  -4.227
  607    HB   VAL  82           HB       VAL  82  -2.813   8.768  -2.773
  608   1HG1  VAL  82          1HG1      VAL  82  -3.070   9.582  -5.122
  609   2HG1  VAL  82          2HG1      VAL  82  -4.444   8.620  -4.577
  610   3HG1  VAL  82          3HG1      VAL  82  -3.239   7.908  -5.649
  611   1HG2  VAL  82          1HG2      VAL  82  -2.971   6.091  -4.174
  612   2HG2  VAL  82          2HG2      VAL  82  -3.959   6.672  -2.833
  613   3HG2  VAL  82          3HG2      VAL  82  -2.259   6.281  -2.572
  614    H    ARG  83           H        ARG  83  -0.178   5.961  -3.166
  615    HA   ARG  83           HA       ARG  83   0.228   6.288  -0.434
  616   1HB   ARG  83          2HB       ARG  83   1.575   4.534  -2.481
  617   2HB   ARG  83          1HB       ARG  83   2.067   4.498  -0.789
  618   1HG   ARG  83          2HG       ARG  83  -0.844   4.385  -1.122
  619   2HG   ARG  83          1HG       ARG  83  -0.015   3.032  -1.894
  620   1HD   ARG  83          2HD       ARG  83   1.292   2.773   0.289
  621   2HD   ARG  83          1HD       ARG  83   0.134   3.890   1.003
  622    HE   ARG  83           HE       ARG  83  -1.206   1.737  -0.316
  623   1HH1  ARG  83          2HH1      ARG  83   0.603   2.558   2.555
  624   2HH1  ARG  83          1HH1      ARG  83  -0.149   1.340   3.527
  625   1HH2  ARG  83          1HH2      ARG  83  -2.178   0.148   0.976
  626   2HH2  ARG  83          2HH2      ARG  83  -1.718  -0.021   2.637
  627    H    CYS  84           H        CYS  84   2.351   7.104  -3.141
  628    HA   CYS  84           HA       CYS  84   4.474   8.008  -1.334
  629   1HB   CYS  84          2HB       CYS  84   4.289   7.851  -4.349
  630   2HB   CYS  84          1HB       CYS  84   5.670   8.537  -3.492
  631    HG   CYS  84           HG       CYS  84   6.363   6.250  -2.714
  632    H    MET  85           H        MET  85   2.216   9.353  -3.736
  633    HA   MET  85           HA       MET  85   3.127  12.016  -3.685
  634   1HB   MET  85          2HB       MET  85   0.765  10.598  -4.666
  635   2HB   MET  85          1HB       MET  85   0.399  12.233  -4.114
  636   1HG   MET  85          2HG       MET  85   1.049  12.713  -6.275
  637   2HG   MET  85          1HG       MET  85   2.623  12.795  -5.483
  638   1HE   MET  85          1HE       MET  85   1.507  12.422  -8.303
  639   2HE   MET  85          2HE       MET  85   0.687  10.872  -8.467
  640   3HE   MET  85          3HE       MET  85   2.292  11.089  -9.159
  641    H    LYS  86           H        LYS  86   0.217  10.719  -2.046
  642    HA   LYS  86           HA       LYS  86   0.230  13.001  -0.218
  643   1HB   LYS  86          2HB       LYS  86  -1.812  11.574  -1.383
  644   2HB   LYS  86          1HB       LYS  86  -1.764  10.897   0.244
  645   1HG   LYS  86          2HG       LYS  86  -1.478  13.621   0.692
  646   2HG   LYS  86          1HG       LYS  86  -2.630  13.553  -0.642
  647   1HD   LYS  86          2HD       LYS  86  -4.046  12.005   0.624
  648   2HD   LYS  86          1HD       LYS  86  -2.877  11.987   1.945
  649   1HE   LYS  86          2HE       LYS  86  -3.955  14.627   1.018
  650   2HE   LYS  86          1HE       LYS  86  -4.976  13.605   2.028
  651   1HZ   LYS  86          1HZ       LYS  86  -3.707  15.044   3.426
  652   2HZ   LYS  86          2HZ       LYS  86  -2.252  14.594   2.674
  653   3HZ   LYS  86          3HZ       LYS  86  -3.107  13.470   3.618
  654    H    ASP  87           H        ASP  87  -0.290  12.513   2.117
  655    HA   ASP  87           HA       ASP  87   0.379  11.705   4.151
  656   1HB   ASP  87          2HB       ASP  87  -0.825   9.655   3.255
  657   2HB   ASP  87          1HB       ASP  87   0.758   9.032   2.791
  658    H    ASP  88           H        ASP  88   2.274  13.124   3.532
  659    HA   ASP  88           HA       ASP  88   4.747  11.934   2.735
  660   1HB   ASP  88          2HB       ASP  88   4.080  14.559   4.078
  661   2HB   ASP  88          1HB       ASP  88   5.731  14.089   3.673
  662    H    SER  89           HN       SER  89   3.251  12.665   5.862
  663    HA   SER  89           HA       SER  89   5.522  11.991   7.458
  664   1HB   SER  89          2HB       SER  89   3.821  11.822   9.315
  665   2HB   SER  89          1HB       SER  89   3.819  13.359   8.455
  666    HG   SER  89           HG       SER  89   1.939  11.310   8.498
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1  -8.926  11.989   7.589
    2   2H    MET   1          2H        MET   1  -7.800  13.214   7.241
    3   3H    MET   1          3H        MET   1  -8.912  13.414   8.510
    4    HA   MET   1           HA       MET   1  -6.752  12.883   9.406
    5   1HB   MET   1          2HB       MET   1  -9.022  10.941   9.625
    6   2HB   MET   1          1HB       MET   1  -7.494  10.529  10.402
    7   1HG   MET   1          2HG       MET   1  -8.556  13.291  10.818
    8   2HG   MET   1          1HG       MET   1  -9.358  11.968  11.667
    9   1HE   MET   1          1HE       MET   1  -8.991  13.287  13.450
   10   2HE   MET   1          2HE       MET   1  -7.489  14.097  13.887
   11   3HE   MET   1          3HE       MET   1  -7.906  12.562  14.643
   12    H    ASN   2           H        ASN   2  -7.993   9.989   7.694
   13    HA   ASN   2           HA       ASN   2  -5.339   9.572   6.502
   14   1HB   ASN   2          2HB       ASN   2  -5.445   7.136   7.148
   15   2HB   ASN   2          1HB       ASN   2  -5.169   8.240   8.495
   16   1HD2  ASN   2          1HD2      ASN   2  -7.518   6.031   7.043
   17   2HD2  ASN   2          2HD2      ASN   2  -8.615   6.066   8.338
   18    H    ASP   3           H        ASP   3  -7.969  10.383   5.452
   19    HA   ASP   3           HA       ASP   3  -8.622   8.051   3.752
   20   1HB   ASP   3          2HB       ASP   3 -10.226  10.502   4.499
   21   2HB   ASP   3          1HB       ASP   3 -10.707   9.398   3.211
   22    H    ILE   4           H        ILE   4  -6.295   9.779   3.348
   23    HA   ILE   4           HA       ILE   4  -6.948  11.477   1.083
   24    HB   ILE   4           HB       ILE   4  -4.531  11.948   0.990
   25   1HG1  ILE   4          2HG1      ILE   4  -3.378  10.915   3.219
   26   2HG1  ILE   4          1HG1      ILE   4  -4.459   9.588   2.801
   27   1HG2  ILE   4          1HG2      ILE   4  -5.650  13.405   2.449
   28   2HG2  ILE   4          2HG2      ILE   4  -4.358  12.763   3.461
   29   3HG2  ILE   4          3HG2      ILE   4  -5.996  12.128   3.615
   30   1HD1  ILE   4          1HD1      ILE   4  -3.517   9.948   0.376
   31   2HD1  ILE   4          2HD1      ILE   4  -2.560   9.054   1.555
   32   3HD1  ILE   4          3HD1      ILE   4  -2.186  10.743   1.215
   33    H    TYR   5           H        TYR   5  -5.574   8.300   1.669
   34    HA   TYR   5           HA       TYR   5  -4.553   7.808  -0.939
   35   1HB   TYR   5          2HB       TYR   5  -5.604   5.810   1.089
   36   2HB   TYR   5          1HB       TYR   5  -4.605   5.431  -0.314
   37    HD1  TYR   5           HD1      TYR   5  -4.655   6.742   3.088
   38    HD2  TYR   5           HD2      TYR   5  -2.251   6.269  -0.443
   39    HE1  TYR   5           HE1      TYR   5  -2.617   7.220   4.411
   40    HE2  TYR   5           HE2      TYR   5  -0.213   6.751   0.881
   41    HH   TYR   5           HH       TYR   5   0.142   6.464   3.873
   42    H    LYS   6           H        LYS   6  -7.706   7.385   0.572
   43    HA   LYS   6           HA       LYS   6  -8.868   6.077  -1.750
   44   1HB   LYS   6          2HB       LYS   6 -10.102   7.085   0.823
   45   2HB   LYS   6          1HB       LYS   6 -10.982   6.219  -0.436
   46   1HG   LYS   6          2HG       LYS   6  -9.387   4.315  -0.191
   47   2HG   LYS   6          1HG       LYS   6  -8.617   5.170   1.146
   48   1HD   LYS   6          2HD       LYS   6 -11.585   4.642   1.160
   49   2HD   LYS   6          1HD       LYS   6 -10.446   3.417   1.717
   50   1HE   LYS   6          2HE       LYS   6  -9.495   5.049   3.324
   51   2HE   LYS   6          1HE       LYS   6 -10.672   6.246   2.787
   52   1HZ   LYS   6          1HZ       LYS   6 -11.465   5.170   4.763
   53   2HZ   LYS   6          2HZ       LYS   6 -11.266   3.633   4.068
   54   3HZ   LYS   6          3HZ       LYS   6 -12.441   4.699   3.459
   55    H    ALA   7           H        ALA   7  -8.663   9.309  -0.400
   56    HA   ALA   7           HA       ALA   7 -10.829  10.495  -1.786
   57   1HB   ALA   7          1HB       ALA   7  -8.269  11.644  -0.667
   58   2HB   ALA   7          2HB       ALA   7  -9.888  11.718   0.030
   59   3HB   ALA   7          3HB       ALA   7  -9.512  12.640  -1.425
   60    H    ALA   8           H        ALA   8  -7.400  10.067  -2.655
   61    HA   ALA   8           HA       ALA   8  -7.544  11.585  -5.072
   62   1HB   ALA   8          1HB       ALA   8  -5.385  10.475  -5.622
   63   2HB   ALA   8          2HB       ALA   8  -5.582   9.450  -4.200
   64   3HB   ALA   8          3HB       ALA   8  -5.389  11.195  -4.012
   65    H    VAL   9           H        VAL   9  -7.728   8.105  -4.350
   66    HA   VAL   9           HA       VAL   9  -8.031   7.300  -7.074
   67    HB   VAL   9           HB       VAL   9  -7.292   5.844  -5.121
   68   1HG1  VAL   9          1HG1      VAL   9 -10.285   5.740  -4.655
   69   2HG1  VAL   9          2HG1      VAL   9  -9.091   6.452  -3.572
   70   3HG1  VAL   9          3HG1      VAL   9  -9.087   4.714  -3.864
   71   1HG2  VAL   9          1HG2      VAL   9  -9.219   4.056  -6.140
   72   2HG2  VAL   9          2HG2      VAL   9  -7.585   4.313  -6.751
   73   3HG2  VAL   9          3HG2      VAL   9  -8.933   5.223  -7.431
   74    H    GLU  10           H        GLU  10 -10.199   8.639  -4.731
   75    HA   GLU  10           HA       GLU  10 -12.616   7.674  -6.005
   76   1HB   GLU  10          2HB       GLU  10 -11.951   9.276  -3.611
   77   2HB   GLU  10          1HB       GLU  10 -13.467   9.696  -4.408
   78   1HG   GLU  10          2HG       GLU  10 -14.337   7.504  -4.166
   79   2HG   GLU  10          1HG       GLU  10 -12.751   6.829  -3.793
   80    H    GLN  11           H        GLN  11 -10.477  10.407  -6.341
   81    HA   GLN  11           HA       GLN  11 -12.395  11.605  -8.253
   82   1HB   GLN  11          2HB       GLN  11 -11.749  13.819  -7.595
   83   2HB   GLN  11          1HB       GLN  11 -12.180  12.939  -6.131
   84   1HG   GLN  11          2HG       GLN  11  -9.599  12.362  -6.085
   85   2HG   GLN  11          1HG       GLN  11  -9.471  13.803  -7.093
   86   1HE2  GLN  11          1HE2      GLN  11  -8.577  13.429  -4.240
   87   2HE2  GLN  11          2HE2      GLN  11  -9.385  14.632  -3.357
   88    H    LEU  12           H        LEU  12 -10.165   9.716  -8.706
   89    HA   LEU  12           HA       LEU  12  -7.943  11.124  -9.824
   90   1HB   LEU  12          2HB       LEU  12  -7.764   8.856 -11.174
   91   2HB   LEU  12          1HB       LEU  12  -7.295   8.977  -9.497
   92    HG   LEU  12           HG       LEU  12  -9.326   7.896  -8.787
   93   1HD1  LEU  12          1HD1      LEU  12 -11.048   8.667 -10.171
   94   2HD1  LEU  12          2HD1      LEU  12 -10.844   7.006 -10.727
   95   3HD1  LEU  12          3HD1      LEU  12 -10.141   8.337 -11.648
   96   1HD2  LEU  12          1HD2      LEU  12  -8.944   5.724  -9.688
   97   2HD2  LEU  12          2HD2      LEU  12  -7.387   6.548  -9.781
   98   3HD2  LEU  12          3HD2      LEU  12  -8.384   6.381 -11.227
   99    H    THR  13           H        THR  13  -7.377  10.663 -12.250
  100    HA   THR  13           HA       THR  13  -9.668  11.627 -13.850
  101    HB   THR  13           HB       THR  13  -7.473  12.076 -15.416
  102    HG1  THR  13           HG1      THR  13  -5.798  12.013 -14.189
  103   1HG2  THR  13          1HG2      THR  13  -7.638  14.441 -14.193
  104   2HG2  THR  13          2HG2      THR  13  -9.084  13.697 -13.511
  105   3HG2  THR  13          3HG2      THR  13  -8.912  13.850 -15.260
  106    H    ASP  14           H        ASP  14  -9.474  11.045 -16.216
  107    HA   ASP  14           HA       ASP  14  -9.445   8.190 -16.467
  108   1HB   ASP  14          2HB       ASP  14  -9.626  10.362 -18.576
  109   2HB   ASP  14          1HB       ASP  14  -9.820   8.639 -18.898
  110    H    GLU  15           H        GLU  15  -7.222  10.812 -17.228
  111    HA   GLU  15           HA       GLU  15  -5.390   9.226 -18.765
  112   1HB   GLU  15          2HB       GLU  15  -5.313  11.937 -17.495
  113   2HB   GLU  15          1HB       GLU  15  -3.799  11.193 -18.008
  114   1HG   GLU  15          2HG       GLU  15  -4.994  10.743 -20.251
  115   2HG   GLU  15          1HG       GLU  15  -6.198  11.906 -19.696
  116    H    GLN  16           H        GLN  16  -5.780   9.996 -15.350
  117    HA   GLN  16           HA       GLN  16  -3.256   9.031 -14.454
  118   1HB   GLN  16          2HB       GLN  16  -5.466  10.282 -13.286
  119   2HB   GLN  16          1HB       GLN  16  -5.393   8.700 -12.514
  120   1HG   GLN  16          2HG       GLN  16  -3.064   9.053 -11.902
  121   2HG   GLN  16          1HG       GLN  16  -3.034  10.582 -12.782
  122   1HE2  GLN  16          1HE2      GLN  16  -5.516   9.236 -10.534
  123   2HE2  GLN  16          2HE2      GLN  16  -5.479  10.559  -9.473
  124    H    LYS  17           H        LYS  17  -6.511   7.545 -14.494
  125    HA   LYS  17           HA       LYS  17  -5.582   5.014 -13.536
  126   1HB   LYS  17          2HB       LYS  17  -7.819   4.175 -14.205
  127   2HB   LYS  17          1HB       LYS  17  -7.913   5.634 -13.222
  128   1HG   LYS  17          2HG       LYS  17  -7.955   6.897 -15.496
  129   2HG   LYS  17          1HG       LYS  17  -8.380   5.325 -16.179
  130   1HD   LYS  17          2HD       LYS  17 -10.066   5.465 -14.018
  131   2HD   LYS  17          1HD       LYS  17  -9.990   7.153 -14.526
  132   1HE   LYS  17          2HE       LYS  17 -10.522   6.436 -16.859
  133   2HE   LYS  17          1HE       LYS  17 -10.705   4.782 -16.277
  134   1HZ   LYS  17          1HZ       LYS  17 -12.838   5.872 -16.391
  135   2HZ   LYS  17          2HZ       LYS  17 -12.291   7.136 -15.396
  136   3HZ   LYS  17          3HZ       LYS  17 -12.447   5.562 -14.771
  137    H    ASN  18           H        ASN  18  -6.093   6.398 -16.755
  138    HA   ASN  18           HA       ASN  18  -5.829   4.008 -18.253
  139   1HB   ASN  18          2HB       ASN  18  -5.503   6.919 -18.864
  140   2HB   ASN  18          1HB       ASN  18  -4.890   5.739 -20.022
  141   1HD2  ASN  18          1HD2      ASN  18  -6.495   5.842 -21.651
  142   2HD2  ASN  18          2HD2      ASN  18  -8.140   5.538 -21.369
  143    H    GLU  19           H        GLU  19  -3.464   6.219 -16.851
  144    HA   GLU  19           HA       GLU  19  -1.143   5.417 -18.193
  145   1HB   GLU  19          2HB       GLU  19  -1.244   7.323 -16.601
  146   2HB   GLU  19          1HB       GLU  19  -1.386   6.176 -15.268
  147   1HG   GLU  19          2HG       GLU  19   0.797   5.283 -15.682
  148   2HG   GLU  19          1HG       GLU  19   0.917   6.119 -17.231
  149    H    PHE  20           H        PHE  20  -2.608   4.106 -15.220
  150    HA   PHE  20           HA       PHE  20  -0.685   1.947 -15.035
  151   1HB   PHE  20          2HB       PHE  20  -3.178   2.685 -13.520
  152   2HB   PHE  20          1HB       PHE  20  -2.374   1.141 -13.259
  153    HD1  PHE  20           HD1      PHE  20  -2.211   4.754 -12.743
  154    HD2  PHE  20           HD2      PHE  20  -0.037   1.063 -12.425
  155    HE1  PHE  20           HE1      PHE  20  -0.574   5.852 -11.242
  156    HE2  PHE  20           HE2      PHE  20   1.593   2.151 -10.910
  157    HZ   PHE  20           HZ       PHE  20   1.331   4.549 -10.322
  158    H    LYS  21           H        LYS  21  -4.138   2.257 -15.841
  159    HA   LYS  21           HA       LYS  21  -4.816  -0.399 -16.214
  160   1HB   LYS  21          2HB       LYS  21  -6.402   1.514 -16.312
  161   2HB   LYS  21          1HB       LYS  21  -5.783   1.906 -17.915
  162   1HG   LYS  21          2HG       LYS  21  -6.492  -0.918 -17.677
  163   2HG   LYS  21          1HG       LYS  21  -7.865   0.138 -17.345
  164   1HD   LYS  21          2HD       LYS  21  -6.226   0.940 -19.672
  165   2HD   LYS  21          1HD       LYS  21  -7.072  -0.597 -19.859
  166   1HE   LYS  21          2HE       LYS  21  -8.692   0.914 -20.592
  167   2HE   LYS  21          1HE       LYS  21  -9.124   0.734 -18.893
  168   1HZ   LYS  21          1HZ       LYS  21  -7.365   2.878 -19.955
  169   2HZ   LYS  21          2HZ       LYS  21  -7.948   2.733 -18.365
  170   3HZ   LYS  21          3HZ       LYS  21  -9.021   3.067 -19.641
  171    H    ALA  22           H        ALA  22  -3.034   1.725 -18.413
  172    HA   ALA  22           HA       ALA  22  -3.171   0.176 -20.758
  173   1HB   ALA  22          1HB       ALA  22  -2.214   2.442 -20.736
  174   2HB   ALA  22          2HB       ALA  22  -1.057   1.288 -21.401
  175   3HB   ALA  22          3HB       ALA  22  -0.870   1.870 -19.747
  176    H    ALA  23           H        ALA  23  -0.650   0.221 -18.237
  177    HA   ALA  23           HA       ALA  23   0.762  -2.053 -19.218
  178   1HB   ALA  23          1HB       ALA  23   1.745  -2.058 -16.862
  179   2HB   ALA  23          2HB       ALA  23   0.727  -0.657 -16.532
  180   3HB   ALA  23          3HB       ALA  23   1.969  -0.571 -17.783
  181    H    PHE  24           H        PHE  24  -1.771  -1.550 -16.819
  182    HA   PHE  24           HA       PHE  24  -1.850  -4.100 -15.661
  183   1HB   PHE  24          2HB       PHE  24  -3.124  -1.949 -14.999
  184   2HB   PHE  24          1HB       PHE  24  -4.326  -2.458 -16.183
  185    HD1  PHE  24           HD1      PHE  24  -5.298  -4.837 -15.960
  186    HD2  PHE  24           HD2      PHE  24  -3.110  -2.873 -12.833
  187    HE1  PHE  24           HE1      PHE  24  -6.263  -6.404 -14.299
  188    HE2  PHE  24           HE2      PHE  24  -4.074  -4.437 -11.176
  189    HZ   PHE  24           HZ       PHE  24  -5.649  -6.200 -11.910
  190    H    ASP  25           H        ASP  25  -3.472  -2.844 -18.567
  191    HA   ASP  25           HA       ASP  25  -5.054  -5.131 -19.103
  192   1HB   ASP  25          2HB       ASP  25  -5.192  -2.738 -20.110
  193   2HB   ASP  25          1HB       ASP  25  -4.016  -3.339 -21.278
  194    H    ILE  26           H        ILE  26  -1.877  -4.136 -20.395
  195    HA   ILE  26           HA       ILE  26  -1.595  -6.389 -22.113
  196    HB   ILE  26           HB       ILE  26   0.804  -5.743 -22.241
  197   1HG1  ILE  26          2HG1      ILE  26   0.004  -3.575 -20.270
  198   2HG1  ILE  26          1HG1      ILE  26   0.993  -4.975 -19.861
  199   1HG2  ILE  26          1HG2      ILE  26  -1.086  -4.637 -23.555
  200   2HG2  ILE  26          2HG2      ILE  26   0.397  -3.695 -23.404
  201   3HG2  ILE  26          3HG2      ILE  26  -0.996  -3.316 -22.391
  202   1HD1  ILE  26          1HD1      ILE  26   1.932  -2.537 -20.815
  203   2HD1  ILE  26          2HD1      ILE  26   1.985  -3.587 -22.230
  204   3HD1  ILE  26          3HD1      ILE  26   2.841  -4.046 -20.759
  205    H    PHE  27           H        PHE  27  -0.616  -5.793 -18.766
  206    HA   PHE  27           HA       PHE  27   0.895  -8.248 -18.571
  207   1HB   PHE  27          2HB       PHE  27  -0.054  -6.297 -16.462
  208   2HB   PHE  27          1HB       PHE  27   0.952  -7.706 -16.123
  209    HD1  PHE  27           HD1      PHE  27   2.771  -7.814 -18.406
  210    HD2  PHE  27           HD2      PHE  27   1.326  -4.403 -16.228
  211    HE1  PHE  27           HE1      PHE  27   4.775  -6.530 -19.090
  212    HE2  PHE  27           HE2      PHE  27   3.335  -3.120 -16.917
  213    HZ   PHE  27           HZ       PHE  27   5.057  -4.184 -18.347
  214    H    ILE  28           H        ILE  28  -2.414  -7.252 -17.903
  215    HA   ILE  28           HA       ILE  28  -2.984  -9.915 -16.777
  216    HB   ILE  28           HB       ILE  28  -3.647  -7.584 -15.704
  217   1HG1  ILE  28          2HG1      ILE  28  -4.114  -9.915 -14.874
  218   2HG1  ILE  28          1HG1      ILE  28  -5.326  -8.716 -14.432
  219   1HG2  ILE  28          1HG2      ILE  28  -5.669  -6.641 -16.323
  220   2HG2  ILE  28          2HG2      ILE  28  -6.228  -8.099 -17.135
  221   3HG2  ILE  28          3HG2      ILE  28  -5.001  -7.085 -17.893
  222   1HD1  ILE  28          1HD1      ILE  28  -5.516 -10.734 -16.683
  223   2HD1  ILE  28          2HD1      ILE  28  -6.701  -9.464 -16.387
  224   3HD1  ILE  28          3HD1      ILE  28  -6.452 -10.734 -15.190
  225    H    GLN  29           H        GLN  29  -2.408  -9.681 -19.499
  226    HA   GLN  29           HA       GLN  29  -4.850  -9.636 -21.047
  227   1HB   GLN  29          2HB       GLN  29  -2.625  -8.933 -21.964
  228   2HB   GLN  29          1HB       GLN  29  -2.100 -10.612 -21.858
  229   1HG   GLN  29          2HG       GLN  29  -3.711 -11.325 -23.459
  230   2HG   GLN  29          1HG       GLN  29  -4.592  -9.800 -23.362
  231   1HE2  GLN  29          1HE2      GLN  29  -3.337  -7.810 -24.143
  232   2HE2  GLN  29          2HE2      GLN  29  -2.224  -8.024 -25.406
  233    H    ASP  30           H        ASP  30  -2.452 -12.123 -20.141
  234    HA   ASP  30           HA       ASP  30  -4.188 -14.263 -21.075
  235   1HB   ASP  30          2HB       ASP  30  -1.446 -14.233 -19.810
  236   2HB   ASP  30          1HB       ASP  30  -2.308 -15.723 -20.195
  237    H    ALA  31           H        ALA  31  -4.185 -12.448 -18.279
  238    HA   ALA  31           HA       ALA  31  -4.841 -14.717 -16.523
  239   1HB   ALA  31          1HB       ALA  31  -3.531 -13.373 -15.210
  240   2HB   ALA  31          2HB       ALA  31  -5.086 -12.603 -14.890
  241   3HB   ALA  31          3HB       ALA  31  -3.982 -11.903 -16.075
  242    H    GLU  32           H        GLU  32  -6.799 -14.730 -15.325
  243    HA   GLU  32           HA       GLU  32  -8.969 -13.055 -16.443
  244   1HB   GLU  32          2HB       GLU  32 -10.484 -15.013 -16.318
  245   2HB   GLU  32          1HB       GLU  32  -9.164 -15.266 -17.458
  246   1HG   GLU  32          2HG       GLU  32  -7.917 -16.443 -15.575
  247   2HG   GLU  32          1HG       GLU  32  -9.420 -16.387 -14.655
  248    H    ASP  33           H        ASP  33  -7.483 -12.602 -14.043
  249    HA   ASP  33           HA       ASP  33  -9.553 -13.119 -11.987
  250   1HB   ASP  33          2HB       ASP  33  -6.553 -12.889 -11.744
  251   2HB   ASP  33          1HB       ASP  33  -7.624 -12.708 -10.354
  252    H    GLY  34           H        GLY  34  -7.213 -10.768 -13.256
  253   1HA   GLY  34          2HA       GLY  34  -7.814  -8.461 -13.570
  254   2HA   GLY  34          1HA       GLY  34  -8.899  -8.592 -12.191
  255    H    CYS  35           H        CYS  35  -5.537  -9.692 -12.471
  256    HA   CYS  35           HA       CYS  35  -4.551  -7.535 -10.770
  257   1HB   CYS  35          2HB       CYS  35  -3.974 -10.326  -9.823
  258   2HB   CYS  35          1HB       CYS  35  -3.892  -8.808  -8.932
  259    HG   CYS  35           HG       CYS  35  -6.506 -10.399  -9.512
  260    H    ILE  36           H        ILE  36  -2.394  -7.152 -11.084
  261    HA   ILE  36           HA       ILE  36  -1.102  -8.714 -13.196
  262    HB   ILE  36           HB       ILE  36   0.498  -6.938 -13.374
  263   1HG1  ILE  36          2HG1      ILE  36  -0.207  -4.961 -11.550
  264   2HG1  ILE  36          1HG1      ILE  36  -0.287  -6.439 -10.591
  265   1HG2  ILE  36          1HG2      ILE  36  -1.982  -6.592 -14.099
  266   2HG2  ILE  36          2HG2      ILE  36  -0.905  -5.195 -14.073
  267   3HG2  ILE  36          3HG2      ILE  36  -2.045  -5.455 -12.752
  268   1HD1  ILE  36          1HD1      ILE  36   1.974  -6.948 -10.945
  269   2HD1  ILE  36          2HD1      ILE  36   2.008  -5.191 -10.811
  270   3HD1  ILE  36          3HD1      ILE  36   2.070  -5.956 -12.398
  271    H    SER  37           H        SER  37   1.434  -8.865 -12.827
  272    HA   SER  37           HA       SER  37   1.745 -10.482 -10.404
  273   1HB   SER  37          2HB       SER  37   2.527 -11.035 -12.903
  274   2HB   SER  37          1HB       SER  37   3.972 -10.188 -12.360
  275    HG   SER  37           HG       SER  37   4.130 -12.381 -11.861
  276    H    THR  38           H        THR  38   2.358  -9.426  -8.633
  277    HA   THR  38           HA       THR  38   3.567  -6.911  -8.482
  278    HB   THR  38           HB       THR  38   4.147  -7.470  -6.163
  279    HG1  THR  38           HG1      THR  38   3.350 -10.095  -6.882
  280   1HG2  THR  38          1HG2      THR  38   1.813  -8.377  -5.494
  281   2HG2  THR  38          2HG2      THR  38   1.465  -8.329  -7.221
  282   3HG2  THR  38          3HG2      THR  38   1.892  -6.849  -6.367
  283    H    LYS  39           H        LYS  39   5.043 -10.139  -8.563
  284    HA   LYS  39           HA       LYS  39   7.723  -9.335  -8.146
  285   1HB   LYS  39          2HB       LYS  39   8.350 -11.502  -9.100
  286   2HB   LYS  39          1HB       LYS  39   6.989 -11.693  -7.996
  287   1HG   LYS  39          2HG       LYS  39   5.565 -11.341 -10.203
  288   2HG   LYS  39          1HG       LYS  39   7.045 -11.888 -10.987
  289   1HD   LYS  39          2HD       LYS  39   6.096 -13.466  -8.642
  290   2HD   LYS  39          1HD       LYS  39   5.163 -13.604 -10.132
  291   1HE   LYS  39          2HE       LYS  39   7.582 -13.873 -11.211
  292   2HE   LYS  39          1HE       LYS  39   7.990 -14.417  -9.584
  293   1HZ   LYS  39          1HZ       LYS  39   5.821 -15.511 -11.294
  294   2HZ   LYS  39          2HZ       LYS  39   6.174 -16.017  -9.712
  295   3HZ   LYS  39          3HZ       LYS  39   7.301 -16.267 -10.958
  296    H    GLU  40           H        GLU  40   5.658  -9.236 -10.968
  297    HA   GLU  40           HA       GLU  40   7.944  -8.466 -12.671
  298   1HB   GLU  40          2HB       GLU  40   5.110  -9.168 -13.477
  299   2HB   GLU  40          1HB       GLU  40   6.458  -8.849 -14.568
  300   1HG   GLU  40          2HG       GLU  40   7.681 -10.770 -13.437
  301   2HG   GLU  40          1HG       GLU  40   6.159 -11.160 -12.638
  302    H    LEU  41           H        LEU  41   6.467  -6.766 -10.591
  303    HA   LEU  41           HA       LEU  41   4.887  -4.842 -11.932
  304   1HB   LEU  41          2HB       LEU  41   5.151  -5.198  -9.414
  305   2HB   LEU  41          1HB       LEU  41   6.615  -4.247  -9.545
  306    HG   LEU  41           HG       LEU  41   4.124  -3.071 -10.680
  307   1HD1  LEU  41          1HD1      LEU  41   3.178  -2.497  -8.612
  308   2HD1  LEU  41          2HD1      LEU  41   4.655  -2.869  -7.724
  309   3HD1  LEU  41          3HD1      LEU  41   3.655  -4.175  -8.363
  310   1HD2  LEU  41          1HD2      LEU  41   6.662  -2.175  -9.347
  311   2HD2  LEU  41          2HD2      LEU  41   5.261  -1.103  -9.335
  312   3HD2  LEU  41          3HD2      LEU  41   5.950  -1.637 -10.867
  313    H    GLY  42           H        GLY  42   8.356  -5.286 -11.700
  314   1HA   GLY  42          2HA       GLY  42   9.291  -2.718 -12.300
  315   2HA   GLY  42          1HA       GLY  42  10.100  -4.214 -12.761
  316    H    LYS  43           H        LYS  43   7.807  -5.164 -14.344
  317    HA   LYS  43           HA       LYS  43   8.491  -4.056 -16.875
  318   1HB   LYS  43          2HB       LYS  43   6.103  -5.768 -16.135
  319   2HB   LYS  43          1HB       LYS  43   6.706  -5.477 -17.766
  320   1HG   LYS  43          2HG       LYS  43   8.874  -6.506 -17.135
  321   2HG   LYS  43          1HG       LYS  43   8.232  -6.839 -15.526
  322   1HD   LYS  43          2HD       LYS  43   7.828  -8.866 -16.606
  323   2HD   LYS  43          1HD       LYS  43   6.295  -8.028 -16.852
  324   1HE   LYS  43          2HE       LYS  43   6.874  -8.878 -18.996
  325   2HE   LYS  43          1HE       LYS  43   7.305  -7.169 -19.056
  326   1HZ   LYS  43          1HZ       LYS  43   9.242  -9.287 -18.315
  327   2HZ   LYS  43          2HZ       LYS  43   9.569  -7.673 -18.734
  328   3HZ   LYS  43          3HZ       LYS  43   9.022  -8.767 -19.913
  329    H    VAL  44           H        VAL  44   6.104  -3.218 -14.481
  330    HA   VAL  44           HA       VAL  44   4.582  -1.580 -16.369
  331    HB   VAL  44           HB       VAL  44   2.877  -1.500 -14.846
  332   1HG1  VAL  44          1HG1      VAL  44   3.869  -3.684 -13.184
  333   2HG1  VAL  44          2HG1      VAL  44   4.157  -3.972 -14.898
  334   3HG1  VAL  44          3HG1      VAL  44   2.520  -3.662 -14.319
  335   1HG2  VAL  44          1HG2      VAL  44   5.058  -1.284 -12.794
  336   2HG2  VAL  44          2HG2      VAL  44   3.449  -1.772 -12.279
  337   3HG2  VAL  44          3HG2      VAL  44   3.683  -0.217 -13.078
  338    H    MET  45           H        MET  45   6.886  -1.312 -13.726
  339    HA   MET  45           HA       MET  45   6.733   1.470 -13.281
  340   1HB   MET  45          2HB       MET  45   8.908  -0.574 -12.875
  341   2HB   MET  45          1HB       MET  45   9.207   1.137 -12.572
  342   1HG   MET  45          2HG       MET  45   6.707   0.456 -11.366
  343   2HG   MET  45          1HG       MET  45   7.894  -0.752 -10.876
  344   1HE   MET  45          1HE       MET  45   7.053   2.674  -8.639
  345   2HE   MET  45          2HE       MET  45   7.014   0.949  -8.281
  346   3HE   MET  45          3HE       MET  45   6.137   1.574  -9.675
  347    H    ARG  46           H        ARG  46   8.670  -0.486 -15.535
  348    HA   ARG  46           HA       ARG  46  10.250   1.594 -16.600
  349   1HB   ARG  46          2HB       ARG  46  10.525   0.131 -18.590
  350   2HB   ARG  46          1HB       ARG  46  10.792  -0.727 -17.073
  351   1HG   ARG  46          2HG       ARG  46   8.612  -1.741 -17.172
  352   2HG   ARG  46          1HG       ARG  46   8.140  -0.726 -18.533
  353   1HD   ARG  46          2HD       ARG  46  10.010  -1.771 -19.857
  354   2HD   ARG  46          1HD       ARG  46  10.253  -2.891 -18.522
  355    HE   ARG  46           HE       ARG  46   7.572  -3.102 -19.147
  356   1HH1  ARG  46          2HH1      ARG  46  10.596  -3.464 -20.856
  357   2HH1  ARG  46          1HH1      ARG  46   9.975  -4.639 -21.962
  358   1HH2  ARG  46          1HH2      ARG  46   6.778  -4.645 -20.607
  359   2HH2  ARG  46          2HH2      ARG  46   7.819  -5.306 -21.823
  360    H    MET  47           H        MET  47   6.974   0.536 -17.356
  361    HA   MET  47           HA       MET  47   6.679   2.213 -19.681
  362   1HB   MET  47          2HB       MET  47   4.776   0.612 -17.979
  363   2HB   MET  47          1HB       MET  47   4.186   1.692 -19.243
  364   1HG   MET  47          2HG       MET  47   6.291  -0.419 -19.764
  365   2HG   MET  47          1HG       MET  47   4.566  -0.735 -19.946
  366   1HE   MET  47          1HE       MET  47   7.522  -0.245 -21.505
  367   2HE   MET  47          2HE       MET  47   7.638   1.507 -21.359
  368   3HE   MET  47          3HE       MET  47   7.362   0.778 -22.939
  369    H    LEU  48           H        LEU  48   6.087   2.506 -16.232
  370    HA   LEU  48           HA       LEU  48   4.511   4.908 -16.373
  371   1HB   LEU  48          2HB       LEU  48   5.789   3.287 -14.237
  372   2HB   LEU  48          1HB       LEU  48   5.456   4.964 -13.873
  373    HG   LEU  48           HG       LEU  48   3.092   4.638 -14.185
  374   1HD1  LEU  48          1HD1      LEU  48   3.315   1.716 -14.691
  375   2HD1  LEU  48          2HD1      LEU  48   3.717   2.772 -16.046
  376   3HD1  LEU  48          3HD1      LEU  48   2.129   2.875 -15.290
  377   1HD2  LEU  48          1HD2      LEU  48   3.212   3.904 -12.048
  378   2HD2  LEU  48          2HD2      LEU  48   4.679   2.982 -12.375
  379   3HD2  LEU  48          3HD2      LEU  48   3.098   2.270 -12.702
  380    H    GLY  49           H        GLY  49   7.928   4.138 -16.083
  381   1HA   GLY  49          2HA       GLY  49   9.391   5.930 -17.090
  382   2HA   GLY  49          1HA       GLY  49   8.562   7.035 -16.005
  383    H    GLN  50           H        GLN  50   9.341   3.836 -14.840
  384    HA   GLN  50           HA       GLN  50  11.729   4.842 -13.433
  385   1HB   GLN  50          2HB       GLN  50   9.484   3.290 -12.117
  386   2HB   GLN  50          1HB       GLN  50  10.966   3.847 -11.341
  387   1HG   GLN  50          2HG       GLN  50  10.048   5.862 -10.949
  388   2HG   GLN  50          1HG       GLN  50   9.711   6.065 -12.667
  389   1HE2  GLN  50          1HE2      GLN  50   7.530   6.253 -13.155
  390   2HE2  GLN  50          2HE2      GLN  50   6.265   5.628 -12.213
  391    H    ASN  51           H        ASN  51  13.169   3.167 -12.699
  392    HA   ASN  51           HA       ASN  51  12.634   0.453 -13.674
  393   1HB   ASN  51          2HB       ASN  51  14.971   0.413 -14.707
  394   2HB   ASN  51          1HB       ASN  51  13.736   1.301 -15.595
  395   1HD2  ASN  51          1HD2      ASN  51  16.851   1.568 -14.156
  396   2HD2  ASN  51          2HD2      ASN  51  17.009   3.253 -14.280
  397    HA   PRO  52           HA       PRO  52  14.989   0.542  -9.690
  398   1HB   PRO  52          2HB       PRO  52  13.042  -0.567  -8.124
  399   2HB   PRO  52          1HB       PRO  52  13.183   1.171  -8.429
  400   1HG   PRO  52          2HG       PRO  52  11.206  -0.756  -9.461
  401   2HG   PRO  52          1HG       PRO  52  11.082   1.000  -9.285
  402   1HD   PRO  52          2HD       PRO  52  11.613  -0.466 -11.690
  403   2HD   PRO  52          1HD       PRO  52  11.612   1.301 -11.482
  404    H    THR  53           H        THR  53  14.584  -1.626  -7.946
  405    HA   THR  53           HA       THR  53  15.393  -3.903  -9.644
  406    HB   THR  53           HB       THR  53  16.728  -4.665  -7.887
  407    HG1  THR  53           HG1      THR  53  16.115  -4.573  -5.875
  408   1HG2  THR  53          1HG2      THR  53  16.643  -1.694  -7.318
  409   2HG2  THR  53          2HG2      THR  53  17.494  -2.420  -8.683
  410   3HG2  THR  53          3HG2      THR  53  17.994  -2.792  -7.033
  411    HA   PRO  54           HA       PRO  54  11.868  -6.259  -8.423
  412   1HB   PRO  54          2HB       PRO  54  12.871  -8.701  -7.681
  413   2HB   PRO  54          1HB       PRO  54  12.748  -8.144  -9.357
  414   1HG   PRO  54          2HG       PRO  54  15.141  -8.331  -7.602
  415   2HG   PRO  54          1HG       PRO  54  15.013  -8.498  -9.360
  416   1HD   PRO  54          2HD       PRO  54  15.942  -6.226  -8.026
  417   2HD   PRO  54          1HD       PRO  54  15.368  -6.256  -9.710
  418    H    GLU  55           H        GLU  55  14.443  -6.098  -6.052
  419    HA   GLU  55           HA       GLU  55  12.789  -6.944  -3.824
  420   1HB   GLU  55          2HB       GLU  55  15.573  -5.794  -4.036
  421   2HB   GLU  55          1HB       GLU  55  14.784  -6.066  -2.482
  422   1HG   GLU  55          2HG       GLU  55  14.642  -8.413  -2.843
  423   2HG   GLU  55          1HG       GLU  55  15.008  -8.249  -4.560
  424    H    GLU  56           H        GLU  56  13.901  -3.929  -5.301
  425    HA   GLU  56           HA       GLU  56  13.030  -2.176  -3.233
  426   1HB   GLU  56          2HB       GLU  56  13.608  -1.735  -6.165
  427   2HB   GLU  56          1HB       GLU  56  13.126  -0.432  -5.079
  428   1HG   GLU  56          2HG       GLU  56  15.521  -2.246  -4.649
  429   2HG   GLU  56          1HG       GLU  56  15.602  -0.610  -5.299
  430    H    LEU  57           H        LEU  57  11.551  -3.142  -6.344
  431    HA   LEU  57           HA       LEU  57   9.183  -1.624  -6.001
  432   1HB   LEU  57          2HB       LEU  57   8.237  -3.036  -7.763
  433   2HB   LEU  57          1HB       LEU  57   9.803  -2.393  -8.188
  434    HG   LEU  57           HG       LEU  57  10.587  -4.785  -7.251
  435   1HD1  LEU  57          1HD1      LEU  57   8.552  -5.792  -6.663
  436   2HD1  LEU  57          2HD1      LEU  57   8.797  -6.387  -8.304
  437   3HD1  LEU  57          3HD1      LEU  57   7.687  -5.050  -8.008
  438   1HD2  LEU  57          1HD2      LEU  57  10.551  -5.539  -9.610
  439   2HD2  LEU  57          2HD2      LEU  57  11.036  -3.848  -9.493
  440   3HD2  LEU  57          3HD2      LEU  57   9.398  -4.262  -9.995
  441    H    GLN  58           H        GLN  58  10.094  -4.886  -4.988
  442    HA   GLN  58           HA       GLN  58   7.539  -5.864  -4.323
  443   1HB   GLN  58          2HB       GLN  58   9.686  -7.202  -4.388
  444   2HB   GLN  58          1HB       GLN  58  10.084  -6.501  -2.820
  445   1HG   GLN  58          2HG       GLN  58   9.023  -8.602  -2.366
  446   2HG   GLN  58          1HG       GLN  58   7.832  -7.356  -1.996
  447   1HE2  GLN  58          1HE2      GLN  58   5.920  -7.248  -3.321
  448   2HE2  GLN  58          2HE2      GLN  58   5.585  -8.388  -4.532
  449    H    GLU  59           H        GLU  59   9.815  -3.848  -2.494
  450    HA   GLU  59           HA       GLU  59   8.455  -3.903  -0.006
  451   1HB   GLU  59          2HB       GLU  59  10.272  -1.819  -1.236
  452   2HB   GLU  59          1HB       GLU  59   9.652  -1.718   0.412
  453   1HG   GLU  59          2HG       GLU  59  10.829  -3.634   1.108
  454   2HG   GLU  59          1HG       GLU  59  11.065  -4.203  -0.545
  455    H    MET  60           H        MET  60   8.158  -1.800  -2.852
  456    HA   MET  60           HA       MET  60   6.266   0.006  -1.715
  457   1HB   MET  60          2HB       MET  60   6.566  -0.668  -4.652
  458   2HB   MET  60          1HB       MET  60   5.894   0.806  -3.957
  459   1HG   MET  60          2HG       MET  60   8.768  -0.119  -3.669
  460   2HG   MET  60          1HG       MET  60   8.210   1.165  -4.739
  461   1HE   MET  60          1HE       MET  60  10.539   1.778  -2.457
  462   2HE   MET  60          2HE       MET  60   9.857   0.265  -1.870
  463   3HE   MET  60          3HE       MET  60   9.895   1.674  -0.812
  464    H    ILE  61           H        ILE  61   6.024  -2.992  -3.537
  465    HA   ILE  61           HA       ILE  61   3.217  -2.998  -3.939
  466    HB   ILE  61           HB       ILE  61   5.188  -5.291  -3.755
  467   1HG1  ILE  61          2HG1      ILE  61   3.845  -4.297  -6.248
  468   2HG1  ILE  61          1HG1      ILE  61   5.229  -3.411  -5.609
  469   1HG2  ILE  61          1HG2      ILE  61   3.497  -6.728  -4.611
  470   2HG2  ILE  61          2HG2      ILE  61   2.424  -5.377  -4.980
  471   3HG2  ILE  61          3HG2      ILE  61   2.713  -5.844  -3.304
  472   1HD1  ILE  61          1HD1      ILE  61   5.547  -5.432  -7.318
  473   2HD1  ILE  61          2HD1      ILE  61   5.465  -6.378  -5.834
  474   3HD1  ILE  61          3HD1      ILE  61   6.701  -5.138  -6.019
  475    H    ASP  62           H        ASP  62   5.259  -4.525  -1.442
  476    HA   ASP  62           HA       ASP  62   3.247  -5.765   0.048
  477   1HB   ASP  62          2HB       ASP  62   5.910  -5.667   0.310
  478   2HB   ASP  62          1HB       ASP  62   5.479  -4.489   1.550
  479    H    GLU  63           H        GLU  63   4.374  -2.415   0.092
  480    HA   GLU  63           HA       GLU  63   2.942  -1.584   2.403
  481   1HB   GLU  63          2HB       GLU  63   4.245  -0.175   0.102
  482   2HB   GLU  63          1HB       GLU  63   3.197   0.734   1.192
  483   1HG   GLU  63          2HG       GLU  63   5.302  -1.067   2.350
  484   2HG   GLU  63          1HG       GLU  63   5.772   0.512   1.723
  485    H    VAL  64           H        VAL  64   2.156  -1.475  -1.077
  486    HA   VAL  64           HA       VAL  64  -0.408  -0.220  -0.595
  487    HB   VAL  64           HB       VAL  64   0.841   0.241  -2.667
  488   1HG1  VAL  64          1HG1      VAL  64   0.898  -1.518  -4.436
  489   2HG1  VAL  64          2HG1      VAL  64   0.297  -2.683  -3.259
  490   3HG1  VAL  64          3HG1      VAL  64   1.877  -1.935  -3.031
  491   1HG2  VAL  64          1HG2      VAL  64  -1.590  -1.245  -3.581
  492   2HG2  VAL  64          2HG2      VAL  64  -1.062   0.390  -3.976
  493   3HG2  VAL  64          3HG2      VAL  64  -1.801   0.057  -2.411
  494    H    ASP  65           H        ASP  65   0.756  -3.510  -1.134
  495    HA   ASP  65           HA       ASP  65  -1.803  -4.680  -1.626
  496   1HB   ASP  65          2HB       ASP  65   0.835  -5.577  -1.708
  497   2HB   ASP  65          1HB       ASP  65   0.120  -6.480  -0.378
  498    H    GLU  66           H        GLU  66  -3.391  -4.608  -0.194
  499    HA   GLU  66           HA       GLU  66  -3.020  -4.242   2.611
  500   1HB   GLU  66          2HB       GLU  66  -5.518  -5.271   1.248
  501   2HB   GLU  66          1HB       GLU  66  -5.407  -4.458   2.809
  502   1HG   GLU  66          2HG       GLU  66  -4.458  -2.450   1.574
  503   2HG   GLU  66          1HG       GLU  66  -4.895  -3.267   0.073
  504    H    ASP  67           H        ASP  67  -3.971  -7.049   0.641
  505    HA   ASP  67           HA       ASP  67  -3.843  -8.790   2.983
  506   1HB   ASP  67          2HB       ASP  67  -4.792 -10.506   1.589
  507   2HB   ASP  67          1HB       ASP  67  -5.694  -9.018   1.325
  508    H    GLY  68           H        GLY  68  -2.004  -8.123   0.056
  509   1HA   GLY  68          2HA       GLY  68   0.223  -8.612  -0.385
  510   2HA   GLY  68          1HA       GLY  68   0.305  -9.473   1.145
  511    H    SER  69           H        SER  69  -1.835  -9.958  -1.655
  512    HA   SER  69           HA       SER  69  -1.448 -12.816  -1.601
  513   1HB   SER  69          2HB       SER  69  -2.774 -12.633  -3.828
  514   2HB   SER  69          1HB       SER  69  -3.589 -12.225  -2.324
  515    HG   SER  69           HG       SER  69  -3.824 -10.280  -3.072
  516    H    GLY  70           H        GLY  70   0.274 -10.243  -3.081
  517   1HA   GLY  70          2HA       GLY  70   2.286 -10.469  -4.278
  518   2HA   GLY  70          1HA       GLY  70   1.876 -12.150  -4.615
  519    H    THR  71           H        THR  71  -0.616  -9.807  -5.076
  520    HA   THR  71           HA       THR  71  -0.083  -9.536  -7.950
  521    HB   THR  71           HB       THR  71  -2.353 -10.212  -8.540
  522    HG1  THR  71           HG1      THR  71  -3.774 -10.126  -7.017
  523   1HG2  THR  71          1HG2      THR  71  -2.204 -12.613  -8.016
  524   2HG2  THR  71          2HG2      THR  71  -1.017 -12.267  -6.757
  525   3HG2  THR  71          3HG2      THR  71  -0.621 -11.967  -8.449
  526    H    VAL  72           H        VAL  72  -0.514  -7.514  -8.644
  527    HA   VAL  72           HA       VAL  72  -1.748  -5.655  -6.738
  528    HB   VAL  72           HB       VAL  72  -0.575  -4.897  -9.408
  529   1HG1  VAL  72          1HG1      VAL  72  -1.946  -3.258  -8.100
  530   2HG1  VAL  72          2HG1      VAL  72  -0.275  -2.744  -8.329
  531   3HG1  VAL  72          3HG1      VAL  72  -0.788  -3.408  -6.778
  532   1HG2  VAL  72          1HG2      VAL  72   0.859  -5.312  -6.767
  533   2HG2  VAL  72          2HG2      VAL  72   1.539  -4.425  -8.132
  534   3HG2  VAL  72          3HG2      VAL  72   1.182  -6.146  -8.289
  535    H    ASP  73           H        ASP  73  -3.823  -5.228  -6.858
  536    HA   ASP  73           HA       ASP  73  -5.373  -5.829  -9.247
  537   1HB   ASP  73          2HB       ASP  73  -6.046  -4.814  -6.485
  538   2HB   ASP  73          1HB       ASP  73  -7.237  -4.756  -7.784
  539    H    PHE  74           H        PHE  74  -6.891  -4.048 -10.100
  540    HA   PHE  74           HA       PHE  74  -5.335  -1.877 -10.989
  541   1HB   PHE  74          2HB       PHE  74  -7.459  -2.785 -12.074
  542   2HB   PHE  74          1HB       PHE  74  -8.349  -1.803 -10.907
  543    HD1  PHE  74           HD1      PHE  74  -5.136  -1.189 -12.724
  544    HD2  PHE  74           HD2      PHE  74  -9.196   0.055 -12.074
  545    HE1  PHE  74           HE1      PHE  74  -4.756   0.805 -14.140
  546    HE2  PHE  74           HE2      PHE  74  -8.808   2.058 -13.493
  547    HZ   PHE  74           HZ       PHE  74  -6.592   2.426 -14.522
  548    H    ASP  75           H        ASP  75  -7.394  -2.242  -8.175
  549    HA   ASP  75           HA       ASP  75  -7.549   0.539  -7.501
  550   1HB   ASP  75          2HB       ASP  75  -7.876  -1.957  -5.811
  551   2HB   ASP  75          1HB       ASP  75  -8.181  -0.321  -5.228
  552    H    GLU  76           H        GLU  76  -5.449  -2.164  -6.546
  553    HA   GLU  76           HA       GLU  76  -3.808  -0.645  -4.749
  554   1HB   GLU  76          2HB       GLU  76  -3.159  -3.223  -6.208
  555   2HB   GLU  76          1HB       GLU  76  -2.309  -2.578  -4.805
  556   1HG   GLU  76          2HG       GLU  76  -4.259  -2.857  -3.406
  557   2HG   GLU  76          1HG       GLU  76  -5.262  -3.265  -4.796
  558    H    PHE  77           H        PHE  77  -3.789  -1.326  -8.186
  559    HA   PHE  77           HA       PHE  77  -1.130  -0.592  -8.793
  560   1HB   PHE  77          2HB       PHE  77  -3.097  -1.703 -10.236
  561   2HB   PHE  77          1HB       PHE  77  -3.309  -0.039 -10.755
  562    HD1  PHE  77           HD1      PHE  77  -2.753  -0.945 -13.024
  563    HD2  PHE  77           HD2      PHE  77   0.107  -0.915  -9.809
  564    HE1  PHE  77           HE1      PHE  77  -0.906  -1.216 -14.648
  565    HE2  PHE  77           HE2      PHE  77   1.943  -1.174 -11.445
  566    HZ   PHE  77           HZ       PHE  77   1.436  -1.330 -13.866
  567    H    LEU  78           H        LEU  78  -4.173   1.249  -8.945
  568    HA   LEU  78           HA       LEU  78  -2.913   3.727  -9.652
  569   1HB   LEU  78          2HB       LEU  78  -5.662   2.898  -8.820
  570   2HB   LEU  78          1HB       LEU  78  -5.239   4.600  -8.777
  571    HG   LEU  78           HG       LEU  78  -5.002   4.716 -11.120
  572   1HD1  LEU  78          1HD1      LEU  78  -4.763   2.819 -12.586
  573   2HD1  LEU  78          2HD1      LEU  78  -5.097   1.692 -11.271
  574   3HD1  LEU  78          3HD1      LEU  78  -3.598   2.623 -11.277
  575   1HD2  LEU  78          1HD2      LEU  78  -7.144   4.196 -11.828
  576   2HD2  LEU  78          2HD2      LEU  78  -7.361   4.062 -10.083
  577   3HD2  LEU  78          3HD2      LEU  78  -7.128   2.611 -11.057
  578    H    VAL  79           H        VAL  79  -3.896   2.188  -6.637
  579    HA   VAL  79           HA       VAL  79  -3.643   4.432  -4.925
  580    HB   VAL  79           HB       VAL  79  -3.775   1.477  -4.590
  581   1HG1  VAL  79          1HG1      VAL  79  -1.832   2.028  -3.194
  582   2HG1  VAL  79          2HG1      VAL  79  -3.228   1.631  -2.188
  583   3HG1  VAL  79          3HG1      VAL  79  -2.749   3.315  -2.408
  584   1HG2  VAL  79          1HG2      VAL  79  -5.701   3.173  -4.535
  585   2HG2  VAL  79          2HG2      VAL  79  -5.056   3.689  -2.976
  586   3HG2  VAL  79          3HG2      VAL  79  -5.619   2.031  -3.191
  587    H    MET  80           H        MET  80  -1.351   1.893  -5.888
  588    HA   MET  80           HA       MET  80   0.856   2.481  -4.348
  589   1HB   MET  80          2HB       MET  80   0.366   0.911  -6.599
  590   2HB   MET  80          1HB       MET  80   1.641   2.015  -7.114
  591   1HG   MET  80          2HG       MET  80   1.947   0.811  -4.411
  592   2HG   MET  80          1HG       MET  80   2.152  -0.276  -5.783
  593   1HE   MET  80          1HE       MET  80   4.949   0.186  -7.473
  594   2HE   MET  80          2HE       MET  80   4.165   1.627  -8.116
  595   3HE   MET  80          3HE       MET  80   3.197   0.212  -7.715
  596    H    MET  81           H        MET  81  -0.422   4.322  -7.060
  597    HA   MET  81           HA       MET  81   1.865   5.908  -7.610
  598   1HB   MET  81          2HB       MET  81  -0.127   5.734  -9.105
  599   2HB   MET  81          1HB       MET  81  -1.046   6.676  -7.933
  600   1HG   MET  81          2HG       MET  81   0.508   8.558  -8.188
  601   2HG   MET  81          1HG       MET  81   1.488   7.615  -9.312
  602   1HE   MET  81          1HE       MET  81  -2.510   7.283  -9.339
  603   2HE   MET  81          2HE       MET  81  -2.869   8.900  -9.933
  604   3HE   MET  81          3HE       MET  81  -1.993   8.702  -8.419
  605    H    VAL  82           H        VAL  82  -1.059   6.636  -5.670
  606    HA   VAL  82           HA       VAL  82  -0.020   9.082  -4.622
  607    HB   VAL  82           HB       VAL  82  -1.892   8.950  -2.995
  608   1HG1  VAL  82          1HG1      VAL  82  -2.356   9.946  -5.136
  609   2HG1  VAL  82          2HG1      VAL  82  -3.718   8.896  -4.743
  610   3HG1  VAL  82          3HG1      VAL  82  -2.501   8.363  -5.902
  611   1HG2  VAL  82          1HG2      VAL  82  -2.574   6.341  -4.381
  612   2HG2  VAL  82          2HG2      VAL  82  -3.435   7.092  -3.036
  613   3HG2  VAL  82          3HG2      VAL  82  -1.819   6.434  -2.789
  614    H    ARG  83           H        ARG  83   0.144   5.729  -3.603
  615    HA   ARG  83           HA       ARG  83   0.895   6.011  -0.922
  616   1HB   ARG  83          2HB       ARG  83   1.627   3.949  -3.001
  617   2HB   ARG  83          1HB       ARG  83   2.193   3.841  -1.335
  618   1HG   ARG  83          2HG       ARG  83  -0.552   4.400  -1.134
  619   2HG   ARG  83          1HG       ARG  83  -0.423   3.207  -2.425
  620   1HD   ARG  83          2HD       ARG  83  -0.426   1.734  -0.678
  621   2HD   ARG  83          1HD       ARG  83   1.290   2.119  -0.641
  622    HE   ARG  83           HE       ARG  83   0.947   3.259   1.356
  623   1HH1  ARG  83          2HH1      ARG  83  -2.113   2.618  -0.205
  624   2HH1  ARG  83          1HH1      ARG  83  -3.055   3.139   1.148
  625   1HH2  ARG  83          1HH2      ARG  83  -0.312   3.941   3.117
  626   2HH2  ARG  83          2HH2      ARG  83  -2.040   3.886   3.023
  627    H    CYS  84           H        CYS  84   2.766   6.403  -3.887
  628    HA   CYS  84           HA       CYS  84   5.371   6.393  -2.847
  629   1HB   CYS  84          2HB       CYS  84   4.512   6.607  -5.322
  630   2HB   CYS  84          1HB       CYS  84   4.598   8.338  -4.998
  631    HG   CYS  84           HG       CYS  84   6.938   7.161  -5.893
  632    H    MET  85           H        MET  85   2.944   8.968  -3.046
  633    HA   MET  85           HA       MET  85   4.668  10.992  -1.921
  634   1HB   MET  85          2HB       MET  85   2.418  11.168  -3.381
  635   2HB   MET  85          1HB       MET  85   1.706  11.275  -1.770
  636   1HG   MET  85          2HG       MET  85   4.125  12.938  -2.356
  637   2HG   MET  85          1HG       MET  85   2.578  13.453  -3.028
  638   1HE   MET  85          1HE       MET  85   3.312  15.638  -1.537
  639   2HE   MET  85          2HE       MET  85   2.078  15.865  -0.301
  640   3HE   MET  85          3HE       MET  85   1.610  15.327  -1.911
  641    H    LYS  86           H        LYS  86   1.836   9.153  -0.762
  642    HA   LYS  86           HA       LYS  86   1.206   8.443   1.319
  643   1HB   LYS  86          2HB       LYS  86   3.955   8.172   1.327
  644   2HB   LYS  86          1HB       LYS  86   3.651   9.143   2.768
  645   1HG   LYS  86          2HG       LYS  86   2.492   7.467   3.822
  646   2HG   LYS  86          1HG       LYS  86   1.822   6.843   2.315
  647   1HD   LYS  86          2HD       LYS  86   3.619   5.479   1.913
  648   2HD   LYS  86          1HD       LYS  86   4.767   6.586   2.669
  649   1HE   LYS  86          2HE       LYS  86   2.727   5.302   4.433
  650   2HE   LYS  86          1HE       LYS  86   4.044   4.290   3.844
  651   1HZ   LYS  86          1HZ       LYS  86   4.409   6.905   5.205
  652   2HZ   LYS  86          2HZ       LYS  86   5.635   5.824   4.736
  653   3HZ   LYS  86          3HZ       LYS  86   4.546   5.396   5.968
  654    H    ASP  87           H        ASP  87   0.738   9.179   3.520
  655    HA   ASP  87           HA       ASP  87   0.660  12.137   3.670
  656   1HB   ASP  87          2HB       ASP  87  -1.481  10.417   3.620
  657   2HB   ASP  87          1HB       ASP  87  -1.238  10.640   5.352
  658    H    ASP  88           H        ASP  88   2.888  10.565   4.588
  659    HA   ASP  88           HA       ASP  88   2.632  10.635   7.522
  660   1HB   ASP  88          2HB       ASP  88   3.779   8.746   5.922
  661   2HB   ASP  88          1HB       ASP  88   5.179   9.733   6.342
  662    H    SER  89           HN       SER  89   4.608  11.898   4.850
  663    HA   SER  89           HA       SER  89   6.421  13.400   6.425
  664   1HB   SER  89          2HB       SER  89   5.504  13.990   3.600
  665   2HB   SER  89          1HB       SER  89   6.969  14.587   4.369
  666    HG   SER  89           HG       SER  89   6.410  12.133   3.259
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1  -7.841  10.051   9.295
    2   2H    MET   1          2H        MET   1  -7.880   8.519   8.561
    3   3H    MET   1          3H        MET   1  -7.429   9.886   7.657
    4    HA   MET   1           HA       MET   1  -5.495  10.171   9.189
    5   1HB   MET   1          2HB       MET   1  -6.702   7.624  10.212
    6   2HB   MET   1          1HB       MET   1  -4.947   7.791  10.227
    7   1HG   MET   1          2HG       MET   1  -5.128   9.867  11.516
    8   2HG   MET   1          1HG       MET   1  -6.889   9.771  11.455
    9   1HE   MET   1          1HE       MET   1  -5.453  10.367  13.657
   10   2HE   MET   1          2HE       MET   1  -4.604   9.167  14.626
   11   3HE   MET   1          3HE       MET   1  -6.317   9.465  14.910
   12    H    ASN   2           H        ASN   2  -6.546   7.042   7.791
   13    HA   ASN   2           HA       ASN   2  -4.209   7.173   5.974
   14   1HB   ASN   2          2HB       ASN   2  -4.354   4.673   5.889
   15   2HB   ASN   2          1HB       ASN   2  -3.938   5.305   7.481
   16   1HD2  ASN   2          1HD2      ASN   2  -6.505   3.724   5.611
   17   2HD2  ASN   2          2HD2      ASN   2  -7.482   3.348   6.948
   18    H    ASP   3           H        ASP   3  -6.904   8.319   5.538
   19    HA   ASP   3           HA       ASP   3  -7.835   6.628   3.300
   20   1HB   ASP   3          2HB       ASP   3  -9.371   7.533   5.289
   21   2HB   ASP   3          1HB       ASP   3  -9.447   8.951   4.244
   22    H    ILE   4           H        ILE   4  -5.496   8.451   3.229
   23    HA   ILE   4           HA       ILE   4  -6.355  10.700   1.595
   24    HB   ILE   4           HB       ILE   4  -3.967  11.269   1.454
   25   1HG1  ILE   4          2HG1      ILE   4  -2.597   9.682   3.178
   26   2HG1  ILE   4          1HG1      ILE   4  -3.697   8.492   2.485
   27   1HG2  ILE   4          1HG2      ILE   4  -5.084  10.580   4.176
   28   2HG2  ILE   4          2HG2      ILE   4  -5.059  12.150   3.372
   29   3HG2  ILE   4          3HG2      ILE   4  -3.560  11.444   3.977
   30   1HD1  ILE   4          1HD1      ILE   4  -2.366  10.364   0.588
   31   2HD1  ILE   4          2HD1      ILE   4  -2.781   8.664   0.385
   32   3HD1  ILE   4          3HD1      ILE   4  -1.359   9.118   1.322
   33    H    TYR   5           H        TYR   5  -4.970   7.511   1.170
   34    HA   TYR   5           HA       TYR   5  -4.201   7.824  -1.573
   35   1HB   TYR   5          2HB       TYR   5  -4.925   5.242  -0.160
   36   2HB   TYR   5          1HB       TYR   5  -3.948   5.420  -1.616
   37    HD1  TYR   5           HD1      TYR   5  -1.774   6.834  -1.420
   38    HD2  TYR   5           HD2      TYR   5  -3.915   5.268   1.959
   39    HE1  TYR   5           HE1      TYR   5   0.249   7.094  -0.018
   40    HE2  TYR   5           HE2      TYR   5  -1.890   5.529   3.362
   41    HH   TYR   5           HH       TYR   5   0.264   7.161   3.191
   42    H    LYS   6           H        LYS   6  -7.105   6.735   0.117
   43    HA   LYS   6           HA       LYS   6  -8.512   5.919  -2.259
   44   1HB   LYS   6          2HB       LYS   6  -9.163   6.178   0.637
   45   2HB   LYS   6          1HB       LYS   6 -10.507   6.199  -0.506
   46   1HG   LYS   6          2HG       LYS   6 -10.020   4.048  -1.317
   47   2HG   LYS   6          1HG       LYS   6  -8.364   4.092  -0.711
   48   1HD   LYS   6          2HD       LYS   6 -10.492   4.362   1.340
   49   2HD   LYS   6          1HD       LYS   6 -10.374   2.785   0.560
   50   1HE   LYS   6          2HE       LYS   6  -7.845   4.093   1.483
   51   2HE   LYS   6          1HE       LYS   6  -8.900   3.369   2.698
   52   1HZ   LYS   6          1HZ       LYS   6  -7.294   1.768   1.894
   53   2HZ   LYS   6          2HZ       LYS   6  -7.812   2.002   0.293
   54   3HZ   LYS   6          3HZ       LYS   6  -8.857   1.298   1.434
   55    H    ALA   7           H        ALA   7  -8.179   8.891  -0.422
   56    HA   ALA   7           HA       ALA   7 -10.452  10.265  -1.403
   57   1HB   ALA   7          1HB       ALA   7  -7.815  11.528  -0.638
   58   2HB   ALA   7          2HB       ALA   7  -8.997  10.967   0.544
   59   3HB   ALA   7          3HB       ALA   7  -9.418  12.261  -0.579
   60    H    ALA   8           H        ALA   8  -7.288   9.646  -2.789
   61    HA   ALA   8           HA       ALA   8  -7.587  11.627  -4.890
   62   1HB   ALA   8          1HB       ALA   8  -5.469  10.778  -5.726
   63   2HB   ALA   8          2HB       ALA   8  -5.567   9.390  -4.642
   64   3HB   ALA   8          3HB       ALA   8  -5.354  11.012  -3.982
   65    H    VAL   9           H        VAL   9  -7.738   8.072  -4.624
   66    HA   VAL   9           HA       VAL   9  -8.189   7.597  -7.387
   67    HB   VAL   9           HB       VAL   9  -7.449   5.857  -5.732
   68   1HG1  VAL   9          1HG1      VAL   9  -9.050   6.380  -3.939
   69   2HG1  VAL   9          2HG1      VAL   9  -9.205   4.697  -4.439
   70   3HG1  VAL   9          3HG1      VAL   9 -10.388   5.890  -4.976
   71   1HG2  VAL   9          1HG2      VAL   9  -8.452   5.404  -8.037
   72   2HG2  VAL   9          2HG2      VAL   9  -9.967   5.051  -7.207
   73   3HG2  VAL   9          3HG2      VAL   9  -8.538   4.068  -6.888
   74    H    GLU  10           H        GLU  10 -10.306   8.655  -4.828
   75    HA   GLU  10           HA       GLU  10 -12.737   7.930  -6.223
   76   1HB   GLU  10          2HB       GLU  10 -13.899   9.014  -4.403
   77   2HB   GLU  10          1HB       GLU  10 -12.597   8.030  -3.735
   78   1HG   GLU  10          2HG       GLU  10 -11.485   9.831  -2.924
   79   2HG   GLU  10          1HG       GLU  10 -11.786  10.787  -4.373
   80    H    GLN  11           H        GLN  11 -10.517  10.584  -6.310
   81    HA   GLN  11           HA       GLN  11 -12.442  12.078  -7.983
   82   1HB   GLN  11          2HB       GLN  11 -11.716  14.185  -7.059
   83   2HB   GLN  11          1HB       GLN  11 -12.212  13.140  -5.730
   84   1HG   GLN  11          2HG       GLN  11  -9.715  12.466  -5.587
   85   2HG   GLN  11          1HG       GLN  11  -9.413  13.887  -6.584
   86   1HE2  GLN  11          1HE2      GLN  11  -8.391  13.791  -3.940
   87   2HE2  GLN  11          2HE2      GLN  11  -9.230  14.917  -2.984
   88    H    LEU  12           H        LEU  12 -10.254  10.224  -8.695
   89    HA   LEU  12           HA       LEU  12  -8.094  11.855  -9.728
   90   1HB   LEU  12          2HB       LEU  12  -7.610   9.642 -11.021
   91   2HB   LEU  12          1HB       LEU  12  -7.285   9.757  -9.308
   92    HG   LEU  12           HG       LEU  12  -9.266   8.477  -8.792
   93   1HD1  LEU  12          1HD1      LEU  12 -10.890   9.166 -10.363
   94   2HD1  LEU  12          2HD1      LEU  12 -10.552   7.494 -10.811
   95   3HD1  LEU  12          3HD1      LEU  12  -9.835   8.815 -11.734
   96   1HD2  LEU  12          1HD2      LEU  12  -8.723   6.364 -10.079
   97   2HD2  LEU  12          2HD2      LEU  12  -7.336   7.135  -9.312
   98   3HD2  LEU  12          3HD2      LEU  12  -7.603   7.324 -11.045
   99    H    THR  13           H        THR  13  -7.499  11.424 -12.159
  100    HA   THR  13           HA       THR  13  -9.819  12.330 -13.722
  101    HB   THR  13           HB       THR  13  -7.713  12.451 -15.454
  102    HG1  THR  13           HG1      THR  13  -6.090  11.964 -14.143
  103   1HG2  THR  13          1HG2      THR  13  -7.515  14.882 -14.352
  104   2HG2  THR  13          2HG2      THR  13  -8.993  14.346 -13.551
  105   3HG2  THR  13          3HG2      THR  13  -8.912  14.394 -15.313
  106    H    ASP  14           H        ASP  14  -9.944  11.556 -15.998
  107    HA   ASP  14           HA       ASP  14 -10.159   8.702 -16.073
  108   1HB   ASP  14          2HB       ASP  14 -10.579  10.914 -18.053
  109   2HB   ASP  14          1HB       ASP  14 -10.489   9.249 -18.624
  110    H    GLU  15           H        GLU  15  -7.803  11.068 -17.177
  111    HA   GLU  15           HA       GLU  15  -6.276   9.324 -18.845
  112   1HB   GLU  15          2HB       GLU  15  -5.669  11.935 -17.465
  113   2HB   GLU  15          1HB       GLU  15  -4.428  11.056 -18.358
  114   1HG   GLU  15          2HG       GLU  15  -5.300  11.644 -20.361
  115   2HG   GLU  15          1HG       GLU  15  -6.945  11.275 -19.843
  116    H    GLN  16           H        GLN  16  -6.317   9.998 -15.393
  117    HA   GLN  16           HA       GLN  16  -3.832   8.740 -14.750
  118   1HB   GLN  16          2HB       GLN  16  -6.026   9.986 -13.310
  119   2HB   GLN  16          1HB       GLN  16  -5.502   8.504 -12.512
  120   1HG   GLN  16          2HG       GLN  16  -3.319   9.288 -12.194
  121   2HG   GLN  16          1HG       GLN  16  -3.462  10.487 -13.480
  122   1HE2  GLN  16          1HE2      GLN  16  -5.427   9.771 -10.526
  123   2HE2  GLN  16          2HE2      GLN  16  -5.429  11.374  -9.972
  124    H    LYS  17           H        LYS  17  -7.229   7.693 -14.689
  125    HA   LYS  17           HA       LYS  17  -6.764   5.058 -13.752
  126   1HB   LYS  17          2HB       LYS  17  -9.017   6.135 -15.471
  127   2HB   LYS  17          1HB       LYS  17  -9.011   4.556 -14.685
  128   1HG   LYS  17          2HG       LYS  17  -9.186   5.470 -12.543
  129   2HG   LYS  17          1HG       LYS  17  -8.518   7.024 -13.044
  130   1HD   LYS  17          2HD       LYS  17 -10.752   7.604 -12.915
  131   2HD   LYS  17          1HD       LYS  17 -10.693   7.054 -14.588
  132   1HE   LYS  17          2HE       LYS  17 -11.108   4.709 -13.143
  133   2HE   LYS  17          1HE       LYS  17 -12.107   5.897 -12.306
  134   1HZ   LYS  17          1HZ       LYS  17 -13.122   6.493 -14.405
  135   2HZ   LYS  17          2HZ       LYS  17 -13.301   4.827 -14.123
  136   3HZ   LYS  17          3HZ       LYS  17 -12.140   5.383 -15.233
  137    H    ASN  18           H        ASN  18  -7.095   6.423 -17.026
  138    HA   ASN  18           HA       ASN  18  -6.804   3.969 -18.429
  139   1HB   ASN  18          2HB       ASN  18  -6.371   6.848 -19.234
  140   2HB   ASN  18          1HB       ASN  18  -6.108   5.512 -20.354
  141   1HD2  ASN  18          1HD2      ASN  18  -7.943   6.143 -21.702
  142   2HD2  ASN  18          2HD2      ASN  18  -9.541   5.927 -21.171
  143    H    GLU  19           H        GLU  19  -4.477   6.294 -17.166
  144    HA   GLU  19           HA       GLU  19  -2.165   5.526 -18.530
  145   1HB   GLU  19          2HB       GLU  19  -2.374   7.457 -16.921
  146   2HB   GLU  19          1HB       GLU  19  -2.282   6.289 -15.603
  147   1HG   GLU  19          2HG       GLU  19  -0.041   6.765 -15.781
  148   2HG   GLU  19          1HG       GLU  19  -0.131   5.494 -16.999
  149    H    PHE  20           H        PHE  20  -3.489   4.241 -15.472
  150    HA   PHE  20           HA       PHE  20  -1.499   2.129 -15.374
  151   1HB   PHE  20          2HB       PHE  20  -3.799   2.956 -13.633
  152   2HB   PHE  20          1HB       PHE  20  -3.050   1.376 -13.423
  153    HD1  PHE  20           HD1      PHE  20  -2.589   5.009 -13.126
  154    HD2  PHE  20           HD2      PHE  20  -0.708   1.170 -12.699
  155    HE1  PHE  20           HE1      PHE  20  -0.754   6.051 -11.828
  156    HE2  PHE  20           HE2      PHE  20   1.117   2.199 -11.393
  157    HZ   PHE  20           HZ       PHE  20   1.104   4.647 -10.960
  158    H    LYS  21           H        LYS  21  -5.025   2.371 -15.909
  159    HA   LYS  21           HA       LYS  21  -5.644  -0.332 -16.077
  160   1HB   LYS  21          2HB       LYS  21  -7.251   1.636 -16.141
  161   2HB   LYS  21          1HB       LYS  21  -6.893   1.754 -17.859
  162   1HG   LYS  21          2HG       LYS  21  -8.867   0.396 -17.651
  163   2HG   LYS  21          1HG       LYS  21  -7.541  -0.694 -18.056
  164   1HD   LYS  21          2HD       LYS  21  -7.282  -1.287 -15.683
  165   2HD   LYS  21          1HD       LYS  21  -8.581  -0.173 -15.254
  166   1HE   LYS  21          2HE       LYS  21  -9.781  -2.150 -15.392
  167   2HE   LYS  21          1HE       LYS  21  -9.932  -1.582 -17.054
  168   1HZ   LYS  21          1HZ       LYS  21  -8.059  -2.956 -17.676
  169   2HZ   LYS  21          2HZ       LYS  21  -9.257  -3.909 -16.941
  170   3HZ   LYS  21          3HZ       LYS  21  -7.862  -3.475 -16.073
  171    H    ALA  22           H        ALA  22  -4.145   1.737 -18.521
  172    HA   ALA  22           HA       ALA  22  -4.433   0.034 -20.759
  173   1HB   ALA  22          1HB       ALA  22  -2.423   1.221 -21.646
  174   2HB   ALA  22          2HB       ALA  22  -2.221   1.987 -20.071
  175   3HB   ALA  22          3HB       ALA  22  -3.656   2.326 -21.040
  176    H    ALA  23           H        ALA  23  -1.705   0.416 -18.501
  177    HA   ALA  23           HA       ALA  23  -0.194  -1.791 -19.461
  178   1HB   ALA  23          1HB       ALA  23   0.712  -1.583 -16.951
  179   2HB   ALA  23          2HB       ALA  23  -0.126  -0.035 -17.047
  180   3HB   ALA  23          3HB       ALA  23   1.158  -0.417 -18.197
  181    H    PHE  24           H        PHE  24  -2.616  -1.362 -16.938
  182    HA   PHE  24           HA       PHE  24  -2.448  -3.811 -15.617
  183   1HB   PHE  24          2HB       PHE  24  -3.947  -1.757 -15.116
  184   2HB   PHE  24          1HB       PHE  24  -5.092  -2.502 -16.231
  185    HD1  PHE  24           HD1      PHE  24  -5.918  -4.851 -15.771
  186    HD2  PHE  24           HD2      PHE  24  -3.651  -2.592 -12.912
  187    HE1  PHE  24           HE1      PHE  24  -6.666  -6.377 -13.968
  188    HE2  PHE  24           HE2      PHE  24  -4.398  -4.111 -11.112
  189    HZ   PHE  24           HZ       PHE  24  -5.909  -5.998 -11.634
  190    H    ASP  25           H        ASP  25  -4.351  -2.928 -18.500
  191    HA   ASP  25           HA       ASP  25  -5.641  -5.393 -18.883
  192   1HB   ASP  25          2HB       ASP  25  -6.085  -3.162 -20.065
  193   2HB   ASP  25          1HB       ASP  25  -4.777  -3.614 -21.157
  194    H    ILE  26           H        ILE  26  -2.528  -4.241 -20.203
  195    HA   ILE  26           HA       ILE  26  -2.077  -6.634 -21.721
  196    HB   ILE  26           HB       ILE  26   0.245  -5.761 -22.007
  197   1HG1  ILE  26          2HG1      ILE  26  -0.773  -3.442 -20.331
  198   2HG1  ILE  26          1HG1      ILE  26   0.391  -4.641 -19.773
  199   1HG2  ILE  26          1HG2      ILE  26  -0.417  -3.922 -23.409
  200   2HG2  ILE  26          2HG2      ILE  26  -1.863  -3.630 -22.441
  201   3HG2  ILE  26          3HG2      ILE  26  -1.742  -5.086 -23.430
  202   1HD1  ILE  26          1HD1      ILE  26   1.046  -2.274 -21.008
  203   2HD1  ILE  26          2HD1      ILE  26   1.097  -3.414 -22.353
  204   3HD1  ILE  26          3HD1      ILE  26   2.095  -3.689 -20.924
  205    H    PHE  27           H        PHE  27  -1.011  -5.512 -18.519
  206    HA   PHE  27           HA       PHE  27   0.787  -7.689 -18.078
  207   1HB   PHE  27          2HB       PHE  27  -0.497  -5.681 -16.229
  208   2HB   PHE  27          1HB       PHE  27   0.536  -6.979 -15.625
  209    HD1  PHE  27           HD1      PHE  27   2.754  -7.297 -17.233
  210    HD2  PHE  27           HD2      PHE  27   0.597  -3.647 -16.559
  211    HE1  PHE  27           HE1      PHE  27   4.756  -5.991 -17.889
  212    HE2  PHE  27           HE2      PHE  27   2.597  -2.341 -17.221
  213    HZ   PHE  27           HZ       PHE  27   4.679  -3.512 -17.882
  214    H    ILE  28           H        ILE  28  -2.676  -7.241 -17.492
  215    HA   ILE  28           HA       ILE  28  -2.787  -9.861 -16.139
  216    HB   ILE  28           HB       ILE  28  -5.054  -9.343 -15.511
  217   1HG1  ILE  28          2HG1      ILE  28  -5.703  -6.811 -16.234
  218   2HG1  ILE  28          1HG1      ILE  28  -4.777  -7.298 -17.653
  219   1HG2  ILE  28          1HG2      ILE  28  -2.989  -8.171 -14.408
  220   2HG2  ILE  28          2HG2      ILE  28  -4.617  -7.644 -13.982
  221   3HG2  ILE  28          3HG2      ILE  28  -3.660  -6.711 -15.133
  222   1HD1  ILE  28          1HD1      ILE  28  -6.293  -8.922 -18.262
  223   2HD1  ILE  28          2HD1      ILE  28  -7.393  -7.809 -17.448
  224   3HD1  ILE  28          3HD1      ILE  28  -6.791  -9.231 -16.598
  225    H    GLN  29           H        GLN  29  -2.640  -8.984 -19.233
  226    HA   GLN  29           HA       GLN  29  -4.875  -9.950 -20.572
  227   1HB   GLN  29          2HB       GLN  29  -3.073  -8.831 -21.755
  228   2HB   GLN  29          1HB       GLN  29  -1.955 -10.134 -21.355
  229   1HG   GLN  29          2HG       GLN  29  -3.134 -11.695 -22.728
  230   2HG   GLN  29          1HG       GLN  29  -4.502 -10.599 -22.920
  231   1HE2  GLN  29          1HE2      GLN  29  -3.973  -8.470 -24.104
  232   2HE2  GLN  29          2HE2      GLN  29  -2.800  -8.527 -25.329
  233    H    ASP  30           H        ASP  30  -2.129 -11.734 -19.223
  234    HA   ASP  30           HA       ASP  30  -3.198 -14.289 -20.168
  235   1HB   ASP  30          2HB       ASP  30  -0.659 -13.504 -19.966
  236   2HB   ASP  30          1HB       ASP  30  -0.845 -14.157 -18.339
  237    H    ALA  31           H        ALA  31  -3.880 -12.337 -17.575
  238    HA   ALA  31           HA       ALA  31  -4.191 -14.539 -15.654
  239   1HB   ALA  31          1HB       ALA  31  -4.743 -11.608 -15.175
  240   2HB   ALA  31          2HB       ALA  31  -3.152 -12.336 -14.946
  241   3HB   ALA  31          3HB       ALA  31  -4.519 -12.879 -13.973
  242    H    GLU  32           H        GLU  32  -6.183 -14.969 -14.666
  243    HA   GLU  32           HA       GLU  32  -8.563 -13.937 -16.101
  244   1HB   GLU  32          2HB       GLU  32  -9.610 -16.154 -15.823
  245   2HB   GLU  32          1HB       GLU  32  -8.136 -16.257 -16.781
  246   1HG   GLU  32          2HG       GLU  32  -7.108 -16.644 -14.296
  247   2HG   GLU  32          1HG       GLU  32  -8.714 -17.336 -14.076
  248    H    ASP  33           H        ASP  33  -7.494 -12.794 -13.745
  249    HA   ASP  33           HA       ASP  33  -9.650 -13.419 -11.816
  250   1HB   ASP  33          2HB       ASP  33  -7.222 -14.162 -11.189
  251   2HB   ASP  33          1HB       ASP  33  -6.969 -12.443 -10.882
  252    H    GLY  34           H        GLY  34  -7.274 -10.993 -12.883
  253   1HA   GLY  34          2HA       GLY  34  -8.169  -8.784 -13.540
  254   2HA   GLY  34          1HA       GLY  34  -9.187  -8.865 -12.106
  255    H    CYS  35           H        CYS  35  -5.781  -9.801 -12.370
  256    HA   CYS  35           HA       CYS  35  -4.871  -7.421 -10.939
  257   1HB   CYS  35          2HB       CYS  35  -4.559 -10.210  -9.795
  258   2HB   CYS  35          1HB       CYS  35  -3.743  -8.771  -9.189
  259    HG   CYS  35           HG       CYS  35  -6.765  -9.386  -8.871
  260    H    ILE  36           H        ILE  36  -2.714  -6.979 -11.323
  261    HA   ILE  36           HA       ILE  36  -1.449  -8.549 -13.425
  262    HB   ILE  36           HB       ILE  36   0.159  -6.811 -13.623
  263   1HG1  ILE  36          2HG1      ILE  36  -0.335  -4.907 -11.655
  264   2HG1  ILE  36          1HG1      ILE  36  -0.402  -6.434 -10.775
  265   1HG2  ILE  36          1HG2      ILE  36  -1.301  -4.707 -13.579
  266   2HG2  ILE  36          2HG2      ILE  36  -2.585  -5.740 -12.952
  267   3HG2  ILE  36          3HG2      ILE  36  -1.894  -6.057 -14.544
  268   1HD1  ILE  36          1HD1      ILE  36   1.920  -5.149 -11.281
  269   2HD1  ILE  36          2HD1      ILE  36   1.815  -6.139 -12.739
  270   3HD1  ILE  36          3HD1      ILE  36   1.814  -6.906 -11.150
  271    H    SER  37           H        SER  37   1.065  -8.835 -13.108
  272    HA   SER  37           HA       SER  37   1.346 -10.485 -10.706
  273   1HB   SER  37          2HB       SER  37   1.981 -11.482 -12.855
  274   2HB   SER  37          1HB       SER  37   3.150 -10.193 -13.122
  275    HG   SER  37           HG       SER  37   3.356 -12.449 -11.629
  276    H    THR  38           H        THR  38   2.040  -9.468  -8.931
  277    HA   THR  38           HA       THR  38   3.425  -7.033  -8.790
  278    HB   THR  38           HB       THR  38   4.027  -7.680  -6.481
  279    HG1  THR  38           HG1      THR  38   4.268  -9.708  -6.094
  280   1HG2  THR  38          1HG2      THR  38   1.254  -8.186  -7.513
  281   2HG2  THR  38          2HG2      THR  38   1.857  -6.818  -6.577
  282   3HG2  THR  38          3HG2      THR  38   1.608  -8.379  -5.796
  283    H    LYS  39           H        LYS  39   4.576 -10.341  -9.092
  284    HA   LYS  39           HA       LYS  39   7.344  -9.875  -8.646
  285   1HB   LYS  39          2HB       LYS  39   6.107 -11.987 -10.435
  286   2HB   LYS  39          1HB       LYS  39   7.711 -12.027  -9.704
  287   1HG   LYS  39          2HG       LYS  39   6.895 -12.505  -7.595
  288   2HG   LYS  39          1HG       LYS  39   5.360 -11.689  -7.892
  289   1HD   LYS  39          2HD       LYS  39   4.778 -13.542  -9.505
  290   2HD   LYS  39          1HD       LYS  39   6.226 -14.388  -8.961
  291   1HE   LYS  39          2HE       LYS  39   4.331 -13.402  -6.871
  292   2HE   LYS  39          1HE       LYS  39   3.852 -14.814  -7.812
  293   1HZ   LYS  39          1HZ       LYS  39   6.376 -14.508  -6.274
  294   2HZ   LYS  39          2HZ       LYS  39   5.973 -15.852  -7.233
  295   3HZ   LYS  39          3HZ       LYS  39   5.056 -15.485  -5.851
  296    H    GLU  40           H        GLU  40   5.246  -9.582 -11.455
  297    HA   GLU  40           HA       GLU  40   7.524  -8.869 -13.181
  298   1HB   GLU  40          2HB       GLU  40   4.601  -9.280 -13.869
  299   2HB   GLU  40          1HB       GLU  40   5.893  -8.958 -15.025
  300   1HG   GLU  40          2HG       GLU  40   5.964 -11.315 -13.127
  301   2HG   GLU  40          1HG       GLU  40   5.246 -11.413 -14.734
  302    H    LEU  41           H        LEU  41   6.222  -7.174 -10.942
  303    HA   LEU  41           HA       LEU  41   4.931  -4.977 -12.225
  304   1HB   LEU  41          2HB       LEU  41   4.621  -5.399  -9.852
  305   2HB   LEU  41          1HB       LEU  41   6.328  -5.161  -9.556
  306    HG   LEU  41           HG       LEU  41   6.104  -2.782 -10.163
  307   1HD1  LEU  41          1HD1      LEU  41   3.669  -3.690 -11.340
  308   2HD1  LEU  41          2HD1      LEU  41   4.352  -2.064 -11.373
  309   3HD1  LEU  41          3HD1      LEU  41   3.248  -2.530 -10.078
  310   1HD2  LEU  41          1HD2      LEU  41   5.491  -3.851  -7.823
  311   2HD2  LEU  41          2HD2      LEU  41   3.864  -3.311  -8.237
  312   3HD2  LEU  41          3HD2      LEU  41   5.180  -2.142  -8.125
  313    H    GLY  42           H        GLY  42   8.234  -5.950 -11.985
  314   1HA   GLY  42          2HA       GLY  42   9.587  -3.490 -12.038
  315   2HA   GLY  42          1HA       GLY  42  10.185  -4.992 -12.739
  316    H    LYS  43           H        LYS  43   8.079  -5.393 -14.631
  317    HA   LYS  43           HA       LYS  43   9.006  -3.792 -16.806
  318   1HB   LYS  43          2HB       LYS  43   6.573  -5.590 -16.600
  319   2HB   LYS  43          1HB       LYS  43   7.186  -4.888 -18.096
  320   1HG   LYS  43          2HG       LYS  43   8.930  -6.581 -16.298
  321   2HG   LYS  43          1HG       LYS  43   7.928  -7.290 -17.565
  322   1HD   LYS  43          2HD       LYS  43   9.106  -5.349 -19.008
  323   2HD   LYS  43          1HD       LYS  43  10.369  -5.599 -17.803
  324   1HE   LYS  43          2HE       LYS  43  11.003  -7.220 -19.312
  325   2HE   LYS  43          1HE       LYS  43   9.855  -8.169 -18.368
  326   1HZ   LYS  43          1HZ       LYS  43   9.426  -8.389 -20.727
  327   2HZ   LYS  43          2HZ       LYS  43   9.254  -6.706 -20.885
  328   3HZ   LYS  43          3HZ       LYS  43   8.131  -7.597 -19.971
  329    H    VAL  44           H        VAL  44   6.443  -3.461 -14.486
  330    HA   VAL  44           HA       VAL  44   4.976  -1.470 -16.021
  331    HB   VAL  44           HB       VAL  44   4.553  -1.951 -13.089
  332   1HG1  VAL  44          1HG1      VAL  44   2.294  -1.784 -14.955
  333   2HG1  VAL  44          2HG1      VAL  44   3.339  -0.366 -14.986
  334   3HG1  VAL  44          3HG1      VAL  44   2.597  -0.880 -13.472
  335   1HG2  VAL  44          1HG2      VAL  44   2.903  -3.638 -14.816
  336   2HG2  VAL  44          2HG2      VAL  44   3.776  -4.062 -13.346
  337   3HG2  VAL  44          3HG2      VAL  44   4.608  -4.079 -14.898
  338    H    MET  45           H        MET  45   6.918  -1.599 -13.035
  339    HA   MET  45           HA       MET  45   6.844   1.092 -12.329
  340   1HB   MET  45          2HB       MET  45   8.846  -1.095 -11.898
  341   2HB   MET  45          1HB       MET  45   9.273   0.558 -11.455
  342   1HG   MET  45          2HG       MET  45   7.190   0.696 -10.091
  343   2HG   MET  45          1HG       MET  45   6.858  -0.992 -10.474
  344   1HE   MET  45          1HE       MET  45   9.209   0.652  -7.121
  345   2HE   MET  45          2HE       MET  45   7.489   0.654  -7.504
  346   3HE   MET  45          3HE       MET  45   8.609   1.568  -8.510
  347    H    ARG  46           H        ARG  46   9.033  -0.582 -14.579
  348    HA   ARG  46           HA       ARG  46  10.632   1.707 -15.185
  349   1HB   ARG  46          2HB       ARG  46  10.123  -0.705 -16.947
  350   2HB   ARG  46          1HB       ARG  46  11.468   0.430 -17.073
  351   1HG   ARG  46          2HG       ARG  46  11.173  -0.747 -14.393
  352   2HG   ARG  46          1HG       ARG  46  11.523  -1.932 -15.650
  353   1HD   ARG  46          2HD       ARG  46  13.378  -0.320 -16.409
  354   2HD   ARG  46          1HD       ARG  46  13.136   0.495 -14.869
  355    HE   ARG  46           HE       ARG  46  14.110  -1.332 -13.782
  356   1HH1  ARG  46          2HH1      ARG  46  13.506  -2.066 -17.147
  357   2HH1  ARG  46          1HH1      ARG  46  14.451  -3.515 -17.127
  358   1HH2  ARG  46          1HH2      ARG  46  15.339  -3.237 -13.784
  359   2HH2  ARG  46          2HH2      ARG  46  15.484  -4.177 -15.232
  360    H    MET  47           H        MET  47   7.614   0.419 -16.437
  361    HA   MET  47           HA       MET  47   7.435   2.064 -18.765
  362   1HB   MET  47          2HB       MET  47   6.087  -0.064 -18.205
  363   2HB   MET  47          1HB       MET  47   5.071   0.991 -17.227
  364   1HG   MET  47          2HG       MET  47   4.098   0.782 -19.450
  365   2HG   MET  47          1HG       MET  47   4.697   2.428 -19.235
  366   1HE   MET  47          1HE       MET  47   4.993  -0.957 -20.690
  367   2HE   MET  47          2HE       MET  47   6.652  -1.023 -20.100
  368   3HE   MET  47          3HE       MET  47   6.344  -0.942 -21.833
  369    H    LEU  48           H        LEU  48   6.519   2.431 -15.385
  370    HA   LEU  48           HA       LEU  48   4.988   4.839 -15.712
  371   1HB   LEU  48          2HB       LEU  48   6.076   3.254 -13.448
  372   2HB   LEU  48          1HB       LEU  48   5.752   4.944 -13.138
  373    HG   LEU  48           HG       LEU  48   3.417   4.664 -13.560
  374   1HD1  LEU  48          1HD1      LEU  48   2.808   2.079 -14.110
  375   2HD1  LEU  48          2HD1      LEU  48   4.343   2.218 -14.966
  376   3HD1  LEU  48          3HD1      LEU  48   3.016   3.307 -15.360
  377   1HD2  LEU  48          1HD2      LEU  48   3.101   2.365 -12.144
  378   2HD2  LEU  48          2HD2      LEU  48   3.572   3.897 -11.407
  379   3HD2  LEU  48          3HD2      LEU  48   4.801   2.700 -11.815
  380    H    GLY  49           H        GLY  49   8.354   4.040 -15.148
  381   1HA   GLY  49          2HA       GLY  49   9.958   5.724 -16.061
  382   2HA   GLY  49          1HA       GLY  49   9.049   6.922 -15.147
  383    H    GLN  50           H        GLN  50   9.780   3.694 -13.913
  384    HA   GLN  50           HA       GLN  50  11.792   4.854 -12.080
  385   1HB   GLN  50          2HB       GLN  50   9.715   2.820 -11.239
  386   2HB   GLN  50          1HB       GLN  50  10.873   3.659 -10.209
  387   1HG   GLN  50          2HG       GLN  50   8.698   5.055 -11.794
  388   2HG   GLN  50          1HG       GLN  50   8.545   4.605 -10.097
  389   1HE2  GLN  50          1HE2      GLN  50   8.930   7.317 -11.716
  390   2HE2  GLN  50          2HE2      GLN  50  10.099   8.122 -10.785
  391    H    ASN  51           H        ASN  51  13.585   3.660 -11.809
  392    HA   ASN  51           HA       ASN  51  13.592   0.888 -12.864
  393   1HB   ASN  51          2HB       ASN  51  14.808   2.734 -14.245
  394   2HB   ASN  51          1HB       ASN  51  16.021   2.668 -12.968
  395   1HD2  ASN  51          1HD2      ASN  51  15.533   1.482 -15.975
  396   2HD2  ASN  51          2HD2      ASN  51  16.273  -0.039 -15.831
  397    HA   PRO  52           HA       PRO  52  15.221   0.957  -8.509
  398   1HB   PRO  52          2HB       PRO  52  13.300  -0.631  -7.390
  399   2HB   PRO  52          1HB       PRO  52  13.145   1.125  -7.548
  400   1HG   PRO  52          2HG       PRO  52  11.791  -1.023  -9.049
  401   2HG   PRO  52          1HG       PRO  52  11.277   0.645  -8.758
  402   1HD   PRO  52          2HD       PRO  52  12.450  -0.396 -11.148
  403   2HD   PRO  52          1HD       PRO  52  12.087   1.306 -10.784
  404    H    THR  53           H        THR  53  14.990  -1.352  -7.006
  405    HA   THR  53           HA       THR  53  16.408  -3.358  -8.653
  406    HB   THR  53           HB       THR  53  17.604  -3.987  -6.728
  407    HG1  THR  53           HG1      THR  53  16.760  -3.964  -4.786
  408   1HG2  THR  53          1HG2      THR  53  17.002  -1.060  -6.244
  409   2HG2  THR  53          2HG2      THR  53  18.160  -1.667  -7.429
  410   3HG2  THR  53          3HG2      THR  53  18.434  -1.937  -5.707
  411    HA   PRO  54           HA       PRO  54  13.212  -6.325  -7.894
  412   1HB   PRO  54          2HB       PRO  54  14.491  -8.587  -7.023
  413   2HB   PRO  54          1HB       PRO  54  14.516  -8.015  -8.698
  414   1HG   PRO  54          2HG       PRO  54  16.638  -7.873  -6.626
  415   2HG   PRO  54          1HG       PRO  54  16.784  -7.987  -8.386
  416   1HD   PRO  54          2HD       PRO  54  17.113  -5.649  -6.872
  417   2HD   PRO  54          1HD       PRO  54  16.847  -5.706  -8.629
  418    H    GLU  55           H        GLU  55  15.354  -5.726  -5.203
  419    HA   GLU  55           HA       GLU  55  13.640  -6.925  -3.195
  420   1HB   GLU  55          2HB       GLU  55  16.053  -5.102  -2.975
  421   2HB   GLU  55          1HB       GLU  55  15.204  -5.794  -1.594
  422   1HG   GLU  55          2HG       GLU  55  16.026  -7.703  -3.724
  423   2HG   GLU  55          1HG       GLU  55  17.325  -7.001  -2.760
  424    H    GLU  56           H        GLU  56  14.419  -3.677  -4.412
  425    HA   GLU  56           HA       GLU  56  12.740  -2.273  -2.568
  426   1HB   GLU  56          2HB       GLU  56  14.700  -1.452  -4.213
  427   2HB   GLU  56          1HB       GLU  56  13.310  -1.076  -5.231
  428   1HG   GLU  56          2HG       GLU  56  13.303   0.870  -4.027
  429   2HG   GLU  56          1HG       GLU  56  12.425  -0.110  -2.852
  430    H    LEU  57           H        LEU  57  12.305  -3.578  -5.836
  431    HA   LEU  57           HA       LEU  57   9.819  -2.438  -6.452
  432   1HB   LEU  57          2HB       LEU  57  10.927  -3.494  -8.211
  433   2HB   LEU  57          1HB       LEU  57  11.288  -4.917  -7.267
  434    HG   LEU  57           HG       LEU  57   9.608  -5.145  -9.163
  435   1HD1  LEU  57          1HD1      LEU  57   8.896  -7.005  -8.102
  436   2HD1  LEU  57          2HD1      LEU  57   8.150  -6.078  -6.800
  437   3HD1  LEU  57          3HD1      LEU  57   9.876  -6.440  -6.747
  438   1HD2  LEU  57          1HD2      LEU  57   7.811  -3.791  -9.162
  439   2HD2  LEU  57          2HD2      LEU  57   8.337  -3.075  -7.640
  440   3HD2  LEU  57          3HD2      LEU  57   7.296  -4.498  -7.630
  441    H    GLN  58           H        GLN  58  10.663  -5.475  -4.796
  442    HA   GLN  58           HA       GLN  58   7.983  -6.324  -4.323
  443   1HB   GLN  58          2HB       GLN  58  10.675  -7.175  -3.480
  444   2HB   GLN  58          1HB       GLN  58   9.408  -7.488  -2.293
  445   1HG   GLN  58          2HG       GLN  58   9.095  -8.225  -5.210
  446   2HG   GLN  58          1HG       GLN  58   9.807  -9.328  -4.033
  447   1HE2  GLN  58          1HE2      GLN  58   6.809  -8.088  -5.258
  448   2HE2  GLN  58          2HE2      GLN  58   5.793  -8.855  -4.136
  449    H    GLU  59           H        GLU  59  10.240  -4.276  -2.536
  450    HA   GLU  59           HA       GLU  59   8.927  -4.150  -0.061
  451   1HB   GLU  59          2HB       GLU  59  10.806  -2.379  -1.538
  452   2HB   GLU  59          1HB       GLU  59   9.899  -1.653  -0.211
  453   1HG   GLU  59          2HG       GLU  59  10.796  -3.152   1.380
  454   2HG   GLU  59          1HG       GLU  59  11.325  -4.290   0.140
  455    H    MET  60           H        MET  60   8.317  -2.426  -3.086
  456    HA   MET  60           HA       MET  60   6.330  -0.662  -1.997
  457   1HB   MET  60          2HB       MET  60   6.594  -1.486  -4.893
  458   2HB   MET  60          1HB       MET  60   5.871  -0.012  -4.254
  459   1HG   MET  60          2HG       MET  60   8.778  -0.701  -3.799
  460   2HG   MET  60          1HG       MET  60   8.240   0.199  -5.214
  461   1HE   MET  60          1HE       MET  60   9.967   2.778  -2.859
  462   2HE   MET  60          2HE       MET  60  10.172   1.619  -4.170
  463   3HE   MET  60          3HE       MET  60  10.236   1.068  -2.498
  464    H    ILE  61           H        ILE  61   6.325  -3.850  -3.469
  465    HA   ILE  61           HA       ILE  61   3.554  -4.082  -3.965
  466    HB   ILE  61           HB       ILE  61   5.639  -6.199  -3.387
  467   1HG1  ILE  61          2HG1      ILE  61   5.960  -4.920  -5.472
  468   2HG1  ILE  61          1HG1      ILE  61   5.474  -6.574  -5.830
  469   1HG2  ILE  61          1HG2      ILE  61   3.545  -7.204  -2.808
  470   2HG2  ILE  61          2HG2      ILE  61   3.901  -7.739  -4.449
  471   3HG2  ILE  61          3HG2      ILE  61   2.726  -6.451  -4.178
  472   1HD1  ILE  61          1HD1      ILE  61   4.027  -5.418  -7.225
  473   2HD1  ILE  61          2HD1      ILE  61   3.920  -4.032  -6.138
  474   3HD1  ILE  61          3HD1      ILE  61   3.037  -5.513  -5.768
  475    H    ASP  62           H        ASP  62   5.423  -5.459  -1.216
  476    HA   ASP  62           HA       ASP  62   3.175  -6.297   0.243
  477   1HB   ASP  62          2HB       ASP  62   4.631  -6.469   2.178
  478   2HB   ASP  62          1HB       ASP  62   5.474  -7.043   0.745
  479    H    GLU  63           H        GLU  63   4.664  -3.114   0.036
  480    HA   GLU  63           HA       GLU  63   3.266  -2.059   2.338
  481   1HB   GLU  63          2HB       GLU  63   4.948  -0.858   0.154
  482   2HB   GLU  63          1HB       GLU  63   4.006   0.178   1.226
  483   1HG   GLU  63          2HG       GLU  63   5.105  -0.793   3.185
  484   2HG   GLU  63          1HG       GLU  63   5.996  -1.913   2.155
  485    H    VAL  64           H        VAL  64   2.981  -1.555  -1.186
  486    HA   VAL  64           HA       VAL  64   0.583  -0.014  -1.018
  487    HB   VAL  64           HB       VAL  64   1.713  -1.541  -3.380
  488   1HG1  VAL  64          1HG1      VAL  64   0.464   0.419  -4.567
  489   2HG1  VAL  64          2HG1      VAL  64  -0.429   0.549  -3.052
  490   3HG1  VAL  64          3HG1      VAL  64  -0.477  -0.952  -3.976
  491   1HG2  VAL  64          1HG2      VAL  64   2.043   1.407  -2.893
  492   2HG2  VAL  64          2HG2      VAL  64   3.040   0.318  -3.858
  493   3HG2  VAL  64          3HG2      VAL  64   3.130   0.264  -2.098
  494    H    ASP  65           H        ASP  65   1.095  -3.254  -2.422
  495    HA   ASP  65           HA       ASP  65  -1.556  -4.018  -2.698
  496   1HB   ASP  65          2HB       ASP  65   0.852  -5.230  -3.168
  497   2HB   ASP  65          1HB       ASP  65   0.237  -6.192  -1.825
  498    H    GLU  66           H        GLU  66  -2.981  -3.670  -1.108
  499    HA   GLU  66           HA       GLU  66  -2.498  -3.991   1.673
  500   1HB   GLU  66          2HB       GLU  66  -5.221  -4.158   0.376
  501   2HB   GLU  66          1HB       GLU  66  -4.817  -3.579   1.992
  502   1HG   GLU  66          2HG       GLU  66  -3.364  -1.812   0.721
  503   2HG   GLU  66          1HG       GLU  66  -4.377  -2.232  -0.660
  504    H    ASP  67           H        ASP  67  -3.671  -6.162  -0.825
  505    HA   ASP  67           HA       ASP  67  -4.541  -8.204   1.028
  506   1HB   ASP  67          2HB       ASP  67  -3.978  -8.540  -1.925
  507   2HB   ASP  67          1HB       ASP  67  -5.004  -9.546  -0.905
  508    H    GLY  68           H        GLY  68  -1.768  -7.785  -1.180
  509   1HA   GLY  68          2HA       GLY  68   0.387  -8.623  -1.041
  510   2HA   GLY  68          1HA       GLY  68  -0.016  -9.286   0.544
  511    H    SER  69           H        SER  69  -1.745  -9.846  -2.478
  512    HA   SER  69           HA       SER  69  -1.414 -12.732  -2.144
  513   1HB   SER  69          2HB       SER  69  -3.101 -12.745  -4.085
  514   2HB   SER  69          1HB       SER  69  -3.662 -12.142  -2.529
  515    HG   SER  69           HG       SER  69  -3.924 -10.243  -3.399
  516    H    GLY  70           H        GLY  70   0.569 -10.594  -3.441
  517   1HA   GLY  70          2HA       GLY  70   2.276 -10.781  -4.979
  518   2HA   GLY  70          1HA       GLY  70   1.719 -12.414  -5.326
  519    H    THR  71           H        THR  71  -0.628  -9.881  -5.519
  520    HA   THR  71           HA       THR  71  -0.276  -9.507  -8.398
  521    HB   THR  71           HB       THR  71  -2.501 -10.218  -8.971
  522    HG1  THR  71           HG1      THR  71  -3.984 -10.744  -7.474
  523   1HG2  THR  71          1HG2      THR  71  -2.418 -12.617  -8.391
  524   2HG2  THR  71          2HG2      THR  71  -1.223 -12.270  -7.139
  525   3HG2  THR  71          3HG2      THR  71  -0.821 -12.016  -8.839
  526    H    VAL  72           H        VAL  72  -0.818  -7.488  -9.015
  527    HA   VAL  72           HA       VAL  72  -1.948  -5.708  -6.970
  528    HB   VAL  72           HB       VAL  72  -0.903  -4.837  -9.660
  529   1HG1  VAL  72          1HG1      VAL  72  -0.449  -2.754  -8.395
  530   2HG1  VAL  72          2HG1      VAL  72  -1.121  -3.502  -6.946
  531   3HG1  VAL  72          3HG1      VAL  72  -2.156  -3.194  -8.340
  532   1HG2  VAL  72          1HG2      VAL  72   1.281  -4.446  -8.523
  533   2HG2  VAL  72          2HG2      VAL  72   0.885  -6.164  -8.639
  534   3HG2  VAL  72          3HG2      VAL  72   0.673  -5.309  -7.109
  535    H    ASP  73           H        ASP  73  -4.020  -5.228  -6.986
  536    HA   ASP  73           HA       ASP  73  -5.704  -5.768  -9.302
  537   1HB   ASP  73          2HB       ASP  73  -6.226  -5.894  -6.649
  538   2HB   ASP  73          1HB       ASP  73  -6.768  -4.249  -6.972
  539    H    PHE  74           H        PHE  74  -7.211  -3.972 -10.070
  540    HA   PHE  74           HA       PHE  74  -5.719  -1.796 -11.013
  541   1HB   PHE  74          2HB       PHE  74  -7.907  -2.658 -11.968
  542   2HB   PHE  74          1HB       PHE  74  -8.721  -1.737 -10.702
  543    HD1  PHE  74           HD1      PHE  74  -5.658  -1.000 -12.717
  544    HD2  PHE  74           HD2      PHE  74  -9.677   0.143 -11.728
  545    HE1  PHE  74           HE1      PHE  74  -5.414   1.061 -14.079
  546    HE2  PHE  74           HE2      PHE  74  -9.427   2.203 -13.083
  547    HZ   PHE  74           HZ       PHE  74  -7.298   2.661 -14.257
  548    H    ASP  75           H        ASP  75  -7.653  -2.140  -8.088
  549    HA   ASP  75           HA       ASP  75  -7.681   0.634  -7.377
  550   1HB   ASP  75          2HB       ASP  75  -7.906  -1.796  -5.572
  551   2HB   ASP  75          1HB       ASP  75  -8.342  -0.142  -5.145
  552    H    GLU  76           H        GLU  76  -5.602  -2.128  -6.562
  553    HA   GLU  76           HA       GLU  76  -3.847  -0.654  -4.834
  554   1HB   GLU  76          2HB       GLU  76  -3.332  -3.266  -6.286
  555   2HB   GLU  76          1HB       GLU  76  -2.416  -2.633  -4.917
  556   1HG   GLU  76          2HG       GLU  76  -4.386  -2.776  -3.478
  557   2HG   GLU  76          1HG       GLU  76  -5.380  -3.290  -4.840
  558    H    PHE  77           H        PHE  77  -4.048  -1.234  -8.269
  559    HA   PHE  77           HA       PHE  77  -1.387  -0.597  -9.023
  560   1HB   PHE  77          2HB       PHE  77  -3.456  -1.619 -10.374
  561   2HB   PHE  77          1HB       PHE  77  -3.689   0.064 -10.811
  562    HD1  PHE  77           HD1      PHE  77  -3.307  -0.687 -13.151
  563    HD2  PHE  77           HD2      PHE  77  -0.216  -0.931 -10.158
  564    HE1  PHE  77           HE1      PHE  77  -1.592  -0.915 -14.918
  565    HE2  PHE  77           HE2      PHE  77   1.481  -1.149 -11.941
  566    HZ   PHE  77           HZ       PHE  77   0.789  -1.144 -14.321
  567    H    LEU  78           H        LEU  78  -4.388   1.331  -9.038
  568    HA   LEU  78           HA       LEU  78  -3.143   3.785  -9.772
  569   1HB   LEU  78          2HB       LEU  78  -5.812   2.995  -8.695
  570   2HB   LEU  78          1HB       LEU  78  -5.356   4.688  -8.646
  571    HG   LEU  78           HG       LEU  78  -5.355   4.874 -10.992
  572   1HD1  LEU  78          1HD1      LEU  78  -3.970   2.806 -11.358
  573   2HD1  LEU  78          2HD1      LEU  78  -5.267   3.018 -12.533
  574   3HD1  LEU  78          3HD1      LEU  78  -5.450   1.856 -11.219
  575   1HD2  LEU  78          1HD2      LEU  78  -7.484   2.789 -10.436
  576   2HD2  LEU  78          2HD2      LEU  78  -7.525   4.043 -11.676
  577   3HD2  LEU  78          3HD2      LEU  78  -7.624   4.485  -9.971
  578    H    VAL  79           H        VAL  79  -3.716   2.192  -6.690
  579    HA   VAL  79           HA       VAL  79  -3.361   4.398  -4.960
  580    HB   VAL  79           HB       VAL  79  -3.096   1.425  -4.689
  581   1HG1  VAL  79          1HG1      VAL  79  -2.426   1.726  -2.306
  582   2HG1  VAL  79          2HG1      VAL  79  -2.151   3.438  -2.628
  583   3HG1  VAL  79          3HG1      VAL  79  -1.165   2.218  -3.436
  584   1HG2  VAL  79          1HG2      VAL  79  -4.895   1.696  -3.163
  585   2HG2  VAL  79          2HG2      VAL  79  -5.244   2.831  -4.467
  586   3HG2  VAL  79          3HG2      VAL  79  -4.561   3.414  -2.948
  587    H    MET  80           H        MET  80  -1.031   1.980  -6.157
  588    HA   MET  80           HA       MET  80   1.322   2.760  -5.013
  589   1HB   MET  80          2HB       MET  80   0.610   1.132  -7.147
  590   2HB   MET  80          1HB       MET  80   1.680   2.327  -7.878
  591   1HG   MET  80          2HG       MET  80   3.397   1.855  -6.194
  592   2HG   MET  80          1HG       MET  80   2.320   0.712  -5.396
  593   1HE   MET  80          1HE       MET  80   2.992   1.201  -9.425
  594   2HE   MET  80          2HE       MET  80   4.544   0.370  -9.345
  595   3HE   MET  80          3HE       MET  80   4.255   1.783  -8.331
  596    H    MET  81           H        MET  81  -0.400   4.428  -7.615
  597    HA   MET  81           HA       MET  81   1.682   6.186  -8.405
  598   1HB   MET  81          2HB       MET  81  -0.396   5.791  -9.722
  599   2HB   MET  81          1HB       MET  81  -1.302   6.685  -8.505
  600   1HG   MET  81          2HG       MET  81   0.095   8.680  -8.929
  601   2HG   MET  81          1HG       MET  81   0.997   7.785 -10.152
  602   1HE   MET  81          1HE       MET  81  -2.428   8.985  -8.944
  603   2HE   MET  81          2HE       MET  81  -2.857   7.352  -9.448
  604   3HE   MET  81          3HE       MET  81  -3.505   8.736 -10.324
  605    H    VAL  82           H        VAL  82  -1.176   6.847  -6.353
  606    HA   VAL  82           HA       VAL  82  -0.278   9.385  -5.472
  607    HB   VAL  82           HB       VAL  82  -1.985   9.126  -3.660
  608   1HG1  VAL  82          1HG1      VAL  82  -3.914   8.759  -5.357
  609   2HG1  VAL  82          2HG1      VAL  82  -2.630   8.587  -6.554
  610   3HG1  VAL  82          3HG1      VAL  82  -2.796  10.092  -5.649
  611   1HG2  VAL  82          1HG2      VAL  82  -2.530   6.450  -4.986
  612   2HG2  VAL  82          2HG2      VAL  82  -3.377   7.141  -3.600
  613   3HG2  VAL  82          3HG2      VAL  82  -1.697   6.629  -3.440
  614    H    ARG  83           H        ARG  83   0.358   6.136  -4.323
  615    HA   ARG  83           HA       ARG  83   1.317   6.746  -1.733
  616   1HB   ARG  83          2HB       ARG  83   2.011   4.496  -3.635
  617   2HB   ARG  83          1HB       ARG  83   2.614   4.591  -1.980
  618   1HG   ARG  83          2HG       ARG  83  -0.097   5.031  -1.660
  619   2HG   ARG  83          1HG       ARG  83  -0.049   3.837  -2.956
  620   1HD   ARG  83          2HD       ARG  83   0.801   2.204  -1.606
  621   2HD   ARG  83          1HD       ARG  83   1.782   3.335  -0.681
  622    HE   ARG  83           HE       ARG  83  -1.006   3.694  -0.135
  623   1HH1  ARG  83          2HH1      ARG  83   1.743   1.643   0.520
  624   2HH1  ARG  83          1HH1      ARG  83   1.138   1.108   2.049
  625   1HH2  ARG  83          1HH2      ARG  83  -1.781   2.979   1.873
  626   2HH2  ARG  83          2HH2      ARG  83  -0.853   1.861   2.816
  627    H    CYS  84           H        CYS  84   2.784   6.956  -4.917
  628    HA   CYS  84           HA       CYS  84   5.471   7.350  -3.915
  629   1HB   CYS  84          2HB       CYS  84   4.195   7.450  -6.636
  630   2HB   CYS  84          1HB       CYS  84   5.825   8.075  -6.388
  631    HG   CYS  84           HG       CYS  84   5.164   5.147  -5.526
  632    H    MET  85           H        MET  85   2.907   9.401  -5.329
  633    HA   MET  85           HA       MET  85   4.437  11.816  -5.200
  634   1HB   MET  85          2HB       MET  85   2.120  11.129  -6.451
  635   2HB   MET  85          1HB       MET  85   1.491  12.049  -5.085
  636   1HG   MET  85          2HG       MET  85   1.869  13.686  -6.743
  637   2HG   MET  85          1HG       MET  85   3.281  13.808  -5.696
  638   1HE   MET  85          1HE       MET  85   2.908  12.705 -10.013
  639   2HE   MET  85          2HE       MET  85   2.738  14.315  -9.319
  640   3HE   MET  85          3HE       MET  85   1.662  13.021  -8.798
  641    H    LYS  86           H        LYS  86   1.604  10.753  -3.289
  642    HA   LYS  86           HA       LYS  86   2.245  12.681  -1.195
  643   1HB   LYS  86          2HB       LYS  86  -0.139  11.822  -2.127
  644   2HB   LYS  86          1HB       LYS  86   0.080  10.685  -0.797
  645   1HG   LYS  86          2HG       LYS  86   0.818  13.349   0.053
  646   2HG   LYS  86          1HG       LYS  86  -0.810  13.363  -0.624
  647   1HD   LYS  86          2HD       LYS  86  -1.663  12.100   1.069
  648   2HD   LYS  86          1HD       LYS  86  -0.231  11.074   1.157
  649   1HE   LYS  86          2HE       LYS  86   0.174  12.184   3.101
  650   2HE   LYS  86          1HE       LYS  86   0.769  13.465   2.046
  651   1HZ   LYS  86          1HZ       LYS  86  -1.429  14.455   2.053
  652   2HZ   LYS  86          2HZ       LYS  86  -0.850  14.293   3.642
  653   3HZ   LYS  86          3HZ       LYS  86  -2.017  13.212   3.046
  654    H    ASP  87           H        ASP  87   2.089  11.864   1.110
  655    HA   ASP  87           HA       ASP  87   2.927  10.618   2.839
  656   1HB   ASP  87          2HB       ASP  87   1.457   8.830   1.719
  657   2HB   ASP  87          1HB       ASP  87   2.953   8.211   1.017
  658    H    ASP  88           H        ASP  88   4.807  12.065   2.078
  659    HA   ASP  88           HA       ASP  88   7.046  10.781   0.806
  660   1HB   ASP  88          2HB       ASP  88   6.596  13.291   0.860
  661   2HB   ASP  88          1HB       ASP  88   7.153  13.261   2.532
  662    H    SER  89           HN       SER  89   6.367  11.821   4.157
  663    HA   SER  89           HA       SER  89   8.644  10.291   5.155
  664   1HB   SER  89          2HB       SER  89   7.958  12.571   6.066
  665   2HB   SER  89          1HB       SER  89   6.578  11.758   6.801
  666    HG   SER  89           HG       SER  89   9.272  11.668   7.438
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  -4.754  11.967  10.306
    2   2H    MET   1          2H        MET   1  -5.136  11.244   8.817
    3   3H    MET   1          3H        MET   1  -4.347  12.747   8.856
    4    HA   MET   1           HA       MET   1  -2.407  11.717   9.894
    5   1HB   MET   1          2HB       MET   1  -4.210   9.317   9.686
    6   2HB   MET   1          1HB       MET   1  -2.460   9.104   9.612
    7   1HG   MET   1          2HG       MET   1  -2.285  10.419  11.754
    8   2HG   MET   1          1HG       MET   1  -4.046  10.392  11.851
    9   1HE   MET   1          1HE       MET   1  -0.809   7.859  11.651
   10   2HE   MET   1          2HE       MET   1  -1.120   7.483  13.344
   11   3HE   MET   1          3HE       MET   1  -0.991   9.164  12.832
   12    H    ASN   2           H        ASN   2  -4.129   9.752   7.440
   13    HA   ASN   2           HA       ASN   2  -2.328  10.811   5.371
   14   1HB   ASN   2          2HB       ASN   2  -2.438   8.004   6.332
   15   2HB   ASN   2          1HB       ASN   2  -2.403   8.227   4.583
   16   1HD2  ASN   2          1HD2      ASN   2  -0.709  10.244   4.065
   17   2HD2  ASN   2          2HD2      ASN   2   0.815  10.007   4.776
   18    H    ASP   3           H        ASP   3  -4.828  11.684   5.603
   19    HA   ASP   3           HA       ASP   3  -6.705  10.106   4.062
   20   1HB   ASP   3          2HB       ASP   3  -8.186  12.072   4.256
   21   2HB   ASP   3          1HB       ASP   3  -7.548  11.580   5.823
   22    H    ILE   4           H        ILE   4  -4.167  12.290   3.323
   23    HA   ILE   4           HA       ILE   4  -5.130  13.560   1.014
   24    HB   ILE   4           HB       ILE   4  -2.748  13.799   0.358
   25   1HG1  ILE   4          2HG1      ILE   4  -1.251  12.913   2.448
   26   2HG1  ILE   4          1HG1      ILE   4  -2.469  11.640   2.383
   27   1HG2  ILE   4          1HG2      ILE   4  -3.552  15.461   1.841
   28   2HG2  ILE   4          2HG2      ILE   4  -2.041  14.910   2.565
   29   3HG2  ILE   4          3HG2      ILE   4  -3.585  14.345   3.205
   30   1HD1  ILE   4          1HD1      ILE   4  -0.444  11.195   0.949
   31   2HD1  ILE   4          2HD1      ILE   4  -0.903  12.587  -0.030
   32   3HD1  ILE   4          3HD1      ILE   4  -1.968  11.185   0.062
   33    H    TYR   5           H        TYR   5  -3.954  10.296   1.504
   34    HA   TYR   5           HA       TYR   5  -3.399   9.546  -1.150
   35   1HB   TYR   5          2HB       TYR   5  -4.335   8.021   1.273
   36   2HB   TYR   5          1HB       TYR   5  -4.198   7.217  -0.291
   37    HD1  TYR   5           HD1      TYR   5  -2.221   9.526   1.922
   38    HD2  TYR   5           HD2      TYR   5  -2.158   6.246  -0.850
   39    HE1  TYR   5           HE1      TYR   5   0.221   9.295   2.254
   40    HE2  TYR   5           HE2      TYR   5   0.286   6.014  -0.516
   41    HH   TYR   5           HH       TYR   5   2.216   8.105   0.463
   42    H    LYS   6           H        LYS   6  -6.426   9.671   0.669
   43    HA   LYS   6           HA       LYS   6  -8.046   8.547  -1.436
   44   1HB   LYS   6          2HB       LYS   6  -8.618   8.447   1.019
   45   2HB   LYS   6          1HB       LYS   6  -8.955  10.175   0.949
   46   1HG   LYS   6          2HG       LYS   6 -10.401   9.239  -1.196
   47   2HG   LYS   6          1HG       LYS   6 -10.552   7.908  -0.050
   48   1HD   LYS   6          2HD       LYS   6 -12.370   9.438   0.377
   49   2HD   LYS   6          1HD       LYS   6 -11.218   9.598   1.703
   50   1HE   LYS   6          2HE       LYS   6 -11.463  11.831   1.223
   51   2HE   LYS   6          1HE       LYS   6 -10.207  11.463   0.043
   52   1HZ   LYS   6          1HZ       LYS   6 -13.127  11.655  -0.407
   53   2HZ   LYS   6          2HZ       LYS   6 -12.075  10.947  -1.536
   54   3HZ   LYS   6          3HZ       LYS   6 -11.899  12.584  -1.116
   55    H    ALA   7           H        ALA   7  -6.989  11.747  -0.470
   56    HA   ALA   7           HA       ALA   7  -8.896  13.312  -1.839
   57   1HB   ALA   7          1HB       ALA   7  -7.123  14.076  -0.145
   58   2HB   ALA   7          2HB       ALA   7  -7.438  15.138  -1.516
   59   3HB   ALA   7          3HB       ALA   7  -6.008  14.107  -1.511
   60    H    ALA   8           H        ALA   8  -6.217  11.422  -3.020
   61    HA   ALA   8           HA       ALA   8  -6.018  12.849  -5.543
   62   1HB   ALA   8          1HB       ALA   8  -4.043  11.730  -4.502
   63   2HB   ALA   8          2HB       ALA   8  -4.365  11.188  -6.149
   64   3HB   ALA   8          3HB       ALA   8  -4.826  10.175  -4.781
   65    H    VAL   9           H        VAL   9  -7.202   9.660  -4.452
   66    HA   VAL   9           HA       VAL   9  -8.055   8.772  -7.001
   67    HB   VAL   9           HB       VAL   9  -7.725   7.289  -5.015
   68   1HG1  VAL   9          1HG1      VAL   9 -10.308   8.606  -4.139
   69   2HG1  VAL   9          2HG1      VAL   9  -8.777   8.559  -3.266
   70   3HG1  VAL   9          3HG1      VAL   9  -9.720   7.084  -3.471
   71   1HG2  VAL   9          1HG2      VAL   9 -10.539   7.049  -6.095
   72   2HG2  VAL   9          2HG2      VAL   9  -9.426   5.752  -5.663
   73   3HG2  VAL   9          3HG2      VAL   9  -9.123   6.731  -7.097
   74    H    GLU  10           H        GLU  10  -9.530  10.916  -4.671
   75    HA   GLU  10           HA       GLU  10 -12.167  10.748  -5.851
   76   1HB   GLU  10          2HB       GLU  10 -12.785  12.454  -4.246
   77   2HB   GLU  10          1HB       GLU  10 -11.826  11.215  -3.440
   78   1HG   GLU  10          2HG       GLU  10 -10.412  12.813  -2.745
   79   2HG   GLU  10          1HG       GLU  10  -9.981  13.116  -4.426
   80    H    GLN  11           H        GLN  11  -9.270  12.503  -6.536
   81    HA   GLN  11           HA       GLN  11 -10.827  14.428  -8.161
   82   1HB   GLN  11          2HB       GLN  11  -9.061  16.037  -7.903
   83   2HB   GLN  11          1HB       GLN  11  -9.489  15.441  -6.301
   84   1HG   GLN  11          2HG       GLN  11  -7.583  13.856  -6.391
   85   2HG   GLN  11          1HG       GLN  11  -7.143  14.488  -7.976
   86   1HE2  GLN  11          1HE2      GLN  11  -8.008  15.980  -4.781
   87   2HE2  GLN  11          2HE2      GLN  11  -6.697  17.059  -4.783
   88    H    LEU  12           H        LEU  12  -9.442  11.625  -8.727
   89    HA   LEU  12           HA       LEU  12  -7.552  12.356 -10.806
   90   1HB   LEU  12          2HB       LEU  12  -7.766   9.847 -11.368
   91   2HB   LEU  12          1HB       LEU  12  -6.946  10.327  -9.902
   92    HG   LEU  12           HG       LEU  12  -8.884   9.704  -8.573
   93   1HD1  LEU  12          1HD1      LEU  12 -10.146   9.294 -11.282
   94   2HD1  LEU  12          2HD1      LEU  12 -10.762  10.216  -9.908
   95   3HD1  LEU  12          3HD1      LEU  12 -10.756   8.453  -9.857
   96   1HD2  LEU  12          1HD2      LEU  12  -8.117   7.608 -10.626
   97   2HD2  LEU  12          2HD2      LEU  12  -8.914   7.265  -9.090
   98   3HD2  LEU  12          3HD2      LEU  12  -7.283   7.936  -9.106
   99    H    THR  13           H        THR  13  -7.822  11.474 -13.034
  100    HA   THR  13           HA       THR  13 -10.573  11.996 -13.987
  101    HB   THR  13           HB       THR  13  -9.005  12.102 -16.227
  102    HG1  THR  13           HG1      THR  13  -7.050  12.082 -15.352
  103   1HG2  THR  13          1HG2      THR  13 -10.688  13.753 -14.947
  104   2HG2  THR  13          2HG2      THR  13  -9.674  14.278 -16.291
  105   3HG2  THR  13          3HG2      THR  13  -9.171  14.595 -14.630
  106    H    ASP  14           H        ASP  14 -10.980  10.922 -16.189
  107    HA   ASP  14           HA       ASP  14 -10.942   8.095 -15.857
  108   1HB   ASP  14          2HB       ASP  14 -11.515   9.797 -18.300
  109   2HB   ASP  14          1HB       ASP  14 -11.757   8.051 -18.228
  110    H    GLU  15           H        GLU  15  -8.870  10.417 -17.486
  111    HA   GLU  15           HA       GLU  15  -7.378   8.608 -19.092
  112   1HB   GLU  15          2HB       GLU  15  -6.987  11.392 -18.090
  113   2HB   GLU  15          1HB       GLU  15  -5.565  10.525 -18.672
  114   1HG   GLU  15          2HG       GLU  15  -6.794  10.009 -20.786
  115   2HG   GLU  15          1HG       GLU  15  -8.137  10.995 -20.209
  116    H    GLN  16           H        GLN  16  -7.127   9.610 -15.713
  117    HA   GLN  16           HA       GLN  16  -4.555   8.511 -15.188
  118   1HB   GLN  16          2HB       GLN  16  -5.884  10.149 -13.718
  119   2HB   GLN  16          1HB       GLN  16  -6.775   8.738 -13.152
  120   1HG   GLN  16          2HG       GLN  16  -3.995   8.086 -13.077
  121   2HG   GLN  16          1HG       GLN  16  -4.196   9.660 -12.309
  122   1HE2  GLN  16          1HE2      GLN  16  -5.825   6.425 -12.312
  123   2HE2  GLN  16          2HE2      GLN  16  -6.156   6.440 -10.648
  124    H    LYS  17           H        LYS  17  -7.869   7.261 -14.807
  125    HA   LYS  17           HA       LYS  17  -7.198   4.738 -13.730
  126   1HB   LYS  17          2HB       LYS  17  -9.547   5.491 -15.496
  127   2HB   LYS  17          1HB       LYS  17  -9.411   3.997 -14.571
  128   1HG   LYS  17          2HG       LYS  17  -9.406   6.793 -13.389
  129   2HG   LYS  17          1HG       LYS  17 -10.775   5.681 -13.378
  130   1HD   LYS  17          2HD       LYS  17  -9.161   4.021 -12.221
  131   2HD   LYS  17          1HD       LYS  17  -8.154   5.437 -11.916
  132   1HE   LYS  17          2HE       LYS  17  -9.450   5.516 -10.013
  133   2HE   LYS  17          1HE       LYS  17 -10.497   6.440 -11.088
  134   1HZ   LYS  17          1HZ       LYS  17 -11.628   4.322 -11.640
  135   2HZ   LYS  17          2HZ       LYS  17 -11.795   4.775 -10.011
  136   3HZ   LYS  17          3HZ       LYS  17 -10.702   3.549 -10.446
  137    H    ASN  18           H        ASN  18  -7.591   5.879 -17.070
  138    HA   ASN  18           HA       ASN  18  -7.152   3.369 -18.338
  139   1HB   ASN  18          2HB       ASN  18  -7.077   6.229 -19.230
  140   2HB   ASN  18          1HB       ASN  18  -6.419   4.983 -20.289
  141   1HD2  ASN  18          1HD2      ASN  18  -9.304   6.556 -19.410
  142   2HD2  ASN  18          2HD2      ASN  18 -10.397   5.435 -20.067
  143    H    GLU  19           H        GLU  19  -4.992   5.845 -17.092
  144    HA   GLU  19           HA       GLU  19  -2.624   5.242 -18.436
  145   1HB   GLU  19          2HB       GLU  19  -2.982   7.138 -16.801
  146   2HB   GLU  19          1HB       GLU  19  -2.793   5.962 -15.501
  147   1HG   GLU  19          2HG       GLU  19  -0.545   5.520 -16.059
  148   2HG   GLU  19          1HG       GLU  19  -0.716   6.213 -17.673
  149    H    PHE  20           H        PHE  20  -3.854   3.850 -15.374
  150    HA   PHE  20           HA       PHE  20  -1.744   1.842 -15.364
  151   1HB   PHE  20          2HB       PHE  20  -3.975   2.573 -13.500
  152   2HB   PHE  20          1HB       PHE  20  -3.182   1.004 -13.354
  153    HD1  PHE  20           HD1      PHE  20  -0.967   0.803 -12.490
  154    HD2  PHE  20           HD2      PHE  20  -2.619   4.678 -13.310
  155    HE1  PHE  20           HE1      PHE  20   0.919   1.854 -11.276
  156    HE2  PHE  20           HE2      PHE  20  -0.729   5.738 -12.110
  157    HZ   PHE  20           HZ       PHE  20   1.042   4.328 -11.091
  158    H    LYS  21           H        LYS  21  -5.280   1.961 -15.805
  159    HA   LYS  21           HA       LYS  21  -5.819  -0.768 -15.964
  160   1HB   LYS  21          2HB       LYS  21  -7.571   0.955 -15.920
  161   2HB   LYS  21          1HB       LYS  21  -7.128   1.451 -17.549
  162   1HG   LYS  21          2HG       LYS  21  -7.649  -1.442 -17.249
  163   2HG   LYS  21          1HG       LYS  21  -9.053  -0.411 -16.974
  164   1HD   LYS  21          2HD       LYS  21  -7.353   0.215 -19.344
  165   2HD   LYS  21          1HD       LYS  21  -8.357  -1.232 -19.432
  166   1HE   LYS  21          2HE       LYS  21 -10.347   0.104 -18.860
  167   2HE   LYS  21          1HE       LYS  21  -9.350   1.554 -18.749
  168   1HZ   LYS  21          1HZ       LYS  21  -8.762   1.299 -21.070
  169   2HZ   LYS  21          2HZ       LYS  21 -10.450   1.375 -20.899
  170   3HZ   LYS  21          3HZ       LYS  21  -9.690  -0.117 -21.182
  171    H    ALA  22           H        ALA  22  -4.546   1.406 -18.462
  172    HA   ALA  22           HA       ALA  22  -4.773  -0.322 -20.684
  173   1HB   ALA  22          1HB       ALA  22  -4.187   2.019 -20.991
  174   2HB   ALA  22          2HB       ALA  22  -2.894   1.012 -21.643
  175   3HB   ALA  22          3HB       ALA  22  -2.695   1.796 -20.076
  176    H    ALA  23           H        ALA  23  -2.042   0.243 -18.468
  177    HA   ALA  23           HA       ALA  23  -0.374  -1.818 -19.504
  178   1HB   ALA  23          1HB       ALA  23   1.096  -1.287 -17.782
  179   2HB   ALA  23          2HB       ALA  23  -0.202  -0.932 -16.641
  180   3HB   ALA  23          3HB       ALA  23   0.189   0.219 -17.921
  181    H    PHE  24           H        PHE  24  -2.815  -1.634 -16.987
  182    HA   PHE  24           HA       PHE  24  -2.403  -4.087 -15.688
  183   1HB   PHE  24          2HB       PHE  24  -4.004  -2.162 -15.070
  184   2HB   PHE  24          1HB       PHE  24  -5.133  -2.905 -16.201
  185    HD1  PHE  24           HD1      PHE  24  -5.697  -5.406 -15.863
  186    HD2  PHE  24           HD2      PHE  24  -3.804  -2.978 -12.870
  187    HE1  PHE  24           HE1      PHE  24  -6.366  -7.032 -14.119
  188    HE2  PHE  24           HE2      PHE  24  -4.472  -4.602 -11.128
  189    HZ   PHE  24           HZ       PHE  24  -5.755  -6.621 -11.749
  190    H    ASP  25           H        ASP  25  -4.442  -3.275 -18.495
  191    HA   ASP  25           HA       ASP  25  -5.576  -5.814 -18.906
  192   1HB   ASP  25          2HB       ASP  25  -5.916  -3.394 -20.069
  193   2HB   ASP  25          1HB       ASP  25  -4.993  -4.213 -21.326
  194    H    ILE  26           H        ILE  26  -2.591  -4.403 -20.264
  195    HA   ILE  26           HA       ILE  26  -2.022  -6.697 -21.893
  196    HB   ILE  26           HB       ILE  26   0.234  -5.652 -22.191
  197   1HG1  ILE  26          2HG1      ILE  26  -0.932  -3.470 -20.425
  198   2HG1  ILE  26          1HG1      ILE  26   0.350  -4.576 -19.938
  199   1HG2  ILE  26          1HG2      ILE  26  -0.592  -3.870 -23.555
  200   2HG2  ILE  26          2HG2      ILE  26  -2.015  -3.657 -22.534
  201   3HG2  ILE  26          3HG2      ILE  26  -1.858  -5.099 -23.538
  202   1HD1  ILE  26          1HD1      ILE  26   1.867  -3.686 -21.547
  203   2HD1  ILE  26          2HD1      ILE  26   1.102  -2.287 -20.791
  204   3HD1  ILE  26          3HD1      ILE  26   0.581  -2.821 -22.389
  205    H    PHE  27           H        PHE  27  -0.881  -5.603 -18.696
  206    HA   PHE  27           HA       PHE  27   1.065  -7.654 -18.382
  207   1HB   PHE  27          2HB       PHE  27  -0.360  -5.867 -16.416
  208   2HB   PHE  27          1HB       PHE  27   0.785  -7.101 -15.889
  209    HD1  PHE  27           HD1      PHE  27   2.918  -7.119 -17.780
  210    HD2  PHE  27           HD2      PHE  27   0.642  -3.752 -16.389
  211    HE1  PHE  27           HE1      PHE  27   4.796  -5.608 -18.355
  212    HE2  PHE  27           HE2      PHE  27   2.521  -2.245 -16.971
  213    HZ   PHE  27           HZ       PHE  27   4.600  -3.171 -17.950
  214    H    ILE  28           H        ILE  28  -2.411  -7.540 -17.720
  215    HA   ILE  28           HA       ILE  28  -2.274 -10.215 -16.485
  216    HB   ILE  28           HB       ILE  28  -4.572  -9.918 -15.819
  217   1HG1  ILE  28          2HG1      ILE  28  -5.464  -7.440 -16.413
  218   2HG1  ILE  28          1HG1      ILE  28  -4.487  -7.737 -17.851
  219   1HG2  ILE  28          1HG2      ILE  28  -3.331  -7.214 -15.359
  220   2HG2  ILE  28          2HG2      ILE  28  -2.631  -8.665 -14.643
  221   3HG2  ILE  28          3HG2      ILE  28  -4.285  -8.197 -14.249
  222   1HD1  ILE  28          1HD1      ILE  28  -6.342  -9.892 -16.911
  223   2HD1  ILE  28          2HD1      ILE  28  -5.799  -9.518 -18.548
  224   3HD1  ILE  28          3HD1      ILE  28  -7.018  -8.507 -17.769
  225    H    GLN  29           H        GLN  29  -2.238  -9.215 -19.539
  226    HA   GLN  29           HA       GLN  29  -4.372 -10.260 -20.940
  227   1HB   GLN  29          2HB       GLN  29  -2.495  -9.039 -21.978
  228   2HB   GLN  29          1HB       GLN  29  -1.444 -10.427 -21.702
  229   1HG   GLN  29          2HG       GLN  29  -2.146 -10.720 -23.927
  230   2HG   GLN  29          1HG       GLN  29  -3.234 -11.770 -23.018
  231   1HE2  GLN  29          1HE2      GLN  29  -3.072  -8.357 -24.205
  232   2HE2  GLN  29          2HE2      GLN  29  -4.733  -8.247 -24.538
  233    H    ASP  30           H        ASP  30  -1.507 -11.988 -19.751
  234    HA   ASP  30           HA       ASP  30  -2.524 -14.549 -20.715
  235   1HB   ASP  30          2HB       ASP  30  -0.415 -15.477 -19.890
  236   2HB   ASP  30          1HB       ASP  30  -0.117 -14.061 -20.897
  237    H    ALA  31           H        ALA  31  -3.198 -12.732 -18.022
  238    HA   ALA  31           HA       ALA  31  -3.341 -15.023 -16.186
  239   1HB   ALA  31          1HB       ALA  31  -2.368 -12.989 -15.250
  240   2HB   ALA  31          2HB       ALA  31  -3.914 -13.330 -14.471
  241   3HB   ALA  31          3HB       ALA  31  -3.805 -12.070 -15.701
  242    H    GLU  32           H        GLU  32  -5.267 -15.602 -15.160
  243    HA   GLU  32           HA       GLU  32  -7.745 -14.633 -16.466
  244   1HB   GLU  32          2HB       GLU  32  -7.042 -17.463 -15.640
  245   2HB   GLU  32          1HB       GLU  32  -8.647 -16.947 -16.161
  246   1HG   GLU  32          2HG       GLU  32  -7.597 -16.123 -18.305
  247   2HG   GLU  32          1HG       GLU  32  -6.093 -16.886 -17.790
  248    H    ASP  33           H        ASP  33  -6.756 -13.449 -14.174
  249    HA   ASP  33           HA       ASP  33  -8.731 -14.322 -12.153
  250   1HB   ASP  33          2HB       ASP  33  -5.825 -13.653 -11.751
  251   2HB   ASP  33          1HB       ASP  33  -6.993 -13.450 -10.445
  252    H    GLY  34           H        GLY  34  -6.629 -11.669 -13.263
  253   1HA   GLY  34          2HA       GLY  34  -7.685  -9.522 -13.811
  254   2HA   GLY  34          1HA       GLY  34  -8.717  -9.749 -12.402
  255    H    CYS  35           H        CYS  35  -5.233 -10.329 -12.672
  256    HA   CYS  35           HA       CYS  35  -4.580  -7.948 -11.108
  257   1HB   CYS  35          2HB       CYS  35  -3.791 -10.691 -10.096
  258   2HB   CYS  35          1HB       CYS  35  -3.474  -9.137  -9.327
  259    HG   CYS  35           HG       CYS  35  -6.083 -10.702  -9.147
  260    H    ILE  36           H        ILE  36  -2.479  -7.264 -11.451
  261    HA   ILE  36           HA       ILE  36  -1.083  -8.523 -13.658
  262    HB   ILE  36           HB       ILE  36   0.355  -6.644 -13.692
  263   1HG1  ILE  36          2HG1      ILE  36  -0.231  -5.026 -11.504
  264   2HG1  ILE  36          1HG1      ILE  36  -0.142  -6.644 -10.808
  265   1HG2  ILE  36          1HG2      ILE  36  -1.160  -4.954 -14.089
  266   2HG2  ILE  36          2HG2      ILE  36  -2.058  -5.261 -12.602
  267   3HG2  ILE  36          3HG2      ILE  36  -2.271  -6.319 -13.997
  268   1HD1  ILE  36          1HD1      ILE  36   2.066  -5.306 -10.988
  269   2HD1  ILE  36          2HD1      ILE  36   1.973  -5.642 -12.717
  270   3HD1  ILE  36          3HD1      ILE  36   2.078  -6.972 -11.564
  271    H    SER  37           H        SER  37   1.395  -8.713 -13.445
  272    HA   SER  37           HA       SER  37   1.898 -10.558 -11.240
  273   1HB   SER  37          2HB       SER  37   2.619 -10.645 -13.865
  274   2HB   SER  37          1HB       SER  37   4.079  -9.974 -13.146
  275    HG   SER  37           HG       SER  37   3.828 -12.361 -13.215
  276    H    THR  38           H        THR  38   2.442  -9.605  -9.378
  277    HA   THR  38           HA       THR  38   3.627  -7.113  -8.978
  278    HB   THR  38           HB       THR  38   4.261  -7.924  -6.733
  279    HG1  THR  38           HG1      THR  38   3.376 -10.442  -7.697
  280   1HG2  THR  38          1HG2      THR  38   2.024  -7.249  -6.807
  281   2HG2  THR  38          2HG2      THR  38   1.913  -8.883  -6.155
  282   3HG2  THR  38          3HG2      THR  38   1.556  -8.587  -7.856
  283    H    LYS  39           H        LYS  39   5.144 -10.291  -9.386
  284    HA   LYS  39           HA       LYS  39   7.817  -9.498  -8.907
  285   1HB   LYS  39          2HB       LYS  39   8.422 -11.544 -10.247
  286   2HB   LYS  39          1HB       LYS  39   7.309 -11.846  -8.916
  287   1HG   LYS  39          2HG       LYS  39   5.866 -11.160 -11.348
  288   2HG   LYS  39          1HG       LYS  39   6.923 -12.546 -11.605
  289   1HD   LYS  39          2HD       LYS  39   5.193 -12.413  -9.146
  290   2HD   LYS  39          1HD       LYS  39   4.506 -12.947 -10.679
  291   1HE   LYS  39          2HE       LYS  39   7.107 -14.163  -9.892
  292   2HE   LYS  39          1HE       LYS  39   5.691 -14.648  -8.959
  293   1HZ   LYS  39          1HZ       LYS  39   5.885 -14.731 -11.923
  294   2HZ   LYS  39          2HZ       LYS  39   4.575 -15.270 -10.984
  295   3HZ   LYS  39          3HZ       LYS  39   6.070 -16.070 -10.899
  296    H    GLU  40           H        GLU  40   5.738  -9.175 -11.707
  297    HA   GLU  40           HA       GLU  40   7.998  -8.281 -13.371
  298   1HB   GLU  40          2HB       GLU  40   5.108  -8.770 -14.138
  299   2HB   GLU  40          1HB       GLU  40   6.423  -8.368 -15.243
  300   1HG   GLU  40          2HG       GLU  40   7.617 -10.453 -14.353
  301   2HG   GLU  40          1HG       GLU  40   6.077 -10.890 -13.613
  302    H    LEU  41           H        LEU  41   6.522  -6.782 -11.070
  303    HA   LEU  41           HA       LEU  41   5.100  -4.611 -12.170
  304   1HB   LEU  41          2HB       LEU  41   5.038  -5.128  -9.794
  305   2HB   LEU  41          1HB       LEU  41   6.744  -4.773  -9.645
  306    HG   LEU  41           HG       LEU  41   6.330  -2.413 -10.068
  307   1HD1  LEU  41          1HD1      LEU  41   4.523  -2.492 -11.654
  308   2HD1  LEU  41          2HD1      LEU  41   3.916  -1.640 -10.234
  309   3HD1  LEU  41          3HD1      LEU  41   3.472  -3.325 -10.507
  310   1HD2  LEU  41          1HD2      LEU  41   5.811  -3.649  -7.781
  311   2HD2  LEU  41          2HD2      LEU  41   4.157  -3.152  -8.139
  312   3HD2  LEU  41          3HD2      LEU  41   5.428  -1.939  -7.979
  313    H    GLY  42           H        GLY  42   8.514  -5.314 -12.063
  314   1HA   GLY  42          2HA       GLY  42   9.628  -2.746 -12.251
  315   2HA   GLY  42          1HA       GLY  42  10.340  -4.208 -12.925
  316    H    LYS  43           H        LYS  43   8.142  -4.826 -14.702
  317    HA   LYS  43           HA       LYS  43   8.880  -3.261 -16.977
  318   1HB   LYS  43          2HB       LYS  43   6.611  -5.226 -16.569
  319   2HB   LYS  43          1HB       LYS  43   7.041  -4.508 -18.122
  320   1HG   LYS  43          2HG       LYS  43   9.244  -5.515 -18.049
  321   2HG   LYS  43          1HG       LYS  43   8.970  -6.097 -16.406
  322   1HD   LYS  43          2HD       LYS  43   7.312  -7.654 -17.122
  323   2HD   LYS  43          1HD       LYS  43   7.191  -6.903 -18.715
  324   1HE   LYS  43          2HE       LYS  43   8.529  -8.779 -19.148
  325   2HE   LYS  43          1HE       LYS  43   9.728  -7.506 -18.918
  326   1HZ   LYS  43          1HZ       LYS  43  10.221  -9.560 -17.672
  327   2HZ   LYS  43          2HZ       LYS  43   8.796  -9.341 -16.775
  328   3HZ   LYS  43          3HZ       LYS  43  10.055  -8.205 -16.667
  329    H    VAL  44           H        VAL  44   6.441  -2.955 -14.535
  330    HA   VAL  44           HA       VAL  44   4.790  -1.123 -16.092
  331    HB   VAL  44           HB       VAL  44   4.480  -1.524 -13.137
  332   1HG1  VAL  44          1HG1      VAL  44   3.144  -0.011 -14.913
  333   2HG1  VAL  44          2HG1      VAL  44   2.366  -0.735 -13.508
  334   3HG1  VAL  44          3HG1      VAL  44   2.237  -1.512 -15.086
  335   1HG2  VAL  44          1HG2      VAL  44   3.842  -3.690 -13.287
  336   2HG2  VAL  44          2HG2      VAL  44   4.612  -3.716 -14.872
  337   3HG2  VAL  44          3HG2      VAL  44   2.886  -3.380 -14.734
  338    H    MET  45           H        MET  45   6.829  -1.068 -13.171
  339    HA   MET  45           HA       MET  45   6.630   1.610 -12.485
  340   1HB   MET  45          2HB       MET  45   9.000  -0.258 -12.291
  341   2HB   MET  45          1HB       MET  45   8.984   1.357 -11.585
  342   1HG   MET  45          2HG       MET  45   6.899  -0.756 -10.981
  343   2HG   MET  45          1HG       MET  45   8.323  -0.476  -9.980
  344   1HE   MET  45          1HE       MET  45   8.457   1.083  -8.150
  345   2HE   MET  45          2HE       MET  45   7.841   2.733  -8.199
  346   3HE   MET  45          3HE       MET  45   8.971   2.185  -9.435
  347    H    ARG  46           H        ARG  46   8.803   0.103 -14.877
  348    HA   ARG  46           HA       ARG  46  10.251   2.441 -15.547
  349   1HB   ARG  46          2HB       ARG  46  10.834   1.284 -17.649
  350   2HB   ARG  46          1HB       ARG  46  11.021   0.223 -16.254
  351   1HG   ARG  46          2HG       ARG  46   8.868  -0.832 -16.722
  352   2HG   ARG  46          1HG       ARG  46   8.578   0.285 -18.054
  353   1HD   ARG  46          2HD       ARG  46  10.647  -0.586 -19.163
  354   2HD   ARG  46          1HD       ARG  46  10.787  -1.780 -17.877
  355    HE   ARG  46           HE       ARG  46   8.200  -1.916 -19.061
  356   1HH1  ARG  46          2HH1      ARG  46  11.556  -2.670 -19.678
  357   2HH1  ARG  46          1HH1      ARG  46  11.193  -3.992 -20.732
  358   1HH2  ARG  46          1HH2      ARG  46   7.751  -3.656 -20.443
  359   2HH2  ARG  46          2HH2      ARG  46   9.047  -4.551 -21.165
  360    H    MET  47           H        MET  47   7.146   1.194 -16.647
  361    HA   MET  47           HA       MET  47   6.822   3.105 -18.779
  362   1HB   MET  47          2HB       MET  47   4.962   1.165 -17.403
  363   2HB   MET  47          1HB       MET  47   4.372   2.327 -18.593
  364   1HG   MET  47          2HG       MET  47   6.740   0.582 -19.233
  365   2HG   MET  47          1HG       MET  47   5.101  -0.046 -19.409
  366   1HE   MET  47          1HE       MET  47   7.795   2.266 -20.365
  367   2HE   MET  47          2HE       MET  47   7.441   2.740 -22.024
  368   3HE   MET  47          3HE       MET  47   7.749   1.047 -21.645
  369    H    LEU  48           H        LEU  48   5.998   2.925 -15.368
  370    HA   LEU  48           HA       LEU  48   4.215   5.172 -15.325
  371   1HB   LEU  48          2HB       LEU  48   5.595   3.477 -13.305
  372   2HB   LEU  48          1HB       LEU  48   5.039   5.052 -12.792
  373    HG   LEU  48           HG       LEU  48   2.767   4.483 -13.136
  374   1HD1  LEU  48          1HD1      LEU  48   2.469   3.416 -15.148
  375   2HD1  LEU  48          2HD1      LEU  48   2.440   1.989 -14.113
  376   3HD1  LEU  48          3HD1      LEU  48   3.919   2.433 -14.962
  377   1HD2  LEU  48          1HD2      LEU  48   4.507   2.509 -11.786
  378   2HD2  LEU  48          2HD2      LEU  48   2.883   1.928 -12.158
  379   3HD2  LEU  48          3HD2      LEU  48   3.099   3.375 -11.171
  380    H    GLY  49           H        GLY  49   7.684   4.733 -15.063
  381   1HA   GLY  49          2HA       GLY  49   9.018   6.708 -15.772
  382   2HA   GLY  49          1HA       GLY  49   8.009   7.658 -14.691
  383    H    GLN  50           H        GLN  50   8.966   4.488 -13.620
  384    HA   GLN  50           HA       GLN  50  11.134   5.628 -11.968
  385   1HB   GLN  50          2HB       GLN  50   8.971   3.752 -10.975
  386   2HB   GLN  50          1HB       GLN  50  10.322   4.379 -10.030
  387   1HG   GLN  50          2HG       GLN  50   9.152   6.242  -9.557
  388   2HG   GLN  50          1HG       GLN  50   8.992   6.585 -11.279
  389   1HE2  GLN  50          1HE2      GLN  50   6.824   6.899 -11.767
  390   2HE2  GLN  50          2HE2      GLN  50   5.543   5.976 -11.145
  391    H    ASN  51           H        ASN  51  12.708   4.089 -11.239
  392    HA   ASN  51           HA       ASN  51  12.601   1.425 -12.480
  393   1HB   ASN  51          2HB       ASN  51  13.852   3.191 -13.932
  394   2HB   ASN  51          1HB       ASN  51  15.123   3.046 -12.721
  395   1HD2  ASN  51          1HD2      ASN  51  15.711   2.212 -15.322
  396   2HD2  ASN  51          2HD2      ASN  51  15.810   0.518 -15.376
  397    HA   PRO  52           HA       PRO  52  14.406   1.297  -8.226
  398   1HB   PRO  52          2HB       PRO  52  12.515  -0.350  -7.140
  399   2HB   PRO  52          1HB       PRO  52  12.358   1.412  -7.203
  400   1HG   PRO  52          2HG       PRO  52  10.952  -0.652  -8.772
  401   2HG   PRO  52          1HG       PRO  52  10.461   1.004  -8.393
  402   1HD   PRO  52          2HD       PRO  52  11.575   0.056 -10.853
  403   2HD   PRO  52          1HD       PRO  52  11.216   1.743 -10.415
  404    H    THR  53           H        THR  53  14.189  -1.140  -6.846
  405    HA   THR  53           HA       THR  53  15.558  -3.010  -8.688
  406    HB   THR  53           HB       THR  53  16.879  -3.737  -6.904
  407    HG1  THR  53           HG1      THR  53  16.151  -3.928  -4.925
  408   1HG2  THR  53          1HG2      THR  53  17.691  -1.771  -5.709
  409   2HG2  THR  53          2HG2      THR  53  16.215  -0.893  -6.108
  410   3HG2  THR  53          3HG2      THR  53  17.342  -1.349  -7.386
  411    HA   PRO  54           HA       PRO  54  12.424  -6.041  -8.028
  412   1HB   PRO  54          2HB       PRO  54  13.784  -8.352  -7.457
  413   2HB   PRO  54          1HB       PRO  54  13.686  -7.630  -9.071
  414   1HG   PRO  54          2HG       PRO  54  15.941  -7.615  -7.130
  415   2HG   PRO  54          1HG       PRO  54  15.975  -7.608  -8.901
  416   1HD   PRO  54          2HD       PRO  54  16.393  -5.373  -7.283
  417   2HD   PRO  54          1HD       PRO  54  15.945  -5.311  -9.002
  418    H    GLU  55           H        GLU  55  14.787  -5.772  -5.442
  419    HA   GLU  55           HA       GLU  55  13.132  -7.104  -3.461
  420   1HB   GLU  55          2HB       GLU  55  15.757  -5.629  -3.375
  421   2HB   GLU  55          1HB       GLU  55  14.898  -6.030  -1.888
  422   1HG   GLU  55          2HG       GLU  55  14.765  -8.433  -2.869
  423   2HG   GLU  55          1HG       GLU  55  16.049  -7.898  -3.954
  424    H    GLU  56           H        GLU  56  13.840  -3.826  -4.543
  425    HA   GLU  56           HA       GLU  56  12.587  -2.470  -2.359
  426   1HB   GLU  56          2HB       GLU  56  14.256  -1.627  -4.262
  427   2HB   GLU  56          1HB       GLU  56  12.740  -1.199  -5.054
  428   1HG   GLU  56          2HG       GLU  56  12.065  -0.017  -2.923
  429   2HG   GLU  56          1HG       GLU  56  13.703  -0.290  -2.329
  430    H    LEU  57           H        LEU  57  11.541  -3.168  -5.717
  431    HA   LEU  57           HA       LEU  57   8.969  -2.046  -5.487
  432   1HB   LEU  57          2HB       LEU  57   8.405  -3.233  -7.483
  433   2HB   LEU  57          1HB       LEU  57  10.032  -2.625  -7.633
  434    HG   LEU  57           HG       LEU  57  10.639  -5.089  -6.805
  435   1HD1  LEU  57          1HD1      LEU  57   8.842  -6.469  -8.281
  436   2HD1  LEU  57          2HD1      LEU  57   7.791  -5.193  -7.668
  437   3HD1  LEU  57          3HD1      LEU  57   8.662  -6.233  -6.542
  438   1HD2  LEU  57          1HD2      LEU  57  11.456  -4.227  -8.882
  439   2HD2  LEU  57          2HD2      LEU  57   9.836  -4.169  -9.576
  440   3HD2  LEU  57          3HD2      LEU  57  10.618  -5.724  -9.286
  441    H    GLN  58           H        GLN  58  10.178  -5.285  -4.702
  442    HA   GLN  58           HA       GLN  58   7.685  -6.554  -4.335
  443   1HB   GLN  58          2HB       GLN  58   9.926  -7.710  -4.423
  444   2HB   GLN  58          1HB       GLN  58  10.210  -7.146  -2.776
  445   1HG   GLN  58          2HG       GLN  58   9.312  -9.388  -2.640
  446   2HG   GLN  58          1HG       GLN  58   8.058  -8.274  -2.099
  447   1HE2  GLN  58          1HE2      GLN  58   6.120  -8.117  -3.371
  448   2HE2  GLN  58          2HE2      GLN  58   5.838  -9.088  -4.734
  449    H    GLU  59           H        GLU  59   9.730  -4.688  -2.103
  450    HA   GLU  59           HA       GLU  59   8.170  -5.104   0.230
  451   1HB   GLU  59          2HB       GLU  59  10.104  -2.936  -0.584
  452   2HB   GLU  59          1HB       GLU  59   9.249  -2.886   0.958
  453   1HG   GLU  59          2HG       GLU  59  10.125  -5.195   1.440
  454   2HG   GLU  59          1HG       GLU  59  11.105  -5.072  -0.021
  455    H    MET  60           H        MET  60   8.050  -2.664  -2.343
  456    HA   MET  60           HA       MET  60   6.066  -1.004  -1.178
  457   1HB   MET  60          2HB       MET  60   6.541  -1.458  -4.133
  458   2HB   MET  60          1HB       MET  60   5.760  -0.064  -3.390
  459   1HG   MET  60          2HG       MET  60   8.165  -0.141  -2.057
  460   2HG   MET  60          1HG       MET  60   8.623  -0.682  -3.672
  461   1HE   MET  60          1HE       MET  60   7.721   2.043  -6.046
  462   2HE   MET  60          2HE       MET  60   7.559   0.317  -5.731
  463   3HE   MET  60          3HE       MET  60   9.143   1.081  -5.617
  464    H    ILE  61           H        ILE  61   5.918  -3.803  -3.317
  465    HA   ILE  61           HA       ILE  61   3.120  -3.788  -3.775
  466    HB   ILE  61           HB       ILE  61   5.063  -6.116  -3.778
  467   1HG1  ILE  61          2HG1      ILE  61   3.910  -4.803  -6.219
  468   2HG1  ILE  61          1HG1      ILE  61   5.256  -4.019  -5.388
  469   1HG2  ILE  61          1HG2      ILE  61   3.382  -7.337  -5.000
  470   2HG2  ILE  61          2HG2      ILE  61   2.335  -5.921  -5.086
  471   3HG2  ILE  61          3HG2      ILE  61   2.613  -6.720  -3.538
  472   1HD1  ILE  61          1HD1      ILE  61   5.616  -5.895  -7.294
  473   2HD1  ILE  61          2HD1      ILE  61   5.533  -6.938  -5.875
  474   3HD1  ILE  61          3HD1      ILE  61   6.744  -5.662  -5.961
  475    H    ASP  62           H        ASP  62   5.127  -5.509  -1.381
  476    HA   ASP  62           HA       ASP  62   3.092  -6.940  -0.096
  477   1HB   ASP  62          2HB       ASP  62   5.720  -6.922   0.236
  478   2HB   ASP  62          1HB       ASP  62   5.321  -5.801   1.537
  479    H    GLU  63           H        GLU  63   4.100  -3.577   0.266
  480    HA   GLU  63           HA       GLU  63   2.540  -3.088   2.636
  481   1HB   GLU  63          2HB       GLU  63   3.981  -1.301   0.682
  482   2HB   GLU  63          1HB       GLU  63   2.980  -0.641   1.978
  483   1HG   GLU  63          2HG       GLU  63   4.336  -1.629   3.670
  484   2HG   GLU  63          1HG       GLU  63   5.154  -2.676   2.510
  485    H    VAL  64           H        VAL  64   2.162  -2.084  -0.792
  486    HA   VAL  64           HA       VAL  64  -0.394  -0.901  -0.427
  487    HB   VAL  64           HB       VAL  64   1.028  -0.377  -2.371
  488   1HG1  VAL  64          1HG1      VAL  64   0.265  -3.091  -3.466
  489   2HG1  VAL  64          2HG1      VAL  64   1.802  -2.790  -2.657
  490   3HG1  VAL  64          3HG1      VAL  64   1.407  -1.931  -4.145
  491   1HG2  VAL  64          1HG2      VAL  64  -1.466  -1.674  -3.455
  492   2HG2  VAL  64          2HG2      VAL  64  -0.738  -0.131  -3.905
  493   3HG2  VAL  64          3HG2      VAL  64  -1.581  -0.294  -2.364
  494    H    ASP  65           H        ASP  65   0.603  -4.171  -1.385
  495    HA   ASP  65           HA       ASP  65  -2.037  -5.125  -1.943
  496   1HB   ASP  65          2HB       ASP  65   0.402  -6.109  -2.511
  497   2HB   ASP  65          1HB       ASP  65   0.067  -7.039  -1.053
  498    H    GLU  66           H        GLU  66  -3.555  -5.179  -0.424
  499    HA   GLU  66           HA       GLU  66  -3.015  -5.330   2.383
  500   1HB   GLU  66          2HB       GLU  66  -5.660  -5.887   1.020
  501   2HB   GLU  66          1HB       GLU  66  -5.402  -5.401   2.694
  502   1HG   GLU  66          2HG       GLU  66  -4.573  -3.696   0.334
  503   2HG   GLU  66          1HG       GLU  66  -6.133  -3.535   1.139
  504    H    ASP  67           H        ASP  67  -4.261  -7.644  -0.003
  505    HA   ASP  67           HA       ASP  67  -4.422  -9.790   1.930
  506   1HB   ASP  67          2HB       ASP  67  -4.873 -11.201  -0.150
  507   2HB   ASP  67          1HB       ASP  67  -6.042  -9.934   0.213
  508    H    GLY  68           H        GLY  68  -2.166  -8.792  -0.599
  509   1HA   GLY  68          2HA       GLY  68   0.048  -9.364  -0.926
  510   2HA   GLY  68          1HA       GLY  68  -0.015 -10.271   0.582
  511    H    SER  69           H        SER  69  -1.845 -10.567  -2.457
  512    HA   SER  69           HA       SER  69  -1.482 -13.452  -2.428
  513   1HB   SER  69          2HB       SER  69  -2.967 -13.405  -4.424
  514   2HB   SER  69          1HB       SER  69  -3.672 -12.606  -3.022
  515    HG   SER  69           HG       SER  69  -2.716 -11.543  -5.421
  516    H    GLY  70           H        GLY  70   0.485 -11.015  -3.498
  517   1HA   GLY  70          2HA       GLY  70   2.394 -11.122  -4.812
  518   2HA   GLY  70          1HA       GLY  70   1.956 -12.769  -5.256
  519    H    THR  71           H        THR  71  -0.444 -10.296  -5.599
  520    HA   THR  71           HA       THR  71   0.143  -9.823  -8.424
  521    HB   THR  71           HB       THR  71  -2.010 -10.558  -9.213
  522    HG1  THR  71           HG1      THR  71  -3.549 -11.369  -7.809
  523   1HG2  THR  71          1HG2      THR  71  -0.295 -12.320  -9.008
  524   2HG2  THR  71          2HG2      THR  71  -1.911 -12.974  -8.747
  525   3HG2  THR  71          3HG2      THR  71  -0.850 -12.668  -7.370
  526    H    VAL  72           H        VAL  72  -0.331  -7.762  -8.951
  527    HA   VAL  72           HA       VAL  72  -1.579  -6.084  -6.922
  528    HB   VAL  72           HB       VAL  72  -0.626  -5.132  -9.615
  529   1HG1  VAL  72          1HG1      VAL  72  -0.806  -3.839  -6.879
  530   2HG1  VAL  72          2HG1      VAL  72  -1.917  -3.564  -8.221
  531   3HG1  VAL  72          3HG1      VAL  72  -0.234  -3.050  -8.350
  532   1HG2  VAL  72          1HG2      VAL  72   1.005  -5.645  -7.109
  533   2HG2  VAL  72          2HG2      VAL  72   1.564  -4.676  -8.473
  534   3HG2  VAL  72          3HG2      VAL  72   1.236  -6.396  -8.689
  535    H    ASP  73           H        ASP  73  -3.658  -5.698  -6.869
  536    HA   ASP  73           HA       ASP  73  -5.399  -6.266  -9.130
  537   1HB   ASP  73          2HB       ASP  73  -5.944  -5.154  -6.359
  538   2HB   ASP  73          1HB       ASP  73  -7.195  -5.458  -7.561
  539    H    PHE  74           H        PHE  74  -7.071  -4.478  -9.726
  540    HA   PHE  74           HA       PHE  74  -5.657  -2.253 -10.727
  541   1HB   PHE  74          2HB       PHE  74  -7.888  -3.164 -11.581
  542   2HB   PHE  74          1HB       PHE  74  -8.639  -2.226 -10.289
  543    HD1  PHE  74           HD1      PHE  74  -5.707  -1.573 -12.524
  544    HD2  PHE  74           HD2      PHE  74  -9.595  -0.295 -11.214
  545    HE1  PHE  74           HE1      PHE  74  -5.520   0.466 -13.929
  546    HE2  PHE  74           HE2      PHE  74  -9.396   1.751 -12.610
  547    HZ   PHE  74           HZ       PHE  74  -7.359   2.124 -13.966
  548    H    ASP  75           H        ASP  75  -7.497  -2.709  -7.753
  549    HA   ASP  75           HA       ASP  75  -7.574   0.028  -6.954
  550   1HB   ASP  75          2HB       ASP  75  -8.919  -1.943  -5.978
  551   2HB   ASP  75          1HB       ASP  75  -7.469  -2.309  -5.044
  552    H    GLU  76           H        GLU  76  -5.351  -2.664  -6.317
  553    HA   GLU  76           HA       GLU  76  -3.554  -1.167  -4.664
  554   1HB   GLU  76          2HB       GLU  76  -3.022  -3.714  -6.216
  555   2HB   GLU  76          1HB       GLU  76  -2.078  -3.095  -4.862
  556   1HG   GLU  76          2HG       GLU  76  -3.860  -3.471  -3.318
  557   2HG   GLU  76          1HG       GLU  76  -5.029  -3.722  -4.609
  558    H    PHE  77           H        PHE  77  -3.909  -1.709  -8.100
  559    HA   PHE  77           HA       PHE  77  -1.311  -0.959  -8.963
  560   1HB   PHE  77          2HB       PHE  77  -3.434  -2.031 -10.215
  561   2HB   PHE  77          1HB       PHE  77  -3.689  -0.351 -10.656
  562    HD1  PHE  77           HD1      PHE  77  -3.389  -1.110 -12.996
  563    HD2  PHE  77           HD2      PHE  77  -0.189  -1.345 -10.124
  564    HE1  PHE  77           HE1      PHE  77  -1.751  -1.343 -14.827
  565    HE2  PHE  77           HE2      PHE  77   1.439  -1.570 -11.970
  566    HZ   PHE  77           HZ       PHE  77   0.658  -1.577 -14.324
  567    H    LEU  78           H        LEU  78  -4.380   0.852  -8.847
  568    HA   LEU  78           HA       LEU  78  -3.258   3.356  -9.605
  569   1HB   LEU  78          2HB       LEU  78  -5.850   2.448  -8.441
  570   2HB   LEU  78          1HB       LEU  78  -5.457   4.155  -8.366
  571    HG   LEU  78           HG       LEU  78  -5.583   4.408 -10.692
  572   1HD1  LEU  78          1HD1      LEU  78  -5.536   1.405 -11.070
  573   2HD1  LEU  78          2HD1      LEU  78  -4.084   2.404 -11.146
  574   3HD1  LEU  78          3HD1      LEU  78  -5.385   2.651 -12.312
  575   1HD2  LEU  78          1HD2      LEU  78  -7.671   3.111 -11.366
  576   2HD2  LEU  78          2HD2      LEU  78  -7.803   4.050  -9.880
  577   3HD2  LEU  78          3HD2      LEU  78  -7.565   2.304  -9.802
  578    H    VAL  79           H        VAL  79  -3.870   1.797  -6.485
  579    HA   VAL  79           HA       VAL  79  -3.390   4.012  -4.803
  580    HB   VAL  79           HB       VAL  79  -3.252   1.034  -4.461
  581   1HG1  VAL  79          1HG1      VAL  79  -2.239   3.079  -2.466
  582   2HG1  VAL  79          2HG1      VAL  79  -1.318   1.762  -3.198
  583   3HG1  VAL  79          3HG1      VAL  79  -2.623   1.404  -2.063
  584   1HG2  VAL  79          1HG2      VAL  79  -4.671   3.099  -2.776
  585   2HG2  VAL  79          2HG2      VAL  79  -5.073   1.396  -2.995
  586   3HG2  VAL  79          3HG2      VAL  79  -5.347   2.542  -4.308
  587    H    MET  80           H        MET  80  -1.191   1.439  -5.917
  588    HA   MET  80           HA       MET  80   1.189   2.175  -4.776
  589   1HB   MET  80          2HB       MET  80   0.428   0.417  -6.781
  590   2HB   MET  80          1HB       MET  80   1.561   1.498  -7.592
  591   1HG   MET  80          2HG       MET  80   3.180   1.131  -5.726
  592   2HG   MET  80          1HG       MET  80   2.060  -0.034  -5.023
  593   1HE   MET  80          1HE       MET  80   3.314   0.086  -9.213
  594   2HE   MET  80          2HE       MET  80   4.857  -0.029  -8.372
  595   3HE   MET  80          3HE       MET  80   3.721   1.244  -7.939
  596    H    MET  81           H        MET  81  -0.445   3.769  -7.474
  597    HA   MET  81           HA       MET  81   1.726   5.312  -8.424
  598   1HB   MET  81          2HB       MET  81  -0.472   5.011  -9.603
  599   2HB   MET  81          1HB       MET  81  -1.195   6.103  -8.425
  600   1HG   MET  81          2HG       MET  81   1.271   7.148  -9.643
  601   2HG   MET  81          1HG       MET  81  -0.037   6.893 -10.796
  602   1HE   MET  81          1HE       MET  81  -2.717   8.569 -10.317
  603   2HE   MET  81          2HE       MET  81  -2.927   8.227  -8.601
  604   3HE   MET  81          3HE       MET  81  -2.343   6.961  -9.679
  605    H    VAL  82           H        VAL  82  -0.978   6.294  -6.301
  606    HA   VAL  82           HA       VAL  82   0.178   8.780  -5.550
  607    HB   VAL  82           HB       VAL  82  -1.514   8.761  -3.717
  608   1HG1  VAL  82          1HG1      VAL  82  -2.091   9.568  -5.972
  609   2HG1  VAL  82          2HG1      VAL  82  -3.472   8.762  -5.229
  610   3HG1  VAL  82          3HG1      VAL  82  -2.518   7.926  -6.455
  611   1HG2  VAL  82          1HG2      VAL  82  -3.023   6.904  -3.462
  612   2HG2  VAL  82          2HG2      VAL  82  -1.391   6.237  -3.414
  613   3HG2  VAL  82          3HG2      VAL  82  -2.358   6.093  -4.882
  614    H    ARG  83           H        ARG  83   0.536   5.528  -4.338
  615    HA   ARG  83           HA       ARG  83   1.515   6.013  -1.757
  616   1HB   ARG  83          2HB       ARG  83   1.975   3.815  -3.755
  617   2HB   ARG  83          1HB       ARG  83   2.850   3.831  -2.226
  618   1HG   ARG  83          2HG       ARG  83  -0.046   4.326  -1.962
  619   2HG   ARG  83          1HG       ARG  83   0.360   2.726  -2.584
  620   1HD   ARG  83          2HD       ARG  83   1.408   3.979  -0.033
  621   2HD   ARG  83          1HD       ARG  83   0.259   2.652  -0.143
  622    HE   ARG  83           HE       ARG  83   2.315   1.574  -1.438
  623   1HH1  ARG  83          2HH1      ARG  83   2.265   3.456   1.511
  624   2HH1  ARG  83          1HH1      ARG  83   3.726   2.759   2.122
  625   1HH2  ARG  83          1HH2      ARG  83   4.227   0.683  -0.611
  626   2HH2  ARG  83          2HH2      ARG  83   4.833   1.202   0.926
  627    H    CYS  84           H        CYS  84   3.111   6.141  -4.901
  628    HA   CYS  84           HA       CYS  84   5.670   6.833  -3.600
  629   1HB   CYS  84          2HB       CYS  84   5.421   5.027  -5.469
  630   2HB   CYS  84          1HB       CYS  84   5.352   6.414  -6.555
  631    HG   CYS  84           HG       CYS  84   7.860   5.966  -6.357
  632    H    MET  85           H        MET  85   3.316   8.018  -5.982
  633    HA   MET  85           HA       MET  85   4.745  10.385  -6.680
  634   1HB   MET  85          2HB       MET  85   1.832   9.620  -6.935
  635   2HB   MET  85          1HB       MET  85   2.473  11.157  -7.515
  636   1HG   MET  85          2HG       MET  85   3.905   8.663  -8.328
  637   2HG   MET  85          1HG       MET  85   2.360   9.012  -9.102
  638   1HE   MET  85          1HE       MET  85   2.326  10.397 -11.333
  639   2HE   MET  85          2HE       MET  85   2.736  12.094 -11.086
  640   3HE   MET  85          3HE       MET  85   1.707  11.264  -9.921
  641    H    LYS  86           H        LYS  86   2.217   9.686  -4.293
  642    HA   LYS  86           HA       LYS  86   1.638  10.771  -2.350
  643   1HB   LYS  86          2HB       LYS  86   4.221  11.464  -2.509
  644   2HB   LYS  86          1HB       LYS  86   3.502  13.051  -2.778
  645   1HG   LYS  86          2HG       LYS  86   3.577  13.062  -0.472
  646   2HG   LYS  86          1HG       LYS  86   1.994  12.320  -0.704
  647   1HD   LYS  86          2HD       LYS  86   2.738  10.214  -0.105
  648   2HD   LYS  86          1HD       LYS  86   4.386  10.525  -0.651
  649   1HE   LYS  86          2HE       LYS  86   4.924  11.759   1.288
  650   2HE   LYS  86          1HE       LYS  86   3.229  12.005   1.709
  651   1HZ   LYS  86          1HZ       LYS  86   3.031   9.642   2.159
  652   2HZ   LYS  86          2HZ       LYS  86   4.259  10.329   3.111
  653   3HZ   LYS  86          3HZ       LYS  86   4.659   9.400   1.745
  654    H    ASP  87           H        ASP  87   0.017  12.171  -1.908
  655    HA   ASP  87           HA       ASP  87  -1.167  13.608  -4.100
  656   1HB   ASP  87          2HB       ASP  87  -2.454  12.417  -2.279
  657   2HB   ASP  87          1HB       ASP  87  -1.969  13.709  -1.184
  658    H    ASP  88           H        ASP  88   0.570  15.095  -4.564
  659    HA   ASP  88           HA       ASP  88   0.165  17.690  -3.541
  660   1HB   ASP  88          2HB       ASP  88   2.633  17.867  -2.614
  661   2HB   ASP  88          1HB       ASP  88   1.320  17.344  -1.563
  662    H    SER  89           HN       SER  89   0.067  17.203  -6.013
  663    HA   SER  89           HA       SER  89   2.624  17.233  -7.382
  664   1HB   SER  89          2HB       SER  89   0.485  16.159  -8.275
  665   2HB   SER  89          1HB       SER  89  -0.074  17.794  -8.616
  666    HG   SER  89           HG       SER  89   1.439  16.324 -10.126
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1  -7.201   4.418   9.556
    2   2H    MET   1          2H        MET   1  -6.189   5.449   8.662
    3   3H    MET   1          3H        MET   1  -6.399   3.833   8.181
    4    HA   MET   1           HA       MET   1  -8.811   4.326   7.849
    5   1HB   MET   1          2HB       MET   1  -8.539   6.470   9.297
    6   2HB   MET   1          1HB       MET   1  -7.936   7.212   7.815
    7   1HG   MET   1          2HG       MET   1 -10.149   7.649   7.453
    8   2HG   MET   1          1HG       MET   1 -10.165   5.989   6.860
    9   1HE   MET   1          1HE       MET   1 -11.545   8.520   9.152
   10   2HE   MET   1          2HE       MET   1 -10.240   8.027  10.228
   11   3HE   MET   1          3HE       MET   1 -11.913   7.722  10.688
   12    H    ASN   2           H        ASN   2  -6.187   6.511   6.754
   13    HA   ASN   2           HA       ASN   2  -5.323   6.958   4.677
   14   1HB   ASN   2          2HB       ASN   2  -5.944   4.033   4.560
   15   2HB   ASN   2          1HB       ASN   2  -5.467   4.854   3.075
   16   1HD2  ASN   2          1HD2      ASN   2  -4.346   5.259   6.497
   17   2HD2  ASN   2          2HD2      ASN   2  -2.706   5.028   6.128
   18    H    ASP   3           H        ASP   3  -7.995   7.758   5.137
   19    HA   ASP   3           HA       ASP   3  -9.677   7.113   2.907
   20   1HB   ASP   3          2HB       ASP   3 -11.103   8.952   3.696
   21   2HB   ASP   3          1HB       ASP   3 -10.628   7.908   5.034
   22    H    ILE   4           H        ILE   4  -7.182   9.477   3.501
   23    HA   ILE   4           HA       ILE   4  -7.849  11.307   1.429
   24    HB   ILE   4           HB       ILE   4  -5.515  12.107   1.643
   25   1HG1  ILE   4          2HG1      ILE   4  -4.386  10.861   3.763
   26   2HG1  ILE   4          1HG1      ILE   4  -5.244   9.494   3.054
   27   1HG2  ILE   4          1HG2      ILE   4  -7.133  12.990   3.198
   28   2HG2  ILE   4          2HG2      ILE   4  -5.658  12.654   4.104
   29   3HG2  ILE   4          3HG2      ILE   4  -7.027  11.548   4.209
   30   1HD1  ILE   4          1HD1      ILE   4  -3.614  11.295   1.286
   31   2HD1  ILE   4          2HD1      ILE   4  -4.036   9.599   1.058
   32   3HD1  ILE   4          3HD1      ILE   4  -2.810  10.048   2.241
   33    H    TYR   5           H        TYR   5  -6.079   8.280   1.483
   34    HA   TYR   5           HA       TYR   5  -4.776   8.500  -1.026
   35   1HB   TYR   5          2HB       TYR   5  -5.669   6.110   0.599
   36   2HB   TYR   5          1HB       TYR   5  -4.824   5.945  -0.940
   37    HD1  TYR   5           HD1      TYR   5  -2.472   6.420  -1.138
   38    HD2  TYR   5           HD2      TYR   5  -4.553   7.249   2.527
   39    HE1  TYR   5           HE1      TYR   5  -0.306   6.786   0.012
   40    HE2  TYR   5           HE2      TYR   5  -2.388   7.611   3.676
   41    HH   TYR   5           HH       TYR   5   0.370   8.247   2.243
   42    H    LYS   6           H        LYS   6  -7.978   7.333  -0.057
   43    HA   LYS   6           HA       LYS   6  -8.759   6.459  -2.679
   44   1HB   LYS   6          2HB       LYS   6  -9.754   5.965  -0.224
   45   2HB   LYS   6          1HB       LYS   6 -10.843   7.261  -0.720
   46   1HG   LYS   6          2HG       LYS   6 -11.101   5.944  -2.929
   47   2HG   LYS   6          1HG       LYS   6 -10.377   4.593  -2.055
   48   1HD   LYS   6          2HD       LYS   6 -12.790   6.116  -1.042
   49   2HD   LYS   6          1HD       LYS   6 -12.913   4.652  -2.015
   50   1HE   LYS   6          2HE       LYS   6 -12.040   3.296  -0.337
   51   2HE   LYS   6          1HE       LYS   6 -11.166   4.625   0.425
   52   1HZ   LYS   6          1HZ       LYS   6 -13.289   5.551   1.140
   53   2HZ   LYS   6          2HZ       LYS   6 -13.072   3.977   1.743
   54   3HZ   LYS   6          3HZ       LYS   6 -14.115   4.250   0.430
   55    H    ALA   7           H        ALA   7  -9.034   9.443  -0.819
   56    HA   ALA   7           HA       ALA   7 -10.882  10.783  -2.513
   57   1HB   ALA   7          1HB       ALA   7 -10.419  12.714  -1.265
   58   2HB   ALA   7          2HB       ALA   7  -8.767  12.206  -0.915
   59   3HB   ALA   7          3HB       ALA   7 -10.122  11.409  -0.118
   60    H    ALA   8           H        ALA   8  -7.423  10.266  -2.681
   61    HA   ALA   8           HA       ALA   8  -6.970  12.323  -4.670
   62   1HB   ALA   8          1HB       ALA   8  -4.689  11.448  -4.756
   63   2HB   ALA   8          2HB       ALA   8  -5.169  10.055  -3.787
   64   3HB   ALA   8          3HB       ALA   8  -5.190  11.671  -3.080
   65    H    VAL   9           H        VAL   9  -7.158   8.760  -4.638
   66    HA   VAL   9           HA       VAL   9  -6.652   8.458  -7.426
   67    HB   VAL   9           HB       VAL   9  -6.412   6.636  -5.697
   68   1HG1  VAL   9          1HG1      VAL   9  -8.435   5.352  -5.118
   69   2HG1  VAL   9          2HG1      VAL   9  -9.431   6.525  -5.977
   70   3HG1  VAL   9          3HG1      VAL   9  -8.551   7.008  -4.528
   71   1HG2  VAL   9          1HG2      VAL   9  -6.441   6.187  -8.141
   72   2HG2  VAL   9          2HG2      VAL   9  -8.193   5.999  -8.071
   73   3HG2  VAL   9          3HG2      VAL   9  -7.149   4.860  -7.221
   74    H    GLU  10           H        GLU  10  -9.569   9.112  -5.582
   75    HA   GLU  10           HA       GLU  10 -11.344   8.516  -7.785
   76   1HB   GLU  10          2HB       GLU  10 -13.123   9.249  -6.365
   77   2HB   GLU  10          1HB       GLU  10 -12.007   8.331  -5.357
   78   1HG   GLU  10          2HG       GLU  10 -10.970  10.448  -4.594
   79   2HG   GLU  10          1HG       GLU  10 -12.120  11.355  -5.574
   80    H    GLN  11           H        GLN  11  -9.474  11.268  -6.764
   81    HA   GLN  11           HA       GLN  11 -11.108  13.099  -8.379
   82   1HB   GLN  11          2HB       GLN  11  -9.789  14.893  -7.444
   83   2HB   GLN  11          1HB       GLN  11 -10.314  13.838  -6.134
   84   1HG   GLN  11          2HG       GLN  11  -8.143  12.766  -6.049
   85   2HG   GLN  11          1HG       GLN  11  -7.603  13.643  -7.480
   86   1HE2  GLN  11          1HE2      GLN  11  -8.452  14.034  -4.039
   87   2HE2  GLN  11          2HE2      GLN  11  -7.695  15.542  -3.857
   88    H    LEU  12           H        LEU  12  -8.820  10.902  -9.129
   89    HA   LEU  12           HA       LEU  12  -6.950  12.435 -10.662
   90   1HB   LEU  12          2HB       LEU  12  -7.725   9.547 -11.034
   91   2HB   LEU  12          1HB       LEU  12  -6.279  10.325 -11.628
   92    HG   LEU  12           HG       LEU  12  -6.963   9.786  -8.735
   93   1HD1  LEU  12          1HD1      LEU  12  -6.078   7.769  -9.222
   94   2HD1  LEU  12          2HD1      LEU  12  -4.537   8.595  -9.444
   95   3HD1  LEU  12          3HD1      LEU  12  -5.586   8.298 -10.831
   96   1HD2  LEU  12          1HD2      LEU  12  -5.709  11.879  -8.965
   97   2HD2  LEU  12          2HD2      LEU  12  -4.532  11.082 -10.011
   98   3HD2  LEU  12          3HD2      LEU  12  -4.656  10.625  -8.312
   99    H    THR  13           H        THR  13  -6.699  11.903 -13.066
  100    HA   THR  13           HA       THR  13  -9.207  12.607 -14.411
  101    HB   THR  13           HB       THR  13  -7.300  12.538 -16.382
  102    HG1  THR  13           HG1      THR  13  -5.584  12.175 -15.072
  103   1HG2  THR  13          1HG2      THR  13  -7.069  15.090 -15.590
  104   2HG2  THR  13          2HG2      THR  13  -8.459  14.620 -14.611
  105   3HG2  THR  13          3HG2      THR  13  -8.522  14.462 -16.368
  106    H    ASP  14           H        ASP  14  -9.364  11.614 -16.718
  107    HA   ASP  14           HA       ASP  14  -9.727   8.788 -16.412
  108   1HB   ASP  14          2HB       ASP  14  -9.891  10.610 -18.825
  109   2HB   ASP  14          1HB       ASP  14 -10.237   8.882 -18.893
  110    H    GLU  15           H        GLU  15  -7.258  10.879 -17.743
  111    HA   GLU  15           HA       GLU  15  -5.814   8.862 -19.172
  112   1HB   GLU  15          2HB       GLU  15  -4.118  10.514 -19.459
  113   2HB   GLU  15          1HB       GLU  15  -5.659  11.365 -19.536
  114   1HG   GLU  15          2HG       GLU  15  -5.232  11.594 -16.907
  115   2HG   GLU  15          1HG       GLU  15  -3.553  11.447 -17.421
  116    H    GLN  16           H        GLN  16  -5.793  10.049 -15.862
  117    HA   GLN  16           HA       GLN  16  -3.335   8.829 -15.060
  118   1HB   GLN  16          2HB       GLN  16  -4.892  10.669 -13.888
  119   2HB   GLN  16          1HB       GLN  16  -5.501   9.238 -13.058
  120   1HG   GLN  16          2HG       GLN  16  -3.730   9.770 -11.667
  121   2HG   GLN  16          1HG       GLN  16  -2.903   8.709 -12.808
  122   1HE2  GLN  16          1HE2      GLN  16  -3.501  12.157 -12.052
  123   2HE2  GLN  16          2HE2      GLN  16  -2.145  12.736 -12.892
  124    H    LYS  17           H        LYS  17  -6.760   7.914 -14.600
  125    HA   LYS  17           HA       LYS  17  -6.283   5.439 -13.326
  126   1HB   LYS  17          2HB       LYS  17  -8.600   6.473 -14.964
  127   2HB   LYS  17          1HB       LYS  17  -8.601   4.853 -14.265
  128   1HG   LYS  17          2HG       LYS  17  -8.745   5.633 -12.101
  129   2HG   LYS  17          1HG       LYS  17  -7.874   7.124 -12.467
  130   1HD   LYS  17          2HD       LYS  17  -9.971   7.705 -13.912
  131   2HD   LYS  17          1HD       LYS  17 -10.775   6.469 -12.943
  132   1HE   LYS  17          2HE       LYS  17  -9.152   8.500 -11.482
  133   2HE   LYS  17          1HE       LYS  17 -10.682   9.037 -12.171
  134   1HZ   LYS  17          1HZ       LYS  17 -10.977   8.224  -9.923
  135   2HZ   LYS  17          2HZ       LYS  17 -10.314   6.719 -10.348
  136   3HZ   LYS  17          3HZ       LYS  17 -11.792   7.220 -11.021
  137    H    ASN  18           H        ASN  18  -6.680   6.288 -16.757
  138    HA   ASN  18           HA       ASN  18  -6.465   3.609 -17.733
  139   1HB   ASN  18          2HB       ASN  18  -6.490   6.326 -18.945
  140   2HB   ASN  18          1HB       ASN  18  -5.772   5.026 -19.894
  141   1HD2  ASN  18          1HD2      ASN  18  -8.795   6.123 -18.378
  142   2HD2  ASN  18          2HD2      ASN  18  -9.799   5.028 -19.201
  143    H    GLU  19           H        GLU  19  -4.133   6.000 -16.747
  144    HA   GLU  19           HA       GLU  19  -1.883   5.265 -18.239
  145   1HB   GLU  19          2HB       GLU  19  -1.994   7.214 -16.664
  146   2HB   GLU  19          1HB       GLU  19  -1.884   6.078 -15.320
  147   1HG   GLU  19          2HG       GLU  19   0.255   5.203 -16.411
  148   2HG   GLU  19          1HG       GLU  19   0.182   6.617 -17.463
  149    H    PHE  20           H        PHE  20  -3.011   4.011 -15.090
  150    HA   PHE  20           HA       PHE  20  -1.002   1.936 -15.013
  151   1HB   PHE  20          2HB       PHE  20  -3.362   2.679 -13.317
  152   2HB   PHE  20          1HB       PHE  20  -2.604   1.101 -13.122
  153    HD1  PHE  20           HD1      PHE  20  -2.041   4.760 -12.952
  154    HD2  PHE  20           HD2      PHE  20  -0.421   0.867 -12.135
  155    HE1  PHE  20           HE1      PHE  20  -0.252   5.790 -11.583
  156    HE2  PHE  20           HE2      PHE  20   1.357   1.893 -10.756
  157    HZ   PHE  20           HZ       PHE  20   1.447   4.358 -10.480
  158    H    LYS  21           H        LYS  21  -4.505   2.105 -15.621
  159    HA   LYS  21           HA       LYS  21  -5.076  -0.601 -15.907
  160   1HB   LYS  21          2HB       LYS  21  -6.690   1.381 -15.951
  161   2HB   LYS  21          1HB       LYS  21  -6.305   1.516 -17.665
  162   1HG   LYS  21          2HG       LYS  21  -6.814  -1.227 -17.183
  163   2HG   LYS  21          1HG       LYS  21  -8.089  -0.335 -16.353
  164   1HD   LYS  21          2HD       LYS  21  -8.123   1.049 -18.624
  165   2HD   LYS  21          1HD       LYS  21  -7.442  -0.441 -19.271
  166   1HE   LYS  21          2HE       LYS  21  -9.927  -0.423 -17.553
  167   2HE   LYS  21          1HE       LYS  21  -9.996  -0.264 -19.306
  168   1HZ   LYS  21          1HZ       LYS  21 -10.229  -2.541 -18.849
  169   2HZ   LYS  21          2HZ       LYS  21  -8.959  -2.542 -17.723
  170   3HZ   LYS  21          3HZ       LYS  21  -8.628  -2.361 -19.380
  171    H    ALA  22           H        ALA  22  -3.669   1.640 -18.271
  172    HA   ALA  22           HA       ALA  22  -3.798   0.023 -20.566
  173   1HB   ALA  22          1HB       ALA  22  -3.097   2.337 -20.745
  174   2HB   ALA  22          2HB       ALA  22  -1.787   1.311 -21.327
  175   3HB   ALA  22          3HB       ALA  22  -1.694   2.031 -19.720
  176    H    ALA  23           H        ALA  23  -1.188   0.350 -18.154
  177    HA   ALA  23           HA       ALA  23   0.468  -1.714 -19.188
  178   1HB   ALA  23          1HB       ALA  23   0.278  -0.651 -16.350
  179   2HB   ALA  23          2HB       ALA  23   1.315  -0.001 -17.622
  180   3HB   ALA  23          3HB       ALA  23   1.597  -1.626 -16.999
  181    H    PHE  24           H        PHE  24  -2.229  -1.636 -16.942
  182    HA   PHE  24           HA       PHE  24  -1.973  -4.224 -15.833
  183   1HB   PHE  24          2HB       PHE  24  -3.585  -2.184 -15.266
  184   2HB   PHE  24          1HB       PHE  24  -4.680  -3.054 -16.338
  185    HD1  PHE  24           HD1      PHE  24  -4.901  -5.648 -15.880
  186    HD2  PHE  24           HD2      PHE  24  -3.489  -2.778 -13.019
  187    HE1  PHE  24           HE1      PHE  24  -5.455  -7.210 -14.033
  188    HE2  PHE  24           HE2      PHE  24  -4.038  -4.336 -11.179
  189    HZ   PHE  24           HZ       PHE  24  -5.032  -6.541 -11.685
  190    H    ASP  25           H        ASP  25  -3.662  -3.019 -18.724
  191    HA   ASP  25           HA       ASP  25  -4.918  -5.468 -19.419
  192   1HB   ASP  25          2HB       ASP  25  -4.142  -3.126 -21.176
  193   2HB   ASP  25          1HB       ASP  25  -5.207  -4.443 -21.657
  194    H    ILE  26           H        ILE  26  -1.785  -4.053 -20.373
  195    HA   ILE  26           HA       ILE  26  -1.201  -6.076 -22.306
  196    HB   ILE  26           HB       ILE  26   1.140  -5.222 -22.207
  197   1HG1  ILE  26          2HG1      ILE  26   0.021  -3.310 -20.130
  198   2HG1  ILE  26          1HG1      ILE  26   1.118  -4.640 -19.769
  199   1HG2  ILE  26          1HG2      ILE  26   0.594  -3.006 -23.098
  200   2HG2  ILE  26          2HG2      ILE  26  -0.994  -3.070 -22.337
  201   3HG2  ILE  26          3HG2      ILE  26  -0.599  -4.183 -23.646
  202   1HD1  ILE  26          1HD1      ILE  26   1.698  -2.006 -20.906
  203   2HD1  ILE  26          2HD1      ILE  26   2.400  -3.325 -21.843
  204   3HD1  ILE  26          3HD1      ILE  26   2.784  -3.158 -20.131
  205    H    PHE  27           H        PHE  27  -0.367  -5.710 -18.860
  206    HA   PHE  27           HA       PHE  27   1.230  -8.129 -18.847
  207   1HB   PHE  27          2HB       PHE  27   0.152  -6.519 -16.513
  208   2HB   PHE  27          1HB       PHE  27   1.358  -7.802 -16.415
  209    HD1  PHE  27           HD1      PHE  27   3.064  -7.296 -18.752
  210    HD2  PHE  27           HD2      PHE  27   1.274  -4.513 -16.008
  211    HE1  PHE  27           HE1      PHE  27   4.836  -5.645 -19.273
  212    HE2  PHE  27           HE2      PHE  27   3.049  -2.861 -16.538
  213    HZ   PHE  27           HZ       PHE  27   4.827  -3.428 -18.166
  214    H    ILE  28           H        ILE  28  -2.025  -7.169 -17.822
  215    HA   ILE  28           HA       ILE  28  -2.682 -10.014 -17.366
  216    HB   ILE  28           HB       ILE  28  -3.886  -7.476 -16.239
  217   1HG1  ILE  28          2HG1      ILE  28  -1.883  -8.419 -15.127
  218   2HG1  ILE  28          1HG1      ILE  28  -3.312  -8.527 -14.099
  219   1HG2  ILE  28          1HG2      ILE  28  -5.223  -9.556 -15.023
  220   2HG2  ILE  28          2HG2      ILE  28  -5.138 -10.095 -16.701
  221   3HG2  ILE  28          3HG2      ILE  28  -5.880  -8.545 -16.310
  222   1HD1  ILE  28          1HD1      ILE  28  -1.689 -10.629 -14.497
  223   2HD1  ILE  28          2HD1      ILE  28  -2.746 -10.849 -15.890
  224   3HD1  ILE  28          3HD1      ILE  28  -3.426 -10.825 -14.264
  225    H    GLN  29           H        GLN  29  -2.602  -9.848 -19.815
  226    HA   GLN  29           HA       GLN  29  -4.884  -8.615 -21.093
  227   1HB   GLN  29          2HB       GLN  29  -2.640  -8.806 -22.194
  228   2HB   GLN  29          1HB       GLN  29  -2.878 -10.551 -22.269
  229   1HG   GLN  29          2HG       GLN  29  -3.541  -9.539 -24.391
  230   2HG   GLN  29          1HG       GLN  29  -4.961 -10.185 -23.570
  231   1HE2  GLN  29          1HE2      GLN  29  -3.140  -7.092 -23.962
  232   2HE2  GLN  29          2HE2      GLN  29  -4.512  -6.103 -23.825
  233    H    ASP  30           H        ASP  30  -3.736 -11.952 -20.625
  234    HA   ASP  30           HA       ASP  30  -6.518 -12.878 -21.045
  235   1HB   ASP  30          2HB       ASP  30  -5.431 -15.087 -21.681
  236   2HB   ASP  30          1HB       ASP  30  -5.202 -13.767 -22.824
  237    H    ALA  31           H        ALA  31  -5.524 -11.977 -18.509
  238    HA   ALA  31           HA       ALA  31  -4.917 -14.356 -16.945
  239   1HB   ALA  31          1HB       ALA  31  -5.682 -11.717 -15.739
  240   2HB   ALA  31          2HB       ALA  31  -4.101 -11.918 -16.493
  241   3HB   ALA  31          3HB       ALA  31  -4.563 -12.938 -15.132
  242    H    GLU  32           H        GLU  32  -6.224 -15.132 -15.240
  243    HA   GLU  32           HA       GLU  32  -9.116 -14.588 -15.592
  244   1HB   GLU  32          2HB       GLU  32  -7.752 -17.188 -14.836
  245   2HB   GLU  32          1HB       GLU  32  -9.497 -16.933 -14.849
  246   1HG   GLU  32          2HG       GLU  32  -7.844 -16.345 -17.301
  247   2HG   GLU  32          1HG       GLU  32  -8.391 -17.985 -16.959
  248    H    ASP  33           H        ASP  33  -7.564 -13.029 -13.877
  249    HA   ASP  33           HA       ASP  33  -8.788 -13.715 -11.299
  250   1HB   ASP  33          2HB       ASP  33  -6.225 -14.428 -11.592
  251   2HB   ASP  33          1HB       ASP  33  -5.980 -12.735 -11.163
  252    H    GLY  34           H        GLY  34  -6.757 -11.337 -13.033
  253   1HA   GLY  34          2HA       GLY  34  -7.423  -9.081 -13.430
  254   2HA   GLY  34          1HA       GLY  34  -8.521  -9.188 -12.058
  255    H    CYS  35           H        CYS  35  -5.084 -10.060 -12.298
  256    HA   CYS  35           HA       CYS  35  -4.239  -7.775 -10.716
  257   1HB   CYS  35          2HB       CYS  35  -3.160  -9.290  -8.988
  258   2HB   CYS  35          1HB       CYS  35  -4.907  -9.114  -8.872
  259    HG   CYS  35           HG       CYS  35  -3.788 -11.580 -10.410
  260    H    ILE  36           H        ILE  36  -2.195  -7.229 -11.212
  261    HA   ILE  36           HA       ILE  36  -0.786  -8.829 -13.177
  262    HB   ILE  36           HB       ILE  36   0.788  -7.026 -13.335
  263   1HG1  ILE  36          2HG1      ILE  36   0.037  -5.067 -11.516
  264   2HG1  ILE  36          1HG1      ILE  36  -0.044  -6.549 -10.563
  265   1HG2  ILE  36          1HG2      ILE  36  -0.932  -4.994 -13.300
  266   2HG2  ILE  36          2HG2      ILE  36  -2.102  -6.298 -13.096
  267   3HG2  ILE  36          3HG2      ILE  36  -1.047  -6.272 -14.509
  268   1HD1  ILE  36          1HD1      ILE  36   2.324  -6.428 -12.293
  269   2HD1  ILE  36          2HD1      ILE  36   2.210  -6.804 -10.571
  270   3HD1  ILE  36          3HD1      ILE  36   2.267  -5.123 -11.108
  271    H    SER  37           H        SER  37   1.748  -8.916 -12.791
  272    HA   SER  37           HA       SER  37   2.074 -10.543 -10.382
  273   1HB   SER  37          2HB       SER  37   2.934 -10.941 -12.930
  274   2HB   SER  37          1HB       SER  37   4.367 -10.209 -12.218
  275    HG   SER  37           HG       SER  37   3.260 -12.669 -11.816
  276    H    THR  38           H        THR  38   2.695  -9.552  -8.580
  277    HA   THR  38           HA       THR  38   3.822  -7.002  -8.336
  278    HB   THR  38           HB       THR  38   4.496  -7.690  -6.046
  279    HG1  THR  38           HG1      THR  38   4.721  -9.719  -5.595
  280   1HG2  THR  38          1HG2      THR  38   2.148  -8.542  -5.375
  281   2HG2  THR  38          2HG2      THR  38   1.766  -8.408  -7.092
  282   3HG2  THR  38          3HG2      THR  38   2.256  -6.978  -6.183
  283    H    LYS  39           H        LYS  39   5.370 -10.181  -8.578
  284    HA   LYS  39           HA       LYS  39   8.041  -9.373  -8.138
  285   1HB   LYS  39          2HB       LYS  39   8.667 -11.428  -9.411
  286   2HB   LYS  39          1HB       LYS  39   7.472 -11.736  -8.152
  287   1HG   LYS  39          2HG       LYS  39   5.842 -11.161 -10.268
  288   2HG   LYS  39          1HG       LYS  39   7.202 -11.916 -11.095
  289   1HD   LYS  39          2HD       LYS  39   5.815 -13.742 -10.562
  290   2HD   LYS  39          1HD       LYS  39   7.014 -13.754  -9.270
  291   1HE   LYS  39          2HE       LYS  39   5.392 -12.350  -7.902
  292   2HE   LYS  39          1HE       LYS  39   4.187 -12.675  -9.148
  293   1HZ   LYS  39          1HZ       LYS  39   5.627 -14.700  -7.521
  294   2HZ   LYS  39          2HZ       LYS  39   4.550 -15.060  -8.784
  295   3HZ   LYS  39          3HZ       LYS  39   3.990 -14.277  -7.384
  296    H    GLU  40           H        GLU  40   5.948  -9.156 -10.939
  297    HA   GLU  40           HA       GLU  40   8.157  -8.165 -12.616
  298   1HB   GLU  40          2HB       GLU  40   5.328  -8.999 -13.303
  299   2HB   GLU  40          1HB       GLU  40   6.470  -8.322 -14.464
  300   1HG   GLU  40          2HG       GLU  40   8.070 -10.202 -13.699
  301   2HG   GLU  40          1HG       GLU  40   6.640 -10.948 -12.985
  302    H    LEU  41           H        LEU  41   6.720  -6.682 -10.352
  303    HA   LEU  41           HA       LEU  41   5.047  -4.673 -11.385
  304   1HB   LEU  41          2HB       LEU  41   5.663  -5.273  -8.928
  305   2HB   LEU  41          1HB       LEU  41   6.987  -4.156  -9.154
  306    HG   LEU  41           HG       LEU  41   4.916  -3.237  -8.021
  307   1HD1  LEU  41          1HD1      LEU  41   6.741  -2.009  -9.577
  308   2HD1  LEU  41          2HD1      LEU  41   5.408  -1.145  -8.813
  309   3HD1  LEU  41          3HD1      LEU  41   5.286  -1.637 -10.501
  310   1HD2  LEU  41          1HD2      LEU  41   3.811  -3.352 -10.846
  311   2HD2  LEU  41          2HD2      LEU  41   3.011  -2.658  -9.436
  312   3HD2  LEU  41          3HD2      LEU  41   3.290  -4.397  -9.524
  313    H    GLY  42           H        GLY  42   8.546  -5.021 -11.380
  314   1HA   GLY  42          2HA       GLY  42   9.326  -2.384 -11.931
  315   2HA   GLY  42          1HA       GLY  42  10.212  -3.823 -12.424
  316    H    LYS  43           H        LYS  43   8.139  -4.953 -14.058
  317    HA   LYS  43           HA       LYS  43   8.681  -3.745 -16.548
  318   1HB   LYS  43          2HB       LYS  43   7.597  -6.132 -15.735
  319   2HB   LYS  43          1HB       LYS  43   6.187  -5.304 -16.399
  320   1HG   LYS  43          2HG       LYS  43   7.011  -5.317 -18.522
  321   2HG   LYS  43          1HG       LYS  43   8.677  -5.102 -17.995
  322   1HD   LYS  43          2HD       LYS  43   8.876  -7.296 -18.601
  323   2HD   LYS  43          1HD       LYS  43   8.182  -7.586 -17.007
  324   1HE   LYS  43          2HE       LYS  43   6.763  -8.848 -18.358
  325   2HE   LYS  43          1HE       LYS  43   5.889  -7.320 -18.272
  326   1HZ   LYS  43          1HZ       LYS  43   6.097  -8.201 -20.548
  327   2HZ   LYS  43          2HZ       LYS  43   7.786  -8.050 -20.438
  328   3HZ   LYS  43          3HZ       LYS  43   6.800  -6.668 -20.373
  329    H    VAL  44           H        VAL  44   6.022  -3.405 -14.283
  330    HA   VAL  44           HA       VAL  44   4.487  -1.699 -16.066
  331    HB   VAL  44           HB       VAL  44   2.717  -2.037 -14.691
  332   1HG1  VAL  44          1HG1      VAL  44   3.995  -4.290 -14.818
  333   2HG1  VAL  44          2HG1      VAL  44   2.704  -4.133 -13.627
  334   3HG1  VAL  44          3HG1      VAL  44   4.390  -3.993 -13.125
  335   1HG2  VAL  44          1HG2      VAL  44   4.654  -1.417 -12.474
  336   2HG2  VAL  44          2HG2      VAL  44   3.088  -2.126 -12.094
  337   3HG2  VAL  44          3HG2      VAL  44   3.170  -0.573 -12.925
  338    H    MET  45           H        MET  45   6.654  -1.403 -13.318
  339    HA   MET  45           HA       MET  45   6.202   1.306 -12.680
  340   1HB   MET  45          2HB       MET  45   7.690  -0.565 -11.515
  341   2HB   MET  45          1HB       MET  45   8.963   0.177 -12.486
  342   1HG   MET  45          2HG       MET  45   9.032   1.429 -10.502
  343   2HG   MET  45          1HG       MET  45   8.039   2.429 -11.559
  344   1HE   MET  45          1HE       MET  45   7.124   2.008  -7.564
  345   2HE   MET  45          2HE       MET  45   8.588   2.140  -8.534
  346   3HE   MET  45          3HE       MET  45   8.027   0.554  -8.011
  347    H    ARG  46           H        ARG  46   8.144  -0.264 -15.180
  348    HA   ARG  46           HA       ARG  46   9.680   1.986 -15.973
  349   1HB   ARG  46          2HB       ARG  46   8.688  -0.267 -17.741
  350   2HB   ARG  46          1HB       ARG  46  10.022   0.831 -18.092
  351   1HG   ARG  46          2HG       ARG  46  10.781  -0.115 -15.651
  352   2HG   ARG  46          1HG       ARG  46   9.937  -1.519 -16.303
  353   1HD   ARG  46          2HD       ARG  46  11.379  -0.782 -18.478
  354   2HD   ARG  46          1HD       ARG  46  12.458  -0.250 -17.194
  355    HE   ARG  46           HE       ARG  46  11.506  -2.927 -16.763
  356   1HH1  ARG  46          2HH1      ARG  46  13.813  -0.978 -18.515
  357   2HH1  ARG  46          1HH1      ARG  46  14.957  -2.263 -18.691
  358   1HH2  ARG  46          1HH2      ARG  46  13.017  -4.601 -17.007
  359   2HH2  ARG  46          2HH2      ARG  46  14.508  -4.311 -17.840
  360    H    MET  47           H        MET  47   6.443   0.862 -16.845
  361    HA   MET  47           HA       MET  47   5.948   2.771 -18.908
  362   1HB   MET  47          2HB       MET  47   4.158   1.073 -17.168
  363   2HB   MET  47          1HB       MET  47   3.491   2.242 -18.308
  364   1HG   MET  47          2HG       MET  47   5.524   0.169 -19.151
  365   2HG   MET  47          1HG       MET  47   3.791  -0.159 -19.169
  366   1HE   MET  47          1HE       MET  47   6.288   0.245 -21.630
  367   2HE   MET  47          2HE       MET  47   6.776   1.538 -20.538
  368   3HE   MET  47          3HE       MET  47   6.307   1.923 -22.192
  369    H    LEU  48           H        LEU  48   5.559   2.759 -15.403
  370    HA   LEU  48           HA       LEU  48   4.041   5.157 -15.160
  371   1HB   LEU  48          2HB       LEU  48   5.697   3.475 -13.340
  372   2HB   LEU  48          1HB       LEU  48   5.323   5.103 -12.829
  373    HG   LEU  48           HG       LEU  48   2.908   4.585 -13.003
  374   1HD1  LEU  48          1HD1      LEU  48   3.756   1.713 -13.437
  375   2HD1  LEU  48          2HD1      LEU  48   3.290   2.767 -14.772
  376   3HD1  LEU  48          3HD1      LEU  48   2.127   2.382 -13.504
  377   1HD2  LEU  48          1HD2      LEU  48   4.838   3.228 -11.228
  378   2HD2  LEU  48          2HD2      LEU  48   3.232   2.500 -11.247
  379   3HD2  LEU  48          3HD2      LEU  48   3.425   4.200 -10.818
  380    H    GLY  49           H        GLY  49   7.469   4.425 -15.409
  381   1HA   GLY  49          2HA       GLY  49   8.784   6.248 -16.524
  382   2HA   GLY  49          1HA       GLY  49   8.105   7.317 -15.305
  383    H    GLN  50           H        GLN  50   8.793   4.211 -14.034
  384    HA   GLN  50           HA       GLN  50  11.427   5.132 -13.035
  385   1HB   GLN  50          2HB       GLN  50   9.617   3.389 -11.384
  386   2HB   GLN  50          1HB       GLN  50  10.968   4.387 -10.859
  387   1HG   GLN  50          2HG       GLN  50   8.393   5.515 -11.994
  388   2HG   GLN  50          1HG       GLN  50   8.696   5.317 -10.270
  389   1HE2  GLN  50          1HE2      GLN  50   8.624   7.725 -12.414
  390   2HE2  GLN  50          2HE2      GLN  50   9.929   8.676 -11.887
  391    H    ASN  51           H        ASN  51  13.038   3.610 -12.898
  392    HA   ASN  51           HA       ASN  51  12.380   0.887 -13.883
  393   1HB   ASN  51          2HB       ASN  51  14.646   2.735 -14.614
  394   2HB   ASN  51          1HB       ASN  51  14.822   0.989 -14.774
  395   1HD2  ASN  51          1HD2      ASN  51  14.914   1.242 -17.150
  396   2HD2  ASN  51          2HD2      ASN  51  13.497   1.542 -18.035
  397    HA   PRO  52           HA       PRO  52  14.709   0.634  -9.845
  398   1HB   PRO  52          2HB       PRO  52  12.742  -0.529  -8.346
  399   2HB   PRO  52          1HB       PRO  52  12.927   1.221  -8.532
  400   1HG   PRO  52          2HG       PRO  52  10.909  -0.589  -9.698
  401   2HG   PRO  52          1HG       PRO  52  10.808   1.146  -9.367
  402   1HD   PRO  52          2HD       PRO  52  11.280  -0.087 -11.899
  403   2HD   PRO  52          1HD       PRO  52  11.362   1.649 -11.520
  404    H    THR  53           H        THR  53  14.269  -1.603  -8.242
  405    HA   THR  53           HA       THR  53  14.894  -3.843 -10.076
  406    HB   THR  53           HB       THR  53  16.365  -4.699  -8.452
  407    HG1  THR  53           HG1      THR  53  16.023  -4.500  -6.375
  408   1HG2  THR  53          1HG2      THR  53  16.434  -1.689  -8.181
  409   2HG2  THR  53          2HG2      THR  53  17.316  -2.663  -9.358
  410   3HG2  THR  53          3HG2      THR  53  17.723  -2.763  -7.644
  411    HA   PRO  54           HA       PRO  54  11.451  -6.100  -8.478
  412   1HB   PRO  54          2HB       PRO  54  12.445  -8.606  -7.973
  413   2HB   PRO  54          1HB       PRO  54  12.127  -7.972  -9.595
  414   1HG   PRO  54          2HG       PRO  54  14.717  -8.330  -8.185
  415   2HG   PRO  54          1HG       PRO  54  14.355  -8.402  -9.916
  416   1HD   PRO  54          2HD       PRO  54  15.539  -6.232  -8.603
  417   2HD   PRO  54          1HD       PRO  54  14.773  -6.165 -10.206
  418    H    GLU  55           H        GLU  55  14.322  -6.077  -6.481
  419    HA   GLU  55           HA       GLU  55  12.986  -6.997  -4.077
  420   1HB   GLU  55          2HB       GLU  55  15.695  -5.679  -4.430
  421   2HB   GLU  55          1HB       GLU  55  15.105  -6.445  -2.955
  422   1HG   GLU  55          2HG       GLU  55  14.719  -8.516  -4.560
  423   2HG   GLU  55          1HG       GLU  55  15.942  -7.711  -5.543
  424    H    GLU  56           H        GLU  56  13.988  -3.914  -5.535
  425    HA   GLU  56           HA       GLU  56  13.376  -2.268  -3.289
  426   1HB   GLU  56          2HB       GLU  56  13.741  -1.746  -6.231
  427   2HB   GLU  56          1HB       GLU  56  13.191  -0.465  -5.153
  428   1HG   GLU  56          2HG       GLU  56  15.200  -1.060  -3.671
  429   2HG   GLU  56          1HG       GLU  56  15.791  -2.004  -5.039
  430    H    LEU  57           H        LEU  57  11.563  -2.927  -6.309
  431    HA   LEU  57           HA       LEU  57   9.253  -1.473  -5.622
  432   1HB   LEU  57          2HB       LEU  57   8.135  -2.725  -7.368
  433   2HB   LEU  57          1HB       LEU  57   9.710  -2.188  -7.897
  434    HG   LEU  57           HG       LEU  57  10.427  -4.628  -7.137
  435   1HD1  LEU  57          1HD1      LEU  57   8.150  -5.878  -8.137
  436   2HD1  LEU  57          2HD1      LEU  57   7.504  -4.659  -7.039
  437   3HD1  LEU  57          3HD1      LEU  57   8.656  -5.855  -6.448
  438   1HD2  LEU  57          1HD2      LEU  57   9.088  -3.672  -9.653
  439   2HD2  LEU  57          2HD2      LEU  57   9.600  -5.354  -9.525
  440   3HD2  LEU  57          3HD2      LEU  57  10.786  -4.058  -9.379
  441    H    GLN  58           H        GLN  58  10.253  -4.754  -4.801
  442    HA   GLN  58           HA       GLN  58   7.797  -5.847  -4.038
  443   1HB   GLN  58          2HB       GLN  58  10.601  -6.474  -3.589
  444   2HB   GLN  58          1HB       GLN  58   9.610  -6.865  -2.184
  445   1HG   GLN  58          2HG       GLN  58   8.997  -7.731  -5.028
  446   2HG   GLN  58          1HG       GLN  58   9.741  -8.756  -3.802
  447   1HE2  GLN  58          1HE2      GLN  58   6.720  -7.700  -5.064
  448   2HE2  GLN  58          2HE2      GLN  58   5.733  -8.320  -3.830
  449    H    GLU  59           H        GLU  59   9.937  -3.651  -2.272
  450    HA   GLU  59           HA       GLU  59   8.694  -3.857   0.269
  451   1HB   GLU  59          2HB       GLU  59  10.448  -1.844  -1.074
  452   2HB   GLU  59          1HB       GLU  59   9.578  -1.347   0.379
  453   1HG   GLU  59          2HG       GLU  59  11.101  -3.944   0.350
  454   2HG   GLU  59          1HG       GLU  59  11.949  -2.424   0.633
  455    H    MET  60           H        MET  60   8.079  -1.784  -2.539
  456    HA   MET  60           HA       MET  60   6.007  -0.230  -1.337
  457   1HB   MET  60          2HB       MET  60   6.406  -0.823  -4.280
  458   2HB   MET  60          1HB       MET  60   5.486   0.514  -3.589
  459   1HG   MET  60          2HG       MET  60   8.411   0.133  -2.956
  460   2HG   MET  60          1HG       MET  60   7.892   1.014  -4.391
  461   1HE   MET  60          1HE       MET  60   6.151   4.089  -3.253
  462   2HE   MET  60          2HE       MET  60   5.914   2.664  -4.263
  463   3HE   MET  60          3HE       MET  60   7.434   3.552  -4.345
  464    H    ILE  61           H        ILE  61   6.112  -3.197  -3.222
  465    HA   ILE  61           HA       ILE  61   3.346  -3.572  -3.634
  466    HB   ILE  61           HB       ILE  61   5.609  -5.567  -3.389
  467   1HG1  ILE  61          2HG1      ILE  61   5.733  -4.034  -5.316
  468   2HG1  ILE  61          1HG1      ILE  61   5.375  -5.674  -5.848
  469   1HG2  ILE  61          1HG2      ILE  61   2.755  -6.030  -4.313
  470   2HG2  ILE  61          2HG2      ILE  61   3.460  -6.646  -2.819
  471   3HG2  ILE  61          3HG2      ILE  61   4.062  -7.211  -4.374
  472   1HD1  ILE  61          1HD1      ILE  61   3.755  -3.244  -6.080
  473   2HD1  ILE  61          2HD1      ILE  61   2.856  -4.601  -5.403
  474   3HD1  ILE  61          3HD1      ILE  61   3.639  -4.758  -6.975
  475    H    ASP  62           H        ASP  62   5.493  -4.890  -1.095
  476    HA   ASP  62           HA       ASP  62   3.571  -6.273   0.386
  477   1HB   ASP  62          2HB       ASP  62   6.265  -5.793   0.661
  478   2HB   ASP  62          1HB       ASP  62   5.589  -4.916   2.033
  479    H    GLU  63           H        GLU  63   4.450  -2.848   0.441
  480    HA   GLU  63           HA       GLU  63   2.865  -2.186   2.740
  481   1HB   GLU  63          2HB       GLU  63   4.153  -0.524   0.575
  482   2HB   GLU  63          1HB       GLU  63   3.204   0.188   1.878
  483   1HG   GLU  63          2HG       GLU  63   5.429  -1.743   2.501
  484   2HG   GLU  63          1HG       GLU  63   5.783  -0.042   2.199
  485    H    VAL  64           H        VAL  64   2.368  -1.794  -0.782
  486    HA   VAL  64           HA       VAL  64  -0.222  -0.591  -0.465
  487    HB   VAL  64           HB       VAL  64   1.210  -0.155  -2.439
  488   1HG1  VAL  64          1HG1      VAL  64   0.424  -2.908  -3.410
  489   2HG1  VAL  64          2HG1      VAL  64   1.958  -2.604  -2.597
  490   3HG1  VAL  64          3HG1      VAL  64   1.593  -1.793  -4.118
  491   1HG2  VAL  64          1HG2      VAL  64  -1.427  -0.138  -2.364
  492   2HG2  VAL  64          2HG2      VAL  64  -1.268  -1.499  -3.474
  493   3HG2  VAL  64          3HG2      VAL  64  -0.589   0.071  -3.901
  494    H    ASP  65           H        ASP  65   0.904  -3.890  -1.153
  495    HA   ASP  65           HA       ASP  65  -1.721  -4.931  -1.664
  496   1HB   ASP  65          2HB       ASP  65   0.883  -5.878  -1.992
  497   2HB   ASP  65          1HB       ASP  65   0.207  -6.911  -0.738
  498    H    GLU  66           H        GLU  66  -3.206  -4.851  -0.118
  499    HA   GLU  66           HA       GLU  66  -2.685  -4.861   2.680
  500   1HB   GLU  66          2HB       GLU  66  -5.280  -5.582   1.290
  501   2HB   GLU  66          1HB       GLU  66  -5.090  -5.052   2.960
  502   1HG   GLU  66          2HG       GLU  66  -4.125  -2.895   2.086
  503   2HG   GLU  66          1HG       GLU  66  -4.547  -3.430   0.460
  504    H    ASP  67           H        ASP  67  -3.896  -7.334   0.449
  505    HA   ASP  67           HA       ASP  67  -3.942  -9.394   2.472
  506   1HB   ASP  67          2HB       ASP  67  -4.385 -10.907   0.470
  507   2HB   ASP  67          1HB       ASP  67  -5.575  -9.638   0.758
  508    H    GLY  68           H        GLY  68  -1.796  -8.471  -0.198
  509   1HA   GLY  68          2HA       GLY  68   0.445  -8.951  -0.525
  510   2HA   GLY  68          1HA       GLY  68   0.451  -9.783   1.027
  511    H    SER  69           H        SER  69  -1.477 -10.329  -1.910
  512    HA   SER  69           HA       SER  69  -1.034 -13.185  -1.765
  513   1HB   SER  69          2HB       SER  69  -2.447 -13.235  -3.830
  514   2HB   SER  69          1HB       SER  69  -3.215 -12.431  -2.464
  515    HG   SER  69           HG       SER  69  -3.333 -10.733  -3.684
  516    H    GLY  70           H        GLY  70   0.627 -10.582  -3.244
  517   1HA   GLY  70          2HA       GLY  70   2.689 -10.802  -4.371
  518   2HA   GLY  70          1HA       GLY  70   2.268 -12.464  -4.780
  519    H    THR  71           H        THR  71  -0.222 -10.132  -5.228
  520    HA   THR  71           HA       THR  71   0.426  -9.685  -8.049
  521    HB   THR  71           HB       THR  71  -1.759 -10.433  -8.812
  522    HG1  THR  71           HG1      THR  71  -2.193 -11.246  -6.125
  523   1HG2  THR  71          1HG2      THR  71   0.040 -12.111  -8.716
  524   2HG2  THR  71          2HG2      THR  71  -1.529 -12.855  -8.400
  525   3HG2  THR  71          3HG2      THR  71  -0.426 -12.519  -7.064
  526    H    VAL  72           H        VAL  72  -0.175  -7.685  -8.718
  527    HA   VAL  72           HA       VAL  72  -1.542  -5.985  -6.752
  528    HB   VAL  72           HB       VAL  72  -0.420  -4.997  -9.362
  529   1HG1  VAL  72          1HG1      VAL  72  -0.302  -2.916  -8.220
  530   2HG1  VAL  72          2HG1      VAL  72  -0.479  -3.682  -6.641
  531   3HG1  VAL  72          3HG1      VAL  72  -1.853  -3.607  -7.745
  532   1HG2  VAL  72          1HG2      VAL  72   1.392  -6.301  -8.336
  533   2HG2  VAL  72          2HG2      VAL  72   1.110  -5.504  -6.786
  534   3HG2  VAL  72          3HG2      VAL  72   1.721  -4.575  -8.157
  535    H    ASP  73           H        ASP  73  -3.653  -5.749  -6.892
  536    HA   ASP  73           HA       ASP  73  -5.101  -6.312  -9.352
  537   1HB   ASP  73          2HB       ASP  73  -6.003  -5.371  -6.612
  538   2HB   ASP  73          1HB       ASP  73  -7.102  -5.649  -7.962
  539    H    PHE  74           H        PHE  74  -6.799  -4.592 -10.048
  540    HA   PHE  74           HA       PHE  74  -5.412  -2.274 -10.844
  541   1HB   PHE  74          2HB       PHE  74  -7.507  -3.259 -11.925
  542   2HB   PHE  74          1HB       PHE  74  -8.420  -2.400 -10.680
  543    HD1  PHE  74           HD1      PHE  74  -5.331  -1.533 -12.614
  544    HD2  PHE  74           HD2      PHE  74  -9.381  -0.492 -11.635
  545    HE1  PHE  74           HE1      PHE  74  -5.113   0.562 -13.919
  546    HE2  PHE  74           HE2      PHE  74  -9.156   1.608 -12.935
  547    HZ   PHE  74           HZ       PHE  74  -7.025   2.131 -14.080
  548    H    ASP  75           H        ASP  75  -7.474  -2.902  -8.054
  549    HA   ASP  75           HA       ASP  75  -7.759  -0.193  -7.202
  550   1HB   ASP  75          2HB       ASP  75  -7.883  -2.797  -5.654
  551   2HB   ASP  75          1HB       ASP  75  -8.277  -1.222  -4.967
  552    H    GLU  76           H        GLU  76  -5.470  -2.794  -6.414
  553    HA   GLU  76           HA       GLU  76  -3.901  -1.232  -4.586
  554   1HB   GLU  76          2HB       GLU  76  -3.105  -3.742  -6.085
  555   2HB   GLU  76          1HB       GLU  76  -2.327  -3.086  -4.645
  556   1HG   GLU  76          2HG       GLU  76  -4.361  -3.451  -3.335
  557   2HG   GLU  76          1HG       GLU  76  -5.217  -4.007  -4.771
  558    H    PHE  77           H        PHE  77  -3.986  -1.656  -8.036
  559    HA   PHE  77           HA       PHE  77  -1.334  -0.832  -8.654
  560   1HB   PHE  77          2HB       PHE  77  -3.296  -1.971 -10.102
  561   2HB   PHE  77          1HB       PHE  77  -3.552  -0.298 -10.568
  562    HD1  PHE  77           HD1      PHE  77  -2.978  -1.060 -12.874
  563    HD2  PHE  77           HD2      PHE  77  -0.117  -1.174  -9.662
  564    HE1  PHE  77           HE1      PHE  77  -1.132  -1.241 -14.510
  565    HE2  PHE  77           HE2      PHE  77   1.718  -1.344 -11.305
  566    HZ   PHE  77           HZ       PHE  77   1.214  -1.382 -13.733
  567    H    LEU  78           H        LEU  78  -4.458   0.884  -8.915
  568    HA   LEU  78           HA       LEU  78  -3.329   3.420  -9.507
  569   1HB   LEU  78          2HB       LEU  78  -6.009   2.425  -8.688
  570   2HB   LEU  78          1HB       LEU  78  -5.686   4.138  -8.495
  571    HG   LEU  78           HG       LEU  78  -5.481   4.477 -10.816
  572   1HD1  LEU  78          1HD1      LEU  78  -5.290   1.469 -11.151
  573   2HD1  LEU  78          2HD1      LEU  78  -3.931   2.590 -11.240
  574   3HD1  LEU  78          3HD1      LEU  78  -5.214   2.666 -12.446
  575   1HD2  LEU  78          1HD2      LEU  78  -7.802   3.959 -10.097
  576   2HD2  LEU  78          2HD2      LEU  78  -7.530   2.264 -10.499
  577   3HD2  LEU  78          3HD2      LEU  78  -7.509   3.486 -11.770
  578    H    VAL  79           H        VAL  79  -4.118   1.795  -6.478
  579    HA   VAL  79           HA       VAL  79  -3.927   4.039  -4.753
  580    HB   VAL  79           HB       VAL  79  -3.775   1.071  -4.422
  581   1HG1  VAL  79          1HG1      VAL  79  -2.858   3.062  -2.327
  582   2HG1  VAL  79          2HG1      VAL  79  -1.898   1.768  -3.050
  583   3HG1  VAL  79          3HG1      VAL  79  -3.256   1.375  -1.993
  584   1HG2  VAL  79          1HG2      VAL  79  -5.630   1.452  -2.957
  585   2HG2  VAL  79          2HG2      VAL  79  -5.884   2.497  -4.353
  586   3HG2  VAL  79          3HG2      VAL  79  -5.273   3.175  -2.845
  587    H    MET  80           H        MET  80  -1.540   1.599  -5.753
  588    HA   MET  80           HA       MET  80   0.700   2.427  -4.364
  589   1HB   MET  80          2HB       MET  80   0.184   0.637  -6.441
  590   2HB   MET  80          1HB       MET  80   1.385   1.742  -7.106
  591   1HG   MET  80          2HG       MET  80   2.724   1.401  -4.978
  592   2HG   MET  80          1HG       MET  80   1.596   0.111  -4.565
  593   1HE   MET  80          1HE       MET  80   1.990  -2.575  -7.089
  594   2HE   MET  80          2HE       MET  80   1.017  -1.211  -7.632
  595   3HE   MET  80          3HE       MET  80   0.964  -1.705  -5.942
  596    H    MET  81           H        MET  81  -0.819   3.976  -7.134
  597    HA   MET  81           HA       MET  81   1.327   5.571  -8.032
  598   1HB   MET  81          2HB       MET  81  -0.902   5.270  -9.194
  599   2HB   MET  81          1HB       MET  81  -1.589   6.382  -8.013
  600   1HG   MET  81          2HG       MET  81   0.518   7.861  -8.783
  601   2HG   MET  81          1HG       MET  81   0.291   6.928 -10.261
  602   1HE   MET  81          1HE       MET  81  -2.549   6.193 -10.267
  603   2HE   MET  81          2HE       MET  81  -1.981   6.972 -11.742
  604   3HE   MET  81          3HE       MET  81  -3.492   7.496 -11.003
  605    H    VAL  82           H        VAL  82  -1.363   6.426  -5.848
  606    HA   VAL  82           HA       VAL  82  -0.204   8.912  -5.035
  607    HB   VAL  82           HB       VAL  82  -1.951   8.877  -3.250
  608   1HG1  VAL  82          1HG1      VAL  82  -2.469   9.778  -5.464
  609   2HG1  VAL  82          2HG1      VAL  82  -3.873   8.926  -4.824
  610   3HG1  VAL  82          3HG1      VAL  82  -2.862   8.163  -6.052
  611   1HG2  VAL  82          1HG2      VAL  82  -1.901   6.358  -2.993
  612   2HG2  VAL  82          2HG2      VAL  82  -2.790   6.250  -4.512
  613   3HG2  VAL  82          3HG2      VAL  82  -3.520   7.047  -3.117
  614    H    ARG  83           H        ARG  83  -0.028   5.607  -3.857
  615    HA   ARG  83           HA       ARG  83   0.978   6.056  -1.266
  616   1HB   ARG  83          2HB       ARG  83   1.488   3.788  -3.208
  617   2HB   ARG  83          1HB       ARG  83   2.037   3.781  -1.533
  618   1HG   ARG  83          2HG       ARG  83  -0.861   4.248  -2.254
  619   2HG   ARG  83          1HG       ARG  83  -0.211   2.627  -2.015
  620   1HD   ARG  83          2HD       ARG  83   0.295   4.731   0.063
  621   2HD   ARG  83          1HD       ARG  83  -1.276   3.940   0.009
  622    HE   ARG  83           HE       ARG  83   0.566   1.881  -0.045
  623   1HH1  ARG  83          2HH1      ARG  83  -0.158   4.572   2.059
  624   2HH1  ARG  83          1HH1      ARG  83   0.383   3.764   3.488
  625   1HH2  ARG  83          1HH2      ARG  83   1.272   0.840   1.843
  626   2HH2  ARG  83          2HH2      ARG  83   1.192   1.657   3.368
  627    H    CYS  84           H        CYS  84   2.569   5.930  -4.425
  628    HA   CYS  84           HA       CYS  84   5.257   5.958  -3.593
  629   1HB   CYS  84          2HB       CYS  84   3.874   6.989  -6.066
  630   2HB   CYS  84          1HB       CYS  84   5.610   7.192  -5.834
  631    HG   CYS  84           HG       CYS  84   5.898   4.835  -6.506
  632    H    MET  85           H        MET  85   2.947   8.600  -4.154
  633    HA   MET  85           HA       MET  85   4.833  10.695  -3.581
  634   1HB   MET  85          2HB       MET  85   2.335  10.622  -4.733
  635   2HB   MET  85          1HB       MET  85   1.991  11.321  -3.151
  636   1HG   MET  85          2HG       MET  85   4.348  12.349  -4.687
  637   2HG   MET  85          1HG       MET  85   2.733  12.868  -5.169
  638   1HE   MET  85          1HE       MET  85   5.064  15.263  -2.713
  639   2HE   MET  85          2HE       MET  85   4.271  15.432  -4.277
  640   3HE   MET  85          3HE       MET  85   5.413  14.117  -4.014
  641    H    LYS  86           H        LYS  86   2.105   9.246  -1.789
  642    HA   LYS  86           HA       LYS  86   1.748   8.947   0.456
  643   1HB   LYS  86          2HB       LYS  86   4.470   8.787   0.309
  644   2HB   LYS  86          1HB       LYS  86   4.265  10.154   1.406
  645   1HG   LYS  86          2HG       LYS  86   2.691   7.608   1.791
  646   2HG   LYS  86          1HG       LYS  86   4.327   7.770   2.433
  647   1HD   LYS  86          2HD       LYS  86   3.403  10.050   3.390
  648   2HD   LYS  86          1HD       LYS  86   1.838   9.260   3.200
  649   1HE   LYS  86          2HE       LYS  86   2.241   8.324   5.220
  650   2HE   LYS  86          1HE       LYS  86   3.382   7.283   4.370
  651   1HZ   LYS  86          1HZ       LYS  86   4.047   9.917   5.573
  652   2HZ   LYS  86          2HZ       LYS  86   5.136   8.854   4.817
  653   3HZ   LYS  86          3HZ       LYS  86   4.388   8.412   6.276
  654    H    ASP  87           H        ASP  87   0.359  10.196   1.472
  655    HA   ASP  87           HA       ASP  87   0.420  13.068   1.217
  656   1HB   ASP  87          2HB       ASP  87  -1.690  11.688   1.265
  657   2HB   ASP  87          1HB       ASP  87  -1.390  11.394   2.976
  658    H    ASP  88           H        ASP  88   0.228  10.978   4.117
  659    HA   ASP  88           HA       ASP  88   2.427  12.191   5.453
  660   1HB   ASP  88          2HB       ASP  88   0.691  14.060   5.527
  661   2HB   ASP  88          1HB       ASP  88  -0.257  13.009   6.578
  662    H    SER  89           HN       SER  89  -0.823  10.887   6.191
  663    HA   SER  89           HA       SER  89   0.421   8.594   7.532
  664   1HB   SER  89          2HB       SER  89  -1.408  10.584   8.866
  665   2HB   SER  89          1HB       SER  89  -1.300   8.917   9.425
  666    HG   SER  89           HG       SER  89   0.193  10.270  10.500
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1  -4.439   8.014  12.233
    2   2H    MET   1          2H        MET   1  -4.011   9.419  11.379
    3   3H    MET   1          3H        MET   1  -3.119   7.987  11.170
    4    HA   MET   1           HA       MET   1  -5.045   6.901  10.186
    5   1HB   MET   1          2HB       MET   1  -6.614   8.515  11.499
    6   2HB   MET   1          1HB       MET   1  -6.370   9.610  10.139
    7   1HG   MET   1          2HG       MET   1  -8.192   8.466   9.325
    8   2HG   MET   1          1HG       MET   1  -6.930   7.371   8.762
    9   1HE   MET   1          1HE       MET   1  -9.628   5.508   9.074
   10   2HE   MET   1          2HE       MET   1  -9.888   7.242   9.249
   11   3HE   MET   1          3HE       MET   1 -10.470   6.141  10.496
   12    H    ASN   2           H        ASN   2  -4.225   6.608   8.221
   13    HA   ASN   2           HA       ASN   2  -2.980   8.829   6.779
   14   1HB   ASN   2          2HB       ASN   2  -2.899   5.856   6.587
   15   2HB   ASN   2          1HB       ASN   2  -2.610   6.776   5.110
   16   1HD2  ASN   2          1HD2      ASN   2  -1.683   7.440   8.547
   17   2HD2  ASN   2          2HD2      ASN   2  -0.029   7.611   8.210
   18    H    ASP   3           H        ASP   3  -4.781  10.046   6.198
   19    HA   ASP   3           HA       ASP   3  -6.736   8.787   4.382
   20   1HB   ASP   3          2HB       ASP   3  -6.854  11.557   5.593
   21   2HB   ASP   3          1HB       ASP   3  -8.155  10.688   4.780
   22    H    ILE   4           H        ILE   4  -3.873  10.555   4.220
   23    HA   ILE   4           HA       ILE   4  -4.381  12.404   2.154
   24    HB   ILE   4           HB       ILE   4  -1.919  12.243   1.688
   25   1HG1  ILE   4          2HG1      ILE   4  -0.884  10.846   3.798
   26   2HG1  ILE   4          1HG1      ILE   4  -2.277   9.843   3.396
   27   1HG2  ILE   4          1HG2      ILE   4  -3.153  12.792   4.341
   28   2HG2  ILE   4          2HG2      ILE   4  -2.274  13.875   3.261
   29   3HG2  ILE   4          3HG2      ILE   4  -1.391  12.736   4.279
   30   1HD1  ILE   4          1HD1      ILE   4  -0.145   9.247   2.163
   31   2HD1  ILE   4          2HD1      ILE   4  -0.281  10.796   1.333
   32   3HD1  ILE   4          3HD1      ILE   4  -1.536   9.573   1.129
   33    H    TYR   5           H        TYR   5  -3.829   8.949   2.088
   34    HA   TYR   5           HA       TYR   5  -3.241   8.679  -0.687
   35   1HB   TYR   5          2HB       TYR   5  -4.422   6.734   1.312
   36   2HB   TYR   5          1HB       TYR   5  -4.007   6.297  -0.345
   37    HD1  TYR   5           HD1      TYR   5  -2.674   7.344   2.933
   38    HD2  TYR   5           HD2      TYR   5  -1.689   6.129  -1.068
   39    HE1  TYR   5           HE1      TYR   5  -0.317   7.017   3.618
   40    HE2  TYR   5           HE2      TYR   5   0.672   5.803  -0.384
   41    HH   TYR   5           HH       TYR   5   2.128   7.011   1.836
   42    H    LYS   6           H        LYS   6  -6.216   8.779   1.198
   43    HA   LYS   6           HA       LYS   6  -7.964   8.070  -0.970
   44   1HB   LYS   6          2HB       LYS   6  -8.475   9.311   1.737
   45   2HB   LYS   6          1HB       LYS   6  -9.759   8.928   0.589
   46   1HG   LYS   6          2HG       LYS   6  -8.934   6.559   0.543
   47   2HG   LYS   6          1HG       LYS   6  -7.790   6.978   1.819
   48   1HD   LYS   6          2HD       LYS   6 -10.701   7.610   2.196
   49   2HD   LYS   6          1HD       LYS   6 -10.138   5.958   2.447
   50   1HE   LYS   6          2HE       LYS   6  -8.544   6.690   4.120
   51   2HE   LYS   6          1HE       LYS   6  -8.900   8.383   3.781
   52   1HZ   LYS   6          1HZ       LYS   6 -11.179   8.003   4.514
   53   2HZ   LYS   6          2HZ       LYS   6 -10.068   7.638   5.746
   54   3HZ   LYS   6          3HZ       LYS   6 -10.810   6.386   4.870
   55    H    ALA   7           H        ALA   7  -6.538  11.045   0.176
   56    HA   ALA   7           HA       ALA   7  -8.395  12.884  -0.908
   57   1HB   ALA   7          1HB       ALA   7  -5.426  13.180  -0.410
   58   2HB   ALA   7          2HB       ALA   7  -6.725  13.603   0.705
   59   3HB   ALA   7          3HB       ALA   7  -6.520  14.510  -0.794
   60    H    ALA   8           H        ALA   8  -5.586  11.230  -2.310
   61    HA   ALA   8           HA       ALA   8  -5.625  12.733  -4.766
   62   1HB   ALA   8          1HB       ALA   8  -4.402  10.016  -4.618
   63   2HB   ALA   8          2HB       ALA   8  -3.691  11.309  -3.653
   64   3HB   ALA   8          3HB       ALA   8  -3.802  11.475  -5.406
   65    H    VAL   9           H        VAL   9  -6.735   9.490  -3.790
   66    HA   VAL   9           HA       VAL   9  -7.697   8.729  -6.348
   67    HB   VAL   9           HB       VAL   9  -7.269   7.176  -4.401
   68   1HG1  VAL   9          1HG1      VAL   9  -9.981   8.195  -3.507
   69   2HG1  VAL   9          2HG1      VAL   9  -8.451   8.513  -2.693
   70   3HG1  VAL   9          3HG1      VAL   9  -9.079   6.869  -2.774
   71   1HG2  VAL   9          1HG2      VAL   9  -9.025   5.637  -5.046
   72   2HG2  VAL   9          2HG2      VAL   9  -8.569   6.565  -6.476
   73   3HG2  VAL   9          3HG2      VAL   9 -10.046   6.963  -5.600
   74    H    GLU  10           H        GLU  10  -8.969  10.822  -3.892
   75    HA   GLU  10           HA       GLU  10 -11.702  10.748  -4.852
   76   1HB   GLU  10          2HB       GLU  10 -10.224  12.245  -2.721
   77   2HB   GLU  10          1HB       GLU  10 -11.762  12.885  -3.302
   78   1HG   GLU  10          2HG       GLU  10 -12.899  10.814  -2.755
   79   2HG   GLU  10          1HG       GLU  10 -11.371  10.037  -2.340
   80    H    GLN  11           H        GLN  11  -8.821  12.252  -5.890
   81    HA   GLN  11           HA       GLN  11 -10.403  14.183  -7.472
   82   1HB   GLN  11          2HB       GLN  11  -8.710  15.890  -7.200
   83   2HB   GLN  11          1HB       GLN  11  -9.245  15.362  -5.607
   84   1HG   GLN  11          2HG       GLN  11  -7.272  13.829  -5.497
   85   2HG   GLN  11          1HG       GLN  11  -6.716  14.483  -7.037
   86   1HE2  GLN  11          1HE2      GLN  11  -6.094  14.782  -3.825
   87   2HE2  GLN  11          2HE2      GLN  11  -5.650  16.419  -3.760
   88    H    LEU  12           H        LEU  12  -9.220  11.483  -8.072
   89    HA   LEU  12           HA       LEU  12  -6.951  11.900  -9.773
   90   1HB   LEU  12          2HB       LEU  12  -7.351   9.632 -10.556
   91   2HB   LEU  12          1HB       LEU  12  -7.376   9.719  -8.812
   92    HG   LEU  12           HG       LEU  12 -10.042   9.988  -9.430
   93   1HD1  LEU  12          1HD1      LEU  12 -10.357   7.984 -11.021
   94   2HD1  LEU  12          2HD1      LEU  12  -8.676   8.249 -11.488
   95   3HD1  LEU  12          3HD1      LEU  12  -9.874   9.516 -11.750
   96   1HD2  LEU  12          1HD2      LEU  12  -8.742   8.488  -7.788
   97   2HD2  LEU  12          2HD2      LEU  12  -8.685   7.312  -9.101
   98   3HD2  LEU  12          3HD2      LEU  12 -10.239   7.837  -8.454
   99    H    THR  13           H        THR  13  -7.119  11.086 -12.127
  100    HA   THR  13           HA       THR  13  -9.329  12.549 -13.447
  101    HB   THR  13           HB       THR  13  -7.405  12.340 -15.373
  102    HG1  THR  13           HG1      THR  13  -5.810  11.565 -14.087
  103   1HG2  THR  13          1HG2      THR  13  -8.078  14.436 -13.339
  104   2HG2  THR  13          2HG2      THR  13  -8.416  14.410 -15.070
  105   3HG2  THR  13          3HG2      THR  13  -6.779  14.724 -14.496
  106    H    ASP  14           H        ASP  14  -9.667  11.795 -15.768
  107    HA   ASP  14           HA       ASP  14 -10.375   9.013 -15.744
  108   1HB   ASP  14          2HB       ASP  14 -11.616  10.814 -17.025
  109   2HB   ASP  14          1HB       ASP  14 -10.265  10.839 -18.157
  110    H    GLU  15           H        GLU  15  -7.751  10.958 -17.036
  111    HA   GLU  15           HA       GLU  15  -6.577   9.013 -18.730
  112   1HB   GLU  15          2HB       GLU  15  -4.649  10.422 -18.761
  113   2HB   GLU  15          1HB       GLU  15  -6.049  11.486 -18.680
  114   1HG   GLU  15          2HG       GLU  15  -5.001  12.465 -16.930
  115   2HG   GLU  15          1HG       GLU  15  -5.481  11.041 -16.012
  116    H    GLN  16           H        GLN  16  -6.510   9.535 -15.286
  117    HA   GLN  16           HA       GLN  16  -4.238   7.916 -14.669
  118   1HB   GLN  16          2HB       GLN  16  -5.319   9.642 -13.145
  119   2HB   GLN  16          1HB       GLN  16  -6.601   8.465 -12.864
  120   1HG   GLN  16          2HG       GLN  16  -4.302   6.969 -12.483
  121   2HG   GLN  16          1HG       GLN  16  -3.871   8.536 -11.800
  122   1HE2  GLN  16          1HE2      GLN  16  -6.691   6.266 -11.766
  123   2HE2  GLN  16          2HE2      GLN  16  -7.045   6.515 -10.124
  124    H    LYS  17           H        LYS  17  -7.733   7.327 -14.866
  125    HA   LYS  17           HA       LYS  17  -7.649   4.619 -13.960
  126   1HB   LYS  17          2HB       LYS  17  -9.722   6.073 -15.623
  127   2HB   LYS  17          1HB       LYS  17  -9.937   4.469 -14.925
  128   1HG   LYS  17          2HG       LYS  17 -10.105   5.271 -12.770
  129   2HG   LYS  17          1HG       LYS  17  -9.060   6.654 -13.090
  130   1HD   LYS  17          2HD       LYS  17 -11.108   7.729 -12.964
  131   2HD   LYS  17          1HD       LYS  17 -11.063   7.365 -14.688
  132   1HE   LYS  17          2HE       LYS  17 -13.188   6.591 -14.064
  133   2HE   LYS  17          1HE       LYS  17 -12.213   5.124 -13.996
  134   1HZ   LYS  17          1HZ       LYS  17 -13.609   5.419 -12.021
  135   2HZ   LYS  17          2HZ       LYS  17 -12.810   6.878 -11.672
  136   3HZ   LYS  17          3HZ       LYS  17 -11.958   5.408 -11.633
  137    H    ASN  18           H        ASN  18  -6.872   6.104 -16.979
  138    HA   ASN  18           HA       ASN  18  -7.108   3.554 -18.429
  139   1HB   ASN  18          2HB       ASN  18  -6.833   6.424 -19.295
  140   2HB   ASN  18          1HB       ASN  18  -6.457   5.105 -20.405
  141   1HD2  ASN  18          1HD2      ASN  18  -9.073   6.737 -18.687
  142   2HD2  ASN  18          2HD2      ASN  18 -10.337   5.894 -19.445
  143    H    GLU  19           H        GLU  19  -4.772   5.851 -17.188
  144    HA   GLU  19           HA       GLU  19  -2.497   5.164 -18.669
  145   1HB   GLU  19          2HB       GLU  19  -2.792   7.037 -16.920
  146   2HB   GLU  19          1HB       GLU  19  -2.408   5.803 -15.722
  147   1HG   GLU  19          2HG       GLU  19  -0.260   6.459 -16.131
  148   2HG   GLU  19          1HG       GLU  19  -0.411   5.369 -17.508
  149    H    PHE  20           H        PHE  20  -3.495   3.929 -15.467
  150    HA   PHE  20           HA       PHE  20  -1.534   1.831 -15.476
  151   1HB   PHE  20          2HB       PHE  20  -3.832   2.570 -13.699
  152   2HB   PHE  20          1HB       PHE  20  -3.080   0.981 -13.540
  153    HD1  PHE  20           HD1      PHE  20  -2.455   4.642 -13.401
  154    HD2  PHE  20           HD2      PHE  20  -0.889   0.727 -12.603
  155    HE1  PHE  20           HE1      PHE  20  -0.590   5.646 -12.113
  156    HE2  PHE  20           HE2      PHE  20   0.970   1.726 -11.308
  157    HZ   PHE  20           HZ       PHE  20   1.123   4.189 -11.066
  158    H    LYS  21           H        LYS  21  -5.039   1.995 -16.115
  159    HA   LYS  21           HA       LYS  21  -5.557  -0.745 -16.313
  160   1HB   LYS  21          2HB       LYS  21  -7.251   1.129 -16.348
  161   2HB   LYS  21          1HB       LYS  21  -6.855   1.355 -18.050
  162   1HG   LYS  21          2HG       LYS  21  -8.706  -0.116 -18.094
  163   2HG   LYS  21          1HG       LYS  21  -7.319  -1.188 -18.279
  164   1HD   LYS  21          2HD       LYS  21  -7.470  -1.986 -16.088
  165   2HD   LYS  21          1HD       LYS  21  -8.357  -0.567 -15.529
  166   1HE   LYS  21          2HE       LYS  21 -10.010  -2.249 -15.635
  167   2HE   LYS  21          1HE       LYS  21 -10.231  -1.348 -17.134
  168   1HZ   LYS  21          1HZ       LYS  21 -10.205  -3.771 -17.461
  169   2HZ   LYS  21          2HZ       LYS  21  -8.611  -3.826 -16.878
  170   3HZ   LYS  21          3HZ       LYS  21  -8.966  -2.992 -18.316
  171    H    ALA  22           H        ALA  22  -4.092   1.449 -18.665
  172    HA   ALA  22           HA       ALA  22  -4.252  -0.224 -20.947
  173   1HB   ALA  22          1HB       ALA  22  -2.330   1.105 -21.796
  174   2HB   ALA  22          2HB       ALA  22  -2.162   1.838 -20.200
  175   3HB   ALA  22          3HB       ALA  22  -3.616   2.127 -21.155
  176    H    ALA  23           H        ALA  23  -1.630   0.265 -18.583
  177    HA   ALA  23           HA       ALA  23   0.047  -1.816 -19.574
  178   1HB   ALA  23          1HB       ALA  23   0.722   0.151 -18.066
  179   2HB   ALA  23          2HB       ALA  23   1.404  -1.425 -17.667
  180   3HB   ALA  23          3HB       ALA  23   0.049  -0.789 -16.733
  181    H    PHE  24           H        PHE  24  -2.534  -1.633 -17.201
  182    HA   PHE  24           HA       PHE  24  -2.171  -4.101 -15.895
  183   1HB   PHE  24          2HB       PHE  24  -3.784  -2.183 -15.300
  184   2HB   PHE  24          1HB       PHE  24  -4.872  -2.890 -16.491
  185    HD1  PHE  24           HD1      PHE  24  -5.529  -5.352 -16.228
  186    HD2  PHE  24           HD2      PHE  24  -3.613  -3.088 -13.125
  187    HE1  PHE  24           HE1      PHE  24  -6.278  -7.017 -14.552
  188    HE2  PHE  24           HE2      PHE  24  -4.360  -4.754 -11.450
  189    HZ   PHE  24           HZ       PHE  24  -5.694  -6.713 -12.165
  190    H    ASP  25           H        ASP  25  -4.005  -3.240 -18.818
  191    HA   ASP  25           HA       ASP  25  -5.149  -5.788 -19.275
  192   1HB   ASP  25          2HB       ASP  25  -5.517  -3.370 -20.402
  193   2HB   ASP  25          1HB       ASP  25  -4.504  -4.114 -21.638
  194    H    ILE  26           H        ILE  26  -2.177  -4.297 -20.594
  195    HA   ILE  26           HA       ILE  26  -1.502  -6.502 -22.256
  196    HB   ILE  26           HB       ILE  26   0.784  -5.503 -22.330
  197   1HG1  ILE  26          2HG1      ILE  26  -0.410  -3.437 -20.455
  198   2HG1  ILE  26          1HG1      ILE  26   0.774  -4.649 -19.975
  199   1HG2  ILE  26          1HG2      ILE  26  -1.046  -4.751 -23.829
  200   2HG2  ILE  26          2HG2      ILE  26   0.074  -3.442 -23.450
  201   3HG2  ILE  26          3HG2      ILE  26  -1.493  -3.523 -22.644
  202   1HD1  ILE  26          1HD1      ILE  26   1.939  -3.518 -22.213
  203   2HD1  ILE  26          2HD1      ILE  26   2.332  -3.112 -20.542
  204   3HD1  ILE  26          3HD1      ILE  26   1.165  -2.137 -21.435
  205    H    PHE  27           H        PHE  27  -0.630  -5.704 -18.902
  206    HA   PHE  27           HA       PHE  27   1.195  -7.927 -18.656
  207   1HB   PHE  27          2HB       PHE  27  -0.059  -6.144 -16.552
  208   2HB   PHE  27          1HB       PHE  27   1.157  -7.376 -16.218
  209    HD1  PHE  27           HD1      PHE  27   2.953  -7.120 -18.564
  210    HD2  PHE  27           HD2      PHE  27   1.041  -4.089 -16.192
  211    HE1  PHE  27           HE1      PHE  27   4.730  -5.511 -19.187
  212    HE2  PHE  27           HE2      PHE  27   2.821  -2.482 -16.822
  213    HZ   PHE  27           HZ       PHE  27   4.664  -3.193 -18.316
  214    H    ILE  28           H        ILE  28  -2.226  -7.385 -18.021
  215    HA   ILE  28           HA       ILE  28  -2.456 -10.083 -16.865
  216    HB   ILE  28           HB       ILE  28  -3.473  -7.822 -15.892
  217   1HG1  ILE  28          2HG1      ILE  28  -3.569 -10.138 -14.951
  218   2HG1  ILE  28          1HG1      ILE  28  -4.993  -9.160 -14.605
  219   1HG2  ILE  28          1HG2      ILE  28  -5.611  -7.243 -16.570
  220   2HG2  ILE  28          2HG2      ILE  28  -5.917  -8.806 -17.321
  221   3HG2  ILE  28          3HG2      ILE  28  -4.859  -7.639 -18.114
  222   1HD1  ILE  28          1HD1      ILE  28  -5.706 -11.388 -15.278
  223   2HD1  ILE  28          2HD1      ILE  28  -4.736 -11.291 -16.746
  224   3HD1  ILE  28          3HD1      ILE  28  -6.142 -10.246 -16.549
  225    H    GLN  29           H        GLN  29  -1.896  -9.719 -19.635
  226    HA   GLN  29           HA       GLN  29  -4.328 -10.130 -21.150
  227   1HB   GLN  29          2HB       GLN  29  -2.278  -9.025 -22.097
  228   2HB   GLN  29          1HB       GLN  29  -1.466 -10.588 -22.027
  229   1HG   GLN  29          2HG       GLN  29  -2.901 -11.542 -23.637
  230   2HG   GLN  29          1HG       GLN  29  -4.117 -10.280 -23.431
  231   1HE2  GLN  29          1HE2      GLN  29  -3.519  -8.062 -24.249
  232   2HE2  GLN  29          2HE2      GLN  29  -2.406  -7.930 -25.523
  233    H    ASP  30           H        ASP  30  -1.471 -12.115 -20.355
  234    HA   ASP  30           HA       ASP  30  -2.880 -14.547 -21.151
  235   1HB   ASP  30          2HB       ASP  30  -0.335 -13.928 -21.516
  236   2HB   ASP  30          1HB       ASP  30  -0.169 -14.591 -19.889
  237    H    ALA  31           H        ALA  31  -2.884 -12.705 -18.389
  238    HA   ALA  31           HA       ALA  31  -2.759 -14.926 -16.496
  239   1HB   ALA  31          1HB       ALA  31  -1.834 -13.069 -15.470
  240   2HB   ALA  31          2HB       ALA  31  -3.504 -12.948 -14.916
  241   3HB   ALA  31          3HB       ALA  31  -2.945 -11.948 -16.257
  242    H    GLU  32           H        GLU  32  -4.492 -15.526 -15.171
  243    HA   GLU  32           HA       GLU  32  -7.177 -14.753 -16.147
  244   1HB   GLU  32          2HB       GLU  32  -6.163 -17.514 -15.436
  245   2HB   GLU  32          1HB       GLU  32  -7.868 -17.124 -15.664
  246   1HG   GLU  32          2HG       GLU  32  -7.633 -17.308 -17.891
  247   2HG   GLU  32          1HG       GLU  32  -6.398 -16.048 -17.874
  248    H    ASP  33           H        ASP  33  -5.871 -13.531 -13.959
  249    HA   ASP  33           HA       ASP  33  -7.574 -14.479 -11.730
  250   1HB   ASP  33          2HB       ASP  33  -4.706 -13.537 -11.550
  251   2HB   ASP  33          1HB       ASP  33  -5.759 -13.808 -10.160
  252    H    GLY  34           H        GLY  34  -7.029 -11.953 -13.812
  253   1HA   GLY  34          2HA       GLY  34  -7.731  -9.761 -13.841
  254   2HA   GLY  34          1HA       GLY  34  -8.651 -10.123 -12.385
  255    H    CYS  35           H        CYS  35  -5.146 -10.402 -12.779
  256    HA   CYS  35           HA       CYS  35  -4.570  -7.928 -11.400
  257   1HB   CYS  35          2HB       CYS  35  -3.380  -9.098  -9.507
  258   2HB   CYS  35          1HB       CYS  35  -5.138  -9.195  -9.445
  259    HG   CYS  35           HG       CYS  35  -4.885 -11.652  -9.472
  260    H    ILE  36           H        ILE  36  -2.372  -7.370 -11.498
  261    HA   ILE  36           HA       ILE  36  -0.871  -8.835 -13.525
  262    HB   ILE  36           HB       ILE  36   0.621  -6.974 -13.603
  263   1HG1  ILE  36          2HG1      ILE  36  -0.180  -5.107 -11.716
  264   2HG1  ILE  36          1HG1      ILE  36  -0.244  -6.624 -10.819
  265   1HG2  ILE  36          1HG2      ILE  36  -1.730  -6.636 -14.491
  266   2HG2  ILE  36          2HG2      ILE  36  -0.861  -5.151 -14.101
  267   3HG2  ILE  36          3HG2      ILE  36  -2.089  -5.769 -12.998
  268   1HD1  ILE  36          1HD1      ILE  36   2.138  -5.802 -12.501
  269   2HD1  ILE  36          2HD1      ILE  36   2.050  -7.123 -11.333
  270   3HD1  ILE  36          3HD1      ILE  36   2.010  -5.451 -10.778
  271    H    SER  37           H        SER  37   1.587  -9.017 -13.094
  272    HA   SER  37           HA       SER  37   1.883 -10.563 -10.625
  273   1HB   SER  37          2HB       SER  37   2.626 -11.534 -12.796
  274   2HB   SER  37          1HB       SER  37   3.821 -10.249 -12.930
  275    HG   SER  37           HG       SER  37   4.475 -12.342 -11.932
  276    H    THR  38           H        THR  38   2.535  -9.516  -8.875
  277    HA   THR  38           HA       THR  38   3.721  -6.981  -8.748
  278    HB   THR  38           HB       THR  38   4.315  -7.517  -6.433
  279    HG1  THR  38           HG1      THR  38   3.535 -10.163  -7.101
  280   1HG2  THR  38          1HG2      THR  38   1.994  -8.517  -5.772
  281   2HG2  THR  38          2HG2      THR  38   1.648  -8.397  -7.496
  282   3HG2  THR  38          3HG2      THR  38   2.055  -6.951  -6.576
  283    H    LYS  39           H        LYS  39   5.143 -10.176  -9.085
  284    HA   LYS  39           HA       LYS  39   7.856  -9.489  -8.583
  285   1HB   LYS  39          2HB       LYS  39   6.835 -11.644 -10.454
  286   2HB   LYS  39          1HB       LYS  39   8.423 -11.571  -9.691
  287   1HG   LYS  39          2HG       LYS  39   7.614 -12.194  -7.621
  288   2HG   LYS  39          1HG       LYS  39   6.026 -11.483  -7.912
  289   1HD   LYS  39          2HD       LYS  39   5.206 -13.438  -8.675
  290   2HD   LYS  39          1HD       LYS  39   6.554 -13.629  -9.796
  291   1HE   LYS  39          2HE       LYS  39   6.799 -15.480  -8.367
  292   2HE   LYS  39          1HE       LYS  39   7.918 -14.304  -7.681
  293   1HZ   LYS  39          1HZ       LYS  39   5.117 -14.673  -6.764
  294   2HZ   LYS  39          2HZ       LYS  39   6.307 -13.692  -6.049
  295   3HZ   LYS  39          3HZ       LYS  39   6.466 -15.382  -6.020
  296    H    GLU  40           H        GLU  40   5.771  -9.282 -11.401
  297    HA   GLU  40           HA       GLU  40   7.985  -8.408 -13.118
  298   1HB   GLU  40          2HB       GLU  40   5.078  -9.004 -13.699
  299   2HB   GLU  40          1HB       GLU  40   6.215  -8.398 -14.902
  300   1HG   GLU  40          2HG       GLU  40   7.698 -10.420 -14.058
  301   2HG   GLU  40          1HG       GLU  40   6.142 -11.067 -13.541
  302    H    LEU  41           H        LEU  41   6.562  -6.801 -10.818
  303    HA   LEU  41           HA       LEU  41   5.186  -4.624 -11.931
  304   1HB   LEU  41          2HB       LEU  41   5.655  -5.300  -9.435
  305   2HB   LEU  41          1HB       LEU  41   7.032  -4.240  -9.610
  306    HG   LEU  41           HG       LEU  41   4.952  -3.226  -8.572
  307   1HD1  LEU  41          1HD1      LEU  41   6.899  -2.103 -10.086
  308   2HD1  LEU  41          2HD1      LEU  41   5.612  -1.176  -9.318
  309   3HD1  LEU  41          3HD1      LEU  41   5.476  -1.632 -11.015
  310   1HD2  LEU  41          1HD2      LEU  41   3.914  -3.006 -11.393
  311   2HD2  LEU  41          2HD2      LEU  41   3.047  -2.767  -9.874
  312   3HD2  LEU  41          3HD2      LEU  41   3.484  -4.396 -10.396
  313    H    GLY  42           H        GLY  42   8.609  -5.381 -11.857
  314   1HA   GLY  42          2HA       GLY  42   9.733  -2.846 -12.306
  315   2HA   GLY  42          1HA       GLY  42  10.427  -4.370 -12.852
  316    H    LYS  43           H        LYS  43   8.273  -5.186 -14.532
  317    HA   LYS  43           HA       LYS  43   8.920  -3.816 -16.955
  318   1HB   LYS  43          2HB       LYS  43   6.631  -5.730 -16.415
  319   2HB   LYS  43          1HB       LYS  43   7.245  -5.264 -18.000
  320   1HG   LYS  43          2HG       LYS  43   9.261  -6.322 -16.093
  321   2HG   LYS  43          1HG       LYS  43   8.076  -7.485 -16.683
  322   1HD   LYS  43          2HD       LYS  43   8.661  -7.053 -18.971
  323   2HD   LYS  43          1HD       LYS  43   9.638  -5.654 -18.520
  324   1HE   LYS  43          2HE       LYS  43  11.417  -6.936 -17.891
  325   2HE   LYS  43          1HE       LYS  43  10.394  -8.189 -17.191
  326   1HZ   LYS  43          1HZ       LYS  43  11.550  -8.992 -19.149
  327   2HZ   LYS  43          2HZ       LYS  43  10.864  -7.757 -20.092
  328   3HZ   LYS  43          3HZ       LYS  43   9.876  -8.964 -19.419
  329    H    VAL  44           H        VAL  44   6.566  -3.308 -14.493
  330    HA   VAL  44           HA       VAL  44   4.727  -1.771 -16.137
  331    HB   VAL  44           HB       VAL  44   4.795  -1.867 -13.116
  332   1HG1  VAL  44          1HG1      VAL  44   2.423  -1.653 -14.968
  333   2HG1  VAL  44          2HG1      VAL  44   3.347  -0.233 -14.479
  334   3HG1  VAL  44          3HG1      VAL  44   2.529  -1.212 -13.265
  335   1HG2  VAL  44          1HG2      VAL  44   4.788  -4.184 -14.289
  336   2HG2  VAL  44          2HG2      VAL  44   3.167  -3.746 -14.828
  337   3HG2  VAL  44          3HG2      VAL  44   3.521  -3.858 -13.107
  338    H    MET  45           H        MET  45   7.079  -1.225 -13.536
  339    HA   MET  45           HA       MET  45   6.826   1.529 -13.229
  340   1HB   MET  45          2HB       MET  45   9.198  -0.310 -12.920
  341   2HB   MET  45          1HB       MET  45   9.310   1.419 -12.585
  342   1HG   MET  45          2HG       MET  45   7.103  -0.218 -11.359
  343   2HG   MET  45          1HG       MET  45   8.707  -0.203 -10.627
  344   1HE   MET  45          1HE       MET  45   5.796   1.194  -9.165
  345   2HE   MET  45          2HE       MET  45   7.013   1.994  -8.175
  346   3HE   MET  45          3HE       MET  45   7.289   0.347  -8.735
  347    H    ARG  46           H        ARG  46   8.830  -0.303 -15.544
  348    HA   ARG  46           HA       ARG  46  10.119   1.953 -16.684
  349   1HB   ARG  46          2HB       ARG  46  10.601   0.477 -18.618
  350   2HB   ARG  46          1HB       ARG  46  10.996  -0.275 -17.074
  351   1HG   ARG  46          2HG       ARG  46   9.213  -1.767 -17.187
  352   2HG   ARG  46          1HG       ARG  46   8.277  -0.730 -18.260
  353   1HD   ARG  46          2HD       ARG  46   9.078  -2.586 -19.569
  354   2HD   ARG  46          1HD       ARG  46   9.987  -1.159 -20.052
  355    HE   ARG  46           HE       ARG  46  11.361  -2.570 -17.985
  356   1HH1  ARG  46          2HH1      ARG  46  10.569  -2.701 -21.384
  357   2HH1  ARG  46          1HH1      ARG  46  11.984  -3.603 -21.806
  358   1HH2  ARG  46          1HH2      ARG  46  13.211  -3.753 -18.563
  359   2HH2  ARG  46          2HH2      ARG  46  13.476  -4.198 -20.216
  360    H    MET  47           H        MET  47   6.992   0.470 -17.284
  361    HA   MET  47           HA       MET  47   6.441   1.950 -19.699
  362   1HB   MET  47          2HB       MET  47   5.099  -0.073 -18.072
  363   2HB   MET  47          1HB       MET  47   3.991   1.175 -18.639
  364   1HG   MET  47          2HG       MET  47   4.003  -0.430 -20.380
  365   2HG   MET  47          1HG       MET  47   5.084   0.840 -20.952
  366   1HE   MET  47          1HE       MET  47   8.099  -0.834 -21.878
  367   2HE   MET  47          2HE       MET  47   7.867   0.590 -20.869
  368   3HE   MET  47          3HE       MET  47   6.765   0.280 -22.208
  369    H    LEU  48           H        LEU  48   5.879   2.366 -16.251
  370    HA   LEU  48           HA       LEU  48   4.060   4.587 -16.513
  371   1HB   LEU  48          2HB       LEU  48   5.484   3.221 -14.279
  372   2HB   LEU  48          1HB       LEU  48   4.894   4.844 -14.005
  373    HG   LEU  48           HG       LEU  48   2.651   4.189 -14.158
  374   1HD1  LEU  48          1HD1      LEU  48   3.737   1.890 -15.761
  375   2HD1  LEU  48          2HD1      LEU  48   2.427   3.002 -16.157
  376   3HD1  LEU  48          3HD1      LEU  48   2.171   1.727 -14.966
  377   1HD2  LEU  48          1HD2      LEU  48   2.747   1.764 -12.965
  378   2HD2  LEU  48          2HD2      LEU  48   3.154   3.259 -12.120
  379   3HD2  LEU  48          3HD2      LEU  48   4.435   2.244 -12.781
  380    H    GLY  49           H        GLY  49   7.531   4.176 -16.270
  381   1HA   GLY  49          2HA       GLY  49   8.909   5.979 -17.227
  382   2HA   GLY  49          1HA       GLY  49   7.870   7.120 -16.383
  383    H    GLN  50           H        GLN  50   8.919   4.133 -14.872
  384    HA   GLN  50           HA       GLN  50  10.909   5.592 -13.247
  385   1HB   GLN  50          2HB       GLN  50   9.012   3.575 -12.042
  386   2HB   GLN  50          1HB       GLN  50  10.075   4.705 -11.208
  387   1HG   GLN  50          2HG       GLN  50   7.781   5.601 -12.972
  388   2HG   GLN  50          1HG       GLN  50   7.616   5.351 -11.236
  389   1HE2  GLN  50          1HE2      GLN  50   7.635   7.899 -13.033
  390   2HE2  GLN  50          2HE2      GLN  50   8.735   8.922 -12.242
  391    H    ASN  51           H        ASN  51  12.217   3.954 -11.897
  392    HA   ASN  51           HA       ASN  51  12.414   1.281 -12.995
  393   1HB   ASN  51          2HB       ASN  51  13.694   2.934 -14.563
  394   2HB   ASN  51          1HB       ASN  51  14.901   2.943 -13.278
  395   1HD2  ASN  51          1HD2      ASN  51  16.539   1.516 -13.885
  396   2HD2  ASN  51          2HD2      ASN  51  16.282  -0.034 -14.529
  397    HA   PRO  52           HA       PRO  52  14.004   1.751  -8.675
  398   1HB   PRO  52          2HB       PRO  52  12.046   0.295  -7.438
  399   2HB   PRO  52          1HB       PRO  52  11.921   2.031  -7.752
  400   1HG   PRO  52          2HG       PRO  52  10.536  -0.216  -9.067
  401   2HG   PRO  52          1HG       PRO  52  10.061   1.484  -8.943
  402   1HD   PRO  52          2HD       PRO  52  11.247   0.186 -11.204
  403   2HD   PRO  52          1HD       PRO  52  10.900   1.922 -11.021
  404    H    THR  53           H        THR  53  13.689  -0.491  -6.988
  405    HA   THR  53           HA       THR  53  15.102  -2.589  -8.524
  406    HB   THR  53           HB       THR  53  16.327  -3.109  -6.590
  407    HG1  THR  53           HG1      THR  53  15.570  -2.169  -4.517
  408   1HG2  THR  53          1HG2      THR  53  16.887  -0.842  -7.433
  409   2HG2  THR  53          2HG2      THR  53  17.170  -1.002  -5.700
  410   3HG2  THR  53          3HG2      THR  53  15.736  -0.158  -6.284
  411    HA   PRO  54           HA       PRO  54  11.904  -5.464  -7.572
  412   1HB   PRO  54          2HB       PRO  54  13.238  -7.725  -6.777
  413   2HB   PRO  54          1HB       PRO  54  13.144  -7.166  -8.454
  414   1HG   PRO  54          2HG       PRO  54  15.409  -7.009  -6.539
  415   2HG   PRO  54          1HG       PRO  54  15.429  -7.139  -8.304
  416   1HD   PRO  54          2HD       PRO  54  15.870  -4.788  -6.844
  417   2HD   PRO  54          1HD       PRO  54  15.467  -4.861  -8.575
  418    H    GLU  55           H        GLU  55  14.283  -4.976  -5.022
  419    HA   GLU  55           HA       GLU  55  12.578  -6.076  -2.946
  420   1HB   GLU  55          2HB       GLU  55  14.309  -5.290  -1.379
  421   2HB   GLU  55          1HB       GLU  55  15.005  -6.256  -2.677
  422   1HG   GLU  55          2HG       GLU  55  15.749  -4.260  -3.840
  423   2HG   GLU  55          1HG       GLU  55  14.916  -3.225  -2.679
  424    H    GLU  56           H        GLU  56  13.301  -2.924  -4.353
  425    HA   GLU  56           HA       GLU  56  12.107  -1.366  -2.264
  426   1HB   GLU  56          2HB       GLU  56  13.713  -0.671  -4.268
  427   2HB   GLU  56          1HB       GLU  56  12.181  -0.373  -5.085
  428   1HG   GLU  56          2HG       GLU  56  12.765   0.723  -2.328
  429   2HG   GLU  56          1HG       GLU  56  13.194   1.602  -3.794
  430    H    LEU  57           H        LEU  57  10.998  -2.334  -5.528
  431    HA   LEU  57           HA       LEU  57   8.400  -1.272  -5.291
  432   1HB   LEU  57          2HB       LEU  57   7.860  -2.453  -7.248
  433   2HB   LEU  57          1HB       LEU  57   9.539  -2.000  -7.409
  434    HG   LEU  57           HG       LEU  57   9.937  -4.453  -6.465
  435   1HD1  LEU  57          1HD1      LEU  57   7.905  -5.450  -6.125
  436   2HD1  LEU  57          2HD1      LEU  57   7.979  -5.729  -7.864
  437   3HD1  LEU  57          3HD1      LEU  57   7.073  -4.356  -7.230
  438   1HD2  LEU  57          1HD2      LEU  57   9.166  -3.635  -9.276
  439   2HD2  LEU  57          2HD2      LEU  57   9.819  -5.230  -8.903
  440   3HD2  LEU  57          3HD2      LEU  57  10.787  -3.789  -8.600
  441    H    GLN  58           H        GLN  58   9.740  -4.411  -4.332
  442    HA   GLN  58           HA       GLN  58   7.305  -5.757  -3.863
  443   1HB   GLN  58          2HB       GLN  58   9.554  -6.854  -3.903
  444   2HB   GLN  58          1HB       GLN  58   9.885  -6.137  -2.327
  445   1HG   GLN  58          2HG       GLN  58   9.068  -8.397  -1.978
  446   2HG   GLN  58          1HG       GLN  58   7.822  -7.270  -1.445
  447   1HE2  GLN  58          1HE2      GLN  58   5.815  -7.220  -2.631
  448   2HE2  GLN  58          2HE2      GLN  58   5.475  -8.306  -3.890
  449    H    GLU  59           H        GLU  59   9.237  -3.618  -1.782
  450    HA   GLU  59           HA       GLU  59   7.749  -4.006   0.602
  451   1HB   GLU  59          2HB       GLU  59   9.693  -1.989  -0.390
  452   2HB   GLU  59          1HB       GLU  59   8.628  -1.476   0.918
  453   1HG   GLU  59          2HG       GLU  59  10.113  -4.101   1.049
  454   2HG   GLU  59          1HG       GLU  59  10.865  -2.596   1.576
  455    H    MET  60           H        MET  60   7.381  -1.759  -2.114
  456    HA   MET  60           HA       MET  60   5.224  -0.272  -0.952
  457   1HB   MET  60          2HB       MET  60   5.837  -0.565  -3.901
  458   2HB   MET  60          1HB       MET  60   4.954   0.744  -3.115
  459   1HG   MET  60          2HG       MET  60   7.320   0.776  -1.725
  460   2HG   MET  60          1HG       MET  60   7.864   0.307  -3.336
  461   1HE   MET  60          1HE       MET  60   5.772   2.789  -1.238
  462   2HE   MET  60          2HE       MET  60   6.456   4.304  -1.822
  463   3HE   MET  60          3HE       MET  60   7.509   3.092  -1.097
  464    H    ILE  61           H        ILE  61   5.471  -3.021  -3.144
  465    HA   ILE  61           HA       ILE  61   2.732  -3.301  -3.785
  466    HB   ILE  61           HB       ILE  61   4.998  -5.301  -3.671
  467   1HG1  ILE  61          2HG1      ILE  61   5.187  -3.591  -5.411
  468   2HG1  ILE  61          1HG1      ILE  61   4.807  -5.145  -6.147
  469   1HG2  ILE  61          1HG2      ILE  61   3.493  -6.817  -4.949
  470   2HG2  ILE  61          2HG2      ILE  61   2.161  -5.696  -4.672
  471   3HG2  ILE  61          3HG2      ILE  61   2.915  -6.525  -3.310
  472   1HD1  ILE  61          1HD1      ILE  61   3.090  -2.710  -5.858
  473   2HD1  ILE  61          2HD1      ILE  61   2.306  -4.289  -5.840
  474   3HD1  ILE  61          3HD1      ILE  61   3.267  -3.797  -7.234
  475    H    ASP  62           H        ASP  62   4.729  -4.754  -1.225
  476    HA   ASP  62           HA       ASP  62   2.771  -6.395  -0.061
  477   1HB   ASP  62          2HB       ASP  62   5.390  -5.328   0.717
  478   2HB   ASP  62          1HB       ASP  62   4.305  -5.586   2.084
  479    H    GLU  63           H        GLU  63   3.514  -2.968   0.443
  480    HA   GLU  63           HA       GLU  63   1.719  -2.625   2.649
  481   1HB   GLU  63          2HB       GLU  63   3.186  -0.738   0.828
  482   2HB   GLU  63          1HB       GLU  63   1.977  -0.136   1.962
  483   1HG   GLU  63          2HG       GLU  63   3.266  -1.571   3.724
  484   2HG   GLU  63          1HG       GLU  63   4.581  -1.526   2.550
  485    H    VAL  64           H        VAL  64   1.481  -1.813  -0.834
  486    HA   VAL  64           HA       VAL  64  -1.159  -0.756  -0.650
  487    HB   VAL  64           HB       VAL  64   0.336  -0.197  -2.524
  488   1HG1  VAL  64          1HG1      VAL  64   1.309  -2.519  -2.726
  489   2HG1  VAL  64          2HG1      VAL  64   0.848  -1.787  -4.260
  490   3HG1  VAL  64          3HG1      VAL  64  -0.185  -3.010  -3.521
  491   1HG2  VAL  64          1HG2      VAL  64  -1.362  -0.078  -4.132
  492   2HG2  VAL  64          2HG2      VAL  64  -2.282  -0.309  -2.645
  493   3HG2  VAL  64          3HG2      VAL  64  -1.994  -1.672  -3.725
  494    H    ASP  65           H        ASP  65   0.093  -4.005  -1.334
  495    HA   ASP  65           HA       ASP  65  -2.459  -5.119  -2.043
  496   1HB   ASP  65          2HB       ASP  65   0.057  -6.011  -2.407
  497   2HB   ASP  65          1HB       ASP  65  -0.334  -6.889  -0.930
  498    H    GLU  66           H        GLU  66  -4.036  -4.960  -0.569
  499    HA   GLU  66           HA       GLU  66  -3.656  -5.029   2.246
  500   1HB   GLU  66          2HB       GLU  66  -6.145  -5.272   2.349
  501   2HB   GLU  66          1HB       GLU  66  -5.601  -3.918   1.362
  502   1HG   GLU  66          2HG       GLU  66  -5.729  -6.155  -0.371
  503   2HG   GLU  66          1HG       GLU  66  -7.208  -6.189   0.586
  504    H    ASP  67           H        ASP  67  -4.459  -7.541  -0.110
  505    HA   ASP  67           HA       ASP  67  -4.823  -9.519   2.016
  506   1HB   ASP  67          2HB       ASP  67  -5.117 -11.093  -0.027
  507   2HB   ASP  67          1HB       ASP  67  -6.387  -9.924   0.327
  508    H    GLY  68           H        GLY  68  -2.469  -8.611  -0.437
  509   1HA   GLY  68          2HA       GLY  68  -0.223  -9.141  -0.593
  510   2HA   GLY  68          1HA       GLY  68  -0.381 -10.049   0.909
  511    H    SER  69           H        SER  69  -2.034 -10.404  -2.222
  512    HA   SER  69           HA       SER  69  -1.560 -13.270  -2.171
  513   1HB   SER  69          2HB       SER  69  -2.939 -13.269  -4.249
  514   2HB   SER  69          1HB       SER  69  -3.748 -12.524  -2.874
  515    HG   SER  69           HG       SER  69  -3.968 -11.180  -4.649
  516    H    GLY  70           H        GLY  70   0.339 -10.732  -3.147
  517   1HA   GLY  70          2HA       GLY  70   2.317 -10.732  -4.352
  518   2HA   GLY  70          1HA       GLY  70   2.009 -12.410  -4.792
  519    H    THR  71           H        THR  71  -0.473 -10.037  -5.319
  520    HA   THR  71           HA       THR  71   0.229  -9.677  -8.143
  521    HB   THR  71           HB       THR  71  -1.940 -10.424  -8.932
  522    HG1  THR  71           HG1      THR  71  -3.448 -11.247  -7.489
  523   1HG2  THR  71          1HG2      THR  71  -0.765 -12.486  -7.044
  524   2HG2  THR  71          2HG2      THR  71  -0.150 -12.129  -8.659
  525   3HG2  THR  71          3HG2      THR  71  -1.761 -12.820  -8.462
  526    H    VAL  72           H        VAL  72  -0.458  -7.731  -8.951
  527    HA   VAL  72           HA       VAL  72  -1.778  -5.944  -7.025
  528    HB   VAL  72           HB       VAL  72  -0.686  -5.061  -9.680
  529   1HG1  VAL  72          1HG1      VAL  72  -2.093  -3.589  -8.145
  530   2HG1  VAL  72          2HG1      VAL  72  -0.514  -2.939  -8.590
  531   3HG1  VAL  72          3HG1      VAL  72  -0.754  -3.662  -6.999
  532   1HG2  VAL  72          1HG2      VAL  72   1.469  -4.598  -8.504
  533   2HG2  VAL  72          2HG2      VAL  72   1.134  -6.325  -8.633
  534   3HG2  VAL  72          3HG2      VAL  72   0.866  -5.485  -7.105
  535    H    ASP  73           H        ASP  73  -3.888  -5.741  -7.145
  536    HA   ASP  73           HA       ASP  73  -5.372  -6.378  -9.567
  537   1HB   ASP  73          2HB       ASP  73  -6.271  -5.306  -6.874
  538   2HB   ASP  73          1HB       ASP  73  -7.358  -5.765  -8.185
  539    H    PHE  74           H        PHE  74  -7.066  -4.691 -10.325
  540    HA   PHE  74           HA       PHE  74  -5.715  -2.392 -11.195
  541   1HB   PHE  74          2HB       PHE  74  -7.820  -3.384 -12.222
  542   2HB   PHE  74          1HB       PHE  74  -8.720  -2.526 -10.968
  543    HD1  PHE  74           HD1      PHE  74  -5.704  -1.674 -13.025
  544    HD2  PHE  74           HD2      PHE  74  -9.689  -0.591 -11.854
  545    HE1  PHE  74           HE1      PHE  74  -5.522   0.425 -14.331
  546    HE2  PHE  74           HE2      PHE  74  -9.503   1.508 -13.158
  547    HZ   PHE  74           HZ       PHE  74  -7.417   2.016 -14.394
  548    H    ASP  75           H        ASP  75  -7.882  -2.845  -8.409
  549    HA   ASP  75           HA       ASP  75  -7.994  -0.091  -7.678
  550   1HB   ASP  75          2HB       ASP  75  -8.891  -0.834  -5.563
  551   2HB   ASP  75          1HB       ASP  75  -9.573  -1.855  -6.825
  552    H    GLU  76           H        GLU  76  -5.753  -2.722  -6.941
  553    HA   GLU  76           HA       GLU  76  -4.221  -1.183  -5.018
  554   1HB   GLU  76          2HB       GLU  76  -3.430  -3.738  -6.443
  555   2HB   GLU  76          1HB       GLU  76  -2.717  -3.079  -4.972
  556   1HG   GLU  76          2HG       GLU  76  -4.836  -3.389  -3.773
  557   2HG   GLU  76          1HG       GLU  76  -5.604  -3.978  -5.244
  558    H    PHE  77           H        PHE  77  -4.295  -1.642  -8.447
  559    HA   PHE  77           HA       PHE  77  -1.610  -0.984  -9.099
  560   1HB   PHE  77          2HB       PHE  77  -3.658  -1.992 -10.509
  561   2HB   PHE  77          1HB       PHE  77  -3.842  -0.305 -10.957
  562    HD1  PHE  77           HD1      PHE  77  -3.392  -1.093 -13.275
  563    HD2  PHE  77           HD2      PHE  77  -0.417  -1.350 -10.178
  564    HE1  PHE  77           HE1      PHE  77  -1.626  -1.358 -14.982
  565    HE2  PHE  77           HE2      PHE  77   1.342  -1.604 -11.899
  566    HZ   PHE  77           HZ       PHE  77   0.736  -1.615 -14.302
  567    H    LEU  78           H        LEU  78  -4.621   0.934  -9.253
  568    HA   LEU  78           HA       LEU  78  -3.399   3.394  -9.923
  569   1HB   LEU  78          2HB       LEU  78  -5.967   3.084  -8.383
  570   2HB   LEU  78          1HB       LEU  78  -5.494   4.415  -9.424
  571    HG   LEU  78           HG       LEU  78  -6.402   1.646 -10.202
  572   1HD1  LEU  78          1HD1      LEU  78  -8.094   3.418  -9.876
  573   2HD1  LEU  78          2HD1      LEU  78  -7.996   2.924 -11.567
  574   3HD1  LEU  78          3HD1      LEU  78  -7.247   4.433 -11.043
  575   1HD2  LEU  78          1HD2      LEU  78  -4.700   3.600 -11.721
  576   2HD2  LEU  78          2HD2      LEU  78  -5.890   2.638 -12.595
  577   3HD2  LEU  78          3HD2      LEU  78  -4.610   1.838 -11.683
  578    H    VAL  79           H        VAL  79  -4.186   1.898  -6.809
  579    HA   VAL  79           HA       VAL  79  -3.610   4.145  -5.169
  580    HB   VAL  79           HB       VAL  79  -3.863   1.196  -4.731
  581   1HG1  VAL  79          1HG1      VAL  79  -3.233   1.502  -2.343
  582   2HG1  VAL  79          2HG1      VAL  79  -2.668   3.131  -2.724
  583   3HG1  VAL  79          3HG1      VAL  79  -1.868   1.728  -3.438
  584   1HG2  VAL  79          1HG2      VAL  79  -5.824   2.696  -4.671
  585   2HG2  VAL  79          2HG2      VAL  79  -5.057   3.649  -3.401
  586   3HG2  VAL  79          3HG2      VAL  79  -5.529   1.978  -3.088
  587    H    MET  80           H        MET  80  -1.639   1.353  -6.152
  588    HA   MET  80           HA       MET  80   0.727   1.828  -4.849
  589   1HB   MET  80          2HB       MET  80  -0.082   0.183  -6.950
  590   2HB   MET  80          1HB       MET  80   1.255   1.117  -7.618
  591   1HG   MET  80          2HG       MET  80   1.606   0.028  -4.864
  592   2HG   MET  80          1HG       MET  80   1.652  -1.124  -6.198
  593   1HE   MET  80          1HE       MET  80   3.821   0.006  -8.646
  594   2HE   MET  80          2HE       MET  80   2.840  -1.252  -7.901
  595   3HE   MET  80          3HE       MET  80   4.581  -1.230  -7.635
  596    H    MET  81           H        MET  81  -0.583   3.661  -7.560
  597    HA   MET  81           HA       MET  81   1.798   4.948  -8.393
  598   1HB   MET  81          2HB       MET  81  -0.479   4.939  -9.570
  599   2HB   MET  81          1HB       MET  81  -0.938   6.220  -8.448
  600   1HG   MET  81          2HG       MET  81   1.582   6.990  -9.398
  601   2HG   MET  81          1HG       MET  81   0.742   6.372 -10.820
  602   1HE   MET  81          1HE       MET  81  -1.851   7.736 -11.703
  603   2HE   MET  81          2HE       MET  81  -2.728   8.029 -10.204
  604   3HE   MET  81          3HE       MET  81  -1.875   6.505 -10.433
  605    H    VAL  82           H        VAL  82  -0.818   6.120  -6.252
  606    HA   VAL  82           HA       VAL  82   0.582   8.446  -5.395
  607    HB   VAL  82           HB       VAL  82  -1.100   8.515  -3.548
  608   1HG1  VAL  82          1HG1      VAL  82  -1.635   9.563  -5.667
  609   2HG1  VAL  82          2HG1      VAL  82  -3.076   8.731  -5.082
  610   3HG1  VAL  82          3HG1      VAL  82  -2.101   8.010  -6.363
  611   1HG2  VAL  82          1HG2      VAL  82  -1.254   5.960  -3.438
  612   2HG2  VAL  82          2HG2      VAL  82  -2.293   6.065  -4.859
  613   3HG2  VAL  82          3HG2      VAL  82  -2.782   6.835  -3.349
  614    H    ARG  83           H        ARG  83   0.574   5.117  -4.335
  615    HA   ARG  83           HA       ARG  83   1.698   5.447  -1.754
  616   1HB   ARG  83          2HB       ARG  83   1.809   3.165  -3.735
  617   2HB   ARG  83          1HB       ARG  83   2.534   3.073  -2.132
  618   1HG   ARG  83          2HG       ARG  83  -0.217   4.078  -2.066
  619   2HG   ARG  83          1HG       ARG  83  -0.101   2.455  -2.750
  620   1HD   ARG  83          2HD       ARG  83   1.069   1.646  -0.795
  621   2HD   ARG  83          1HD       ARG  83   1.207   3.274  -0.143
  622    HE   ARG  83           HE       ARG  83  -1.531   2.631  -0.530
  623   1HH1  ARG  83          2HH1      ARG  83   1.208   1.869   1.498
  624   2HH1  ARG  83          1HH1      ARG  83   0.238   1.463   2.872
  625   1HH2  ARG  83          1HH2      ARG  83  -2.785   2.091   1.283
  626   2HH2  ARG  83          2HH2      ARG  83  -2.017   1.588   2.752
  627    H    CYS  84           H        CYS  84   3.105   5.116  -4.982
  628    HA   CYS  84           HA       CYS  84   5.839   5.086  -4.056
  629   1HB   CYS  84          2HB       CYS  84   4.602   5.419  -6.794
  630   2HB   CYS  84          1HB       CYS  84   6.342   5.450  -6.516
  631    HG   CYS  84           HG       CYS  84   6.338   2.984  -6.267
  632    H    MET  85           H        MET  85   3.666   7.491  -5.522
  633    HA   MET  85           HA       MET  85   5.563   9.600  -5.702
  634   1HB   MET  85          2HB       MET  85   3.103   9.311  -6.691
  635   2HB   MET  85          1HB       MET  85   2.678  10.218  -5.240
  636   1HG   MET  85          2HG       MET  85   4.951  11.176  -6.951
  637   2HG   MET  85          1HG       MET  85   3.293  11.496  -7.456
  638   1HE   MET  85          1HE       MET  85   5.829  13.764  -4.699
  639   2HE   MET  85          2HE       MET  85   5.636  13.867  -6.447
  640   3HE   MET  85          3HE       MET  85   6.196  12.364  -5.716
  641    H    LYS  86           H        LYS  86   3.181   8.700  -3.248
  642    HA   LYS  86           HA       LYS  86   3.122   9.071  -0.981
  643   1HB   LYS  86          2HB       LYS  86   5.694   9.097  -1.162
  644   2HB   LYS  86          1HB       LYS  86   5.546  10.854  -1.173
  645   1HG   LYS  86          2HG       LYS  86   5.843  10.274   1.116
  646   2HG   LYS  86          1HG       LYS  86   4.118  10.592   0.944
  647   1HD   LYS  86          2HD       LYS  86   3.925   8.566   1.986
  648   2HD   LYS  86          1HD       LYS  86   4.159   7.947   0.351
  649   1HE   LYS  86          2HE       LYS  86   6.274   7.203   0.794
  650   2HE   LYS  86          1HE       LYS  86   6.644   8.570   1.844
  651   1HZ   LYS  86          1HZ       LYS  86   6.499   6.468   3.062
  652   2HZ   LYS  86          2HZ       LYS  86   4.883   6.290   2.571
  653   3HZ   LYS  86          3HZ       LYS  86   5.328   7.579   3.585
  654    H    ASP  87           H        ASP  87   1.444  10.268  -0.463
  655    HA   ASP  87           HA       ASP  87   1.299  13.064  -1.375
  656   1HB   ASP  87          2HB       ASP  87  -0.764  11.080  -0.416
  657   2HB   ASP  87          1HB       ASP  87  -1.119  12.806  -0.498
  658    H    ASP  88           H        ASP  88   3.097  12.406   0.757
  659    HA   ASP  88           HA       ASP  88   2.278  14.337   2.705
  660   1HB   ASP  88          2HB       ASP  88   1.122  12.036   3.312
  661   2HB   ASP  88          1HB       ASP  88   2.724  11.640   3.933
  662    H    SER  89           HN       SER  89   4.413  14.521   1.179
  663    HA   SER  89           HA       SER  89   6.770  13.270   2.269
  664   1HB   SER  89          2HB       SER  89   7.963  14.960   0.791
  665   2HB   SER  89          1HB       SER  89   6.882  13.846  -0.038
  666    HG   SER  89           HG       SER  89   6.758  16.556   0.205
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  -9.988   6.009   8.260
    2   2H    MET   1          2H        MET   1 -10.314   4.731   9.330
    3   3H    MET   1          3H        MET   1 -10.163   4.429   7.665
    4    HA   MET   1           HA       MET   1  -8.026   5.231   9.562
    5   1HB   MET   1          2HB       MET   1  -8.598   2.775   7.889
    6   2HB   MET   1          1HB       MET   1  -6.999   3.102   8.555
    7   1HG   MET   1          2HG       MET   1  -7.798   1.938  10.350
    8   2HG   MET   1          1HG       MET   1  -8.529   3.487  10.769
    9   1HE   MET   1          1HE       MET   1 -10.496  -0.403   9.710
   10   2HE   MET   1          2HE       MET   1  -9.113  -0.020  10.732
   11   3HE   MET   1          3HE       MET   1  -8.959   0.080   8.980
   12    H    ASN   2           H        ASN   2  -8.362   4.070   6.191
   13    HA   ASN   2           HA       ASN   2  -6.325   6.053   5.376
   14   1HB   ASN   2          2HB       ASN   2  -7.023   3.308   4.441
   15   2HB   ASN   2          1HB       ASN   2  -6.475   4.460   3.225
   16   1HD2  ASN   2          1HD2      ASN   2  -5.443   4.022   6.669
   17   2HD2  ASN   2          2HD2      ASN   2  -3.804   3.801   6.291
   18    H    ASP   3           H        ASP   3  -7.883   7.749   5.312
   19    HA   ASP   3           HA       ASP   3  -9.943   7.541   3.217
   20   1HB   ASP   3          2HB       ASP   3  -9.534   9.551   5.438
   21   2HB   ASP   3          1HB       ASP   3 -10.779   9.694   4.198
   22    H    ILE   4           H        ILE   4  -6.977   9.214   4.034
   23    HA   ILE   4           HA       ILE   4  -7.223  11.298   2.099
   24    HB   ILE   4           HB       ILE   4  -4.807  11.665   2.449
   25   1HG1  ILE   4          2HG1      ILE   4  -4.040  10.063   4.521
   26   2HG1  ILE   4          1HG1      ILE   4  -5.020   8.933   3.588
   27   1HG2  ILE   4          1HG2      ILE   4  -6.367  11.139   4.996
   28   2HG2  ILE   4          2HG2      ILE   4  -6.443  12.610   4.028
   29   3HG2  ILE   4          3HG2      ILE   4  -4.948  12.177   4.857
   30   1HD1  ILE   4          1HD1      ILE   4  -3.075  10.644   2.101
   31   2HD1  ILE   4          2HD1      ILE   4  -3.610   8.999   1.761
   32   3HD1  ILE   4          3HD1      ILE   4  -2.436   9.298   3.043
   33    H    TYR   5           H        TYR   5  -5.896   8.035   2.008
   34    HA   TYR   5           HA       TYR   5  -4.596   8.256  -0.521
   35   1HB   TYR   5          2HB       TYR   5  -5.661   5.856   0.986
   36   2HB   TYR   5          1HB       TYR   5  -4.769   5.735  -0.531
   37    HD1  TYR   5           HD1      TYR   5  -2.394   6.445  -0.660
   38    HD2  TYR   5           HD2      TYR   5  -4.559   6.459   3.051
   39    HE1  TYR   5           HE1      TYR   5  -0.257   6.641   0.589
   40    HE2  TYR   5           HE2      TYR   5  -2.427   6.653   4.297
   41    HH   TYR   5           HH       TYR   5   0.194   7.700   3.306
   42    H    LYS   6           H        LYS   6  -7.855   7.351   0.498
   43    HA   LYS   6           HA       LYS   6  -8.750   6.639  -2.152
   44   1HB   LYS   6          2HB       LYS   6  -9.748   5.718  -0.035
   45   2HB   LYS   6          1HB       LYS   6 -10.430   7.314   0.275
   46   1HG   LYS   6          2HG       LYS   6 -11.168   6.817  -2.355
   47   2HG   LYS   6          1HG       LYS   6 -11.319   5.236  -1.593
   48   1HD   LYS   6          2HD       LYS   6 -13.431   6.434  -1.369
   49   2HD   LYS   6          1HD       LYS   6 -12.682   6.280   0.220
   50   1HE   LYS   6          2HE       LYS   6 -12.469   8.520   0.444
   51   2HE   LYS   6          1HE       LYS   6 -11.816   8.695  -1.183
   52   1HZ   LYS   6          1HZ       LYS   6 -14.064   8.558  -2.062
   53   2HZ   LYS   6          2HZ       LYS   6 -13.926   9.841  -0.957
   54   3HZ   LYS   6          3HZ       LYS   6 -14.690   8.396  -0.494
   55    H    ALA   7           H        ALA   7  -8.675   9.529  -0.164
   56    HA   ALA   7           HA       ALA   7 -10.553  11.056  -1.674
   57   1HB   ALA   7          1HB       ALA   7  -9.431  13.017  -0.525
   58   2HB   ALA   7          2HB       ALA   7  -8.356  11.848   0.241
   59   3HB   ALA   7          3HB       ALA   7 -10.091  11.787   0.552
   60    H    ALA   8           H        ALA   8  -7.180  10.275  -2.128
   61    HA   ALA   8           HA       ALA   8  -6.720  12.459  -3.998
   62   1HB   ALA   8          1HB       ALA   8  -4.863  10.145  -3.840
   63   2HB   ALA   8          2HB       ALA   8  -5.012  11.158  -2.406
   64   3HB   ALA   8          3HB       ALA   8  -4.505  11.868  -3.939
   65    H    VAL   9           H        VAL   9  -7.075   8.919  -4.121
   66    HA   VAL   9           HA       VAL   9  -6.687   8.621  -6.895
   67    HB   VAL   9           HB       VAL   9  -6.681   6.736  -5.258
   68   1HG1  VAL   9          1HG1      VAL   9  -8.653   7.349  -3.948
   69   2HG1  VAL   9          2HG1      VAL   9  -8.874   5.744  -4.640
   70   3HG1  VAL   9          3HG1      VAL   9  -9.688   7.133  -5.359
   71   1HG2  VAL   9          1HG2      VAL   9  -8.760   6.193  -7.374
   72   2HG2  VAL   9          2HG2      VAL   9  -7.442   5.156  -6.828
   73   3HG2  VAL   9          3HG2      VAL   9  -7.096   6.569  -7.824
   74    H    GLU  10           H        GLU  10  -9.504   9.634  -5.050
   75    HA   GLU  10           HA       GLU  10 -11.382   9.270  -7.189
   76   1HB   GLU  10          2HB       GLU  10 -12.935  10.521  -5.789
   77   2HB   GLU  10          1HB       GLU  10 -12.082   9.321  -4.822
   78   1HG   GLU  10          2HG       GLU  10 -10.717  10.938  -3.790
   79   2HG   GLU  10          1HG       GLU  10 -11.054  12.148  -5.027
   80    H    GLN  11           H        GLN  11  -9.027  11.705  -6.417
   81    HA   GLN  11           HA       GLN  11 -10.359  13.801  -7.938
   82   1HB   GLN  11          2HB       GLN  11  -7.459  13.914  -7.187
   83   2HB   GLN  11          1HB       GLN  11  -8.629  15.228  -7.305
   84   1HG   GLN  11          2HG       GLN  11  -9.838  13.975  -5.352
   85   2HG   GLN  11          1HG       GLN  11  -8.271  13.204  -5.120
   86   1HE2  GLN  11          1HE2      GLN  11  -7.597  14.287  -3.199
   87   2HE2  GLN  11          2HE2      GLN  11  -7.377  15.968  -3.110
   88    H    LEU  12           H        LEU  12  -8.129  11.241  -8.491
   89    HA   LEU  12           HA       LEU  12  -6.630  12.059 -10.662
   90   1HB   LEU  12          2HB       LEU  12  -7.903   9.360 -10.243
   91   2HB   LEU  12          1HB       LEU  12  -6.619   9.699 -11.380
   92    HG   LEU  12           HG       LEU  12  -6.512   9.521  -8.391
   93   1HD1  LEU  12          1HD1      LEU  12  -5.649   7.556  -9.119
   94   2HD1  LEU  12          2HD1      LEU  12  -4.209   8.498  -9.501
   95   3HD1  LEU  12          3HD1      LEU  12  -5.405   8.167 -10.757
   96   1HD2  LEU  12          1HD2      LEU  12  -4.102  10.463  -8.736
   97   2HD2  LEU  12          2HD2      LEU  12  -5.441  11.606  -8.617
   98   3HD2  LEU  12          3HD2      LEU  12  -4.769  11.194 -10.197
   99    H    THR  13           H        THR  13  -6.829  11.885 -12.890
  100    HA   THR  13           HA       THR  13  -9.557  12.271 -13.904
  101    HB   THR  13           HB       THR  13  -7.904  12.535 -16.079
  102    HG1  THR  13           HG1      THR  13  -5.985  12.512 -15.157
  103   1HG2  THR  13          1HG2      THR  13  -7.953  15.075 -15.177
  104   2HG2  THR  13          2HG2      THR  13  -9.175  14.358 -14.125
  105   3HG2  THR  13          3HG2      THR  13  -9.354  14.265 -15.877
  106    H    ASP  14           H        ASP  14  -9.943  11.319 -16.155
  107    HA   ASP  14           HA       ASP  14  -9.890   8.492 -16.003
  108   1HB   ASP  14          2HB       ASP  14 -11.352  10.159 -17.476
  109   2HB   ASP  14          1HB       ASP  14 -10.092   9.832 -18.666
  110    H    GLU  15           H        GLU  15  -7.753  10.881 -17.450
  111    HA   GLU  15           HA       GLU  15  -6.184   9.098 -19.026
  112   1HB   GLU  15          2HB       GLU  15  -5.765  11.863 -17.929
  113   2HB   GLU  15          1HB       GLU  15  -4.426  10.999 -18.684
  114   1HG   GLU  15          2HG       GLU  15  -5.887  10.620 -20.694
  115   2HG   GLU  15          1HG       GLU  15  -7.101  11.659 -19.947
  116    H    GLN  16           H        GLN  16  -5.940  10.277 -15.686
  117    HA   GLN  16           HA       GLN  16  -3.409   9.186 -15.049
  118   1HB   GLN  16          2HB       GLN  16  -5.010  10.794 -13.686
  119   2HB   GLN  16          1HB       GLN  16  -5.569   9.279 -12.979
  120   1HG   GLN  16          2HG       GLN  16  -3.772   9.284 -11.628
  121   2HG   GLN  16          1HG       GLN  16  -2.736   9.128 -13.047
  122   1HE2  GLN  16          1HE2      GLN  16  -3.147  11.683 -14.252
  123   2HE2  GLN  16          2HE2      GLN  16  -2.546  12.879 -13.209
  124    H    LYS  17           H        LYS  17  -6.688   7.881 -14.536
  125    HA   LYS  17           HA       LYS  17  -5.870   5.379 -13.486
  126   1HB   LYS  17          2HB       LYS  17  -8.400   6.151 -14.965
  127   2HB   LYS  17          1HB       LYS  17  -8.158   4.609 -14.144
  128   1HG   LYS  17          2HG       LYS  17  -8.251   5.555 -12.039
  129   2HG   LYS  17          1HG       LYS  17  -7.622   7.106 -12.591
  130   1HD   LYS  17          2HD       LYS  17  -9.880   7.589 -12.171
  131   2HD   LYS  17          1HD       LYS  17  -9.868   7.279 -13.907
  132   1HE   LYS  17          2HE       LYS  17 -10.583   4.959 -13.514
  133   2HE   LYS  17          1HE       LYS  17 -10.565   5.238 -11.773
  134   1HZ   LYS  17          1HZ       LYS  17 -12.262   6.694 -13.729
  135   2HZ   LYS  17          2HZ       LYS  17 -12.260   6.924 -12.046
  136   3HZ   LYS  17          3HZ       LYS  17 -12.793   5.452 -12.704
  137    H    ASN  18           H        ASN  18  -6.381   6.569 -16.771
  138    HA   ASN  18           HA       ASN  18  -6.247   4.093 -18.138
  139   1HB   ASN  18          2HB       ASN  18  -5.789   6.950 -18.942
  140   2HB   ASN  18          1HB       ASN  18  -5.395   5.648 -20.061
  141   1HD2  ASN  18          1HD2      ASN  18  -7.549   7.592 -20.464
  142   2HD2  ASN  18          2HD2      ASN  18  -9.005   6.719 -20.481
  143    H    GLU  19           H        GLU  19  -3.747   6.247 -16.886
  144    HA   GLU  19           HA       GLU  19  -1.523   5.345 -18.345
  145   1HB   GLU  19          2HB       GLU  19  -1.397   5.984 -15.391
  146   2HB   GLU  19          1HB       GLU  19  -0.130   6.182 -16.599
  147   1HG   GLU  19          2HG       GLU  19  -2.044   7.733 -17.704
  148   2HG   GLU  19          1HG       GLU  19  -2.466   7.907 -16.001
  149    H    PHE  20           H        PHE  20  -2.799   4.178 -15.234
  150    HA   PHE  20           HA       PHE  20  -1.003   1.912 -15.175
  151   1HB   PHE  20          2HB       PHE  20  -3.298   2.827 -13.458
  152   2HB   PHE  20          1HB       PHE  20  -2.552   1.247 -13.225
  153    HD1  PHE  20           HD1      PHE  20  -1.984   4.907 -13.138
  154    HD2  PHE  20           HD2      PHE  20  -0.303   1.026 -12.360
  155    HE1  PHE  20           HE1      PHE  20  -0.144   5.958 -11.852
  156    HE2  PHE  20           HE2      PHE  20   1.525   2.070 -11.067
  157    HZ   PHE  20           HZ       PHE  20   1.615   4.541 -10.815
  158    H    LYS  21           H        LYS  21  -4.471   2.423 -15.800
  159    HA   LYS  21           HA       LYS  21  -5.312  -0.222 -16.018
  160   1HB   LYS  21          2HB       LYS  21  -6.831   1.730 -16.063
  161   2HB   LYS  21          1HB       LYS  21  -6.271   2.113 -17.689
  162   1HG   LYS  21          2HG       LYS  21  -7.057  -0.676 -17.498
  163   2HG   LYS  21          1HG       LYS  21  -8.376   0.383 -16.999
  164   1HD   LYS  21          2HD       LYS  21  -6.872   1.165 -19.453
  165   2HD   LYS  21          1HD       LYS  21  -7.939  -0.235 -19.578
  166   1HE   LYS  21          2HE       LYS  21  -9.842   1.049 -18.856
  167   2HE   LYS  21          1HE       LYS  21  -8.823   2.423 -18.427
  168   1HZ   LYS  21          1HZ       LYS  21  -9.235   1.340 -21.162
  169   2HZ   LYS  21          2HZ       LYS  21  -8.204   2.631 -20.765
  170   3HZ   LYS  21          3HZ       LYS  21  -9.883   2.784 -20.552
  171    H    ALA  22           H        ALA  22  -3.621   1.786 -18.398
  172    HA   ALA  22           HA       ALA  22  -3.930   0.111 -20.653
  173   1HB   ALA  22          1HB       ALA  22  -1.587   1.893 -19.938
  174   2HB   ALA  22          2HB       ALA  22  -3.033   2.405 -20.808
  175   3HB   ALA  22          3HB       ALA  22  -1.931   1.238 -21.538
  176    H    ALA  23           H        ALA  23  -1.257   0.340 -18.305
  177    HA   ALA  23           HA       ALA  23   0.188  -1.915 -19.272
  178   1HB   ALA  23          1HB       ALA  23   0.216  -0.428 -16.637
  179   2HB   ALA  23          2HB       ALA  23   1.402  -0.348 -17.942
  180   3HB   ALA  23          3HB       ALA  23   1.269  -1.806 -16.959
  181    H    PHE  24           H        PHE  24  -2.324  -1.445 -16.864
  182    HA   PHE  24           HA       PHE  24  -2.224  -3.960 -15.597
  183   1HB   PHE  24          2HB       PHE  24  -3.557  -1.831 -14.950
  184   2HB   PHE  24          1HB       PHE  24  -4.787  -2.442 -16.056
  185    HD1  PHE  24           HD1      PHE  24  -5.778  -4.728 -15.667
  186    HD2  PHE  24           HD2      PHE  24  -3.229  -2.799 -12.803
  187    HE1  PHE  24           HE1      PHE  24  -6.573  -6.284 -13.912
  188    HE2  PHE  24           HE2      PHE  24  -4.026  -4.349 -11.048
  189    HZ   PHE  24           HZ       PHE  24  -5.701  -6.092 -11.598
  190    H    ASP  25           H        ASP  25  -4.118  -2.807 -18.380
  191    HA   ASP  25           HA       ASP  25  -5.600  -5.162 -18.822
  192   1HB   ASP  25          2HB       ASP  25  -4.969  -2.724 -20.376
  193   2HB   ASP  25          1HB       ASP  25  -5.447  -4.136 -21.320
  194    H    ILE  26           H        ILE  26  -2.382  -4.224 -19.989
  195    HA   ILE  26           HA       ILE  26  -2.202  -6.489 -21.777
  196    HB   ILE  26           HB       ILE  26   0.168  -5.783 -22.079
  197   1HG1  ILE  26          2HG1      ILE  26  -0.592  -3.526 -20.193
  198   2HG1  ILE  26          1HG1      ILE  26   0.461  -4.869 -19.758
  199   1HG2  ILE  26          1HG2      ILE  26  -1.791  -4.832 -23.368
  200   2HG2  ILE  26          2HG2      ILE  26  -0.380  -3.777 -23.292
  201   3HG2  ILE  26          3HG2      ILE  26  -1.772  -3.463 -22.255
  202   1HD1  ILE  26          1HD1      ILE  26   1.272  -3.593 -22.258
  203   2HD1  ILE  26          2HD1      ILE  26   2.227  -3.953 -20.820
  204   3HD1  ILE  26          3HD1      ILE  26   1.274  -2.471 -20.896
  205    H    PHE  27           H        PHE  27  -0.969  -5.721 -18.531
  206    HA   PHE  27           HA       PHE  27   0.649  -8.082 -18.355
  207   1HB   PHE  27          2HB       PHE  27  -0.349  -6.161 -16.249
  208   2HB   PHE  27          1HB       PHE  27   0.686  -7.542 -15.883
  209    HD1  PHE  27           HD1      PHE  27   0.947  -4.207 -16.154
  210    HD2  PHE  27           HD2      PHE  27   2.557  -7.695 -18.076
  211    HE1  PHE  27           HE1      PHE  27   2.914  -2.897 -16.894
  212    HE2  PHE  27           HE2      PHE  27   4.526  -6.384 -18.805
  213    HZ   PHE  27           HZ       PHE  27   4.704  -3.986 -18.216
  214    H    ILE  28           H        ILE  28  -2.682  -7.301 -17.393
  215    HA   ILE  28           HA       ILE  28  -2.992  -9.948 -16.179
  216    HB   ILE  28           HB       ILE  28  -5.161  -9.267 -15.460
  217   1HG1  ILE  28          2HG1      ILE  28  -5.779  -6.762 -16.235
  218   2HG1  ILE  28          1HG1      ILE  28  -4.889  -7.281 -17.669
  219   1HG2  ILE  28          1HG2      ILE  28  -2.952  -8.091 -14.564
  220   2HG2  ILE  28          2HG2      ILE  28  -4.545  -7.617 -13.977
  221   3HG2  ILE  28          3HG2      ILE  28  -3.739  -6.654 -15.212
  222   1HD1  ILE  28          1HD1      ILE  28  -6.948  -9.124 -16.511
  223   2HD1  ILE  28          2HD1      ILE  28  -6.417  -8.951 -18.184
  224   3HD1  ILE  28          3HD1      ILE  28  -7.488  -7.745 -17.468
  225    H    GLN  29           H        GLN  29  -3.140  -8.711 -19.291
  226    HA   GLN  29           HA       GLN  29  -5.404  -9.770 -20.482
  227   1HB   GLN  29          2HB       GLN  29  -3.763  -8.397 -21.700
  228   2HB   GLN  29          1HB       GLN  29  -2.598  -9.718 -21.624
  229   1HG   GLN  29          2HG       GLN  29  -3.945 -11.116 -23.015
  230   2HG   GLN  29          1HG       GLN  29  -5.336 -10.043 -22.866
  231   1HE2  GLN  29          1HE2      GLN  29  -5.012  -7.771 -23.831
  232   2HE2  GLN  29          2HE2      GLN  29  -4.028  -7.638 -25.207
  233    H    ASP  30           H        ASP  30  -2.329 -11.403 -19.773
  234    HA   ASP  30           HA       ASP  30  -3.501 -13.977 -20.601
  235   1HB   ASP  30          2HB       ASP  30  -0.654 -13.124 -20.047
  236   2HB   ASP  30          1HB       ASP  30  -1.122 -14.799 -20.338
  237    H    ALA  31           H        ALA  31  -4.044 -12.471 -17.993
  238    HA   ALA  31           HA       ALA  31  -3.011 -14.419 -16.045
  239   1HB   ALA  31          1HB       ALA  31  -3.657 -12.879 -14.334
  240   2HB   ALA  31          2HB       ALA  31  -4.607 -11.918 -15.467
  241   3HB   ALA  31          3HB       ALA  31  -2.847 -11.933 -15.583
  242    H    GLU  32           H        GLU  32  -4.402 -15.511 -14.629
  243    HA   GLU  32           HA       GLU  32  -7.140 -15.889 -15.690
  244   1HB   GLU  32          2HB       GLU  32  -5.369 -17.744 -14.075
  245   2HB   GLU  32          1HB       GLU  32  -7.054 -18.082 -14.473
  246   1HG   GLU  32          2HG       GLU  32  -6.589 -18.528 -16.666
  247   2HG   GLU  32          1HG       GLU  32  -5.335 -17.292 -16.758
  248    H    ASP  33           H        ASP  33  -6.740 -13.666 -14.112
  249    HA   ASP  33           HA       ASP  33  -8.538 -14.205 -11.905
  250   1HB   ASP  33          2HB       ASP  33  -6.061 -14.617 -11.136
  251   2HB   ASP  33          1HB       ASP  33  -5.981 -12.855 -11.113
  252    H    GLY  34           H        GLY  34  -6.296 -11.822 -13.317
  253   1HA   GLY  34          2HA       GLY  34  -7.224  -9.820 -14.376
  254   2HA   GLY  34          1HA       GLY  34  -8.432  -9.779 -13.094
  255    H    CYS  35           H        CYS  35  -4.948 -10.371 -12.806
  256    HA   CYS  35           HA       CYS  35  -4.503  -7.748 -11.581
  257   1HB   CYS  35          2HB       CYS  35  -3.836 -10.337 -10.154
  258   2HB   CYS  35          1HB       CYS  35  -3.459  -8.710  -9.589
  259    HG   CYS  35           HG       CYS  35  -6.303  -9.968  -9.648
  260    H    ILE  36           H        ILE  36  -2.313  -7.116 -11.606
  261    HA   ILE  36           HA       ILE  36  -0.720  -8.486 -13.611
  262    HB   ILE  36           HB       ILE  36   0.708  -6.622 -13.638
  263   1HG1  ILE  36          2HG1      ILE  36   0.130  -4.901 -11.555
  264   2HG1  ILE  36          1HG1      ILE  36   0.038  -6.481 -10.775
  265   1HG2  ILE  36          1HG2      ILE  36  -0.737  -4.739 -13.893
  266   2HG2  ILE  36          2HG2      ILE  36  -1.894  -5.380 -12.726
  267   3HG2  ILE  36          3HG2      ILE  36  -1.704  -6.156 -14.299
  268   1HD1  ILE  36          1HD1      ILE  36   2.288  -6.650 -10.785
  269   2HD1  ILE  36          2HD1      ILE  36   2.381  -5.031 -11.478
  270   3HD1  ILE  36          3HD1      ILE  36   2.316  -6.438 -12.536
  271    H    SER  37           H        SER  37   1.647  -8.871 -13.177
  272    HA   SER  37           HA       SER  37   1.867 -10.507 -10.779
  273   1HB   SER  37          2HB       SER  37   2.809 -10.857 -13.311
  274   2HB   SER  37          1HB       SER  37   4.238 -10.206 -12.514
  275    HG   SER  37           HG       SER  37   3.909 -12.555 -12.400
  276    H    THR  38           H        THR  38   2.395  -9.518  -8.936
  277    HA   THR  38           HA       THR  38   3.627  -7.034  -8.612
  278    HB   THR  38           HB       THR  38   4.141  -7.755  -6.295
  279    HG1  THR  38           HG1      THR  38   4.547  -9.796  -6.104
  280   1HG2  THR  38          1HG2      THR  38   1.454  -8.385  -7.496
  281   2HG2  THR  38          2HG2      THR  38   1.935  -6.973  -6.556
  282   3HG2  THR  38          3HG2      THR  38   1.734  -8.535  -5.762
  283    H    LYS  39           H        LYS  39   5.048 -10.268  -8.830
  284    HA   LYS  39           HA       LYS  39   7.715  -9.608  -8.212
  285   1HB   LYS  39          2HB       LYS  39   8.337 -11.659  -9.420
  286   2HB   LYS  39          1HB       LYS  39   6.937 -11.943  -8.387
  287   1HG   LYS  39          2HG       LYS  39   5.491 -11.468 -10.438
  288   2HG   LYS  39          1HG       LYS  39   6.973 -11.550 -11.389
  289   1HD   LYS  39          2HD       LYS  39   6.486 -13.792  -9.492
  290   2HD   LYS  39          1HD       LYS  39   5.439 -13.714 -10.909
  291   1HE   LYS  39          2HE       LYS  39   7.530 -13.487 -12.322
  292   2HE   LYS  39          1HE       LYS  39   8.464 -13.847 -10.871
  293   1HZ   LYS  39          1HZ       LYS  39   8.085 -15.853 -12.108
  294   2HZ   LYS  39          2HZ       LYS  39   6.408 -15.586 -12.124
  295   3HZ   LYS  39          3HZ       LYS  39   7.204 -15.927 -10.661
  296    H    GLU  40           H        GLU  40   5.843  -9.245 -11.159
  297    HA   GLU  40           HA       GLU  40   8.215  -8.249 -12.598
  298   1HB   GLU  40          2HB       GLU  40   5.501  -9.191 -13.527
  299   2HB   GLU  40          1HB       GLU  40   6.609  -8.318 -14.586
  300   1HG   GLU  40          2HG       GLU  40   8.098 -10.063 -14.704
  301   2HG   GLU  40          1HG       GLU  40   7.742 -10.616 -13.067
  302    H    LEU  41           H        LEU  41   6.788  -6.729 -10.467
  303    HA   LEU  41           HA       LEU  41   5.089  -4.748 -11.470
  304   1HB   LEU  41          2HB       LEU  41   5.993  -5.268  -9.031
  305   2HB   LEU  41          1HB       LEU  41   7.140  -4.015  -9.432
  306    HG   LEU  41           HG       LEU  41   5.090  -3.275  -8.145
  307   1HD1  LEU  41          1HD1      LEU  41   5.183  -1.898 -10.818
  308   2HD1  LEU  41          2HD1      LEU  41   6.594  -1.871  -9.759
  309   3HD1  LEU  41          3HD1      LEU  41   5.065  -1.190  -9.207
  310   1HD2  LEU  41          1HD2      LEU  41   2.977  -3.151  -9.233
  311   2HD2  LEU  41          2HD2      LEU  41   3.564  -4.778  -9.578
  312   3HD2  LEU  41          3HD2      LEU  41   3.678  -3.519 -10.808
  313    H    GLY  42           H        GLY  42   8.617  -5.005 -11.572
  314   1HA   GLY  42          2HA       GLY  42   9.279  -2.394 -12.356
  315   2HA   GLY  42          1HA       GLY  42  10.204  -3.834 -12.767
  316    H    LYS  43           H        LYS  43   7.973  -5.099 -14.200
  317    HA   LYS  43           HA       LYS  43   8.454  -4.100 -16.811
  318   1HB   LYS  43          2HB       LYS  43   6.247  -5.937 -15.840
  319   2HB   LYS  43          1HB       LYS  43   6.689  -5.674 -17.526
  320   1HG   LYS  43          2HG       LYS  43   9.046  -6.417 -16.894
  321   2HG   LYS  43          1HG       LYS  43   8.369  -6.941 -15.351
  322   1HD   LYS  43          2HD       LYS  43   8.245  -8.893 -16.646
  323   2HD   LYS  43          1HD       LYS  43   6.629  -8.213 -16.825
  324   1HE   LYS  43          2HE       LYS  43   7.930  -6.955 -18.865
  325   2HE   LYS  43          1HE       LYS  43   8.792  -8.493 -18.828
  326   1HZ   LYS  43          1HZ       LYS  43   6.839  -8.552 -20.278
  327   2HZ   LYS  43          2HZ       LYS  43   5.838  -8.197 -18.952
  328   3HZ   LYS  43          3HZ       LYS  43   6.705  -9.657 -18.998
  329    H    VAL  44           H        VAL  44   6.036  -3.373 -14.398
  330    HA   VAL  44           HA       VAL  44   4.397  -1.892 -16.316
  331    HB   VAL  44           HB       VAL  44   2.664  -2.029 -14.848
  332   1HG1  VAL  44          1HG1      VAL  44   4.062  -3.993 -13.124
  333   2HG1  VAL  44          2HG1      VAL  44   4.110  -4.324 -14.854
  334   3HG1  VAL  44          3HG1      VAL  44   2.558  -4.153 -14.034
  335   1HG2  VAL  44          1HG2      VAL  44   4.727  -1.390 -12.767
  336   2HG2  VAL  44          2HG2      VAL  44   3.206  -2.110 -12.250
  337   3HG2  VAL  44          3HG2      VAL  44   3.201  -0.575 -13.120
  338    H    MET  45           H        MET  45   6.613  -1.389 -13.625
  339    HA   MET  45           HA       MET  45   6.213   1.356 -13.187
  340   1HB   MET  45          2HB       MET  45   8.651  -0.400 -12.878
  341   2HB   MET  45          1HB       MET  45   8.668   1.312 -12.461
  342   1HG   MET  45          2HG       MET  45   6.412  -0.304 -11.384
  343   2HG   MET  45          1HG       MET  45   8.003  -0.590 -10.680
  344   1HE   MET  45          1HE       MET  45   4.896   1.650  -9.713
  345   2HE   MET  45          2HE       MET  45   5.166   1.376 -11.432
  346   3HE   MET  45          3HE       MET  45   5.333   3.000 -10.770
  347    H    ARG  46           H        ARG  46   8.225  -0.368 -15.559
  348    HA   ARG  46           HA       ARG  46   9.590   1.881 -16.594
  349   1HB   ARG  46          2HB       ARG  46   9.954   0.519 -18.629
  350   2HB   ARG  46          1HB       ARG  46  10.323  -0.372 -17.155
  351   1HG   ARG  46          2HG       ARG  46   8.240  -1.571 -17.264
  352   2HG   ARG  46          1HG       ARG  46   7.655  -0.551 -18.577
  353   1HD   ARG  46          2HD       ARG  46   8.407  -2.310 -19.838
  354   2HD   ARG  46          1HD       ARG  46   9.916  -1.411 -19.727
  355    HE   ARG  46           HE       ARG  46  10.058  -3.014 -17.555
  356   1HH1  ARG  46          2HH1      ARG  46   9.275  -3.642 -20.902
  357   2HH1  ARG  46          1HH1      ARG  46   9.864  -5.268 -20.864
  358   1HH2  ARG  46          1HH2      ARG  46  10.821  -5.149 -17.530
  359   2HH2  ARG  46          2HH2      ARG  46  10.738  -6.120 -18.961
  360    H    MET  47           H        MET  47   6.395   0.557 -17.251
  361    HA   MET  47           HA       MET  47   5.798   2.154 -19.544
  362   1HB   MET  47          2HB       MET  47   4.412   0.242 -17.860
  363   2HB   MET  47          1HB       MET  47   3.384   1.632 -18.204
  364   1HG   MET  47          2HG       MET  47   3.148  -0.129 -19.932
  365   2HG   MET  47          1HG       MET  47   3.792   1.366 -20.610
  366   1HE   MET  47          1HE       MET  47   4.299  -2.419 -20.909
  367   2HE   MET  47          2HE       MET  47   4.299  -1.980 -19.203
  368   3HE   MET  47          3HE       MET  47   5.753  -2.658 -19.931
  369    H    LEU  48           H        LEU  48   5.556   2.612 -16.064
  370    HA   LEU  48           HA       LEU  48   3.977   5.013 -16.168
  371   1HB   LEU  48          2HB       LEU  48   5.514   3.546 -14.070
  372   2HB   LEU  48          1HB       LEU  48   5.090   5.213 -13.772
  373    HG   LEU  48           HG       LEU  48   3.342   4.072 -12.758
  374   1HD1  LEU  48          1HD1      LEU  48   1.373   4.458 -14.069
  375   2HD1  LEU  48          2HD1      LEU  48   2.266   4.278 -15.580
  376   3HD1  LEU  48          3HD1      LEU  48   2.543   5.685 -14.553
  377   1HD2  LEU  48          1HD2      LEU  48   2.381   2.009 -13.535
  378   2HD2  LEU  48          2HD2      LEU  48   4.131   1.844 -13.691
  379   3HD2  LEU  48          3HD2      LEU  48   3.147   2.180 -15.115
  380    H    GLY  49           H        GLY  49   7.398   4.229 -16.189
  381   1HA   GLY  49          2HA       GLY  49   8.809   5.888 -17.400
  382   2HA   GLY  49          1HA       GLY  49   8.042   7.116 -16.403
  383    H    GLN  50           H        GLN  50   8.998   3.966 -15.126
  384    HA   GLN  50           HA       GLN  50  11.493   4.980 -14.020
  385   1HB   GLN  50          2HB       GLN  50  10.829   4.517 -11.667
  386   2HB   GLN  50          1HB       GLN  50   9.934   5.860 -12.375
  387   1HG   GLN  50          2HG       GLN  50   8.430   3.565 -13.000
  388   2HG   GLN  50          1HG       GLN  50   8.931   3.348 -11.324
  389   1HE2  GLN  50          1HE2      GLN  50   7.427   5.808 -13.491
  390   2HE2  GLN  50          2HE2      GLN  50   6.494   6.524 -12.267
  391    H    ASN  51           H        ASN  51  12.687   3.297 -12.811
  392    HA   ASN  51           HA       ASN  51  11.721   0.555 -13.148
  393   1HB   ASN  51          2HB       ASN  51  12.982   1.298 -15.268
  394   2HB   ASN  51          1HB       ASN  51  14.432   1.261 -14.263
  395   1HD2  ASN  51          1HD2      ASN  51  11.613  -0.843 -15.107
  396   2HD2  ASN  51          2HD2      ASN  51  12.498  -2.291 -15.043
  397    HA   PRO  52           HA       PRO  52  14.139   0.954  -9.301
  398   1HB   PRO  52          2HB       PRO  52  12.356  -0.439  -7.765
  399   2HB   PRO  52          1HB       PRO  52  12.205   1.288  -8.120
  400   1HG   PRO  52          2HG       PRO  52  10.643  -0.986  -9.165
  401   2HG   PRO  52          1HG       PRO  52  10.195   0.720  -9.027
  402   1HD   PRO  52          2HD       PRO  52  11.044  -0.644 -11.389
  403   2HD   PRO  52          1HD       PRO  52  10.760   1.103 -11.203
  404    H    THR  53           H        THR  53  14.056  -1.165  -7.494
  405    HA   THR  53           HA       THR  53  15.323  -3.342  -9.037
  406    HB   THR  53           HB       THR  53  16.679  -3.774  -7.177
  407    HG1  THR  53           HG1      THR  53  15.972  -3.640  -5.194
  408   1HG2  THR  53          1HG2      THR  53  17.603  -1.678  -6.457
  409   2HG2  THR  53          2HG2      THR  53  16.090  -0.835  -6.787
  410   3HG2  THR  53          3HG2      THR  53  17.056  -1.466  -8.120
  411    HA   PRO  54           HA       PRO  54  12.215  -6.232  -7.815
  412   1HB   PRO  54          2HB       PRO  54  13.591  -8.400  -6.852
  413   2HB   PRO  54          1HB       PRO  54  13.469  -7.982  -8.569
  414   1HG   PRO  54          2HG       PRO  54  15.744  -7.596  -6.688
  415   2HG   PRO  54          1HG       PRO  54  15.762  -7.935  -8.426
  416   1HD   PRO  54          2HD       PRO  54  16.200  -5.431  -7.296
  417   2HD   PRO  54          1HD       PRO  54  15.693  -5.700  -8.979
  418    H    GLU  55           H        GLU  55  14.599  -5.480  -5.349
  419    HA   GLU  55           HA       GLU  55  12.983  -6.455  -3.142
  420   1HB   GLU  55          2HB       GLU  55  15.468  -4.718  -3.154
  421   2HB   GLU  55          1HB       GLU  55  14.713  -5.408  -1.717
  422   1HG   GLU  55          2HG       GLU  55  15.655  -7.108  -4.040
  423   2HG   GLU  55          1HG       GLU  55  16.688  -6.718  -2.666
  424    H    GLU  56           H        GLU  56  13.663  -3.403  -4.779
  425    HA   GLU  56           HA       GLU  56  12.386  -1.706  -2.867
  426   1HB   GLU  56          2HB       GLU  56  14.068  -1.097  -4.769
  427   2HB   GLU  56          1HB       GLU  56  12.624  -1.003  -5.777
  428   1HG   GLU  56          2HG       GLU  56  11.637   0.660  -4.312
  429   2HG   GLU  56          1HG       GLU  56  12.954   0.479  -3.153
  430    H    LEU  57           H        LEU  57  11.334  -3.054  -6.017
  431    HA   LEU  57           HA       LEU  57   8.757  -1.903  -5.983
  432   1HB   LEU  57          2HB       LEU  57   8.161  -3.569  -7.660
  433   2HB   LEU  57          1HB       LEU  57   9.680  -2.794  -8.027
  434    HG   LEU  57           HG       LEU  57  10.683  -4.948  -6.847
  435   1HD1  LEU  57          1HD1      LEU  57   9.083  -6.436  -6.261
  436   2HD1  LEU  57          2HD1      LEU  57   8.836  -6.710  -7.985
  437   3HD1  LEU  57          3HD1      LEU  57   7.838  -5.539  -7.127
  438   1HD2  LEU  57          1HD2      LEU  57  11.095  -4.302  -9.171
  439   2HD2  LEU  57          2HD2      LEU  57   9.494  -4.874  -9.639
  440   3HD2  LEU  57          3HD2      LEU  57  10.719  -6.023  -9.104
  441    H    GLN  58           H        GLN  58  10.019  -4.917  -4.623
  442    HA   GLN  58           HA       GLN  58   7.509  -6.068  -3.952
  443   1HB   GLN  58          2HB       GLN  58  10.330  -6.612  -3.349
  444   2HB   GLN  58          1HB       GLN  58   9.233  -7.037  -2.036
  445   1HG   GLN  58          2HG       GLN  58   8.865  -7.899  -4.922
  446   2HG   GLN  58          1HG       GLN  58   9.569  -8.909  -3.659
  447   1HE2  GLN  58          1HE2      GLN  58   6.593  -7.939  -5.098
  448   2HE2  GLN  58          2HE2      GLN  58   5.554  -8.613  -3.936
  449    H    GLU  59           H        GLU  59   9.642  -3.795  -2.285
  450    HA   GLU  59           HA       GLU  59   8.319  -3.853   0.237
  451   1HB   GLU  59          2HB       GLU  59  10.170  -1.909  -1.118
  452   2HB   GLU  59          1HB       GLU  59   9.374  -1.468   0.393
  453   1HG   GLU  59          2HG       GLU  59  10.716  -4.139   0.241
  454   2HG   GLU  59          1HG       GLU  59  11.733  -2.707   0.391
  455    H    MET  60           H        MET  60   7.896  -1.913  -2.697
  456    HA   MET  60           HA       MET  60   5.931  -0.142  -1.613
  457   1HB   MET  60          2HB       MET  60   6.384  -0.901  -4.509
  458   2HB   MET  60          1HB       MET  60   5.504   0.511  -3.924
  459   1HG   MET  60          2HG       MET  60   8.327   0.105  -3.007
  460   2HG   MET  60          1HG       MET  60   8.048   0.706  -4.641
  461   1HE   MET  60          1HE       MET  60   9.618   2.909  -3.010
  462   2HE   MET  60          2HE       MET  60   8.601   4.143  -3.749
  463   3HE   MET  60          3HE       MET  60   8.988   2.678  -4.647
  464    H    ILE  61           H        ILE  61   5.789  -3.092  -3.552
  465    HA   ILE  61           HA       ILE  61   2.972  -3.201  -3.837
  466    HB   ILE  61           HB       ILE  61   5.006  -5.448  -3.875
  467   1HG1  ILE  61          2HG1      ILE  61   3.632  -4.267  -6.273
  468   2HG1  ILE  61          1HG1      ILE  61   5.018  -3.427  -5.577
  469   1HG2  ILE  61          1HG2      ILE  61   3.329  -6.837  -4.812
  470   2HG2  ILE  61          2HG2      ILE  61   2.246  -5.477  -5.109
  471   3HG2  ILE  61          3HG2      ILE  61   2.522  -6.044  -3.462
  472   1HD1  ILE  61          1HD1      ILE  61   4.896  -6.092  -6.925
  473   2HD1  ILE  61          2HD1      ILE  61   6.078  -5.868  -5.636
  474   3HD1  ILE  61          3HD1      ILE  61   6.113  -4.824  -7.056
  475    H    ASP  62           H        ASP  62   5.168  -4.805  -1.519
  476    HA   ASP  62           HA       ASP  62   3.311  -6.265  -0.058
  477   1HB   ASP  62          2HB       ASP  62   5.847  -6.238   0.216
  478   2HB   ASP  62          1HB       ASP  62   5.624  -4.809   1.226
  479    H    GLU  63           H        GLU  63   4.089  -2.824   0.139
  480    HA   GLU  63           HA       GLU  63   2.551  -2.332   2.515
  481   1HB   GLU  63          2HB       GLU  63   3.862  -0.593   0.448
  482   2HB   GLU  63          1HB       GLU  63   2.754   0.110   1.627
  483   1HG   GLU  63          2HG       GLU  63   4.174  -1.213   3.379
  484   2HG   GLU  63          1HG       GLU  63   5.388  -1.267   2.101
  485    H    VAL  64           H        VAL  64   2.004  -1.521  -0.936
  486    HA   VAL  64           HA       VAL  64  -0.615  -0.505  -0.532
  487    HB   VAL  64           HB       VAL  64   0.726   0.065  -2.512
  488   1HG1  VAL  64          1HG1      VAL  64   1.091  -1.521  -4.298
  489   2HG1  VAL  64          2HG1      VAL  64   0.146  -2.753  -3.462
  490   3HG1  VAL  64          3HG1      VAL  64   1.699  -2.236  -2.806
  491   1HG2  VAL  64          1HG2      VAL  64  -1.660  -1.397  -3.595
  492   2HG2  VAL  64          2HG2      VAL  64  -1.093   0.235  -3.950
  493   3HG2  VAL  64          3HG2      VAL  64  -1.912  -0.101  -2.425
  494    H    ASP  65           H        ASP  65   0.561  -3.751  -1.371
  495    HA   ASP  65           HA       ASP  65  -2.053  -4.838  -1.849
  496   1HB   ASP  65          2HB       ASP  65   0.583  -5.724  -2.222
  497   2HB   ASP  65          1HB       ASP  65  -0.092  -6.810  -1.013
  498    H    GLU  66           H        GLU  66  -3.491  -4.797  -0.240
  499    HA   GLU  66           HA       GLU  66  -2.826  -4.917   2.537
  500   1HB   GLU  66          2HB       GLU  66  -5.523  -5.491   1.286
  501   2HB   GLU  66          1HB       GLU  66  -5.206  -4.988   2.945
  502   1HG   GLU  66          2HG       GLU  66  -4.203  -3.233   0.740
  503   2HG   GLU  66          1HG       GLU  66  -5.932  -3.228   1.076
  504    H    ASP  67           H        ASP  67  -4.137  -7.252   0.225
  505    HA   ASP  67           HA       ASP  67  -4.234  -9.392   2.173
  506   1HB   ASP  67          2HB       ASP  67  -4.778 -10.800   0.115
  507   2HB   ASP  67          1HB       ASP  67  -5.923  -9.521   0.512
  508    H    GLY  68           H        GLY  68  -2.121  -8.432  -0.504
  509   1HA   GLY  68          2HA       GLY  68   0.077  -9.003  -0.939
  510   2HA   GLY  68          1HA       GLY  68   0.103  -9.880   0.590
  511    H    SER  69           H        SER  69  -1.896 -10.227  -2.329
  512    HA   SER  69           HA       SER  69  -1.626 -13.111  -2.270
  513   1HB   SER  69          2HB       SER  69  -3.090 -13.005  -4.300
  514   2HB   SER  69          1HB       SER  69  -3.771 -12.204  -2.888
  515    HG   SER  69           HG       SER  69  -3.822 -10.467  -4.059
  516    H    GLY  70           H        GLY  70   0.352 -10.693  -3.513
  517   1HA   GLY  70          2HA       GLY  70   2.297 -10.961  -4.769
  518   2HA   GLY  70          1HA       GLY  70   1.770 -12.585  -5.202
  519    H    THR  71           H        THR  71  -0.591 -10.115  -5.565
  520    HA   THR  71           HA       THR  71   0.045  -9.635  -8.385
  521    HB   THR  71           HB       THR  71  -2.140 -10.299  -9.166
  522    HG1  THR  71           HG1      THR  71  -3.731 -10.884  -7.818
  523   1HG2  THR  71          1HG2      THR  71  -0.446 -12.090  -8.987
  524   2HG2  THR  71          2HG2      THR  71  -2.074 -12.721  -8.729
  525   3HG2  THR  71          3HG2      THR  71  -1.005 -12.448  -7.352
  526    H    VAL  72           H        VAL  72  -0.461  -7.598  -8.992
  527    HA   VAL  72           HA       VAL  72  -1.679  -5.867  -6.971
  528    HB   VAL  72           HB       VAL  72  -0.603  -4.987  -9.649
  529   1HG1  VAL  72          1HG1      VAL  72  -0.801  -3.563  -6.980
  530   2HG1  VAL  72          2HG1      VAL  72  -2.001  -3.423  -8.265
  531   3HG1  VAL  72          3HG1      VAL  72  -0.354  -2.851  -8.530
  532   1HG2  VAL  72          1HG2      VAL  72   1.189  -6.238  -8.560
  533   2HG2  VAL  72          2HG2      VAL  72   0.890  -5.392  -7.038
  534   3HG2  VAL  72          3HG2      VAL  72   1.526  -4.510  -8.426
  535    H    ASP  73           H        ASP  73  -3.737  -5.340  -7.007
  536    HA   ASP  73           HA       ASP  73  -5.406  -5.923  -9.329
  537   1HB   ASP  73          2HB       ASP  73  -5.833  -5.605  -6.493
  538   2HB   ASP  73          1HB       ASP  73  -6.873  -4.483  -7.368
  539    H    PHE  74           H        PHE  74  -6.945  -4.140 -10.089
  540    HA   PHE  74           HA       PHE  74  -5.444  -1.923 -10.960
  541   1HB   PHE  74          2HB       PHE  74  -7.591  -2.815 -12.009
  542   2HB   PHE  74          1HB       PHE  74  -8.455  -1.902 -10.771
  543    HD1  PHE  74           HD1      PHE  74  -5.322  -1.139 -12.667
  544    HD2  PHE  74           HD2      PHE  74  -9.380  -0.021 -11.828
  545    HE1  PHE  74           HE1      PHE  74  -5.028   0.927 -13.998
  546    HE2  PHE  74           HE2      PHE  74  -9.085   2.047 -13.160
  547    HZ   PHE  74           HZ       PHE  74  -6.911   2.521 -14.246
  548    H    ASP  75           H        ASP  75  -7.498  -2.381  -8.137
  549    HA   ASP  75           HA       ASP  75  -7.637   0.359  -7.349
  550   1HB   ASP  75          2HB       ASP  75  -9.045  -1.653  -6.496
  551   2HB   ASP  75          1HB       ASP  75  -7.691  -1.940  -5.402
  552    H    GLU  76           H        GLU  76  -5.462  -2.335  -6.558
  553    HA   GLU  76           HA       GLU  76  -3.820  -0.833  -4.739
  554   1HB   GLU  76          2HB       GLU  76  -3.156  -3.388  -6.232
  555   2HB   GLU  76          1HB       GLU  76  -2.319  -2.758  -4.814
  556   1HG   GLU  76          2HG       GLU  76  -4.302  -3.044  -3.440
  557   2HG   GLU  76          1HG       GLU  76  -5.264  -3.495  -4.846
  558    H    PHE  77           H        PHE  77  -3.882  -1.392  -8.184
  559    HA   PHE  77           HA       PHE  77  -1.232  -0.627  -8.835
  560   1HB   PHE  77          2HB       PHE  77  -3.226  -1.724 -10.254
  561   2HB   PHE  77          1HB       PHE  77  -3.468  -0.050 -10.726
  562    HD1  PHE  77           HD1      PHE  77  -2.957  -0.846 -13.036
  563    HD2  PHE  77           HD2      PHE  77  -0.023  -0.960  -9.889
  564    HE1  PHE  77           HE1      PHE  77  -1.151  -1.074 -14.712
  565    HE2  PHE  77           HE2      PHE  77   1.770  -1.175 -11.575
  566    HZ   PHE  77           HZ       PHE  77   1.210  -1.238 -13.987
  567    H    LEU  78           H        LEU  78  -4.306   1.182  -8.965
  568    HA   LEU  78           HA       LEU  78  -3.104   3.685  -9.624
  569   1HB   LEU  78          2HB       LEU  78  -5.804   2.780  -8.753
  570   2HB   LEU  78          1HB       LEU  78  -5.420   4.484  -8.601
  571    HG   LEU  78           HG       LEU  78  -5.284   4.784 -10.920
  572   1HD1  LEU  78          1HD1      LEU  78  -3.736   2.866 -11.318
  573   2HD1  LEU  78          2HD1      LEU  78  -5.001   2.984 -12.539
  574   3HD1  LEU  78          3HD1      LEU  78  -5.121   1.775 -11.260
  575   1HD2  LEU  78          1HD2      LEU  78  -7.332   2.590 -10.478
  576   2HD2  LEU  78          2HD2      LEU  78  -7.313   3.705 -11.845
  577   3HD2  LEU  78          3HD2      LEU  78  -7.590   4.315 -10.214
  578    H    VAL  79           H        VAL  79  -3.966   2.101  -6.585
  579    HA   VAL  79           HA       VAL  79  -3.669   4.326  -4.860
  580    HB   VAL  79           HB       VAL  79  -3.635   1.355  -4.531
  581   1HG1  VAL  79          1HG1      VAL  79  -3.073   1.608  -2.123
  582   2HG1  VAL  79          2HG1      VAL  79  -2.668   3.302  -2.416
  583   3HG1  VAL  79          3HG1      VAL  79  -1.719   2.021  -3.177
  584   1HG2  VAL  79          1HG2      VAL  79  -5.673   2.917  -4.454
  585   2HG2  VAL  79          2HG2      VAL  79  -5.039   3.485  -2.909
  586   3HG2  VAL  79          3HG2      VAL  79  -5.490   1.792  -3.107
  587    H    MET  80           H        MET  80  -1.379   1.812  -5.892
  588    HA   MET  80           HA       MET  80   0.895   2.451  -4.507
  589   1HB   MET  80          2HB       MET  80   0.308   0.843  -6.689
  590   2HB   MET  80          1HB       MET  80   1.503   1.973  -7.321
  591   1HG   MET  80          2HG       MET  80   2.620   1.381  -4.913
  592   2HG   MET  80          1HG       MET  80   1.800  -0.139  -5.267
  593   1HE   MET  80          1HE       MET  80   2.122  -1.560  -7.345
  594   2HE   MET  80          2HE       MET  80   3.155  -1.160  -8.714
  595   3HE   MET  80          3HE       MET  80   1.728  -0.183  -8.381
  596    H    MET  81           H        MET  81  -0.571   4.319  -7.099
  597    HA   MET  81           HA       MET  81   1.662   5.887  -7.849
  598   1HB   MET  81          2HB       MET  81  -0.828   5.711  -8.811
  599   2HB   MET  81          1HB       MET  81  -1.044   7.139  -7.799
  600   1HG   MET  81          2HG       MET  81   1.182   7.945  -8.933
  601   2HG   MET  81          1HG       MET  81   0.767   6.756 -10.168
  602   1HE   MET  81          1HE       MET  81  -2.359   7.575 -11.662
  603   2HE   MET  81          2HE       MET  81  -2.896   7.365  -9.997
  604   3HE   MET  81          3HE       MET  81  -1.605   6.351 -10.630
  605    H    VAL  82           H        VAL  82  -0.997   6.586  -5.568
  606    HA   VAL  82           HA       VAL  82   0.232   8.972  -4.548
  607    HB   VAL  82           HB       VAL  82  -1.511   8.851  -2.783
  608   1HG1  VAL  82          1HG1      VAL  82  -2.467   8.354  -5.617
  609   2HG1  VAL  82          2HG1      VAL  82  -2.018   9.915  -4.930
  610   3HG1  VAL  82          3HG1      VAL  82  -3.443   9.064  -4.331
  611   1HG2  VAL  82          1HG2      VAL  82  -3.088   7.057  -2.703
  612   2HG2  VAL  82          2HG2      VAL  82  -1.498   6.295  -2.760
  613   3HG2  VAL  82          3HG2      VAL  82  -2.490   6.373  -4.217
  614    H    ARG  83           H        ARG  83   0.349   5.574  -3.716
  615    HA   ARG  83           HA       ARG  83   1.393   5.823  -1.081
  616   1HB   ARG  83          2HB       ARG  83   1.728   3.589  -3.104
  617   2HB   ARG  83          1HB       ARG  83   2.170   3.483  -1.400
  618   1HG   ARG  83          2HG       ARG  83  -0.624   4.223  -2.285
  619   2HG   ARG  83          1HG       ARG  83  -0.131   2.548  -2.042
  620   1HD   ARG  83          2HD       ARG  83   0.586   4.392   0.152
  621   2HD   ARG  83          1HD       ARG  83  -1.142   4.147  -0.074
  622    HE   ARG  83           HE       ARG  83  -0.146   1.608  -0.097
  623   1HH1  ARG  83          2HH1      ARG  83   0.198   4.326   2.068
  624   2HH1  ARG  83          1HH1      ARG  83   0.390   3.342   3.476
  625   1HH2  ARG  83          1HH2      ARG  83   0.109   0.337   1.768
  626   2HH2  ARG  83          2HH2      ARG  83   0.342   1.092   3.309
  627    H    CYS  84           H        CYS  84   2.878   5.578  -4.287
  628    HA   CYS  84           HA       CYS  84   5.588   5.518  -3.366
  629   1HB   CYS  84          2HB       CYS  84   4.673   4.814  -5.680
  630   2HB   CYS  84          1HB       CYS  84   4.737   6.531  -6.075
  631    HG   CYS  84           HG       CYS  84   7.133   4.688  -5.913
  632    H    MET  85           H        MET  85   3.399   8.077  -4.496
  633    HA   MET  85           HA       MET  85   5.343  10.184  -4.328
  634   1HB   MET  85          2HB       MET  85   2.336  10.135  -4.554
  635   2HB   MET  85          1HB       MET  85   3.228  11.646  -4.365
  636   1HG   MET  85          2HG       MET  85   4.645  10.911  -6.352
  637   2HG   MET  85          1HG       MET  85   3.459   9.630  -6.609
  638   1HE   MET  85          1HE       MET  85   3.869  12.935  -8.701
  639   2HE   MET  85          2HE       MET  85   2.882  11.675  -9.439
  640   3HE   MET  85          3HE       MET  85   4.338  11.236  -8.550
  641    H    LYS  86           H        LYS  86   2.979   8.769  -2.146
  642    HA   LYS  86           HA       LYS  86   2.783   8.865   0.136
  643   1HB   LYS  86          2HB       LYS  86   5.422   9.811  -0.245
  644   2HB   LYS  86          1HB       LYS  86   4.641  10.935   0.868
  645   1HG   LYS  86          2HG       LYS  86   4.545   7.923   1.188
  646   2HG   LYS  86          1HG       LYS  86   5.734   8.951   1.989
  647   1HD   LYS  86          2HD       LYS  86   3.696  10.291   2.858
  648   2HD   LYS  86          1HD       LYS  86   2.742   8.885   2.382
  649   1HE   LYS  86          2HE       LYS  86   3.936   7.451   3.873
  650   2HE   LYS  86          1HE       LYS  86   5.183   8.664   4.155
  651   1HZ   LYS  86          1HZ       LYS  86   3.660  10.017   5.331
  652   2HZ   LYS  86          2HZ       LYS  86   3.492   8.447   5.956
  653   3HZ   LYS  86          3HZ       LYS  86   2.334   9.063   4.876
  654    H    ASP  87           H        ASP  87   1.310   9.908   1.298
  655    HA   ASP  87           HA       ASP  87  -0.066  12.138   0.278
  656   1HB   ASP  87          2HB       ASP  87  -1.233  12.191   2.467
  657   2HB   ASP  87          1HB       ASP  87  -1.161  10.570   1.782
  658    H    ASP  88           H        ASP  88   2.494  11.913   2.715
  659    HA   ASP  88           HA       ASP  88   3.083  14.736   2.384
  660   1HB   ASP  88          2HB       ASP  88   1.267  14.471   4.228
  661   2HB   ASP  88          1HB       ASP  88   2.579  13.815   5.205
  662    H    SER  89           HN       SER  89   3.696  12.102   4.731
  663    HA   SER  89           HA       SER  89   5.626  11.109   5.460
  664   1HB   SER  89          2HB       SER  89   5.871  11.078   2.791
  665   2HB   SER  89          1HB       SER  89   7.241  12.116   3.171
  666    HG   SER  89           HG       SER  89   8.209  10.491   4.156
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  -4.784   2.916  10.395
    2   2H    MET   1          2H        MET   1  -5.574   3.459  11.797
    3   3H    MET   1          3H        MET   1  -4.141   4.212  11.281
    4    HA   MET   1           HA       MET   1  -6.734   4.226   9.829
    5   1HB   MET   1          2HB       MET   1  -6.290   5.650  12.020
    6   2HB   MET   1          1HB       MET   1  -5.360   6.662  10.917
    7   1HG   MET   1          2HG       MET   1  -7.479   6.531   9.395
    8   2HG   MET   1          1HG       MET   1  -8.305   6.036  10.873
    9   1HE   MET   1          1HE       MET   1  -7.586   7.248  13.160
   10   2HE   MET   1          2HE       MET   1  -9.206   7.663  12.608
   11   3HE   MET   1          3HE       MET   1  -8.151   8.922  13.242
   12    H    ASN   2           H        ASN   2  -5.974   3.760   7.799
   13    HA   ASN   2           HA       ASN   2  -4.146   5.746   6.614
   14   1HB   ASN   2          2HB       ASN   2  -3.803   2.768   6.641
   15   2HB   ASN   2          1HB       ASN   2  -3.285   3.676   5.220
   16   1HD2  ASN   2          1HD2      ASN   2  -2.001   5.841   5.973
   17   2HD2  ASN   2          2HD2      ASN   2  -0.809   5.557   7.148
   18    H    ASP   3           H        ASP   3  -6.599   6.273   6.214
   19    HA   ASP   3           HA       ASP   3  -7.494   4.930   3.735
   20   1HB   ASP   3          2HB       ASP   3  -9.018   6.530   5.799
   21   2HB   ASP   3          1HB       ASP   3  -9.707   6.030   4.256
   22    H    ILE   4           H        ILE   4  -5.499   7.286   4.225
   23    HA   ILE   4           HA       ILE   4  -6.768   9.535   2.943
   24    HB   ILE   4           HB       ILE   4  -4.528  10.544   2.915
   25   1HG1  ILE   4          2HG1      ILE   4  -2.844   8.945   4.324
   26   2HG1  ILE   4          1HG1      ILE   4  -3.729   7.722   3.414
   27   1HG2  ILE   4          1HG2      ILE   4  -4.112  10.450   5.389
   28   2HG2  ILE   4          2HG2      ILE   4  -5.292   9.143   5.491
   29   3HG2  ILE   4          3HG2      ILE   4  -5.798  10.749   4.966
   30   1HD1  ILE   4          1HD1      ILE   4  -1.937   8.292   1.989
   31   2HD1  ILE   4          2HD1      ILE   4  -2.069  10.009   2.360
   32   3HD1  ILE   4          3HD1      ILE   4  -3.287   9.228   1.352
   33    H    TYR   5           H        TYR   5  -4.825   6.801   1.925
   34    HA   TYR   5           HA       TYR   5  -4.201   7.752  -0.696
   35   1HB   TYR   5          2HB       TYR   5  -4.374   4.912   0.352
   36   2HB   TYR   5          1HB       TYR   5  -3.663   5.388  -1.190
   37    HD1  TYR   5           HD1      TYR   5  -1.719   7.065  -1.161
   38    HD2  TYR   5           HD2      TYR   5  -3.100   5.002   2.345
   39    HE1  TYR   5           HE1      TYR   5   0.425   7.564  -0.022
   40    HE2  TYR   5           HE2      TYR   5  -0.954   5.499   3.484
   41    HH   TYR   5           HH       TYR   5   0.893   7.447   3.158
   42    H    LYS   6           H        LYS   6  -6.919   6.042   0.727
   43    HA   LYS   6           HA       LYS   6  -8.155   5.227  -1.711
   44   1HB   LYS   6          2HB       LYS   6  -8.653   4.871   1.034
   45   2HB   LYS   6          1HB       LYS   6 -10.075   5.696   0.397
   46   1HG   LYS   6          2HG       LYS   6 -10.445   3.327   0.134
   47   2HG   LYS   6          1HG       LYS   6 -10.120   3.988  -1.468
   48   1HD   LYS   6          2HD       LYS   6  -8.731   2.106  -1.438
   49   2HD   LYS   6          1HD       LYS   6  -7.626   3.379  -0.922
   50   1HE   LYS   6          2HE       LYS   6  -7.203   1.980   0.825
   51   2HE   LYS   6          1HE       LYS   6  -8.706   2.633   1.475
   52   1HZ   LYS   6          1HZ       LYS   6  -8.465   0.186  -0.194
   53   2HZ   LYS   6          2HZ       LYS   6  -9.909   0.814   0.445
   54   3HZ   LYS   6          3HZ       LYS   6  -8.706   0.215   1.484
   55    H    ALA   7           H        ALA   7  -8.022   8.254  -0.004
   56    HA   ALA   7           HA       ALA   7 -10.412   9.410  -1.052
   57   1HB   ALA   7          1HB       ALA   7  -9.650  11.455  -0.149
   58   2HB   ALA   7          2HB       ALA   7  -7.957  10.972  -0.260
   59   3HB   ALA   7          3HB       ALA   7  -9.009  10.227   0.943
   60    H    ALA   8           H        ALA   8  -7.073   9.193  -2.199
   61    HA   ALA   8           HA       ALA   8  -7.394  11.069  -4.352
   62   1HB   ALA   8          1HB       ALA   8  -5.226  10.309  -5.107
   63   2HB   ALA   8          2HB       ALA   8  -5.333   8.867  -4.094
   64   3HB   ALA   8          3HB       ALA   8  -5.177  10.459  -3.350
   65    H    VAL   9           H        VAL   9  -7.485   7.525  -4.087
   66    HA   VAL   9           HA       VAL   9  -7.887   7.059  -6.873
   67    HB   VAL   9           HB       VAL   9  -7.052   5.358  -5.201
   68   1HG1  VAL   9          1HG1      VAL   9 -10.001   5.227  -4.502
   69   2HG1  VAL   9          2HG1      VAL   9  -8.699   5.747  -3.434
   70   3HG1  VAL   9          3HG1      VAL   9  -8.778   4.072  -3.974
   71   1HG2  VAL   9          1HG2      VAL   9  -8.078   4.917  -7.551
   72   2HG2  VAL   9          2HG2      VAL   9  -9.479   4.321  -6.662
   73   3HG2  VAL   9          3HG2      VAL   9  -7.907   3.550  -6.451
   74    H    GLU  10           H        GLU  10  -9.979   8.096  -4.326
   75    HA   GLU  10           HA       GLU  10 -12.433   7.234  -5.602
   76   1HB   GLU  10          2HB       GLU  10 -11.741   8.783  -3.137
   77   2HB   GLU  10          1HB       GLU  10 -13.365   8.938  -3.810
   78   1HG   GLU  10          2HG       GLU  10 -12.167   6.206  -3.429
   79   2HG   GLU  10          1HG       GLU  10 -12.874   7.049  -2.052
   80    H    GLN  11           H        GLN  11 -10.323   9.999  -5.759
   81    HA   GLN  11           HA       GLN  11 -12.293  11.343  -7.513
   82   1HB   GLN  11          2HB       GLN  11 -11.618  13.516  -6.657
   83   2HB   GLN  11          1HB       GLN  11 -12.172  12.510  -5.320
   84   1HG   GLN  11          2HG       GLN  11  -9.702  11.871  -4.994
   85   2HG   GLN  11          1HG       GLN  11  -9.330  13.219  -6.066
   86   1HE2  GLN  11          1HE2      GLN  11 -10.734  12.392  -2.899
   87   2HE2  GLN  11          2HE2      GLN  11 -10.666  13.969  -2.276
   88    H    LEU  12           H        LEU  12 -10.017   9.567  -8.121
   89    HA   LEU  12           HA       LEU  12  -7.791  11.077  -9.046
   90   1HB   LEU  12          2HB       LEU  12  -7.576   8.995 -10.636
   91   2HB   LEU  12          1HB       LEU  12  -7.205   8.885  -8.933
   92    HG   LEU  12           HG       LEU  12  -9.265   7.750  -8.483
   93   1HD1  LEU  12          1HD1      LEU  12 -10.873   8.857  -9.826
   94   2HD1  LEU  12          2HD1      LEU  12 -10.796   7.226 -10.492
   95   3HD1  LEU  12          3HD1      LEU  12  -9.968   8.551 -11.309
   96   1HD2  LEU  12          1HD2      LEU  12  -8.877   5.730  -9.658
   97   2HD2  LEU  12          2HD2      LEU  12  -7.310   6.541  -9.650
   98   3HD2  LEU  12          3HD2      LEU  12  -8.316   6.580 -11.098
   99    H    THR  13           H        THR  13  -7.200  10.763 -11.527
  100    HA   THR  13           HA       THR  13  -9.323  12.158 -13.025
  101    HB   THR  13           HB       THR  13  -7.087  12.312 -14.602
  102    HG1  THR  13           HG1      THR  13  -5.770  11.383 -13.042
  103   1HG2  THR  13          1HG2      THR  13  -8.419  14.051 -12.603
  104   2HG2  THR  13          2HG2      THR  13  -8.119  14.323 -14.320
  105   3HG2  THR  13          3HG2      THR  13  -6.822  14.563 -13.150
  106    H    ASP  14           H        ASP  14  -9.109  11.764 -15.486
  107    HA   ASP  14           HA       ASP  14  -9.722   9.003 -15.984
  108   1HB   ASP  14          2HB       ASP  14  -9.357  11.368 -17.839
  109   2HB   ASP  14          1HB       ASP  14  -9.837   9.762 -18.387
  110    H    GLU  15           H        GLU  15  -6.935  11.090 -16.369
  111    HA   GLU  15           HA       GLU  15  -5.385   9.533 -18.130
  112   1HB   GLU  15          2HB       GLU  15  -3.496  10.801 -17.363
  113   2HB   GLU  15          1HB       GLU  15  -4.882  11.889 -17.388
  114   1HG   GLU  15          2HG       GLU  15  -5.193  11.244 -14.905
  115   2HG   GLU  15          1HG       GLU  15  -3.552  10.607 -15.000
  116    H    GLN  16           H        GLN  16  -5.925   9.305 -14.651
  117    HA   GLN  16           HA       GLN  16  -3.857   7.404 -14.105
  118   1HB   GLN  16          2HB       GLN  16  -6.218   8.491 -12.652
  119   2HB   GLN  16          1HB       GLN  16  -5.608   6.923 -12.121
  120   1HG   GLN  16          2HG       GLN  16  -3.296   7.971 -12.048
  121   2HG   GLN  16          1HG       GLN  16  -4.082   9.532 -12.290
  122   1HE2  GLN  16          1HE2      GLN  16  -5.158  10.486 -10.485
  123   2HE2  GLN  16          2HE2      GLN  16  -5.210   9.764  -8.950
  124    H    LYS  17           H        LYS  17  -7.248   7.187 -15.041
  125    HA   LYS  17           HA       LYS  17  -7.471   4.346 -14.697
  126   1HB   LYS  17          2HB       LYS  17  -9.204   6.208 -16.341
  127   2HB   LYS  17          1HB       LYS  17  -9.618   4.569 -15.841
  128   1HG   LYS  17          2HG       LYS  17  -9.039   6.859 -13.937
  129   2HG   LYS  17          1HG       LYS  17 -10.652   6.292 -14.372
  130   1HD   LYS  17          2HD       LYS  17  -9.629   3.944 -13.635
  131   2HD   LYS  17          1HD       LYS  17  -8.573   4.981 -12.679
  132   1HE   LYS  17          2HE       LYS  17 -10.295   4.802 -11.169
  133   2HE   LYS  17          1HE       LYS  17 -10.929   6.151 -12.111
  134   1HZ   LYS  17          1HZ       LYS  17 -11.563   3.280 -12.548
  135   2HZ   LYS  17          2HZ       LYS  17 -12.166   4.577 -13.467
  136   3HZ   LYS  17          3HZ       LYS  17 -12.588   4.423 -11.828
  137    H    ASN  18           H        ASN  18  -5.849   6.175 -17.017
  138    HA   ASN  18           HA       ASN  18  -6.088   3.996 -19.003
  139   1HB   ASN  18          2HB       ASN  18  -5.927   6.969 -19.332
  140   2HB   ASN  18          1HB       ASN  18  -5.247   5.927 -20.584
  141   1HD2  ASN  18          1HD2      ASN  18  -8.246   7.001 -19.080
  142   2HD2  ASN  18          2HD2      ASN  18  -9.286   6.208 -20.162
  143    H    GLU  19           H        GLU  19  -3.925   6.127 -17.239
  144    HA   GLU  19           HA       GLU  19  -1.530   5.556 -18.644
  145   1HB   GLU  19          2HB       GLU  19  -1.846   7.421 -16.976
  146   2HB   GLU  19          1HB       GLU  19  -1.770   6.209 -15.697
  147   1HG   GLU  19          2HG       GLU  19   0.465   5.486 -16.706
  148   2HG   GLU  19          1HG       GLU  19   0.394   6.961 -17.673
  149    H    PHE  20           H        PHE  20  -2.842   4.190 -15.620
  150    HA   PHE  20           HA       PHE  20  -0.844   2.088 -15.582
  151   1HB   PHE  20          2HB       PHE  20  -3.150   2.846 -13.818
  152   2HB   PHE  20          1HB       PHE  20  -2.386   1.267 -13.655
  153    HD1  PHE  20           HD1      PHE  20  -1.931   4.901 -13.306
  154    HD2  PHE  20           HD2      PHE  20  -0.063   1.053 -12.886
  155    HE1  PHE  20           HE1      PHE  20  -0.112   5.925 -11.970
  156    HE2  PHE  20           HE2      PHE  20   1.743   2.074 -11.539
  157    HZ   PHE  20           HZ       PHE  20   1.726   4.513 -11.087
  158    H    LYS  21           H        LYS  21  -4.273   2.425 -16.447
  159    HA   LYS  21           HA       LYS  21  -4.944  -0.304 -16.563
  160   1HB   LYS  21          2HB       LYS  21  -6.584   1.558 -16.710
  161   2HB   LYS  21          1HB       LYS  21  -6.016   1.891 -18.342
  162   1HG   LYS  21          2HG       LYS  21  -6.736  -0.933 -17.808
  163   2HG   LYS  21          1HG       LYS  21  -8.082   0.206 -17.774
  164   1HD   LYS  21          2HD       LYS  21  -6.146   0.471 -20.026
  165   2HD   LYS  21          1HD       LYS  21  -7.226  -0.924 -20.057
  166   1HE   LYS  21          2HE       LYS  21  -9.005   0.355 -20.600
  167   2HE   LYS  21          1HE       LYS  21  -8.643   1.518 -19.326
  168   1HZ   LYS  21          1HZ       LYS  21  -8.508   2.496 -21.549
  169   2HZ   LYS  21          2HZ       LYS  21  -7.280   1.398 -21.962
  170   3HZ   LYS  21          3HZ       LYS  21  -7.016   2.555 -20.745
  171    H    ALA  22           H        ALA  22  -3.237   1.751 -18.863
  172    HA   ALA  22           HA       ALA  22  -3.391   0.104 -21.142
  173   1HB   ALA  22          1HB       ALA  22  -1.028   1.810 -20.318
  174   2HB   ALA  22          2HB       ALA  22  -2.477   2.446 -21.098
  175   3HB   ALA  22          3HB       ALA  22  -1.446   1.298 -21.954
  176    H    ALA  23           H        ALA  23  -0.836   0.309 -18.662
  177    HA   ALA  23           HA       ALA  23   0.615  -1.964 -19.595
  178   1HB   ALA  23          1HB       ALA  23   0.942  -1.437 -16.749
  179   2HB   ALA  23          2HB       ALA  23   1.044   0.046 -17.698
  180   3HB   ALA  23          3HB       ALA  23   2.122  -1.304 -18.054
  181    H    PHE  24           H        PHE  24  -1.905  -1.429 -17.197
  182    HA   PHE  24           HA       PHE  24  -1.881  -3.929 -15.912
  183   1HB   PHE  24          2HB       PHE  24  -3.193  -1.794 -15.304
  184   2HB   PHE  24          1HB       PHE  24  -4.400  -2.360 -16.454
  185    HD1  PHE  24           HD1      PHE  24  -5.353  -4.731 -16.134
  186    HD2  PHE  24           HD2      PHE  24  -3.115  -2.662 -13.112
  187    HE1  PHE  24           HE1      PHE  24  -6.281  -6.245 -14.405
  188    HE2  PHE  24           HE2      PHE  24  -4.042  -4.171 -11.387
  189    HZ   PHE  24           HZ       PHE  24  -5.629  -5.957 -12.032
  190    H    ASP  25           H        ASP  25  -3.684  -2.828 -18.794
  191    HA   ASP  25           HA       ASP  25  -5.143  -5.234 -19.170
  192   1HB   ASP  25          2HB       ASP  25  -5.256  -2.765 -20.296
  193   2HB   ASP  25          1HB       ASP  25  -4.496  -3.681 -21.596
  194    H    ILE  26           H        ILE  26  -2.003  -4.167 -20.441
  195    HA   ILE  26           HA       ILE  26  -1.730  -6.414 -22.220
  196    HB   ILE  26           HB       ILE  26   0.615  -5.643 -22.494
  197   1HG1  ILE  26          2HG1      ILE  26  -0.161  -3.478 -20.513
  198   2HG1  ILE  26          1HG1      ILE  26   0.878  -4.844 -20.119
  199   1HG2  ILE  26          1HG2      ILE  26   0.027  -3.427 -23.452
  200   2HG2  ILE  26          2HG2      ILE  26  -1.509  -3.477 -22.586
  201   3HG2  ILE  26          3HG2      ILE  26  -1.172  -4.656 -23.853
  202   1HD1  ILE  26          1HD1      ILE  26   2.119  -2.737 -20.731
  203   2HD1  ILE  26          2HD1      ILE  26   1.461  -2.894 -22.360
  204   3HD1  ILE  26          3HD1      ILE  26   2.535  -4.138 -21.719
  205    H    PHE  27           H        PHE  27  -0.659  -5.702 -18.922
  206    HA   PHE  27           HA       PHE  27   1.034  -8.028 -18.752
  207   1HB   PHE  27          2HB       PHE  27  -0.025  -6.184 -16.597
  208   2HB   PHE  27          1HB       PHE  27   1.135  -7.484 -16.317
  209    HD1  PHE  27           HD1      PHE  27   2.723  -7.283 -18.877
  210    HD2  PHE  27           HD2      PHE  27   1.312  -4.244 -16.184
  211    HE1  PHE  27           HE1      PHE  27   4.552  -5.783 -19.612
  212    HE2  PHE  27           HE2      PHE  27   3.144  -2.745 -16.927
  213    HZ   PHE  27           HZ       PHE  27   4.760  -3.515 -18.639
  214    H    ILE  28           H        ILE  28  -2.334  -7.310 -17.917
  215    HA   ILE  28           HA       ILE  28  -2.615  -9.998 -16.742
  216    HB   ILE  28           HB       ILE  28  -4.771  -9.333 -15.943
  217   1HG1  ILE  28          2HG1      ILE  28  -5.249  -6.714 -16.579
  218   2HG1  ILE  28          1HG1      ILE  28  -4.527  -7.297 -18.079
  219   1HG2  ILE  28          1HG2      ILE  28  -4.208  -7.397 -14.565
  220   2HG2  ILE  28          2HG2      ILE  28  -2.885  -6.979 -15.652
  221   3HG2  ILE  28          3HG2      ILE  28  -2.809  -8.461 -14.700
  222   1HD1  ILE  28          1HD1      ILE  28  -6.228  -8.821 -18.470
  223   2HD1  ILE  28          2HD1      ILE  28  -7.131  -7.544 -17.652
  224   3HD1  ILE  28          3HD1      ILE  28  -6.624  -8.978 -16.757
  225    H    GLN  29           H        GLN  29  -2.505  -8.932 -19.772
  226    HA   GLN  29           HA       GLN  29  -4.815  -9.548 -21.139
  227   1HB   GLN  29          2HB       GLN  29  -2.843  -8.670 -22.263
  228   2HB   GLN  29          1HB       GLN  29  -1.957 -10.158 -21.934
  229   1HG   GLN  29          2HG       GLN  29  -3.471 -11.435 -23.336
  230   2HG   GLN  29          1HG       GLN  29  -4.505 -10.025 -23.569
  231   1HE2  GLN  29          1HE2      GLN  29  -3.179  -8.019 -24.493
  232   2HE2  GLN  29          2HE2      GLN  29  -2.088  -8.388 -25.739
  233    H    ASP  30           H        ASP  30  -2.365 -11.792 -19.903
  234    HA   ASP  30           HA       ASP  30  -4.049 -14.071 -20.749
  235   1HB   ASP  30          2HB       ASP  30  -1.108 -13.893 -20.070
  236   2HB   ASP  30          1HB       ASP  30  -1.958 -15.423 -20.292
  237    H    ALA  31           H        ALA  31  -4.444 -12.338 -18.323
  238    HA   ALA  31           HA       ALA  31  -3.929 -14.259 -16.154
  239   1HB   ALA  31          1HB       ALA  31  -4.378 -12.477 -14.625
  240   2HB   ALA  31          2HB       ALA  31  -5.063 -11.470 -15.901
  241   3HB   ALA  31          3HB       ALA  31  -3.333 -11.810 -15.879
  242    H    GLU  32           H        GLU  32  -5.637 -14.752 -14.659
  243    HA   GLU  32           HA       GLU  32  -8.361 -14.532 -15.788
  244   1HB   GLU  32          2HB       GLU  32  -8.787 -16.865 -14.951
  245   2HB   GLU  32          1HB       GLU  32  -7.654 -16.780 -16.298
  246   1HG   GLU  32          2HG       GLU  32  -6.473 -16.615 -13.568
  247   2HG   GLU  32          1HG       GLU  32  -7.138 -18.177 -14.042
  248    H    ASP  33           H        ASP  33  -7.202 -12.861 -13.826
  249    HA   ASP  33           HA       ASP  33  -8.949 -13.482 -11.539
  250   1HB   ASP  33          2HB       ASP  33  -6.417 -14.072 -11.191
  251   2HB   ASP  33          1HB       ASP  33  -6.238 -12.328 -11.006
  252    H    GLY  34           H        GLY  34  -6.834 -11.046 -13.059
  253   1HA   GLY  34          2HA       GLY  34  -7.765  -8.904 -13.744
  254   2HA   GLY  34          1HA       GLY  34  -8.815  -8.970 -12.331
  255    H    CYS  35           H        CYS  35  -5.347  -9.660 -12.599
  256    HA   CYS  35           HA       CYS  35  -4.550  -7.209 -11.286
  257   1HB   CYS  35          2HB       CYS  35  -3.470  -8.476  -9.365
  258   2HB   CYS  35          1HB       CYS  35  -5.224  -8.328  -9.291
  259    HG   CYS  35           HG       CYS  35  -4.280 -10.917 -10.645
  260    H    ILE  36           H        ILE  36  -2.284  -6.896 -11.313
  261    HA   ILE  36           HA       ILE  36  -0.914  -8.560 -13.292
  262    HB   ILE  36           HB       ILE  36   0.730  -6.842 -13.444
  263   1HG1  ILE  36          2HG1      ILE  36   0.074  -4.831 -11.634
  264   2HG1  ILE  36          1HG1      ILE  36  -0.086  -6.306 -10.679
  265   1HG2  ILE  36          1HG2      ILE  36  -2.001  -5.605 -12.992
  266   2HG2  ILE  36          2HG2      ILE  36  -1.368  -6.235 -14.512
  267   3HG2  ILE  36          3HG2      ILE  36  -0.656  -4.792 -13.791
  268   1HD1  ILE  36          1HD1      ILE  36   2.335  -5.635 -12.380
  269   2HD1  ILE  36          2HD1      ILE  36   2.170  -6.997 -11.270
  270   3HD1  ILE  36          3HD1      ILE  36   2.235  -5.351 -10.642
  271    H    SER  37           H        SER  37   1.500  -8.968 -12.832
  272    HA   SER  37           HA       SER  37   1.645 -10.399 -10.283
  273   1HB   SER  37          2HB       SER  37   2.419 -11.194 -12.731
  274   2HB   SER  37          1HB       SER  37   3.923 -10.454 -12.196
  275    HG   SER  37           HG       SER  37   2.707 -12.763 -11.388
  276    H    THR  38           H        THR  38   2.291  -9.223  -8.602
  277    HA   THR  38           HA       THR  38   3.674  -6.816  -8.591
  278    HB   THR  38           HB       THR  38   4.244  -7.286  -6.240
  279    HG1  THR  38           HG1      THR  38   3.227  -9.875  -6.807
  280   1HG2  THR  38          1HG2      THR  38   1.514  -7.886  -7.311
  281   2HG2  THR  38          2HG2      THR  38   2.065  -6.506  -6.364
  282   3HG2  THR  38          3HG2      THR  38   1.812  -8.066  -5.583
  283    H    LYS  39           H        LYS  39   4.972 -10.118  -8.459
  284    HA   LYS  39           HA       LYS  39   7.687  -9.446  -8.075
  285   1HB   LYS  39          2HB       LYS  39   8.106 -11.732  -9.133
  286   2HB   LYS  39          1HB       LYS  39   7.079 -11.708  -7.703
  287   1HG   LYS  39          2HG       LYS  39   5.445 -12.710  -8.878
  288   2HG   LYS  39          1HG       LYS  39   5.373 -11.309  -9.943
  289   1HD   LYS  39          2HD       LYS  39   5.935 -12.856 -11.524
  290   2HD   LYS  39          1HD       LYS  39   7.565 -12.507 -10.951
  291   1HE   LYS  39          2HE       LYS  39   7.515 -14.841 -10.825
  292   2HE   LYS  39          1HE       LYS  39   7.052 -14.386  -9.186
  293   1HZ   LYS  39          1HZ       LYS  39   4.711 -14.573  -9.878
  294   2HZ   LYS  39          2HZ       LYS  39   5.551 -16.045 -10.010
  295   3HZ   LYS  39          3HZ       LYS  39   5.216 -15.127 -11.401
  296    H    GLU  40           H        GLU  40   5.666  -9.459 -10.940
  297    HA   GLU  40           HA       GLU  40   8.020  -8.863 -12.627
  298   1HB   GLU  40          2HB       GLU  40   5.229  -9.791 -13.345
  299   2HB   GLU  40          1HB       GLU  40   6.425  -9.279 -14.535
  300   1HG   GLU  40          2HG       GLU  40   7.319 -11.294 -12.536
  301   2HG   GLU  40          1HG       GLU  40   6.170 -11.846 -13.755
  302    H    LEU  41           H        LEU  41   6.665  -6.981 -10.743
  303    HA   LEU  41           HA       LEU  41   5.078  -5.158 -12.258
  304   1HB   LEU  41          2HB       LEU  41   5.146  -5.369  -9.738
  305   2HB   LEU  41          1HB       LEU  41   6.670  -4.509  -9.788
  306    HG   LEU  41           HG       LEU  41   4.443  -3.179 -11.204
  307   1HD1  LEU  41          1HD1      LEU  41   3.133  -2.648  -9.362
  308   2HD1  LEU  41          2HD1      LEU  41   4.427  -2.991  -8.213
  309   3HD1  LEU  41          3HD1      LEU  41   3.560  -4.317  -8.988
  310   1HD2  LEU  41          1HD2      LEU  41   6.538  -2.345  -9.174
  311   2HD2  LEU  41          2HD2      LEU  41   5.411  -1.236  -9.954
  312   3HD2  LEU  41          3HD2      LEU  41   6.607  -2.099 -10.919
  313    H    GLY  42           H        GLY  42   8.495  -5.691 -12.066
  314   1HA   GLY  42          2HA       GLY  42   9.561  -3.157 -12.541
  315   2HA   GLY  42          1HA       GLY  42  10.262  -4.660 -13.131
  316    H    LYS  43           H        LYS  43   7.914  -5.372 -14.732
  317    HA   LYS  43           HA       LYS  43   8.594  -4.039 -17.168
  318   1HB   LYS  43          2HB       LYS  43   6.295  -5.898 -16.510
  319   2HB   LYS  43          1HB       LYS  43   6.717  -5.356 -18.135
  320   1HG   LYS  43          2HG       LYS  43   8.804  -6.647 -16.391
  321   2HG   LYS  43          1HG       LYS  43   7.655  -7.645 -17.283
  322   1HD   LYS  43          2HD       LYS  43   8.385  -5.988 -19.270
  323   2HD   LYS  43          1HD       LYS  43   9.859  -5.921 -18.304
  324   1HE   LYS  43          2HE       LYS  43  10.333  -8.167 -18.615
  325   2HE   LYS  43          1HE       LYS  43   8.638  -8.601 -18.832
  326   1HZ   LYS  43          1HZ       LYS  43   8.679  -7.478 -20.985
  327   2HZ   LYS  43          2HZ       LYS  43   9.820  -8.735 -20.917
  328   3HZ   LYS  43          3HZ       LYS  43  10.325  -7.119 -20.778
  329    H    VAL  44           H        VAL  44   6.258  -3.405 -14.674
  330    HA   VAL  44           HA       VAL  44   4.693  -1.647 -16.420
  331    HB   VAL  44           HB       VAL  44   2.955  -1.887 -14.997
  332   1HG1  VAL  44          1HG1      VAL  44   2.820  -3.989 -13.983
  333   2HG1  VAL  44          2HG1      VAL  44   4.509  -3.961 -13.474
  334   3HG1  VAL  44          3HG1      VAL  44   4.105  -4.219 -15.169
  335   1HG2  VAL  44          1HG2      VAL  44   4.994  -1.411 -12.838
  336   2HG2  VAL  44          2HG2      VAL  44   3.403  -2.034 -12.411
  337   3HG2  VAL  44          3HG2      VAL  44   3.547  -0.480 -13.232
  338    H    MET  45           H        MET  45   7.000  -1.563 -13.775
  339    HA   MET  45           HA       MET  45   6.764   1.132 -13.017
  340   1HB   MET  45          2HB       MET  45   8.882  -0.947 -12.814
  341   2HB   MET  45          1HB       MET  45   9.388   0.729 -12.617
  342   1HG   MET  45          2HG       MET  45   6.921   0.122 -11.160
  343   2HG   MET  45          1HG       MET  45   8.285  -0.864 -10.632
  344   1HE   MET  45          1HE       MET  45   7.151   2.940  -9.097
  345   2HE   MET  45          2HE       MET  45   6.295   1.686  -9.991
  346   3HE   MET  45          3HE       MET  45   6.992   3.053 -10.855
  347    H    ARG  46           H        ARG  46   8.566  -0.414 -15.661
  348    HA   ARG  46           HA       ARG  46  10.097   1.818 -16.458
  349   1HB   ARG  46          2HB       ARG  46  10.225   0.741 -18.686
  350   2HB   ARG  46          1HB       ARG  46  10.565  -0.385 -17.376
  351   1HG   ARG  46          2HG       ARG  46   8.363  -1.348 -17.528
  352   2HG   ARG  46          1HG       ARG  46   7.835  -0.099 -18.656
  353   1HD   ARG  46          2HD       ARG  46   9.435  -0.893 -20.329
  354   2HD   ARG  46          1HD       ARG  46  10.050  -2.095 -19.200
  355    HE   ARG  46           HE       ARG  46   8.187  -3.415 -19.649
  356   1HH1  ARG  46          2HH1      ARG  46   7.718  -0.186 -20.904
  357   2HH1  ARG  46          1HH1      ARG  46   6.272  -0.596 -21.759
  358   1HH2  ARG  46          1HH2      ARG  46   6.282  -3.922 -20.773
  359   2HH2  ARG  46          2HH2      ARG  46   5.460  -2.701 -21.687
  360    H    MET  47           H        MET  47   6.753   0.941 -17.111
  361    HA   MET  47           HA       MET  47   6.290   2.953 -19.105
  362   1HB   MET  47          2HB       MET  47   4.600   1.079 -17.511
  363   2HB   MET  47          1HB       MET  47   3.816   2.482 -18.236
  364   1HG   MET  47          2HG       MET  47   5.630   0.670 -19.831
  365   2HG   MET  47          1HG       MET  47   3.906   0.346 -19.665
  366   1HE   MET  47          1HE       MET  47   6.697   2.102 -20.921
  367   2HE   MET  47          2HE       MET  47   6.186   3.397 -21.999
  368   3HE   MET  47          3HE       MET  47   6.033   1.719 -22.515
  369    H    LEU  48           H        LEU  48   6.162   2.815 -15.599
  370    HA   LEU  48           HA       LEU  48   4.695   5.254 -15.221
  371   1HB   LEU  48          2HB       LEU  48   6.247   3.395 -13.489
  372   2HB   LEU  48          1HB       LEU  48   5.978   5.020 -12.901
  373    HG   LEU  48           HG       LEU  48   3.554   4.687 -13.032
  374   1HD1  LEU  48          1HD1      LEU  48   3.234   1.938 -13.366
  375   2HD1  LEU  48          2HD1      LEU  48   4.388   2.382 -14.623
  376   3HD1  LEU  48          3HD1      LEU  48   2.818   3.178 -14.549
  377   1HD2  LEU  48          1HD2      LEU  48   4.828   2.301 -11.666
  378   2HD2  LEU  48          2HD2      LEU  48   3.365   3.160 -11.185
  379   3HD2  LEU  48          3HD2      LEU  48   4.938   3.942 -11.028
  380    H    GLY  49           H        GLY  49   8.084   4.394 -15.623
  381   1HA   GLY  49          2HA       GLY  49   9.347   6.333 -16.674
  382   2HA   GLY  49          1HA       GLY  49   8.829   7.242 -15.265
  383    H    GLN  50           H        GLN  50   9.652   3.940 -14.589
  384    HA   GLN  50           HA       GLN  50  12.476   4.435 -14.161
  385   1HB   GLN  50          2HB       GLN  50  12.377   4.021 -11.696
  386   2HB   GLN  50          1HB       GLN  50  11.668   5.558 -12.181
  387   1HG   GLN  50          2HG       GLN  50   9.878   3.162 -12.014
  388   2HG   GLN  50          1HG       GLN  50  10.388   3.929 -10.512
  389   1HE2  GLN  50          1HE2      GLN  50  10.291   6.594 -10.908
  390   2HE2  GLN  50          2HE2      GLN  50   8.778   7.100 -11.485
  391    H    ASN  51           H        ASN  51  13.445   2.507 -12.833
  392    HA   ASN  51           HA       ASN  51  11.939   0.028 -13.155
  393   1HB   ASN  51          2HB       ASN  51  13.486   0.805 -15.280
  394   2HB   ASN  51          1HB       ASN  51  14.612  -0.195 -14.365
  395   1HD2  ASN  51          1HD2      ASN  51  13.423  -2.354 -13.500
  396   2HD2  ASN  51          2HD2      ASN  51  12.481  -3.147 -14.668
  397    HA   PRO  52           HA       PRO  52  14.717  -0.241  -9.548
  398   1HB   PRO  52          2HB       PRO  52  12.815  -1.267  -7.871
  399   2HB   PRO  52          1HB       PRO  52  13.012   0.463  -8.180
  400   1HG   PRO  52          2HG       PRO  52  10.904  -1.380  -9.106
  401   2HG   PRO  52          1HG       PRO  52  10.854   0.377  -8.904
  402   1HD   PRO  52          2HD       PRO  52  11.177  -1.067 -11.353
  403   2HD   PRO  52          1HD       PRO  52  11.282   0.695 -11.123
  404    H    THR  53           H        THR  53  14.312  -2.404  -7.791
  405    HA   THR  53           HA       THR  53  14.822  -4.718  -9.563
  406    HB   THR  53           HB       THR  53  16.290  -5.575  -7.950
  407    HG1  THR  53           HG1      THR  53  15.950  -5.378  -5.880
  408   1HG2  THR  53          1HG2      THR  53  17.754  -3.739  -7.243
  409   2HG2  THR  53          2HG2      THR  53  16.467  -2.577  -7.566
  410   3HG2  THR  53          3HG2      THR  53  17.191  -3.483  -8.896
  411    HA   PRO  54           HA       PRO  54  11.320  -6.816  -7.894
  412   1HB   PRO  54          2HB       PRO  54  12.232  -9.340  -7.330
  413   2HB   PRO  54          1HB       PRO  54  11.933  -8.736  -8.967
  414   1HG   PRO  54          2HG       PRO  54  14.511  -9.147  -7.551
  415   2HG   PRO  54          1HG       PRO  54  14.144  -9.246  -9.279
  416   1HD   PRO  54          2HD       PRO  54  15.400  -7.087  -8.010
  417   2HD   PRO  54          1HD       PRO  54  14.644  -7.032  -9.618
  418    H    GLU  55           H        GLU  55  14.211  -6.898  -5.918
  419    HA   GLU  55           HA       GLU  55  12.847  -7.669  -3.477
  420   1HB   GLU  55          2HB       GLU  55  15.653  -6.816  -4.158
  421   2HB   GLU  55          1HB       GLU  55  15.121  -6.906  -2.479
  422   1HG   GLU  55          2HG       GLU  55  14.534  -9.240  -4.255
  423   2HG   GLU  55          1HG       GLU  55  16.196  -9.019  -3.708
  424    H    GLU  56           H        GLU  56  13.958  -4.707  -5.062
  425    HA   GLU  56           HA       GLU  56  13.449  -2.992  -2.808
  426   1HB   GLU  56          2HB       GLU  56  15.046  -2.552  -4.783
  427   2HB   GLU  56          1HB       GLU  56  13.601  -2.088  -5.680
  428   1HG   GLU  56          2HG       GLU  56  13.152  -0.640  -3.477
  429   2HG   GLU  56          1HG       GLU  56  14.909  -0.735  -3.358
  430    H    LEU  57           H        LEU  57  11.767  -3.641  -5.896
  431    HA   LEU  57           HA       LEU  57   9.582  -1.908  -5.405
  432   1HB   LEU  57          2HB       LEU  57   8.533  -2.900  -7.269
  433   2HB   LEU  57          1HB       LEU  57  10.239  -2.840  -7.630
  434    HG   LEU  57           HG       LEU  57  10.227  -5.326  -6.783
  435   1HD1  LEU  57          1HD1      LEU  57   7.342  -4.624  -7.047
  436   2HD1  LEU  57          2HD1      LEU  57   8.119  -5.809  -5.996
  437   3HD1  LEU  57          3HD1      LEU  57   7.844  -6.184  -7.695
  438   1HD2  LEU  57          1HD2      LEU  57  10.782  -5.018  -9.032
  439   2HD2  LEU  57          2HD2      LEU  57   9.269  -4.190  -9.397
  440   3HD2  LEU  57          3HD2      LEU  57   9.286  -5.938  -9.173
  441    H    GLN  58           H        GLN  58  10.256  -5.203  -4.389
  442    HA   GLN  58           HA       GLN  58   7.676  -6.101  -3.790
  443   1HB   GLN  58          2HB       GLN  58  10.389  -6.860  -3.046
  444   2HB   GLN  58          1HB       GLN  58   9.247  -7.115  -1.728
  445   1HG   GLN  58          2HG       GLN  58   8.785  -8.073  -4.567
  446   2HG   GLN  58          1HG       GLN  58   9.456  -9.083  -3.287
  447   1HE2  GLN  58          1HE2      GLN  58   6.504  -7.824  -4.621
  448   2HE2  GLN  58          2HE2      GLN  58   5.459  -8.442  -3.435
  449    H    GLU  59           H        GLU  59   9.856  -4.017  -1.925
  450    HA   GLU  59           HA       GLU  59   8.359  -3.933   0.477
  451   1HB   GLU  59          2HB       GLU  59  10.435  -2.197  -0.789
  452   2HB   GLU  59          1HB       GLU  59   9.484  -1.514   0.530
  453   1HG   GLU  59          2HG       GLU  59  10.634  -4.258   0.879
  454   2HG   GLU  59          1HG       GLU  59  11.712  -2.869   1.027
  455    H    MET  60           H        MET  60   8.217  -2.028  -2.502
  456    HA   MET  60           HA       MET  60   6.256  -0.152  -1.636
  457   1HB   MET  60          2HB       MET  60   6.742  -1.094  -4.473
  458   2HB   MET  60          1HB       MET  60   6.001   0.424  -3.969
  459   1HG   MET  60          2HG       MET  60   8.166   1.006  -2.815
  460   2HG   MET  60          1HG       MET  60   8.878  -0.429  -3.551
  461   1HE   MET  60          1HE       MET  60   8.568   3.477  -4.279
  462   2HE   MET  60          2HE       MET  60  10.058   3.005  -5.093
  463   3HE   MET  60          3HE       MET  60   9.699   2.369  -3.490
  464    H    ILE  61           H        ILE  61   6.119  -3.303  -3.195
  465    HA   ILE  61           HA       ILE  61   3.355  -3.369  -3.792
  466    HB   ILE  61           HB       ILE  61   5.281  -5.630  -3.185
  467   1HG1  ILE  61          2HG1      ILE  61   5.861  -4.272  -5.166
  468   2HG1  ILE  61          1HG1      ILE  61   5.325  -5.881  -5.642
  469   1HG2  ILE  61          1HG2      ILE  61   3.603  -7.071  -4.312
  470   2HG2  ILE  61          2HG2      ILE  61   2.495  -5.701  -4.389
  471   3HG2  ILE  61          3HG2      ILE  61   2.968  -6.366  -2.826
  472   1HD1  ILE  61          1HD1      ILE  61   2.971  -4.371  -5.551
  473   2HD1  ILE  61          2HD1      ILE  61   3.842  -4.862  -7.003
  474   3HD1  ILE  61          3HD1      ILE  61   4.159  -3.287  -6.275
  475    H    ASP  62           H        ASP  62   5.159  -4.700  -1.003
  476    HA   ASP  62           HA       ASP  62   2.959  -5.674   0.434
  477   1HB   ASP  62          2HB       ASP  62   5.543  -5.887   0.872
  478   2HB   ASP  62          1HB       ASP  62   5.288  -4.463   1.882
  479    H    GLU  63           H        GLU  63   4.292  -2.414   0.220
  480    HA   GLU  63           HA       GLU  63   2.781  -1.339   2.406
  481   1HB   GLU  63          2HB       GLU  63   4.335  -0.099   0.141
  482   2HB   GLU  63          1HB       GLU  63   3.402   0.885   1.268
  483   1HG   GLU  63          2HG       GLU  63   5.398  -1.166   2.238
  484   2HG   GLU  63          1HG       GLU  63   5.883   0.483   1.844
  485    H    VAL  64           H        VAL  64   2.411  -1.081  -1.156
  486    HA   VAL  64           HA       VAL  64  -0.056   0.363  -0.972
  487    HB   VAL  64           HB       VAL  64   1.437   0.537  -2.937
  488   1HG1  VAL  64          1HG1      VAL  64   0.414  -2.178  -3.778
  489   2HG1  VAL  64          2HG1      VAL  64   1.939  -1.991  -2.913
  490   3HG1  VAL  64          3HG1      VAL  64   1.721  -1.231  -4.489
  491   1HG2  VAL  64          1HG2      VAL  64  -1.091  -0.634  -4.020
  492   2HG2  VAL  64          2HG2      VAL  64  -0.311   0.900  -4.401
  493   3HG2  VAL  64          3HG2      VAL  64  -1.228   0.725  -2.905
  494    H    ASP  65           H        ASP  65   0.747  -3.063  -1.443
  495    HA   ASP  65           HA       ASP  65  -1.962  -3.878  -1.936
  496   1HB   ASP  65          2HB       ASP  65   0.470  -5.090  -2.282
  497   2HB   ASP  65          1HB       ASP  65  -0.120  -5.905  -0.836
  498    H    GLU  66           H        GLU  66  -3.444  -3.525  -0.411
  499    HA   GLU  66           HA       GLU  66  -2.903  -3.493   2.391
  500   1HB   GLU  66          2HB       GLU  66  -5.362  -3.377   2.655
  501   2HB   GLU  66          1HB       GLU  66  -4.760  -2.202   1.491
  502   1HG   GLU  66          2HG       GLU  66  -5.261  -4.418  -0.092
  503   2HG   GLU  66          1HG       GLU  66  -6.575  -4.475   1.083
  504    H    ASP  67           H        ASP  67  -4.153  -5.951   0.177
  505    HA   ASP  67           HA       ASP  67  -4.662  -7.812   2.362
  506   1HB   ASP  67          2HB       ASP  67  -5.241  -9.407   0.471
  507   2HB   ASP  67          1HB       ASP  67  -6.260  -7.978   0.609
  508    H    GLY  68           H        GLY  68  -2.283  -7.316  -0.203
  509   1HA   GLY  68          2HA       GLY  68  -0.108  -8.095  -0.364
  510   2HA   GLY  68          1HA       GLY  68  -0.311  -8.861   1.207
  511    H    SER  69           H        SER  69  -2.101  -9.280  -1.840
  512    HA   SER  69           HA       SER  69  -1.952 -12.167  -1.578
  513   1HB   SER  69          2HB       SER  69  -3.348 -12.171  -3.641
  514   2HB   SER  69          1HB       SER  69  -4.045 -11.212  -2.340
  515    HG   SER  69           HG       SER  69  -2.983 -10.434  -4.784
  516    H    GLY  70           H        GLY  70   0.055  -9.823  -2.958
  517   1HA   GLY  70          2HA       GLY  70   2.055 -10.177  -4.108
  518   2HA   GLY  70          1HA       GLY  70   1.563 -11.843  -4.408
  519    H    THR  71           H        THR  71  -0.755  -9.370  -5.078
  520    HA   THR  71           HA       THR  71  -0.052  -9.213  -7.919
  521    HB   THR  71           HB       THR  71  -2.264  -9.882  -8.657
  522    HG1  THR  71           HG1      THR  71  -3.840 -10.435  -7.220
  523   1HG2  THR  71          1HG2      THR  71  -0.595 -11.677  -8.315
  524   2HG2  THR  71          2HG2      THR  71  -2.236 -12.255  -8.023
  525   3HG2  THR  71          3HG2      THR  71  -1.174 -11.886  -6.662
  526    H    VAL  72           H        VAL  72  -0.385  -7.208  -8.678
  527    HA   VAL  72           HA       VAL  72  -1.676  -5.263  -6.915
  528    HB   VAL  72           HB       VAL  72  -0.447  -4.634  -9.592
  529   1HG1  VAL  72          1HG1      VAL  72  -0.511  -3.000  -7.051
  530   2HG1  VAL  72          2HG1      VAL  72  -1.841  -2.974  -8.211
  531   3HG1  VAL  72          3HG1      VAL  72  -0.232  -2.440  -8.701
  532   1HG2  VAL  72          1HG2      VAL  72   1.657  -4.155  -8.281
  533   2HG2  VAL  72          2HG2      VAL  72   1.273  -5.872  -8.420
  534   3HG2  VAL  72          3HG2      VAL  72   0.932  -5.009  -6.918
  535    H    ASP  73           H        ASP  73  -3.745  -4.825  -7.100
  536    HA   ASP  73           HA       ASP  73  -5.228  -5.497  -9.521
  537   1HB   ASP  73          2HB       ASP  73  -6.123  -4.266  -6.893
  538   2HB   ASP  73          1HB       ASP  73  -7.201  -4.707  -8.218
  539    H    PHE  74           H        PHE  74  -6.814  -3.724 -10.336
  540    HA   PHE  74           HA       PHE  74  -5.278  -1.570 -11.290
  541   1HB   PHE  74          2HB       PHE  74  -7.440  -2.501 -12.293
  542   2HB   PHE  74          1HB       PHE  74  -8.285  -1.468 -11.138
  543    HD1  PHE  74           HD1      PHE  74  -5.119  -0.971 -13.068
  544    HD2  PHE  74           HD2      PHE  74  -9.131   0.370 -12.329
  545    HE1  PHE  74           HE1      PHE  74  -4.750   0.971 -14.561
  546    HE2  PHE  74           HE2      PHE  74  -8.756   2.314 -13.821
  547    HZ   PHE  74           HZ       PHE  74  -6.565   2.615 -14.938
  548    H    ASP  75           H        ASP  75  -7.360  -1.837  -8.454
  549    HA   ASP  75           HA       ASP  75  -7.422   0.959  -7.849
  550   1HB   ASP  75          2HB       ASP  75  -8.922  -0.939  -6.890
  551   2HB   ASP  75          1HB       ASP  75  -7.604  -1.191  -5.747
  552    H    GLU  76           H        GLU  76  -5.360  -1.755  -6.850
  553    HA   GLU  76           HA       GLU  76  -3.694  -0.197  -5.102
  554   1HB   GLU  76          2HB       GLU  76  -3.086  -2.857  -6.421
  555   2HB   GLU  76          1HB       GLU  76  -2.268  -2.169  -5.020
  556   1HG   GLU  76          2HG       GLU  76  -4.252  -2.344  -3.671
  557   2HG   GLU  76          1HG       GLU  76  -5.239  -2.753  -5.069
  558    H    PHE  77           H        PHE  77  -3.765  -0.897  -8.510
  559    HA   PHE  77           HA       PHE  77  -1.065  -0.309  -9.163
  560   1HB   PHE  77          2HB       PHE  77  -3.119  -1.374 -10.540
  561   2HB   PHE  77          1HB       PHE  77  -3.232   0.280 -11.120
  562    HD1  PHE  77           HD1      PHE  77  -2.743  -0.706 -13.359
  563    HD2  PHE  77           HD2      PHE  77   0.124  -0.807 -10.156
  564    HE1  PHE  77           HE1      PHE  77  -0.936  -1.153 -14.982
  565    HE2  PHE  77           HE2      PHE  77   1.926  -1.248 -11.786
  566    HZ   PHE  77           HZ       PHE  77   1.400  -1.427 -14.204
  567    H    LEU  78           H        LEU  78  -4.051   1.626  -9.385
  568    HA   LEU  78           HA       LEU  78  -2.727   4.036 -10.170
  569   1HB   LEU  78          2HB       LEU  78  -5.481   3.330  -9.245
  570   2HB   LEU  78          1HB       LEU  78  -5.002   5.018  -9.295
  571    HG   LEU  78           HG       LEU  78  -4.670   4.919 -11.679
  572   1HD1  LEU  78          1HD1      LEU  78  -3.690   2.601 -11.679
  573   2HD1  LEU  78          2HD1      LEU  78  -4.859   2.887 -12.966
  574   3HD1  LEU  78          3HD1      LEU  78  -5.331   1.969 -11.538
  575   1HD2  LEU  78          1HD2      LEU  78  -6.898   5.215 -11.806
  576   2HD2  LEU  78          2HD2      LEU  78  -7.162   4.172 -10.410
  577   3HD2  LEU  78          3HD2      LEU  78  -7.065   3.474 -12.026
  578    H    VAL  79           H        VAL  79  -3.641   2.610  -7.086
  579    HA   VAL  79           HA       VAL  79  -3.351   4.891  -5.443
  580    HB   VAL  79           HB       VAL  79  -3.323   1.933  -5.010
  581   1HG1  VAL  79          1HG1      VAL  79  -2.403   3.962  -2.951
  582   2HG1  VAL  79          2HG1      VAL  79  -1.439   2.651  -3.637
  583   3HG1  VAL  79          3HG1      VAL  79  -2.818   2.282  -2.598
  584   1HG2  VAL  79          1HG2      VAL  79  -5.348   3.555  -5.031
  585   2HG2  VAL  79          2HG2      VAL  79  -4.763   4.079  -3.451
  586   3HG2  VAL  79          3HG2      VAL  79  -5.236   2.399  -3.705
  587    H    MET  80           H        MET  80  -1.058   2.325  -6.336
  588    HA   MET  80           HA       MET  80   1.200   3.022  -4.953
  589   1HB   MET  80          2HB       MET  80   0.623   1.316  -7.065
  590   2HB   MET  80          1HB       MET  80   1.842   2.401  -7.733
  591   1HG   MET  80          2HG       MET  80   3.348   1.924  -5.879
  592   2HG   MET  80          1HG       MET  80   2.112   0.948  -5.086
  593   1HE   MET  80          1HE       MET  80   4.662   1.390  -7.793
  594   2HE   MET  80          2HE       MET  80   3.288   1.245  -8.887
  595   3HE   MET  80          3HE       MET  80   4.522  -0.012  -8.861
  596    H    MET  81           H        MET  81  -0.156   4.700  -7.746
  597    HA   MET  81           HA       MET  81   2.193   6.320  -8.205
  598   1HB   MET  81          2HB       MET  81   0.408   5.681  -9.927
  599   2HB   MET  81          1HB       MET  81  -0.595   6.920  -9.179
  600   1HG   MET  81          2HG       MET  81   2.194   7.701  -9.876
  601   2HG   MET  81          1HG       MET  81   1.081   7.457 -11.221
  602   1HE   MET  81          1HE       MET  81  -1.719   9.633 -10.900
  603   2HE   MET  81          2HE       MET  81  -1.884   8.776  -9.369
  604   3HE   MET  81          3HE       MET  81  -1.305   7.916 -10.791
  605    H    VAL  82           H        VAL  82  -1.075   6.935  -6.884
  606    HA   VAL  82           HA       VAL  82  -0.556   9.642  -6.190
  607    HB   VAL  82           HB       VAL  82  -2.609   9.488  -4.810
  608   1HG1  VAL  82          1HG1      VAL  82  -3.121   8.062  -7.410
  609   2HG1  VAL  82          2HG1      VAL  82  -2.486   9.707  -7.406
  610   3HG1  VAL  82          3HG1      VAL  82  -4.045   9.362  -6.658
  611   1HG2  VAL  82          1HG2      VAL  82  -2.178   7.073  -4.129
  612   2HG2  VAL  82          2HG2      VAL  82  -2.738   6.607  -5.734
  613   3HG2  VAL  82          3HG2      VAL  82  -3.832   7.429  -4.623
  614    H    ARG  83           H        ARG  83  -0.093   6.611  -4.430
  615    HA   ARG  83           HA       ARG  83   0.331   7.858  -1.887
  616   1HB   ARG  83          2HB       ARG  83   1.313   5.696  -1.198
  617   2HB   ARG  83          1HB       ARG  83  -0.253   5.494  -1.977
  618   1HG   ARG  83          2HG       ARG  83   0.628   4.334  -3.705
  619   2HG   ARG  83          1HG       ARG  83   2.016   5.409  -3.847
  620   1HD   ARG  83          2HD       ARG  83   2.489   4.146  -1.445
  621   2HD   ARG  83          1HD       ARG  83   1.751   2.865  -2.402
  622    HE   ARG  83           HE       ARG  83   3.649   4.000  -4.059
  623   1HH1  ARG  83          2HH1      ARG  83   3.603   2.486  -0.912
  624   2HH1  ARG  83          1HH1      ARG  83   5.223   1.892  -1.036
  625   1HH2  ARG  83          1HH2      ARG  83   5.770   3.211  -4.199
  626   2HH2  ARG  83          2HH2      ARG  83   6.448   2.308  -2.888
  627    H    CYS  84           H        CYS  84   2.366   7.118  -4.641
  628    HA   CYS  84           HA       CYS  84   4.881   7.511  -3.352
  629   1HB   CYS  84          2HB       CYS  84   3.916   7.219  -6.137
  630   2HB   CYS  84          1HB       CYS  84   5.420   8.119  -5.937
  631    HG   CYS  84           HG       CYS  84   5.066   5.118  -5.460
  632    H    MET  85           H        MET  85   2.603   9.651  -5.029
  633    HA   MET  85           HA       MET  85   4.414  11.936  -4.781
  634   1HB   MET  85          2HB       MET  85   2.668  11.376  -6.715
  635   2HB   MET  85          1HB       MET  85   1.575  12.259  -5.649
  636   1HG   MET  85          2HG       MET  85   4.243  13.489  -6.105
  637   2HG   MET  85          1HG       MET  85   3.137  13.485  -7.479
  638   1HE   MET  85          1HE       MET  85   3.756  16.359  -6.768
  639   2HE   MET  85          2HE       MET  85   2.083  16.910  -6.810
  640   3HE   MET  85          3HE       MET  85   2.609  15.630  -7.900
  641    H    LYS  86           H        LYS  86   1.049  11.232  -3.796
  642    HA   LYS  86           HA       LYS  86   0.988  13.362  -1.870
  643   1HB   LYS  86          2HB       LYS  86  -1.002  12.312  -3.156
  644   2HB   LYS  86          1HB       LYS  86  -0.938  11.044  -1.934
  645   1HG   LYS  86          2HG       LYS  86  -0.817  13.757  -0.809
  646   2HG   LYS  86          1HG       LYS  86  -2.314  13.423  -1.679
  647   1HD   LYS  86          2HD       LYS  86  -2.922  11.690  -0.246
  648   2HD   LYS  86          1HD       LYS  86  -1.257  11.373   0.246
  649   1HE   LYS  86          2HE       LYS  86  -1.233  13.110   1.781
  650   2HE   LYS  86          1HE       LYS  86  -2.447  14.041   0.905
  651   1HZ   LYS  86          1HZ       LYS  86  -3.675  13.273   2.647
  652   2HZ   LYS  86          2HZ       LYS  86  -2.803  11.823   2.788
  653   3HZ   LYS  86          3HZ       LYS  86  -3.944  12.013   1.544
  654    H    ASP  87           H        ASP  87   0.862  13.162   0.381
  655    HA   ASP  87           HA       ASP  87   1.382  12.348   2.467
  656   1HB   ASP  87          2HB       ASP  87   0.030  10.292   1.369
  657   2HB   ASP  87          1HB       ASP  87   1.601   9.521   1.580
  658    H    ASP  88           H        ASP  88   3.430  13.025   0.444
  659    HA   ASP  88           HA       ASP  88   5.710  13.153   0.350
  660   1HB   ASP  88          2HB       ASP  88   5.719  11.381   2.807
  661   2HB   ASP  88          1HB       ASP  88   7.069  12.333   2.193
  662    H    SER  89           HN       SER  89   5.213   9.836   1.597
  663    HA   SER  89           HA       SER  89   6.276   8.789  -0.952
  664   1HB   SER  89          2HB       SER  89   7.932   8.874   1.092
  665   2HB   SER  89          1HB       SER  89   7.027   7.461   1.626
  666    HG   SER  89           HG       SER  89   8.905   7.650  -0.273
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  -7.522   5.624   9.503
    2   2H    MET   1          2H        MET   1  -6.286   6.559   8.807
    3   3H    MET   1          3H        MET   1  -6.952   5.252   7.949
    4    HA   MET   1           HA       MET   1  -9.156   6.466   8.090
    5   1HB   MET   1          2HB       MET   1  -7.885   8.089   9.810
    6   2HB   MET   1          1HB       MET   1  -7.542   8.964   8.319
    7   1HG   MET   1          2HG       MET   1 -10.129   8.555   7.879
    8   2HG   MET   1          1HG       MET   1 -10.176   8.425   9.638
    9   1HE   MET   1          1HE       MET   1 -11.886  10.682   9.496
   10   2HE   MET   1          2HE       MET   1 -11.641  10.369   7.779
   11   3HE   MET   1          3HE       MET   1 -11.449  12.004   8.406
   12    H    ASN   2           H        ASN   2  -6.007   7.822   7.045
   13    HA   ASN   2           HA       ASN   2  -5.140   8.296   4.978
   14   1HB   ASN   2          2HB       ASN   2  -7.274   6.386   3.983
   15   2HB   ASN   2          1HB       ASN   2  -5.901   6.972   3.047
   16   1HD2  ASN   2          1HD2      ASN   2  -3.720   6.712   4.635
   17   2HD2  ASN   2          2HD2      ASN   2  -3.544   5.127   5.214
   18    H    ASP   3           H        ASP   3  -5.629  10.448   4.874
   19    HA   ASP   3           HA       ASP   3  -8.246  11.278   3.858
   20   1HB   ASP   3          2HB       ASP   3  -6.684  12.393   5.767
   21   2HB   ASP   3          1HB       ASP   3  -6.174  13.323   4.359
   22    H    ILE   4           H        ILE   4  -4.815  11.562   3.000
   23    HA   ILE   4           HA       ILE   4  -5.237  13.025   0.597
   24    HB   ILE   4           HB       ILE   4  -2.925  12.429   0.016
   25   1HG1  ILE   4          2HG1      ILE   4  -1.848  11.079   2.121
   26   2HG1  ILE   4          1HG1      ILE   4  -3.433  10.314   2.040
   27   1HG2  ILE   4          1HG2      ILE   4  -1.863  13.532   1.863
   28   2HG2  ILE   4          2HG2      ILE   4  -3.121  13.004   2.981
   29   3HG2  ILE   4          3HG2      ILE   4  -3.490  14.203   1.741
   30   1HD1  ILE   4          1HD1      ILE   4  -1.465   9.356   0.588
   31   2HD1  ILE   4          2HD1      ILE   4  -1.846  10.704  -0.483
   32   3HD1  ILE   4          3HD1      ILE   4  -3.075   9.493  -0.117
   33    H    TYR   5           H        TYR   5  -5.222   9.598   1.340
   34    HA   TYR   5           HA       TYR   5  -5.057   8.633  -1.338
   35   1HB   TYR   5          2HB       TYR   5  -6.198   7.354   1.161
   36   2HB   TYR   5          1HB       TYR   5  -5.976   6.515  -0.373
   37    HD1  TYR   5           HD1      TYR   5  -4.302   7.962   2.555
   38    HD2  TYR   5           HD2      TYR   5  -3.715   6.080  -1.262
   39    HE1  TYR   5           HE1      TYR   5  -1.931   7.532   3.132
   40    HE2  TYR   5           HE2      TYR   5  -1.342   5.653  -0.685
   41    HH   TYR   5           HH       TYR   5   0.241   7.162   1.821
   42    H    LYS   6           H        LYS   6  -7.727   9.530   0.794
   43    HA   LYS   6           HA       LYS   6  -9.767   8.705  -1.098
   44   1HB   LYS   6          2HB       LYS   6  -9.830   8.970   1.579
   45   2HB   LYS   6          1HB       LYS   6 -10.447  10.558   1.125
   46   1HG   LYS   6          2HG       LYS   6 -12.409   9.289   1.196
   47   2HG   LYS   6          1HG       LYS   6 -11.983   9.195  -0.513
   48   1HD   LYS   6          2HD       LYS   6 -12.418   6.951   0.051
   49   2HD   LYS   6          1HD       LYS   6 -10.660   7.058   0.163
   50   1HE   LYS   6          2HE       LYS   6 -10.657   6.838   2.441
   51   2HE   LYS   6          1HE       LYS   6 -12.159   7.741   2.635
   52   1HZ   LYS   6          1HZ       LYS   6 -12.402   5.376   3.173
   53   2HZ   LYS   6          2HZ       LYS   6 -11.966   4.969   1.582
   54   3HZ   LYS   6          3HZ       LYS   6 -13.397   5.838   1.879
   55    H    ALA   7           H        ALA   7  -8.151  11.692  -0.143
   56    HA   ALA   7           HA       ALA   7  -9.909  13.495  -1.464
   57   1HB   ALA   7          1HB       ALA   7  -7.995  15.096  -1.289
   58   2HB   ALA   7          2HB       ALA   7  -7.003  13.774  -0.673
   59   3HB   ALA   7          3HB       ALA   7  -8.409  14.321   0.240
   60    H    ALA   8           H        ALA   8  -7.076  11.667  -2.535
   61    HA   ALA   8           HA       ALA   8  -6.853  13.076  -5.048
   62   1HB   ALA   8          1HB       ALA   8  -5.150  11.439  -5.602
   63   2HB   ALA   8          2HB       ALA   8  -5.647  10.418  -4.251
   64   3HB   ALA   8          3HB       ALA   8  -4.904  11.989  -3.944
   65    H    VAL   9           H        VAL   9  -8.109   9.902  -4.020
   66    HA   VAL   9           HA       VAL   9  -8.795   9.009  -6.626
   67    HB   VAL   9           HB       VAL   9  -8.568   7.545  -4.588
   68   1HG1  VAL   9          1HG1      VAL   9 -10.504   7.311  -3.115
   69   2HG1  VAL   9          2HG1      VAL   9 -11.361   8.570  -4.002
   70   3HG1  VAL   9          3HG1      VAL   9  -9.922   8.974  -3.069
   71   1HG2  VAL   9          1HG2      VAL   9 -11.248   7.231  -5.961
   72   2HG2  VAL   9          2HG2      VAL   9 -10.175   5.959  -5.375
   73   3HG2  VAL   9          3HG2      VAL   9  -9.720   6.916  -6.785
   74    H    GLU  10           H        GLU  10 -10.408  11.142  -4.371
   75    HA   GLU  10           HA       GLU  10 -12.976  10.950  -5.694
   76   1HB   GLU  10          2HB       GLU  10 -13.745  12.574  -4.114
   77   2HB   GLU  10          1HB       GLU  10 -12.715  11.442  -3.244
   78   1HG   GLU  10          2HG       GLU  10 -11.180  13.036  -2.752
   79   2HG   GLU  10          1HG       GLU  10 -11.241  13.722  -4.372
   80    H    GLN  11           H        GLN  11 -10.071  12.774  -6.184
   81    HA   GLN  11           HA       GLN  11 -11.548  14.526  -8.057
   82   1HB   GLN  11          2HB       GLN  11 -10.171  16.389  -7.517
   83   2HB   GLN  11          1HB       GLN  11 -10.709  15.712  -5.981
   84   1HG   GLN  11          2HG       GLN  11  -8.537  14.411  -5.898
   85   2HG   GLN  11          1HG       GLN  11  -8.004  15.336  -7.300
   86   1HE2  GLN  11          1HE2      GLN  11  -7.273  15.320  -4.219
   87   2HE2  GLN  11          2HE2      GLN  11  -7.248  16.975  -3.846
   88    H    LEU  12           H        LEU  12  -9.958  11.930  -8.388
   89    HA   LEU  12           HA       LEU  12  -7.613  12.693  -9.893
   90   1HB   LEU  12          2HB       LEU  12  -7.789  10.233 -10.675
   91   2HB   LEU  12          1HB       LEU  12  -7.341  10.581  -9.023
   92    HG   LEU  12           HG       LEU  12  -9.534   9.967  -8.235
   93   1HD1  LEU  12          1HD1      LEU  12 -11.024  10.781  -9.889
   94   2HD1  LEU  12          2HD1      LEU  12 -11.180   9.026  -9.983
   95   3HD1  LEU  12          3HD1      LEU  12 -10.211   9.890 -11.177
   96   1HD2  LEU  12          1HD2      LEU  12  -9.604   7.600  -8.983
   97   2HD2  LEU  12          2HD2      LEU  12  -7.959   8.129  -8.631
   98   3HD2  LEU  12          3HD2      LEU  12  -8.507   8.001 -10.304
   99    H    THR  13           H        THR  13  -7.424  11.636 -12.194
  100    HA   THR  13           HA       THR  13  -9.733  12.624 -13.758
  101    HB   THR  13           HB       THR  13  -7.750  12.390 -15.600
  102    HG1  THR  13           HG1      THR  13  -6.075  11.940 -14.337
  103   1HG2  THR  13          1HG2      THR  13  -8.791  14.423 -15.639
  104   2HG2  THR  13          2HG2      THR  13  -7.312  14.919 -14.816
  105   3HG2  THR  13          3HG2      THR  13  -8.773  14.589 -13.884
  106    H    ASP  14           H        ASP  14 -10.079  11.534 -15.852
  107    HA   ASP  14           HA       ASP  14 -10.388   8.708 -15.498
  108   1HB   ASP  14          2HB       ASP  14 -10.910  10.632 -17.742
  109   2HB   ASP  14          1HB       ASP  14 -10.949   8.897 -18.053
  110    H    GLU  15           H        GLU  15  -8.080  10.802 -17.106
  111    HA   GLU  15           HA       GLU  15  -6.760   8.823 -18.672
  112   1HB   GLU  15          2HB       GLU  15  -5.895  11.522 -17.626
  113   2HB   GLU  15          1HB       GLU  15  -4.833  10.503 -18.598
  114   1HG   GLU  15          2HG       GLU  15  -5.825  11.708 -20.297
  115   2HG   GLU  15          1HG       GLU  15  -6.996  10.397 -20.168
  116    H    GLN  16           H        GLN  16  -6.475   9.867 -15.323
  117    HA   GLN  16           HA       GLN  16  -3.968   8.658 -14.735
  118   1HB   GLN  16          2HB       GLN  16  -6.037  10.047 -13.289
  119   2HB   GLN  16          1HB       GLN  16  -5.579   8.591 -12.406
  120   1HG   GLN  16          2HG       GLN  16  -3.278   9.239 -12.339
  121   2HG   GLN  16          1HG       GLN  16  -3.539  10.529 -13.514
  122   1HE2  GLN  16          1HE2      GLN  16  -5.390   9.655 -10.535
  123   2HE2  GLN  16          2HE2      GLN  16  -5.244  11.190  -9.826
  124    H    LYS  17           H        LYS  17  -7.332   7.577 -14.242
  125    HA   LYS  17           HA       LYS  17  -6.690   5.015 -13.202
  126   1HB   LYS  17          2HB       LYS  17  -9.176   6.017 -14.613
  127   2HB   LYS  17          1HB       LYS  17  -9.049   4.437 -13.842
  128   1HG   LYS  17          2HG       LYS  17  -9.133   5.308 -11.730
  129   2HG   LYS  17          1HG       LYS  17  -8.211   6.744 -12.175
  130   1HD   LYS  17          2HD       LYS  17 -10.255   7.754 -11.924
  131   2HD   LYS  17          1HD       LYS  17 -10.455   7.222 -13.593
  132   1HE   LYS  17          2HE       LYS  17 -11.554   5.154 -12.801
  133   2HE   LYS  17          1HE       LYS  17 -11.363   5.694 -11.133
  134   1HZ   LYS  17          1HZ       LYS  17 -12.696   7.656 -11.677
  135   2HZ   LYS  17          2HZ       LYS  17 -13.560   6.217 -11.935
  136   3HZ   LYS  17          3HZ       LYS  17 -12.919   7.073 -13.256
  137    H    ASN  18           H        ASN  18  -7.398   6.178 -16.484
  138    HA   ASN  18           HA       ASN  18  -7.291   3.635 -17.757
  139   1HB   ASN  18          2HB       ASN  18  -7.276   6.471 -18.653
  140   2HB   ASN  18          1HB       ASN  18  -6.643   5.271 -19.780
  141   1HD2  ASN  18          1HD2      ASN  18  -9.543   6.035 -17.800
  142   2HD2  ASN  18          2HD2      ASN  18 -10.624   5.171 -18.784
  143    H    GLU  19           H        GLU  19  -4.835   5.980 -16.848
  144    HA   GLU  19           HA       GLU  19  -2.700   5.178 -18.467
  145   1HB   GLU  19          2HB       GLU  19  -2.666   7.159 -16.944
  146   2HB   GLU  19          1HB       GLU  19  -2.520   6.061 -15.573
  147   1HG   GLU  19          2HG       GLU  19  -0.412   5.192 -16.438
  148   2HG   GLU  19          1HG       GLU  19  -0.572   6.172 -17.895
  149    H    PHE  20           H        PHE  20  -3.681   3.973 -15.253
  150    HA   PHE  20           HA       PHE  20  -1.673   1.900 -15.229
  151   1HB   PHE  20          2HB       PHE  20  -3.999   2.617 -13.469
  152   2HB   PHE  20          1HB       PHE  20  -3.180   1.069 -13.276
  153    HD1  PHE  20           HD1      PHE  20  -2.820   4.733 -13.049
  154    HD2  PHE  20           HD2      PHE  20  -0.883   0.947 -12.478
  155    HE1  PHE  20           HE1      PHE  20  -1.026   5.848 -11.753
  156    HE2  PHE  20           HE2      PHE  20   0.903   2.043 -11.173
  157    HZ   PHE  20           HZ       PHE  20   0.840   4.503 -10.811
  158    H    LYS  21           H        LYS  21  -5.211   2.017 -15.655
  159    HA   LYS  21           HA       LYS  21  -5.785  -0.675 -15.931
  160   1HB   LYS  21          2HB       LYS  21  -7.483   1.127 -15.904
  161   2HB   LYS  21          1HB       LYS  21  -7.013   1.574 -17.541
  162   1HG   LYS  21          2HG       LYS  21  -7.595  -1.293 -17.224
  163   2HG   LYS  21          1HG       LYS  21  -8.981  -0.250 -16.904
  164   1HD   LYS  21          2HD       LYS  21  -8.280   0.958 -19.109
  165   2HD   LYS  21          1HD       LYS  21  -7.370  -0.518 -19.435
  166   1HE   LYS  21          2HE       LYS  21  -9.386  -1.108 -20.392
  167   2HE   LYS  21          1HE       LYS  21  -9.683  -1.659 -18.744
  168   1HZ   LYS  21          1HZ       LYS  21 -10.452   1.001 -19.823
  169   2HZ   LYS  21          2HZ       LYS  21 -10.780   0.421 -18.260
  170   3HZ   LYS  21          3HZ       LYS  21 -11.508  -0.309 -19.611
  171    H    ALA  22           H        ALA  22  -4.396   1.521 -18.341
  172    HA   ALA  22           HA       ALA  22  -4.606  -0.147 -20.610
  173   1HB   ALA  22          1HB       ALA  22  -3.980   2.220 -20.788
  174   2HB   ALA  22          2HB       ALA  22  -2.748   1.200 -21.530
  175   3HB   ALA  22          3HB       ALA  22  -2.471   1.894 -19.933
  176    H    ALA  23           H        ALA  23  -1.855   0.351 -18.395
  177    HA   ALA  23           HA       ALA  23  -0.224  -1.714 -19.463
  178   1HB   ALA  23          1HB       ALA  23   1.144  -1.426 -17.489
  179   2HB   ALA  23          2HB       ALA  23  -0.172  -0.617 -16.639
  180   3HB   ALA  23          3HB       ALA  23   0.604   0.167 -18.016
  181    H    PHE  24           H        PHE  24  -2.633  -1.567 -16.913
  182    HA   PHE  24           HA       PHE  24  -2.229  -4.066 -15.700
  183   1HB   PHE  24          2HB       PHE  24  -3.771  -2.123 -14.983
  184   2HB   PHE  24          1HB       PHE  24  -4.949  -2.818 -16.093
  185    HD1  PHE  24           HD1      PHE  24  -5.540  -5.318 -15.796
  186    HD2  PHE  24           HD2      PHE  24  -3.522  -2.988 -12.812
  187    HE1  PHE  24           HE1      PHE  24  -6.186  -6.968 -14.065
  188    HE2  PHE  24           HE2      PHE  24  -4.166  -4.634 -11.085
  189    HZ   PHE  24           HZ       PHE  24  -5.506  -6.615 -11.707
  190    H    ASP  25           H        ASP  25  -4.345  -3.126 -18.411
  191    HA   ASP  25           HA       ASP  25  -5.489  -5.684 -18.827
  192   1HB   ASP  25          2HB       ASP  25  -5.363  -3.139 -20.346
  193   2HB   ASP  25          1HB       ASP  25  -5.744  -4.597 -21.263
  194    H    ILE  26           H        ILE  26  -2.607  -4.162 -20.257
  195    HA   ILE  26           HA       ILE  26  -2.201  -6.246 -22.183
  196    HB   ILE  26           HB       ILE  26   0.045  -5.233 -22.512
  197   1HG1  ILE  26          2HG1      ILE  26  -0.833  -3.251 -20.392
  198   2HG1  ILE  26          1HG1      ILE  26   0.320  -4.548 -20.090
  199   1HG2  ILE  26          1HG2      ILE  26  -0.789  -3.108 -23.386
  200   2HG2  ILE  26          2HG2      ILE  26  -2.213  -3.214 -22.350
  201   3HG2  ILE  26          3HG2      ILE  26  -1.990  -4.371 -23.663
  202   1HD1  ILE  26          1HD1      ILE  26   1.320  -3.386 -22.384
  203   2HD1  ILE  26          2HD1      ILE  26   1.894  -3.064 -20.749
  204   3HD1  ILE  26          3HD1      ILE  26   0.701  -1.997 -21.488
  205    H    PHE  27           H        PHE  27  -0.978  -5.667 -18.905
  206    HA   PHE  27           HA       PHE  27   0.914  -7.841 -19.022
  207   1HB   PHE  27          2HB       PHE  27  -0.158  -6.276 -16.661
  208   2HB   PHE  27          1HB       PHE  27   1.124  -7.482 -16.561
  209    HD1  PHE  27           HD1      PHE  27   2.608  -6.952 -19.104
  210    HD2  PHE  27           HD2      PHE  27   0.954  -4.234 -16.214
  211    HE1  PHE  27           HE1      PHE  27   4.246  -5.227 -19.790
  212    HE2  PHE  27           HE2      PHE  27   2.599  -2.510 -16.906
  213    HZ   PHE  27           HZ       PHE  27   4.242  -3.006 -18.693
  214    H    ILE  28           H        ILE  28  -2.430  -7.462 -17.906
  215    HA   ILE  28           HA       ILE  28  -2.445 -10.240 -16.929
  216    HB   ILE  28           HB       ILE  28  -4.620  -9.797 -16.003
  217   1HG1  ILE  28          2HG1      ILE  28  -5.320  -7.198 -16.382
  218   2HG1  ILE  28          1HG1      ILE  28  -4.568  -7.543 -17.939
  219   1HG2  ILE  28          1HG2      ILE  28  -4.095  -8.037 -14.445
  220   2HG2  ILE  28          2HG2      ILE  28  -2.950  -7.308 -15.571
  221   3HG2  ILE  28          3HG2      ILE  28  -2.589  -8.868 -14.836
  222   1HD1  ILE  28          1HD1      ILE  28  -7.144  -8.060 -17.515
  223   2HD1  ILE  28          2HD1      ILE  28  -6.489  -9.551 -16.836
  224   3HD1  ILE  28          3HD1      ILE  28  -6.153  -9.122 -18.514
  225    H    GLN  29           H        GLN  29  -2.647  -8.922 -19.882
  226    HA   GLN  29           HA       GLN  29  -4.988  -9.713 -21.116
  227   1HB   GLN  29          2HB       GLN  29  -3.264  -8.465 -22.300
  228   2HB   GLN  29          1HB       GLN  29  -2.160  -9.837 -22.197
  229   1HG   GLN  29          2HG       GLN  29  -3.574 -11.174 -23.621
  230   2HG   GLN  29          1HG       GLN  29  -4.854  -9.959 -23.579
  231   1HE2  GLN  29          1HE2      GLN  29  -4.181  -7.726 -24.504
  232   2HE2  GLN  29          2HE2      GLN  29  -3.116  -7.728 -25.826
  233    H    ASP  30           H        ASP  30  -2.156 -11.684 -20.318
  234    HA   ASP  30           HA       ASP  30  -3.589 -14.093 -21.255
  235   1HB   ASP  30          2HB       ASP  30  -1.361 -15.201 -21.183
  236   2HB   ASP  30          1HB       ASP  30  -1.405 -13.827 -22.285
  237    H    ALA  31           H        ALA  31  -4.041 -12.674 -18.655
  238    HA   ALA  31           HA       ALA  31  -3.085 -14.676 -16.721
  239   1HB   ALA  31          1HB       ALA  31  -2.792 -12.265 -16.167
  240   2HB   ALA  31          2HB       ALA  31  -3.796 -13.123 -14.999
  241   3HB   ALA  31          3HB       ALA  31  -4.545 -12.076 -16.205
  242    H    GLU  32           H        GLU  32  -4.502 -15.760 -15.342
  243    HA   GLU  32           HA       GLU  32  -7.291 -15.941 -16.329
  244   1HB   GLU  32          2HB       GLU  32  -5.624 -18.057 -14.935
  245   2HB   GLU  32          1HB       GLU  32  -7.301 -18.246 -15.443
  246   1HG   GLU  32          2HG       GLU  32  -5.068 -17.533 -17.361
  247   2HG   GLU  32          1HG       GLU  32  -5.583 -19.190 -17.056
  248    H    ASP  33           H        ASP  33  -6.683 -13.914 -14.577
  249    HA   ASP  33           HA       ASP  33  -8.345 -14.617 -12.292
  250   1HB   ASP  33          2HB       ASP  33  -5.983 -15.138 -11.576
  251   2HB   ASP  33          1HB       ASP  33  -5.604 -13.431 -11.804
  252    H    GLY  34           H        GLY  34  -6.194 -12.096 -13.622
  253   1HA   GLY  34          2HA       GLY  34  -7.170 -10.042 -14.518
  254   2HA   GLY  34          1HA       GLY  34  -8.376 -10.128 -13.239
  255    H    CYS  35           H        CYS  35  -4.879 -10.652 -12.967
  256    HA   CYS  35           HA       CYS  35  -4.481  -8.093 -11.608
  257   1HB   CYS  35          2HB       CYS  35  -3.974 -10.763 -10.268
  258   2HB   CYS  35          1HB       CYS  35  -3.402  -9.211  -9.659
  259    HG   CYS  35           HG       CYS  35  -5.945  -8.487  -9.409
  260    H    ILE  36           H        ILE  36  -2.317  -7.407 -11.655
  261    HA   ILE  36           HA       ILE  36  -0.674  -8.770 -13.623
  262    HB   ILE  36           HB       ILE  36   0.723  -6.889 -13.653
  263   1HG1  ILE  36          2HG1      ILE  36   0.096  -5.178 -11.556
  264   2HG1  ILE  36          1HG1      ILE  36   0.088  -6.769 -10.792
  265   1HG2  ILE  36          1HG2      ILE  36  -1.953  -5.769 -12.778
  266   2HG2  ILE  36          2HG2      ILE  36  -1.610  -6.394 -14.391
  267   3HG2  ILE  36          3HG2      ILE  36  -0.756  -4.971 -13.797
  268   1HD1  ILE  36          1HD1      ILE  36   2.327  -7.185 -11.324
  269   2HD1  ILE  36          2HD1      ILE  36   2.353  -5.453 -10.990
  270   3HD1  ILE  36          3HD1      ILE  36   2.328  -6.031 -12.657
  271    H    SER  37           H        SER  37   1.719  -9.065 -13.145
  272    HA   SER  37           HA       SER  37   1.935 -10.714 -10.742
  273   1HB   SER  37          2HB       SER  37   2.749 -11.575 -12.925
  274   2HB   SER  37          1HB       SER  37   3.936 -10.277 -12.974
  275    HG   SER  37           HG       SER  37   3.833 -12.574 -11.409
  276    H    THR  38           H        THR  38   2.398  -9.644  -8.929
  277    HA   THR  38           HA       THR  38   3.565  -7.152  -8.619
  278    HB   THR  38           HB       THR  38   4.134  -7.857  -6.298
  279    HG1  THR  38           HG1      THR  38   4.095  -9.906  -5.752
  280   1HG2  THR  38          1HG2      THR  38   1.439  -8.481  -7.483
  281   2HG2  THR  38          2HG2      THR  38   1.925  -7.088  -6.517
  282   3HG2  THR  38          3HG2      THR  38   1.730  -8.665  -5.754
  283    H    LYS  39           H        LYS  39   5.211 -10.318  -8.405
  284    HA   LYS  39           HA       LYS  39   7.808  -9.350  -7.971
  285   1HB   LYS  39          2HB       LYS  39   8.597 -11.531  -8.799
  286   2HB   LYS  39          1HB       LYS  39   7.239 -11.719  -7.692
  287   1HG   LYS  39          2HG       LYS  39   5.950 -11.483 -10.105
  288   2HG   LYS  39          1HG       LYS  39   7.418 -12.341 -10.571
  289   1HD   LYS  39          2HD       LYS  39   5.894 -14.058  -9.985
  290   2HD   LYS  39          1HD       LYS  39   6.933 -13.892  -8.569
  291   1HE   LYS  39          2HE       LYS  39   5.273 -12.587  -7.408
  292   2HE   LYS  39          1HE       LYS  39   4.284 -12.449  -8.861
  293   1HZ   LYS  39          1HZ       LYS  39   4.937 -15.020  -7.527
  294   2HZ   LYS  39          2HZ       LYS  39   3.852 -14.782  -8.813
  295   3HZ   LYS  39          3HZ       LYS  39   3.500 -14.156  -7.273
  296    H    GLU  40           H        GLU  40   5.917  -9.511 -10.918
  297    HA   GLU  40           HA       GLU  40   8.285  -8.777 -12.516
  298   1HB   GLU  40          2HB       GLU  40   5.531  -9.684 -13.385
  299   2HB   GLU  40          1HB       GLU  40   6.839  -9.241 -14.481
  300   1HG   GLU  40          2HG       GLU  40   7.245 -11.346 -12.358
  301   2HG   GLU  40          1HG       GLU  40   6.530 -11.756 -13.916
  302    H    LEU  41           H        LEU  41   6.781  -6.942 -10.650
  303    HA   LEU  41           HA       LEU  41   5.198  -5.128 -12.135
  304   1HB   LEU  41          2HB       LEU  41   5.249  -5.179  -9.679
  305   2HB   LEU  41          1HB       LEU  41   6.902  -4.606  -9.698
  306    HG   LEU  41           HG       LEU  41   6.111  -2.482 -10.738
  307   1HD1  LEU  41          1HD1      LEU  41   3.735  -4.013 -11.126
  308   2HD1  LEU  41          2HD1      LEU  41   4.048  -2.350 -11.618
  309   3HD1  LEU  41          3HD1      LEU  41   3.335  -2.680 -10.040
  310   1HD2  LEU  41          1HD2      LEU  41   4.779  -3.305  -8.141
  311   2HD2  LEU  41          2HD2      LEU  41   4.967  -1.639  -8.686
  312   3HD2  LEU  41          3HD2      LEU  41   6.391  -2.611  -8.314
  313    H    GLY  42           H        GLY  42   8.584  -5.724 -12.244
  314   1HA   GLY  42          2HA       GLY  42   9.693  -3.225 -12.788
  315   2HA   GLY  42          1HA       GLY  42  10.279  -4.747 -13.451
  316    H    LYS  43           H        LYS  43   7.891  -5.428 -14.916
  317    HA   LYS  43           HA       LYS  43   8.374  -4.086 -17.366
  318   1HB   LYS  43          2HB       LYS  43   6.450  -5.302 -18.234
  319   2HB   LYS  43          1HB       LYS  43   7.393  -6.377 -17.203
  320   1HG   LYS  43          2HG       LYS  43   5.764  -5.517 -15.316
  321   2HG   LYS  43          1HG       LYS  43   4.722  -5.109 -16.676
  322   1HD   LYS  43          2HD       LYS  43   4.806  -7.420 -17.477
  323   2HD   LYS  43          1HD       LYS  43   5.922  -7.849 -16.180
  324   1HE   LYS  43          2HE       LYS  43   4.251  -7.416 -14.496
  325   2HE   LYS  43          1HE       LYS  43   3.153  -6.721 -15.689
  326   1HZ   LYS  43          1HZ       LYS  43   2.548  -8.994 -15.151
  327   2HZ   LYS  43          2HZ       LYS  43   4.082  -9.543 -15.630
  328   3HZ   LYS  43          3HZ       LYS  43   3.021  -8.873 -16.775
  329    H    VAL  44           H        VAL  44   6.290  -3.384 -14.681
  330    HA   VAL  44           HA       VAL  44   4.704  -1.440 -16.185
  331    HB   VAL  44           HB       VAL  44   4.498  -1.813 -13.218
  332   1HG1  VAL  44          1HG1      VAL  44   2.204  -1.566 -15.104
  333   2HG1  VAL  44          2HG1      VAL  44   3.239  -0.155 -14.889
  334   3HG1  VAL  44          3HG1      VAL  44   2.422  -0.869 -13.499
  335   1HG2  VAL  44          1HG2      VAL  44   2.914  -3.556 -15.089
  336   2HG2  VAL  44          2HG2      VAL  44   3.236  -3.779 -13.374
  337   3HG2  VAL  44          3HG2      VAL  44   4.508  -4.084 -14.555
  338    H    MET  45           H        MET  45   6.633  -1.487 -13.180
  339    HA   MET  45           HA       MET  45   6.747   1.208 -12.640
  340   1HB   MET  45          2HB       MET  45   8.732  -1.001 -12.174
  341   2HB   MET  45          1HB       MET  45   9.113   0.658 -11.712
  342   1HG   MET  45          2HG       MET  45   6.461  -0.463 -10.892
  343   2HG   MET  45          1HG       MET  45   7.897  -0.985 -10.012
  344   1HE   MET  45          1HE       MET  45   5.741   2.297 -11.057
  345   2HE   MET  45          2HE       MET  45   5.437   2.563  -9.342
  346   3HE   MET  45          3HE       MET  45   5.134   0.978 -10.047
  347    H    ARG  46           H        ARG  46   9.011  -0.620 -14.714
  348    HA   ARG  46           HA       ARG  46  10.649   1.579 -15.410
  349   1HB   ARG  46          2HB       ARG  46  10.067  -0.973 -16.926
  350   2HB   ARG  46          1HB       ARG  46  11.313   0.191 -17.382
  351   1HG   ARG  46          2HG       ARG  46  12.169  -0.061 -14.958
  352   2HG   ARG  46          1HG       ARG  46  11.161  -1.505 -14.891
  353   1HD   ARG  46          2HD       ARG  46  12.987  -1.173 -17.232
  354   2HD   ARG  46          1HD       ARG  46  13.698  -1.625 -15.688
  355    HE   ARG  46           HE       ARG  46  11.536  -3.338 -16.085
  356   1HH1  ARG  46          2HH1      ARG  46  14.541  -2.543 -17.678
  357   2HH1  ARG  46          1HH1      ARG  46  14.746  -4.122 -18.354
  358   1HH2  ARG  46          1HH2      ARG  46  11.827  -5.404 -16.981
  359   2HH2  ARG  46          2HH2      ARG  46  13.214  -5.739 -17.961
  360    H    MET  47           H        MET  47   7.601   0.415 -16.716
  361    HA   MET  47           HA       MET  47   7.632   2.125 -19.042
  362   1HB   MET  47          2HB       MET  47   5.536   0.418 -17.713
  363   2HB   MET  47          1HB       MET  47   5.103   1.536 -19.006
  364   1HG   MET  47          2HG       MET  47   7.331  -0.490 -19.293
  365   2HG   MET  47          1HG       MET  47   5.662  -0.847 -19.737
  366   1HE   MET  47          1HE       MET  47   8.827   1.404 -21.951
  367   2HE   MET  47          2HE       MET  47   8.748  -0.309 -21.547
  368   3HE   MET  47          3HE       MET  47   8.835   0.889 -20.258
  369    H    LEU  48           H        LEU  48   6.431   2.320 -15.742
  370    HA   LEU  48           HA       LEU  48   4.842   4.685 -16.110
  371   1HB   LEU  48          2HB       LEU  48   5.757   3.028 -13.827
  372   2HB   LEU  48          1HB       LEU  48   5.355   4.693 -13.471
  373    HG   LEU  48           HG       LEU  48   3.085   4.383 -14.060
  374   1HD1  LEU  48          1HD1      LEU  48   2.961   3.278 -16.084
  375   2HD1  LEU  48          2HD1      LEU  48   2.515   1.950 -15.012
  376   3HD1  LEU  48          3HD1      LEU  48   4.167   2.077 -15.622
  377   1HD2  LEU  48          1HD2      LEU  48   3.439   1.624 -13.025
  378   2HD2  LEU  48          2HD2      LEU  48   2.477   2.954 -12.380
  379   3HD2  LEU  48          3HD2      LEU  48   4.213   2.895 -12.076
  380    H    GLY  49           H        GLY  49   8.186   4.010 -15.350
  381   1HA   GLY  49          2HA       GLY  49   9.737   5.853 -16.047
  382   2HA   GLY  49          1HA       GLY  49   8.718   6.917 -15.088
  383    H    GLN  50           H        GLN  50   9.504   3.664 -14.005
  384    HA   GLN  50           HA       GLN  50  11.478   4.738 -12.087
  385   1HB   GLN  50          2HB       GLN  50   9.418   2.689 -11.271
  386   2HB   GLN  50          1HB       GLN  50  10.486   3.636 -10.239
  387   1HG   GLN  50          2HG       GLN  50   8.336   4.881 -11.969
  388   2HG   GLN  50          1HG       GLN  50   8.067   4.409 -10.293
  389   1HE2  GLN  50          1HE2      GLN  50   8.322   7.169 -11.749
  390   2HE2  GLN  50          2HE2      GLN  50   9.415   8.019 -10.766
  391    H    ASN  51           H        ASN  51  13.234   3.469 -11.809
  392    HA   ASN  51           HA       ASN  51  13.145   0.729 -12.941
  393   1HB   ASN  51          2HB       ASN  51  15.325   2.810 -13.212
  394   2HB   ASN  51          1HB       ASN  51  15.572   1.099 -13.564
  395   1HD2  ASN  51          1HD2      ASN  51  13.698   3.974 -14.576
  396   2HD2  ASN  51          2HD2      ASN  51  13.306   3.370 -16.113
  397    HA   PRO  52           HA       PRO  52  14.761   0.551  -8.601
  398   1HB   PRO  52          2HB       PRO  52  12.817  -1.086  -7.598
  399   2HB   PRO  52          1HB       PRO  52  12.675   0.676  -7.659
  400   1HG   PRO  52          2HG       PRO  52  11.330  -1.374  -9.299
  401   2HG   PRO  52          1HG       PRO  52  10.816   0.274  -8.916
  402   1HD   PRO  52          2HD       PRO  52  12.011  -0.626 -11.349
  403   2HD   PRO  52          1HD       PRO  52  11.658   1.055 -10.885
  404    H    THR  53           H        THR  53  14.502  -1.849  -7.234
  405    HA   THR  53           HA       THR  53  15.844  -3.793  -9.021
  406    HB   THR  53           HB       THR  53  17.201  -4.453  -7.235
  407    HG1  THR  53           HG1      THR  53  16.480  -4.594  -5.258
  408   1HG2  THR  53          1HG2      THR  53  16.567  -1.568  -6.577
  409   2HG2  THR  53          2HG2      THR  53  17.691  -2.106  -7.826
  410   3HG2  THR  53          3HG2      THR  53  18.033  -2.437  -6.127
  411    HA   PRO  54           HA       PRO  54  12.701  -6.765  -8.098
  412   1HB   PRO  54          2HB       PRO  54  14.037  -9.045  -7.374
  413   2HB   PRO  54          1HB       PRO  54  13.941  -8.438  -9.035
  414   1HG   PRO  54          2HG       PRO  54  16.207  -8.329  -7.113
  415   2HG   PRO  54          1HG       PRO  54  16.228  -8.424  -8.882
  416   1HD   PRO  54          2HD       PRO  54  16.676  -6.106  -7.382
  417   2HD   PRO  54          1HD       PRO  54  16.255  -6.141  -9.109
  418    H    GLU  55           H        GLU  55  15.089  -6.363  -5.550
  419    HA   GLU  55           HA       GLU  55  13.420  -7.523  -3.476
  420   1HB   GLU  55          2HB       GLU  55  16.055  -6.048  -3.462
  421   2HB   GLU  55          1HB       GLU  55  15.209  -6.462  -1.970
  422   1HG   GLU  55          2HG       GLU  55  15.259  -8.828  -2.541
  423   2HG   GLU  55          1HG       GLU  55  15.971  -8.467  -4.113
  424    H    GLU  56           H        GLU  56  14.294  -4.316  -4.690
  425    HA   GLU  56           HA       GLU  56  12.964  -2.856  -2.604
  426   1HB   GLU  56          2HB       GLU  56  14.865  -2.105  -4.262
  427   2HB   GLU  56          1HB       GLU  56  13.507  -1.671  -5.300
  428   1HG   GLU  56          2HG       GLU  56  12.668  -0.102  -3.758
  429   2HG   GLU  56          1HG       GLU  56  13.570  -0.803  -2.415
  430    H    LEU  57           H        LEU  57  12.132  -3.706  -5.980
  431    HA   LEU  57           HA       LEU  57   9.702  -2.294  -6.091
  432   1HB   LEU  57          2HB       LEU  57   9.180  -3.525  -8.024
  433   2HB   LEU  57          1HB       LEU  57  10.911  -3.306  -8.037
  434    HG   LEU  57           HG       LEU  57  10.936  -5.720  -6.985
  435   1HD1  LEU  57          1HD1      LEU  57   8.906  -6.885  -8.316
  436   2HD1  LEU  57          2HD1      LEU  57   8.135  -5.347  -7.934
  437   3HD1  LEU  57          3HD1      LEU  57   8.751  -6.371  -6.638
  438   1HD2  LEU  57          1HD2      LEU  57  11.046  -6.645  -9.257
  439   2HD2  LEU  57          2HD2      LEU  57  11.810  -5.055  -9.221
  440   3HD2  LEU  57          3HD2      LEU  57  10.187  -5.239  -9.887
  441    H    GLN  58           H        GLN  58  10.449  -5.533  -4.859
  442    HA   GLN  58           HA       GLN  58   7.750  -6.369  -4.523
  443   1HB   GLN  58          2HB       GLN  58   9.838  -7.841  -4.487
  444   2HB   GLN  58          1HB       GLN  58  10.066  -7.296  -2.825
  445   1HG   GLN  58          2HG       GLN  58   8.822  -9.409  -2.845
  446   2HG   GLN  58          1HG       GLN  58   7.785  -8.107  -2.266
  447   1HE2  GLN  58          1HE2      GLN  58   5.879  -7.653  -3.465
  448   2HE2  GLN  58          2HE2      GLN  58   5.475  -8.438  -4.913
  449    H    GLU  59           H        GLU  59   9.956  -4.485  -2.511
  450    HA   GLU  59           HA       GLU  59   8.508  -4.626  -0.078
  451   1HB   GLU  59          2HB       GLU  59  10.447  -2.595  -1.184
  452   2HB   GLU  59          1HB       GLU  59   9.692  -2.403   0.398
  453   1HG   GLU  59          2HG       GLU  59  10.521  -4.793   0.890
  454   2HG   GLU  59          1HG       GLU  59  11.546  -4.598  -0.531
  455    H    MET  60           H        MET  60   8.484  -2.131  -2.652
  456    HA   MET  60           HA       MET  60   6.466  -0.545  -1.450
  457   1HB   MET  60          2HB       MET  60   6.201   0.502  -3.678
  458   2HB   MET  60          1HB       MET  60   7.889   0.400  -3.183
  459   1HG   MET  60          2HG       MET  60   8.218  -1.577  -4.581
  460   2HG   MET  60          1HG       MET  60   6.508  -1.586  -5.016
  461   1HE   MET  60          1HE       MET  60   5.313  -0.126  -6.004
  462   2HE   MET  60          2HE       MET  60   5.882  -0.026  -7.669
  463   3HE   MET  60          3HE       MET  60   5.731   1.442  -6.707
  464    H    ILE  61           H        ILE  61   6.332  -3.392  -3.476
  465    HA   ILE  61           HA       ILE  61   3.576  -3.180  -4.206
  466    HB   ILE  61           HB       ILE  61   5.426  -5.573  -4.064
  467   1HG1  ILE  61          2HG1      ILE  61   4.308  -4.200  -6.507
  468   2HG1  ILE  61          1HG1      ILE  61   5.783  -3.622  -5.730
  469   1HG2  ILE  61          1HG2      ILE  61   3.207  -5.947  -5.834
  470   2HG2  ILE  61          2HG2      ILE  61   2.573  -5.498  -4.252
  471   3HG2  ILE  61          3HG2      ILE  61   3.637  -6.896  -4.413
  472   1HD1  ILE  61          1HD1      ILE  61   6.776  -5.878  -5.966
  473   2HD1  ILE  61          2HD1      ILE  61   6.333  -5.196  -7.531
  474   3HD1  ILE  61          3HD1      ILE  61   5.313  -6.425  -6.783
  475    H    ASP  62           H        ASP  62   5.306  -5.001  -1.664
  476    HA   ASP  62           HA       ASP  62   3.041  -6.190  -0.484
  477   1HB   ASP  62          2HB       ASP  62   5.808  -5.561   0.464
  478   2HB   ASP  62          1HB       ASP  62   4.594  -6.023   1.658
  479    H    GLU  63           H        GLU  63   4.439  -2.975  -0.146
  480    HA   GLU  63           HA       GLU  63   3.017  -2.153   2.172
  481   1HB   GLU  63          2HB       GLU  63   4.308  -0.664  -0.106
  482   2HB   GLU  63          1HB       GLU  63   3.392   0.191   1.135
  483   1HG   GLU  63          2HG       GLU  63   4.860  -0.495   2.859
  484   2HG   GLU  63          1HG       GLU  63   5.559  -1.776   1.869
  485    H    VAL  64           H        VAL  64   2.292  -1.819  -1.314
  486    HA   VAL  64           HA       VAL  64  -0.259  -0.551  -0.804
  487    HB   VAL  64           HB       VAL  64   1.038  -0.012  -2.834
  488   1HG1  VAL  64          1HG1      VAL  64   1.055  -1.690  -4.694
  489   2HG1  VAL  64          2HG1      VAL  64   0.452  -2.896  -3.559
  490   3HG1  VAL  64          3HG1      VAL  64   2.039  -2.167  -3.311
  491   1HG2  VAL  64          1HG2      VAL  64  -1.622  -0.164  -2.623
  492   2HG2  VAL  64          2HG2      VAL  64  -1.406  -1.381  -3.880
  493   3HG2  VAL  64          3HG2      VAL  64  -0.843   0.269  -4.145
  494    H    ASP  65           H        ASP  65   0.886  -3.821  -1.424
  495    HA   ASP  65           HA       ASP  65  -1.697  -4.941  -1.992
  496   1HB   ASP  65          2HB       ASP  65   0.944  -5.849  -2.154
  497   2HB   ASP  65          1HB       ASP  65   0.217  -6.836  -0.892
  498    H    GLU  66           H        GLU  66  -3.237  -4.807  -0.495
  499    HA   GLU  66           HA       GLU  66  -2.826  -4.621   2.298
  500   1HB   GLU  66          2HB       GLU  66  -5.333  -5.612   0.922
  501   2HB   GLU  66          1HB       GLU  66  -5.212  -4.893   2.527
  502   1HG   GLU  66          2HG       GLU  66  -4.295  -2.807   1.401
  503   2HG   GLU  66          1HG       GLU  66  -4.748  -3.537  -0.139
  504    H    ASP  67           H        ASP  67  -3.778  -7.350   0.237
  505    HA   ASP  67           HA       ASP  67  -3.624  -9.197   2.492
  506   1HB   ASP  67          2HB       ASP  67  -4.409 -10.896   0.889
  507   2HB   ASP  67          1HB       ASP  67  -5.468  -9.489   0.927
  508    H    GLY  68           H        GLY  68  -1.817  -8.439  -0.453
  509   1HA   GLY  68          2HA       GLY  68   0.388  -8.910  -0.985
  510   2HA   GLY  68          1HA       GLY  68   0.565  -9.663   0.596
  511    H    SER  69           H        SER  69  -1.630 -10.395  -2.106
  512    HA   SER  69           HA       SER  69  -1.208 -13.228  -1.860
  513   1HB   SER  69          2HB       SER  69  -2.560 -13.247  -4.053
  514   2HB   SER  69          1HB       SER  69  -3.359 -12.637  -2.609
  515    HG   SER  69           HG       SER  69  -2.446 -11.289  -4.880
  516    H    GLY  70           H        GLY  70   0.292 -10.710  -3.726
  517   1HA   GLY  70          2HA       GLY  70   2.442 -11.114  -4.760
  518   2HA   GLY  70          1HA       GLY  70   1.898 -12.741  -5.156
  519    H    THR  71           H        THR  71  -0.504 -10.349  -5.589
  520    HA   THR  71           HA       THR  71   0.156  -9.863  -8.402
  521    HB   THR  71           HB       THR  71  -2.060 -10.538  -9.166
  522    HG1  THR  71           HG1      THR  71  -3.607 -10.922  -7.801
  523   1HG2  THR  71          1HG2      THR  71  -0.341 -12.274  -9.175
  524   2HG2  THR  71          2HG2      THR  71  -1.900 -12.988  -8.759
  525   3HG2  THR  71          3HG2      THR  71  -0.708 -12.676  -7.497
  526    H    VAL  72           H        VAL  72  -0.324  -7.808  -8.971
  527    HA   VAL  72           HA       VAL  72  -1.550  -6.095  -6.965
  528    HB   VAL  72           HB       VAL  72  -0.622  -5.262  -9.715
  529   1HG1  VAL  72          1HG1      VAL  72  -0.435  -3.069  -8.673
  530   2HG1  VAL  72          2HG1      VAL  72  -0.858  -3.746  -7.100
  531   3HG1  VAL  72          3HG1      VAL  72  -2.057  -3.700  -8.392
  532   1HG2  VAL  72          1HG2      VAL  72   1.502  -4.605  -8.515
  533   2HG2  VAL  72          2HG2      VAL  72   1.271  -6.349  -8.662
  534   3HG2  VAL  72          3HG2      VAL  72   0.939  -5.540  -7.129
  535    H    ASP  73           H        ASP  73  -3.606  -5.608  -6.891
  536    HA   ASP  73           HA       ASP  73  -5.400  -6.310  -9.088
  537   1HB   ASP  73          2HB       ASP  73  -5.910  -5.134  -6.334
  538   2HB   ASP  73          1HB       ASP  73  -7.177  -5.513  -7.501
  539    H    PHE  74           H        PHE  74  -6.977  -4.645  -9.890
  540    HA   PHE  74           HA       PHE  74  -5.655  -2.367 -10.844
  541   1HB   PHE  74          2HB       PHE  74  -7.775  -3.375 -11.793
  542   2HB   PHE  74          1HB       PHE  74  -8.653  -2.540 -10.508
  543    HD1  PHE  74           HD1      PHE  74  -5.679  -1.534 -12.537
  544    HD2  PHE  74           HD2      PHE  74  -9.768  -0.732 -11.507
  545    HE1  PHE  74           HE1      PHE  74  -5.612   0.558 -13.874
  546    HE2  PHE  74           HE2      PHE  74  -9.699   1.356 -12.840
  547    HZ   PHE  74           HZ       PHE  74  -7.622   2.000 -14.026
  548    H    ASP  75           H        ASP  75  -7.508  -2.866  -7.893
  549    HA   ASP  75           HA       ASP  75  -7.756  -0.112  -7.165
  550   1HB   ASP  75          2HB       ASP  75  -7.724  -2.566  -5.382
  551   2HB   ASP  75          1HB       ASP  75  -8.275  -0.956  -4.916
  552    H    GLU  76           H        GLU  76  -5.417  -2.679  -6.399
  553    HA   GLU  76           HA       GLU  76  -3.768  -1.063  -4.696
  554   1HB   GLU  76          2HB       GLU  76  -2.992  -3.576  -6.205
  555   2HB   GLU  76          1HB       GLU  76  -2.176  -2.895  -4.799
  556   1HG   GLU  76          2HG       GLU  76  -4.160  -3.284  -3.414
  557   2HG   GLU  76          1HG       GLU  76  -5.048  -3.878  -4.814
  558    H    PHE  77           H        PHE  77  -3.951  -1.684  -8.129
  559    HA   PHE  77           HA       PHE  77  -1.398  -0.767  -8.939
  560   1HB   PHE  77          2HB       PHE  77  -3.437  -1.972 -10.215
  561   2HB   PHE  77          1HB       PHE  77  -3.768  -0.316 -10.687
  562    HD1  PHE  77           HD1      PHE  77  -3.382  -0.996 -13.006
  563    HD2  PHE  77           HD2      PHE  77  -0.236  -1.219 -10.076
  564    HE1  PHE  77           HE1      PHE  77  -1.704  -1.183 -14.807
  565    HE2  PHE  77           HE2      PHE  77   1.430  -1.400 -11.893
  566    HZ   PHE  77           HZ       PHE  77   0.691  -1.387 -14.259
  567    H    LEU  78           H        LEU  78  -4.574   0.863  -8.877
  568    HA   LEU  78           HA       LEU  78  -3.551   3.428  -9.616
  569   1HB   LEU  78          2HB       LEU  78  -6.155   2.373  -8.629
  570   2HB   LEU  78          1HB       LEU  78  -5.864   4.098  -8.491
  571    HG   LEU  78           HG       LEU  78  -5.800   4.386 -10.831
  572   1HD1  LEU  78          1HD1      LEU  78  -5.631   1.377 -11.147
  573   2HD1  LEU  78          2HD1      LEU  78  -4.250   2.469 -11.261
  574   3HD1  LEU  78          3HD1      LEU  78  -5.560   2.579 -12.436
  575   1HD2  LEU  78          1HD2      LEU  78  -7.869   3.346 -11.629
  576   2HD2  LEU  78          2HD2      LEU  78  -8.062   3.846  -9.950
  577   3HD2  LEU  78          3HD2      LEU  78  -7.786   2.148 -10.337
  578    H    VAL  79           H        VAL  79  -4.187   1.827  -6.525
  579    HA   VAL  79           HA       VAL  79  -3.974   4.074  -4.828
  580    HB   VAL  79           HB       VAL  79  -3.702   1.123  -4.497
  581   1HG1  VAL  79          1HG1      VAL  79  -2.709   3.122  -2.441
  582   2HG1  VAL  79          2HG1      VAL  79  -1.731   1.917  -3.282
  583   3HG1  VAL  79          3HG1      VAL  79  -2.974   1.404  -2.139
  584   1HG2  VAL  79          1HG2      VAL  79  -5.827   2.523  -4.260
  585   2HG2  VAL  79          2HG2      VAL  79  -5.113   3.184  -2.790
  586   3HG2  VAL  79          3HG2      VAL  79  -5.453   1.458  -2.905
  587    H    MET  80           H        MET  80  -1.520   1.778  -5.999
  588    HA   MET  80           HA       MET  80   0.752   2.659  -4.715
  589   1HB   MET  80          2HB       MET  80   0.194   0.978  -6.875
  590   2HB   MET  80          1HB       MET  80   1.300   2.185  -7.529
  591   1HG   MET  80          2HG       MET  80   2.986   1.663  -5.965
  592   2HG   MET  80          1HG       MET  80   1.853   0.850  -4.886
  593   1HE   MET  80          1HE       MET  80   3.509   0.923  -8.311
  594   2HE   MET  80          2HE       MET  80   1.892   0.452  -8.829
  595   3HE   MET  80          3HE       MET  80   3.229  -0.682  -9.001
  596    H    MET  81           H        MET  81  -1.013   4.248  -7.305
  597    HA   MET  81           HA       MET  81   0.991   6.068  -8.152
  598   1HB   MET  81          2HB       MET  81  -1.274   5.517  -9.266
  599   2HB   MET  81          1HB       MET  81  -1.959   6.692  -8.144
  600   1HG   MET  81          2HG       MET  81   0.168   8.102  -9.078
  601   2HG   MET  81          1HG       MET  81  -0.211   7.124 -10.496
  602   1HE   MET  81          1HE       MET  81  -2.604   7.083 -11.694
  603   2HE   MET  81          2HE       MET  81  -4.030   7.796 -10.943
  604   3HE   MET  81          3HE       MET  81  -3.155   6.513 -10.112
  605    H    VAL  82           H        VAL  82  -1.800   6.569  -5.960
  606    HA   VAL  82           HA       VAL  82  -0.974   9.149  -5.088
  607    HB   VAL  82           HB       VAL  82  -2.605   8.828  -3.243
  608   1HG1  VAL  82          1HG1      VAL  82  -4.563   8.751  -4.664
  609   2HG1  VAL  82          2HG1      VAL  82  -3.673   7.878  -5.913
  610   3HG1  VAL  82          3HG1      VAL  82  -3.273   9.558  -5.557
  611   1HG2  VAL  82          1HG2      VAL  82  -2.139   6.352  -3.013
  612   2HG2  VAL  82          2HG2      VAL  82  -3.092   6.107  -4.478
  613   3HG2  VAL  82          3HG2      VAL  82  -3.850   6.779  -3.034
  614    H    ARG  83           H        ARG  83  -0.146   5.918  -4.065
  615    HA   ARG  83           HA       ARG  83   0.765   6.320  -1.464
  616   1HB   ARG  83          2HB       ARG  83   1.739   4.484  -3.651
  617   2HB   ARG  83          1HB       ARG  83   2.448   4.474  -2.037
  618   1HG   ARG  83          2HG       ARG  83  -0.087   4.315  -1.278
  619   2HG   ARG  83          1HG       ARG  83  -0.304   3.664  -2.902
  620   1HD   ARG  83          2HD       ARG  83   0.135   1.763  -1.563
  621   2HD   ARG  83          1HD       ARG  83   1.665   2.105  -2.359
  622    HE   ARG  83           HE       ARG  83   2.576   2.615  -0.285
  623   1HH1  ARG  83          2HH1      ARG  83  -0.912   2.546  -0.077
  624   2HH1  ARG  83          1HH1      ARG  83  -0.937   2.707   1.644
  625   1HH2  ARG  83          1HH2      ARG  83   2.515   2.825   1.974
  626   2HH2  ARG  83          2HH2      ARG  83   0.996   2.865   2.803
  627    H    CYS  84           H        CYS  84   2.286   7.160  -4.538
  628    HA   CYS  84           HA       CYS  84   4.903   7.658  -3.618
  629   1HB   CYS  84          2HB       CYS  84   5.283   8.821  -5.635
  630   2HB   CYS  84          1HB       CYS  84   4.062   7.621  -6.049
  631    HG   CYS  84           HG       CYS  84   3.572  10.308  -6.733
  632    H    MET  85           H        MET  85   1.977   9.619  -3.515
  633    HA   MET  85           HA       MET  85   3.314  12.007  -2.600
  634   1HB   MET  85          2HB       MET  85   0.957  11.705  -3.788
  635   2HB   MET  85          1HB       MET  85   0.396  11.549  -2.125
  636   1HG   MET  85          2HG       MET  85   2.282  13.781  -2.610
  637   2HG   MET  85          1HG       MET  85   0.711  13.940  -3.396
  638   1HE   MET  85          1HE       MET  85  -0.419  16.122  -0.677
  639   2HE   MET  85          2HE       MET  85  -1.130  15.321  -2.076
  640   3HE   MET  85          3HE       MET  85   0.484  16.017  -2.194
  641    H    LYS  86           H        LYS  86   1.094   9.637  -1.081
  642    HA   LYS  86           HA       LYS  86   0.928   8.869   1.080
  643   1HB   LYS  86          2HB       LYS  86   3.619   9.084   0.716
  644   2HB   LYS  86          1HB       LYS  86   3.383  10.182   2.075
  645   1HG   LYS  86          2HG       LYS  86   3.684   8.134   3.163
  646   2HG   LYS  86          1HG       LYS  86   1.927   8.231   3.055
  647   1HD   LYS  86          2HD       LYS  86   2.279   6.088   2.235
  648   2HD   LYS  86          1HD       LYS  86   2.321   7.014   0.735
  649   1HE   LYS  86          2HE       LYS  86   4.828   7.168   0.996
  650   2HE   LYS  86          1HE       LYS  86   4.696   6.049   2.353
  651   1HZ   LYS  86          1HZ       LYS  86   3.575   4.482   0.822
  652   2HZ   LYS  86          2HZ       LYS  86   5.183   4.813   0.387
  653   3HZ   LYS  86          3HZ       LYS  86   3.903   5.539  -0.463
  654    H    ASP  87           H        ASP  87   0.398   9.578   3.232
  655    HA   ASP  87           HA       ASP  87  -0.803  12.170   3.279
  656   1HB   ASP  87          2HB       ASP  87  -1.340  11.638   5.659
  657   2HB   ASP  87          1HB       ASP  87  -1.845  10.381   4.533
  658    H    ASP  88           H        ASP  88   2.111  10.798   4.780
  659    HA   ASP  88           HA       ASP  88   3.457  13.297   4.854
  660   1HB   ASP  88          2HB       ASP  88   1.724  13.431   6.812
  661   2HB   ASP  88          1HB       ASP  88   2.835  12.333   7.632
  662    H    SER  89           HN       SER  89   5.447  12.634   4.432
  663    HA   SER  89           HA       SER  89   6.380  10.027   5.381
  664   1HB   SER  89          2HB       SER  89   6.759  10.971   3.003
  665   2HB   SER  89          1HB       SER  89   8.007  11.965   3.748
  666    HG   SER  89           HG       SER  89   9.177  10.229   3.478
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1  -7.011   7.035   9.983
    2   2H    MET   1          2H        MET   1  -7.536   8.191  11.110
    3   3H    MET   1          3H        MET   1  -6.050   8.393  10.311
    4    HA   MET   1           HA       MET   1  -8.706   8.387   8.980
    5   1HB   MET   1          2HB       MET   1  -8.086  10.353  10.562
    6   2HB   MET   1          1HB       MET   1  -6.890  10.772   9.338
    7   1HG   MET   1          2HG       MET   1  -8.546  11.147   7.684
    8   2HG   MET   1          1HG       MET   1  -9.782  10.297   8.611
    9   1HE   MET   1          1HE       MET   1 -10.590  13.401   7.575
   10   2HE   MET   1          2HE       MET   1  -8.890  13.122   7.201
   11   3HE   MET   1          3HE       MET   1  -9.355  14.522   8.163
   12    H    ASN   2           H        ASN   2  -7.993   7.043   7.318
   13    HA   ASN   2           HA       ASN   2  -5.813   8.133   5.626
   14   1HB   ASN   2          2HB       ASN   2  -6.720   5.248   5.841
   15   2HB   ASN   2          1HB       ASN   2  -5.409   5.855   4.829
   16   1HD2  ASN   2          1HD2      ASN   2  -6.423   5.624   8.273
   17   2HD2  ASN   2          2HD2      ASN   2  -4.842   5.597   8.891
   18    H    ASP   3           H        ASP   3  -8.755   8.721   5.671
   19    HA   ASP   3           HA       ASP   3 -10.003   7.487   3.432
   20   1HB   ASP   3          2HB       ASP   3 -10.555  10.076   4.888
   21   2HB   ASP   3          1HB       ASP   3 -11.549   9.493   3.553
   22    H    ILE   4           H        ILE   4  -7.680  10.053   3.706
   23    HA   ILE   4           HA       ILE   4  -8.208  11.513   1.367
   24    HB   ILE   4           HB       ILE   4  -5.828  12.188   1.439
   25   1HG1  ILE   4          2HG1      ILE   4  -4.776  11.156   3.734
   26   2HG1  ILE   4          1HG1      ILE   4  -5.681   9.763   3.145
   27   1HG2  ILE   4          1HG2      ILE   4  -5.894  12.954   3.913
   28   2HG2  ILE   4          2HG2      ILE   4  -7.453  12.134   3.978
   29   3HG2  ILE   4          3HG2      ILE   4  -7.208  13.471   2.856
   30   1HD1  ILE   4          1HD1      ILE   4  -4.462   9.657   1.137
   31   2HD1  ILE   4          2HD1      ILE   4  -3.229  10.074   2.327
   32   3HD1  ILE   4          3HD1      ILE   4  -3.902  11.324   1.280
   33    H    TYR   5           H        TYR   5  -6.537   8.451   1.834
   34    HA   TYR   5           HA       TYR   5  -5.276   8.227  -0.681
   35   1HB   TYR   5          2HB       TYR   5  -6.310   6.170   1.273
   36   2HB   TYR   5          1HB       TYR   5  -5.557   5.703  -0.251
   37    HD1  TYR   5           HD1      TYR   5  -3.190   5.859  -0.576
   38    HD2  TYR   5           HD2      TYR   5  -5.007   7.537   2.938
   39    HE1  TYR   5           HE1      TYR   5  -0.947   6.192   0.428
   40    HE2  TYR   5           HE2      TYR   5  -2.767   7.870   3.939
   41    HH   TYR   5           HH       TYR   5   0.072   7.732   2.184
   42    H    LYS   6           H        LYS   6  -8.534   7.372   0.411
   43    HA   LYS   6           HA       LYS   6  -9.322   6.343  -2.191
   44   1HB   LYS   6          2HB       LYS   6 -10.650   6.658   0.472
   45   2HB   LYS   6          1HB       LYS   6 -11.657   6.471  -0.965
   46   1HG   LYS   6          2HG       LYS   6 -11.202   4.269  -1.075
   47   2HG   LYS   6          1HG       LYS   6  -9.467   4.577  -1.024
   48   1HD   LYS   6          2HD       LYS   6 -10.993   4.879   1.526
   49   2HD   LYS   6          1HD       LYS   6 -10.712   3.242   0.933
   50   1HE   LYS   6          2HE       LYS   6  -8.401   3.415   1.135
   51   2HE   LYS   6          1HE       LYS   6  -8.416   5.172   0.987
   52   1HZ   LYS   6          1HZ       LYS   6  -7.949   4.423   3.257
   53   2HZ   LYS   6          2HZ       LYS   6  -9.461   3.653   3.316
   54   3HZ   LYS   6          3HZ       LYS   6  -9.370   5.344   3.175
   55    H    ALA   7           H        ALA   7  -9.431   9.377  -0.476
   56    HA   ALA   7           HA       ALA   7 -11.546  10.605  -1.931
   57   1HB   ALA   7          1HB       ALA   7  -9.218  11.782  -0.404
   58   2HB   ALA   7          2HB       ALA   7 -10.868  11.558   0.174
   59   3HB   ALA   7          3HB       ALA   7 -10.530  12.740  -1.091
   60    H    ALA   8           H        ALA   8  -8.138  10.111  -2.595
   61    HA   ALA   8           HA       ALA   8  -8.039  12.073  -4.729
   62   1HB   ALA   8          1HB       ALA   8  -6.015  11.583  -3.439
   63   2HB   ALA   8          2HB       ALA   8  -5.779  11.173  -5.138
   64   3HB   ALA   8          3HB       ALA   8  -6.080   9.898  -3.957
   65    H    VAL   9           H        VAL   9  -8.141   8.516  -4.486
   66    HA   VAL   9           HA       VAL   9  -8.011   8.018  -7.276
   67    HB   VAL   9           HB       VAL   9  -7.591   6.299  -5.503
   68   1HG1  VAL   9          1HG1      VAL   9  -9.484   6.806  -4.031
   69   2HG1  VAL   9          2HG1      VAL   9  -9.562   5.126  -4.558
   70   3HG1  VAL   9          3HG1      VAL   9 -10.618   6.332  -5.294
   71   1HG2  VAL   9          1HG2      VAL   9  -9.764   5.521  -7.472
   72   2HG2  VAL   9          2HG2      VAL   9  -8.538   4.462  -6.777
   73   3HG2  VAL   9          3HG2      VAL   9  -8.068   5.733  -7.906
   74    H    GLU  10           H        GLU  10 -10.649   8.977  -5.193
   75    HA   GLU  10           HA       GLU  10 -12.709   8.228  -7.082
   76   1HB   GLU  10          2HB       GLU  10 -14.263   9.203  -5.521
   77   2HB   GLU  10          1HB       GLU  10 -13.085   8.257  -4.612
   78   1HG   GLU  10          2HG       GLU  10 -11.926  10.199  -3.884
   79   2HG   GLU  10          1HG       GLU  10 -12.742  11.227  -5.060
   80    H    GLN  11           H        GLN  11 -10.619  10.958  -6.640
   81    HA   GLN  11           HA       GLN  11 -12.302  12.498  -8.525
   82   1HB   GLN  11          2HB       GLN  11 -11.633  14.555  -7.471
   83   2HB   GLN  11          1HB       GLN  11 -12.264  13.479  -6.227
   84   1HG   GLN  11          2HG       GLN  11  -9.792  12.752  -5.897
   85   2HG   GLN  11          1HG       GLN  11  -9.394  14.220  -6.788
   86   1HE2  GLN  11          1HE2      GLN  11  -8.381  14.734  -4.528
   87   2HE2  GLN  11          2HE2      GLN  11  -9.395  15.498  -3.402
   88    H    LEU  12           H        LEU  12  -9.888  10.635  -8.918
   89    HA   LEU  12           HA       LEU  12  -7.772  12.386  -9.819
   90   1HB   LEU  12          2HB       LEU  12  -7.044  10.181 -11.029
   91   2HB   LEU  12          1HB       LEU  12  -6.849  10.360  -9.303
   92    HG   LEU  12           HG       LEU  12  -8.788   8.966  -8.895
   93   1HD1  LEU  12          1HD1      LEU  12  -9.840   7.833 -10.953
   94   2HD1  LEU  12          2HD1      LEU  12  -9.100   9.128 -11.896
   95   3HD1  LEU  12          3HD1      LEU  12 -10.292   9.511 -10.652
   96   1HD2  LEU  12          1HD2      LEU  12  -7.777   6.947  -9.442
   97   2HD2  LEU  12          2HD2      LEU  12  -6.426   8.055  -9.680
   98   3HD2  LEU  12          3HD2      LEU  12  -7.353   7.483 -11.067
   99    H    THR  13           H        THR  13  -6.974  11.754 -12.251
  100    HA   THR  13           HA       THR  13  -9.163  12.713 -13.946
  101    HB   THR  13           HB       THR  13  -7.034  12.597 -15.622
  102    HG1  THR  13           HG1      THR  13  -5.391  12.129 -14.411
  103   1HG2  THR  13          1HG2      THR  13  -7.251  14.846 -15.595
  104   2HG2  THR  13          2HG2      THR  13  -6.970  14.952 -13.857
  105   3HG2  THR  13          3HG2      THR  13  -8.572  14.539 -14.470
  106    H    ASP  14           H        ASP  14  -9.341  11.845 -16.143
  107    HA   ASP  14           HA       ASP  14  -9.740   9.006 -16.104
  108   1HB   ASP  14          2HB       ASP  14  -9.933  11.094 -18.279
  109   2HB   ASP  14          1HB       ASP  14 -10.209   9.381 -18.591
  110    H    GLU  15           H        GLU  15  -7.253  11.185 -17.290
  111    HA   GLU  15           HA       GLU  15  -5.872   9.265 -18.913
  112   1HB   GLU  15          2HB       GLU  15  -5.318  12.006 -17.895
  113   2HB   GLU  15          1HB       GLU  15  -3.924  11.020 -18.333
  114   1HG   GLU  15          2HG       GLU  15  -5.311  10.503 -20.502
  115   2HG   GLU  15          1HG       GLU  15  -6.181  11.975 -20.072
  116    H    GLN  16           H        GLN  16  -5.630  10.352 -15.559
  117    HA   GLN  16           HA       GLN  16  -3.248   9.036 -14.829
  118   1HB   GLN  16          2HB       GLN  16  -4.293  10.699 -13.373
  119   2HB   GLN  16          1HB       GLN  16  -5.695   9.654 -13.151
  120   1HG   GLN  16          2HG       GLN  16  -4.636   8.361 -11.619
  121   2HG   GLN  16          1HG       GLN  16  -3.130   8.337 -12.541
  122   1HE2  GLN  16          1HE2      GLN  16  -5.077  10.838 -10.782
  123   2HE2  GLN  16          2HE2      GLN  16  -3.737  11.531 -10.008
  124    H    LYS  17           H        LYS  17  -6.628   7.958 -14.845
  125    HA   LYS  17           HA       LYS  17  -6.141   5.378 -13.722
  126   1HB   LYS  17          2HB       LYS  17  -8.410   6.288 -15.514
  127   2HB   LYS  17          1HB       LYS  17  -8.384   4.810 -14.554
  128   1HG   LYS  17          2HG       LYS  17  -8.620   5.946 -12.543
  129   2HG   LYS  17          1HG       LYS  17  -7.895   7.426 -13.173
  130   1HD   LYS  17          2HD       LYS  17 -10.003   8.202 -13.423
  131   2HD   LYS  17          1HD       LYS  17 -10.150   7.074 -14.769
  132   1HE   LYS  17          2HE       LYS  17 -10.652   6.161 -11.940
  133   2HE   LYS  17          1HE       LYS  17 -11.923   6.952 -12.872
  134   1HZ   LYS  17          1HZ       LYS  17 -11.540   5.277 -14.632
  135   2HZ   LYS  17          2HZ       LYS  17 -12.097   4.604 -13.175
  136   3HZ   LYS  17          3HZ       LYS  17 -10.457   4.475 -13.601
  137    H    ASN  18           H        ASN  18  -6.224   6.672 -17.014
  138    HA   ASN  18           HA       ASN  18  -6.108   4.179 -18.378
  139   1HB   ASN  18          2HB       ASN  18  -5.546   7.023 -19.144
  140   2HB   ASN  18          1HB       ASN  18  -5.081   5.719 -20.236
  141   1HD2  ASN  18          1HD2      ASN  18  -7.465   7.853 -20.026
  142   2HD2  ASN  18          2HD2      ASN  18  -8.806   6.909 -20.466
  143    H    GLU  19           H        GLU  19  -3.622   6.233 -16.953
  144    HA   GLU  19           HA       GLU  19  -1.353   5.260 -18.292
  145   1HB   GLU  19          2HB       GLU  19  -1.352   5.895 -15.339
  146   2HB   GLU  19          1HB       GLU  19  -0.034   6.078 -16.494
  147   1HG   GLU  19          2HG       GLU  19  -1.934   7.655 -17.644
  148   2HG   GLU  19          1HG       GLU  19  -2.323   7.859 -15.935
  149    H    PHE  20           H        PHE  20  -2.906   4.097 -15.308
  150    HA   PHE  20           HA       PHE  20  -1.148   1.783 -15.197
  151   1HB   PHE  20          2HB       PHE  20  -3.349   2.839 -13.445
  152   2HB   PHE  20          1HB       PHE  20  -2.701   1.214 -13.220
  153    HD1  PHE  20           HD1      PHE  20  -1.909   4.834 -13.105
  154    HD2  PHE  20           HD2      PHE  20  -0.442   0.853 -12.442
  155    HE1  PHE  20           HE1      PHE  20   0.031   5.750 -11.880
  156    HE2  PHE  20           HE2      PHE  20   1.495   1.764 -11.206
  157    HZ   PHE  20           HZ       PHE  20   1.740   4.219 -10.928
  158    H    LYS  21           H        LYS  21  -4.600   2.434 -15.824
  159    HA   LYS  21           HA       LYS  21  -5.494  -0.216 -15.966
  160   1HB   LYS  21          2HB       LYS  21  -7.013   1.719 -15.953
  161   2HB   LYS  21          1HB       LYS  21  -6.485   2.145 -17.579
  162   1HG   LYS  21          2HG       LYS  21  -7.373  -0.658 -17.261
  163   2HG   LYS  21          1HG       LYS  21  -8.639   0.547 -17.031
  164   1HD   LYS  21          2HD       LYS  21  -6.850   0.992 -19.359
  165   2HD   LYS  21          1HD       LYS  21  -7.921  -0.404 -19.470
  166   1HE   LYS  21          2HE       LYS  21  -9.051   2.216 -18.544
  167   2HE   LYS  21          1HE       LYS  21  -8.754   1.975 -20.264
  168   1HZ   LYS  21          1HZ       LYS  21 -10.983   1.299 -19.705
  169   2HZ   LYS  21          2HZ       LYS  21 -10.408   0.239 -18.509
  170   3HZ   LYS  21          3HZ       LYS  21 -10.078  -0.065 -20.148
  171    H    ALA  22           H        ALA  22  -3.952   1.795 -18.456
  172    HA   ALA  22           HA       ALA  22  -4.337   0.073 -20.662
  173   1HB   ALA  22          1HB       ALA  22  -3.517   2.350 -20.972
  174   2HB   ALA  22          2HB       ALA  22  -2.348   1.207 -21.633
  175   3HB   ALA  22          3HB       ALA  22  -2.050   1.968 -20.070
  176    H    ALA  23           H        ALA  23  -1.565   0.400 -18.452
  177    HA   ALA  23           HA       ALA  23  -0.099  -1.818 -19.458
  178   1HB   ALA  23          1HB       ALA  23   1.379  -1.463 -17.671
  179   2HB   ALA  23          2HB       ALA  23   0.105  -0.855 -16.611
  180   3HB   ALA  23          3HB       ALA  23   0.701   0.142 -17.939
  181    H    PHE  24           H        PHE  24  -2.507  -1.399 -16.931
  182    HA   PHE  24           HA       PHE  24  -2.307  -3.885 -15.644
  183   1HB   PHE  24          2HB       PHE  24  -3.704  -1.832 -14.974
  184   2HB   PHE  24          1HB       PHE  24  -4.918  -2.439 -16.099
  185    HD1  PHE  24           HD1      PHE  24  -5.815  -4.798 -15.778
  186    HD2  PHE  24           HD2      PHE  24  -3.448  -2.780 -12.820
  187    HE1  PHE  24           HE1      PHE  24  -6.607  -6.391 -14.057
  188    HE2  PHE  24           HE2      PHE  24  -4.242  -4.367 -11.097
  189    HZ   PHE  24           HZ       PHE  24  -5.822  -6.168 -11.712
  190    H    ASP  25           H        ASP  25  -4.289  -2.867 -18.421
  191    HA   ASP  25           HA       ASP  25  -5.688  -5.269 -18.816
  192   1HB   ASP  25          2HB       ASP  25  -6.006  -2.941 -19.933
  193   2HB   ASP  25          1HB       ASP  25  -4.852  -3.539 -21.126
  194    H    ILE  26           H        ILE  26  -2.564  -4.204 -20.166
  195    HA   ILE  26           HA       ILE  26  -2.255  -6.563 -21.778
  196    HB   ILE  26           HB       ILE  26   0.101  -5.769 -22.088
  197   1HG1  ILE  26          2HG1      ILE  26  -0.821  -3.435 -20.376
  198   2HG1  ILE  26          1HG1      ILE  26   0.306  -4.678 -19.839
  199   1HG2  ILE  26          1HG2      ILE  26  -2.054  -3.668 -22.471
  200   2HG2  ILE  26          2HG2      ILE  26  -1.774  -5.040 -23.543
  201   3HG2  ILE  26          3HG2      ILE  26  -0.546  -3.787 -23.377
  202   1HD1  ILE  26          1HD1      ILE  26   2.029  -3.808 -21.035
  203   2HD1  ILE  26          2HD1      ILE  26   1.055  -2.337 -21.037
  204   3HD1  ILE  26          3HD1      ILE  26   1.004  -3.430 -22.420
  205    H    PHE  27           H        PHE  27  -1.033  -5.570 -18.583
  206    HA   PHE  27           HA       PHE  27   0.696  -7.817 -18.268
  207   1HB   PHE  27          2HB       PHE  27  -0.476  -5.847 -16.310
  208   2HB   PHE  27          1HB       PHE  27   0.532  -7.199 -15.784
  209    HD1  PHE  27           HD1      PHE  27   2.644  -7.519 -17.597
  210    HD2  PHE  27           HD2      PHE  27   0.720  -3.847 -16.472
  211    HE1  PHE  27           HE1      PHE  27   4.667  -6.253 -18.262
  212    HE2  PHE  27           HE2      PHE  27   2.743  -2.585 -17.141
  213    HZ   PHE  27           HZ       PHE  27   4.718  -3.786 -18.034
  214    H    ILE  28           H        ILE  28  -2.740  -7.321 -17.623
  215    HA   ILE  28           HA       ILE  28  -2.890  -9.957 -16.318
  216    HB   ILE  28           HB       ILE  28  -5.180  -9.418 -15.739
  217   1HG1  ILE  28          2HG1      ILE  28  -5.732  -6.840 -16.369
  218   2HG1  ILE  28          1HG1      ILE  28  -4.791  -7.298 -17.789
  219   1HG2  ILE  28          1HG2      ILE  28  -4.689  -7.870 -14.103
  220   2HG2  ILE  28          2HG2      ILE  28  -3.796  -6.825 -15.205
  221   3HG2  ILE  28          3HG2      ILE  28  -3.055  -8.306 -14.602
  222   1HD1  ILE  28          1HD1      ILE  28  -6.340  -8.867 -18.482
  223   2HD1  ILE  28          2HD1      ILE  28  -7.418  -7.724 -17.683
  224   3HD1  ILE  28          3HD1      ILE  28  -6.906  -9.187 -16.843
  225    H    GLN  29           H        GLN  29  -2.537  -9.212 -19.346
  226    HA   GLN  29           HA       GLN  29  -4.686  -9.931 -20.901
  227   1HB   GLN  29          2HB       GLN  29  -2.528  -9.217 -21.826
  228   2HB   GLN  29          1HB       GLN  29  -1.793 -10.733 -21.306
  229   1HG   GLN  29          2HG       GLN  29  -3.178 -12.010 -22.800
  230   2HG   GLN  29          1HG       GLN  29  -4.160 -10.596 -23.189
  231   1HE2  GLN  29          1HE2      GLN  29  -2.652  -8.641 -24.033
  232   2HE2  GLN  29          2HE2      GLN  29  -1.493  -9.096 -25.186
  233    H    ASP  30           H        ASP  30  -2.423 -12.089 -19.225
  234    HA   ASP  30           HA       ASP  30  -4.154 -14.387 -19.917
  235   1HB   ASP  30          2HB       ASP  30  -1.211 -14.183 -19.307
  236   2HB   ASP  30          1HB       ASP  30  -2.070 -15.717 -19.161
  237    H    ALA  31           H        ALA  31  -4.707 -12.486 -17.754
  238    HA   ALA  31           HA       ALA  31  -4.198 -14.085 -15.335
  239   1HB   ALA  31          1HB       ALA  31  -3.757 -11.593 -15.332
  240   2HB   ALA  31          2HB       ALA  31  -4.853 -12.155 -14.071
  241   3HB   ALA  31          3HB       ALA  31  -5.496 -11.358 -15.506
  242    H    GLU  32           H        GLU  32  -5.979 -14.498 -13.868
  243    HA   GLU  32           HA       GLU  32  -8.614 -14.642 -15.211
  244   1HB   GLU  32          2HB       GLU  32  -7.277 -16.792 -13.551
  245   2HB   GLU  32          1HB       GLU  32  -8.959 -16.840 -14.079
  246   1HG   GLU  32          2HG       GLU  32  -8.286 -16.817 -16.413
  247   2HG   GLU  32          1HG       GLU  32  -6.597 -16.587 -15.963
  248    H    ASP  33           H        ASP  33  -7.387 -12.799 -13.100
  249    HA   ASP  33           HA       ASP  33  -9.679 -12.912 -11.285
  250   1HB   ASP  33          2HB       ASP  33  -7.513 -14.175 -10.385
  251   2HB   ASP  33          1HB       ASP  33  -7.035 -12.532  -9.958
  252    H    GLY  34           H        GLY  34  -8.309 -11.077 -13.410
  253   1HA   GLY  34          2HA       GLY  34  -8.047  -8.817 -13.762
  254   2HA   GLY  34          1HA       GLY  34  -9.176  -8.614 -12.427
  255    H    CYS  35           H        CYS  35  -5.829  -9.851 -12.641
  256    HA   CYS  35           HA       CYS  35  -4.844  -7.646 -10.980
  257   1HB   CYS  35          2HB       CYS  35  -4.541 -10.541 -10.135
  258   2HB   CYS  35          1HB       CYS  35  -3.805  -9.150  -9.343
  259    HG   CYS  35           HG       CYS  35  -5.913  -9.284  -7.997
  260    H    ILE  36           H        ILE  36  -2.699  -7.190 -11.348
  261    HA   ILE  36           HA       ILE  36  -1.426  -8.675 -13.525
  262    HB   ILE  36           HB       ILE  36   0.083  -6.886 -13.772
  263   1HG1  ILE  36          2HG1      ILE  36  -0.235  -5.045 -11.729
  264   2HG1  ILE  36          1HG1      ILE  36  -0.308  -6.586 -10.873
  265   1HG2  ILE  36          1HG2      ILE  36  -1.727  -5.802 -14.604
  266   2HG2  ILE  36          2HG2      ILE  36  -1.572  -4.803 -13.159
  267   3HG2  ILE  36          3HG2      ILE  36  -2.713  -6.145 -13.183
  268   1HD1  ILE  36          1HD1      ILE  36   1.788  -6.831 -12.768
  269   2HD1  ILE  36          2HD1      ILE  36   1.939  -6.723 -11.014
  270   3HD1  ILE  36          3HD1      ILE  36   1.995  -5.259 -11.996
  271    H    SER  37           H        SER  37   0.940  -9.191 -13.320
  272    HA   SER  37           HA       SER  37   1.336 -10.682 -10.852
  273   1HB   SER  37          2HB       SER  37   1.984 -11.249 -13.431
  274   2HB   SER  37          1HB       SER  37   3.516 -10.607 -12.848
  275    HG   SER  37           HG       SER  37   2.092 -12.879 -12.072
  276    H    THR  38           H        THR  38   2.071  -9.574  -9.148
  277    HA   THR  38           HA       THR  38   3.513  -7.157  -9.222
  278    HB   THR  38           HB       THR  38   2.415  -7.772  -7.174
  279    HG1  THR  38           HG1      THR  38   4.166  -7.532  -5.740
  280   1HG2  THR  38          1HG2      THR  38   2.595  -9.783  -6.107
  281   2HG2  THR  38          2HG2      THR  38   4.310  -9.950  -6.488
  282   3HG2  THR  38          3HG2      THR  38   3.096 -10.337  -7.705
  283    H    LYS  39           H        LYS  39   4.589 -10.513  -9.230
  284    HA   LYS  39           HA       LYS  39   7.356 -10.018  -8.808
  285   1HB   LYS  39          2HB       LYS  39   7.714 -12.273  -9.715
  286   2HB   LYS  39          1HB       LYS  39   6.381 -12.269  -8.563
  287   1HG   LYS  39          2HG       LYS  39   5.067 -11.736 -10.914
  288   2HG   LYS  39          1HG       LYS  39   6.357 -12.804 -11.467
  289   1HD   LYS  39          2HD       LYS  39   5.592 -14.157  -9.262
  290   2HD   LYS  39          1HD       LYS  39   4.061 -13.378  -9.663
  291   1HE   LYS  39          2HE       LYS  39   4.176 -14.279 -11.945
  292   2HE   LYS  39          1HE       LYS  39   5.734 -15.021 -11.587
  293   1HZ   LYS  39          1HZ       LYS  39   3.927 -16.610 -11.380
  294   2HZ   LYS  39          2HZ       LYS  39   3.172 -15.634 -10.213
  295   3HZ   LYS  39          3HZ       LYS  39   4.673 -16.356  -9.878
  296    H    GLU  40           H        GLU  40   5.272  -9.740 -11.595
  297    HA   GLU  40           HA       GLU  40   7.602  -9.279 -13.352
  298   1HB   GLU  40          2HB       GLU  40   4.701  -9.718 -14.116
  299   2HB   GLU  40          1HB       GLU  40   6.068  -9.584 -15.223
  300   1HG   GLU  40          2HG       GLU  40   6.991 -11.564 -13.634
  301   2HG   GLU  40          1HG       GLU  40   5.258 -11.856 -13.481
  302    H    LEU  41           H        LEU  41   6.327  -7.400 -11.303
  303    HA   LEU  41           HA       LEU  41   5.021  -5.340 -12.808
  304   1HB   LEU  41          2HB       LEU  41   5.186  -5.907 -10.164
  305   2HB   LEU  41          1HB       LEU  41   6.338  -4.596 -10.281
  306    HG   LEU  41           HG       LEU  41   3.757  -4.085 -11.618
  307   1HD1  LEU  41          1HD1      LEU  41   2.661  -5.115  -9.849
  308   2HD1  LEU  41          2HD1      LEU  41   2.877  -3.491  -9.196
  309   3HD1  LEU  41          3HD1      LEU  41   3.968  -4.789  -8.712
  310   1HD2  LEU  41          1HD2      LEU  41   5.426  -2.335 -11.381
  311   2HD2  LEU  41          2HD2      LEU  41   5.525  -2.610  -9.641
  312   3HD2  LEU  41          3HD2      LEU  41   4.055  -1.935 -10.346
  313    H    GLY  42           H        GLY  42   8.280  -6.273 -12.618
  314   1HA   GLY  42          2HA       GLY  42   9.658  -3.820 -12.608
  315   2HA   GLY  42          1HA       GLY  42  10.226  -5.301 -13.376
  316    H    LYS  43           H        LYS  43   7.958  -5.557 -15.164
  317    HA   LYS  43           HA       LYS  43   8.876  -3.965 -17.356
  318   1HB   LYS  43          2HB       LYS  43   6.303  -5.551 -17.153
  319   2HB   LYS  43          1HB       LYS  43   7.089  -5.005 -18.633
  320   1HG   LYS  43          2HG       LYS  43   8.500  -6.801 -16.653
  321   2HG   LYS  43          1HG       LYS  43   7.487  -7.452 -17.941
  322   1HD   LYS  43          2HD       LYS  43   8.884  -6.587 -19.640
  323   2HD   LYS  43          1HD       LYS  43   9.683  -5.470 -18.533
  324   1HE   LYS  43          2HE       LYS  43   9.862  -8.462 -18.160
  325   2HE   LYS  43          1HE       LYS  43  10.990  -7.591 -19.198
  326   1HZ   LYS  43          1HZ       LYS  43  11.968  -7.703 -17.070
  327   2HZ   LYS  43          2HZ       LYS  43  10.539  -7.215 -16.291
  328   3HZ   LYS  43          3HZ       LYS  43  11.414  -6.109 -17.239
  329    H    VAL  44           H        VAL  44   6.541  -3.459 -14.864
  330    HA   VAL  44           HA       VAL  44   5.083  -1.399 -16.339
  331    HB   VAL  44           HB       VAL  44   4.686  -1.769 -13.404
  332   1HG1  VAL  44          1HG1      VAL  44   3.430  -0.398 -15.460
  333   2HG1  VAL  44          2HG1      VAL  44   2.741  -0.728 -13.871
  334   3HG1  VAL  44          3HG1      VAL  44   2.395  -1.805 -15.224
  335   1HG2  VAL  44          1HG2      VAL  44   4.612  -3.996 -15.220
  336   2HG2  VAL  44          2HG2      VAL  44   2.961  -3.609 -14.738
  337   3HG2  VAL  44          3HG2      VAL  44   4.177  -3.959 -13.512
  338    H    MET  45           H        MET  45   7.287  -1.757 -13.592
  339    HA   MET  45           HA       MET  45   7.384   0.863 -12.667
  340   1HB   MET  45          2HB       MET  45   8.900  -1.510 -12.290
  341   2HB   MET  45          1HB       MET  45  10.044  -0.220 -12.661
  342   1HG   MET  45          2HG       MET  45   9.848   0.221 -10.428
  343   2HG   MET  45          1HG       MET  45   8.399   1.083 -10.940
  344   1HE   MET  45          1HE       MET  45   6.764   1.091  -9.572
  345   2HE   MET  45          2HE       MET  45   5.838  -0.241  -8.885
  346   3HE   MET  45          3HE       MET  45   5.822   0.027 -10.625
  347    H    ARG  46           H        ARG  46   9.230  -0.662 -15.302
  348    HA   ARG  46           HA       ARG  46  10.789   1.626 -15.955
  349   1HB   ARG  46          2HB       ARG  46  11.236   0.498 -18.097
  350   2HB   ARG  46          1HB       ARG  46  11.414  -0.614 -16.741
  351   1HG   ARG  46          2HG       ARG  46   9.222  -1.573 -17.167
  352   2HG   ARG  46          1HG       ARG  46   8.897  -0.374 -18.419
  353   1HD   ARG  46          2HD       ARG  46  11.188  -2.351 -18.530
  354   2HD   ARG  46          1HD       ARG  46   9.631  -2.614 -19.306
  355    HE   ARG  46           HE       ARG  46  10.494  -0.152 -20.229
  356   1HH1  ARG  46          2HH1      ARG  46  11.699  -3.430 -20.221
  357   2HH1  ARG  46          1HH1      ARG  46  12.594  -3.237 -21.689
  358   1HH2  ARG  46          1HH2      ARG  46  11.675   0.077 -22.154
  359   2HH2  ARG  46          2HH2      ARG  46  12.582  -1.259 -22.781
  360    H    MET  47           H        MET  47   7.556   0.598 -16.860
  361    HA   MET  47           HA       MET  47   7.230   2.557 -18.959
  362   1HB   MET  47          2HB       MET  47   5.356   0.671 -17.540
  363   2HB   MET  47          1HB       MET  47   4.766   1.876 -18.683
  364   1HG   MET  47          2HG       MET  47   7.061   0.166 -19.539
  365   2HG   MET  47          1HG       MET  47   5.462  -0.577 -19.482
  366   1HE   MET  47          1HE       MET  47   7.159   2.879 -21.641
  367   2HE   MET  47          2HE       MET  47   7.563   1.364 -22.444
  368   3HE   MET  47          3HE       MET  47   7.898   1.557 -20.726
  369    H    LEU  48           H        LEU  48   6.687   2.412 -15.502
  370    HA   LEU  48           HA       LEU  48   4.924   4.690 -15.367
  371   1HB   LEU  48          2HB       LEU  48   6.329   2.930 -13.429
  372   2HB   LEU  48          1HB       LEU  48   5.899   4.532 -12.876
  373    HG   LEU  48           HG       LEU  48   3.546   4.089 -13.264
  374   1HD1  LEU  48          1HD1      LEU  48   4.184   1.266 -14.083
  375   2HD1  LEU  48          2HD1      LEU  48   4.152   2.546 -15.296
  376   3HD1  LEU  48          3HD1      LEU  48   2.707   2.190 -14.350
  377   1HD2  LEU  48          1HD2      LEU  48   5.203   2.192 -11.672
  378   2HD2  LEU  48          2HD2      LEU  48   3.504   1.765 -11.891
  379   3HD2  LEU  48          3HD2      LEU  48   3.939   3.301 -11.138
  380    H    GLY  49           H        GLY  49   8.365   4.118 -15.285
  381   1HA   GLY  49          2HA       GLY  49   9.809   5.958 -16.034
  382   2HA   GLY  49          1HA       GLY  49   8.832   7.036 -15.045
  383    H    GLN  50           H        GLN  50   9.955   3.821 -14.062
  384    HA   GLN  50           HA       GLN  50  12.120   4.909 -12.452
  385   1HB   GLN  50          2HB       GLN  50  11.208   4.000 -10.314
  386   2HB   GLN  50          1HB       GLN  50  10.278   5.358 -10.944
  387   1HG   GLN  50          2HG       GLN  50   9.116   3.087 -12.121
  388   2HG   GLN  50          1HG       GLN  50   9.427   2.622 -10.450
  389   1HE2  GLN  50          1HE2      GLN  50   8.122   5.480 -12.254
  390   2HE2  GLN  50          2HE2      GLN  50   6.899   5.805 -11.123
  391    H    ASN  51           H        ASN  51  13.710   3.448 -12.206
  392    HA   ASN  51           HA       ASN  51  13.061   0.603 -12.721
  393   1HB   ASN  51          2HB       ASN  51  14.447   2.059 -14.481
  394   2HB   ASN  51          1HB       ASN  51  15.774   1.635 -13.402
  395   1HD2  ASN  51          1HD2      ASN  51  13.064   0.112 -15.228
  396   2HD2  ASN  51          2HD2      ASN  51  13.872  -1.360 -15.480
  397    HA   PRO  52           HA       PRO  52  15.154   0.764  -8.648
  398   1HB   PRO  52          2HB       PRO  52  13.386  -0.906  -7.396
  399   2HB   PRO  52          1HB       PRO  52  13.133   0.837  -7.570
  400   1HG   PRO  52          2HG       PRO  52  11.807  -1.399  -8.966
  401   2HG   PRO  52          1HG       PRO  52  11.225   0.243  -8.662
  402   1HD   PRO  52          2HD       PRO  52  12.304  -0.767 -11.104
  403   2HD   PRO  52          1HD       PRO  52  11.890   0.924 -10.735
  404    H    THR  53           H        THR  53  15.111  -1.554  -7.096
  405    HA   THR  53           HA       THR  53  16.631  -3.447  -8.777
  406    HB   THR  53           HB       THR  53  17.849  -4.040  -6.864
  407    HG1  THR  53           HG1      THR  53  16.979  -4.176  -4.941
  408   1HG2  THR  53          1HG2      THR  53  18.120  -1.599  -7.490
  409   2HG2  THR  53          2HG2      THR  53  18.594  -2.014  -5.842
  410   3HG2  THR  53          3HG2      THR  53  17.048  -1.220  -6.141
  411    HA   PRO  54           HA       PRO  54  13.635  -6.639  -8.140
  412   1HB   PRO  54          2HB       PRO  54  15.044  -8.824  -7.270
  413   2HB   PRO  54          1HB       PRO  54  15.077  -8.221  -8.934
  414   1HG   PRO  54          2HG       PRO  54  17.123  -7.971  -6.797
  415   2HG   PRO  54          1HG       PRO  54  17.328  -8.045  -8.553
  416   1HD   PRO  54          2HD       PRO  54  17.451  -5.718  -6.996
  417   2HD   PRO  54          1HD       PRO  54  17.239  -5.762  -8.761
  418    H    GLU  55           H        GLU  55  15.678  -5.997  -5.368
  419    HA   GLU  55           HA       GLU  55  13.953  -7.328  -3.454
  420   1HB   GLU  55          2HB       GLU  55  16.302  -5.443  -3.123
  421   2HB   GLU  55          1HB       GLU  55  15.418  -6.155  -1.772
  422   1HG   GLU  55          2HG       GLU  55  15.912  -8.428  -2.759
  423   2HG   GLU  55          1HG       GLU  55  16.969  -7.626  -3.921
  424    H    GLU  56           H        GLU  56  14.574  -4.034  -4.609
  425    HA   GLU  56           HA       GLU  56  12.740  -2.795  -2.753
  426   1HB   GLU  56          2HB       GLU  56  14.777  -1.697  -3.877
  427   2HB   GLU  56          1HB       GLU  56  13.756  -1.556  -5.307
  428   1HG   GLU  56          2HG       GLU  56  12.099  -0.278  -4.047
  429   2HG   GLU  56          1HG       GLU  56  13.031  -0.484  -2.564
  430    H    LEU  57           H        LEU  57  12.596  -4.024  -6.056
  431    HA   LEU  57           HA       LEU  57  10.208  -2.815  -6.909
  432   1HB   LEU  57          2HB       LEU  57  11.451  -3.863  -8.571
  433   2HB   LEU  57          1HB       LEU  57  11.715  -5.300  -7.617
  434    HG   LEU  57           HG       LEU  57  10.226  -5.507  -9.659
  435   1HD1  LEU  57          1HD1      LEU  57   8.527  -6.422  -7.451
  436   2HD1  LEU  57          2HD1      LEU  57  10.234  -6.813  -7.240
  437   3HD1  LEU  57          3HD1      LEU  57   9.376  -7.355  -8.684
  438   1HD2  LEU  57          1HD2      LEU  57   7.827  -4.741  -8.211
  439   2HD2  LEU  57          2HD2      LEU  57   8.340  -4.284  -9.834
  440   3HD2  LEU  57          3HD2      LEU  57   8.896  -3.357  -8.440
  441    H    GLN  58           H        GLN  58  10.812  -5.887  -5.220
  442    HA   GLN  58           HA       GLN  58   8.017  -6.557  -5.020
  443   1HB   GLN  58          2HB       GLN  58   9.907  -8.236  -5.019
  444   2HB   GLN  58          1HB       GLN  58  10.301  -7.690  -3.390
  445   1HG   GLN  58          2HG       GLN  58   8.890  -9.587  -3.093
  446   2HG   GLN  58          1HG       GLN  58   7.857  -8.191  -2.793
  447   1HE2  GLN  58          1HE2      GLN  58   5.999  -7.988  -4.088
  448   2HE2  GLN  58          2HE2      GLN  58   5.686  -8.943  -5.456
  449    H    GLU  59           H        GLU  59  10.380  -4.943  -2.958
  450    HA   GLU  59           HA       GLU  59   8.880  -4.983  -0.549
  451   1HB   GLU  59          2HB       GLU  59  11.223  -3.467  -1.578
  452   2HB   GLU  59          1HB       GLU  59  10.343  -2.759  -0.223
  453   1HG   GLU  59          2HG       GLU  59  10.595  -4.832   1.061
  454   2HG   GLU  59          1HG       GLU  59  11.414  -5.597  -0.302
  455    H    MET  60           H        MET  60   9.107  -2.562  -3.168
  456    HA   MET  60           HA       MET  60   7.419  -0.659  -1.910
  457   1HB   MET  60          2HB       MET  60   7.320   0.471  -4.052
  458   2HB   MET  60          1HB       MET  60   8.968  -0.077  -3.755
  459   1HG   MET  60          2HG       MET  60   8.501  -2.094  -5.155
  460   2HG   MET  60          1HG       MET  60   6.911  -1.431  -5.527
  461   1HE   MET  60          1HE       MET  60   6.380   0.543  -6.729
  462   2HE   MET  60          2HE       MET  60   7.459   1.626  -7.604
  463   3HE   MET  60          3HE       MET  60   7.384   1.702  -5.845
  464    H    ILE  61           H        ILE  61   6.738  -3.452  -3.938
  465    HA   ILE  61           HA       ILE  61   3.980  -2.705  -4.387
  466    HB   ILE  61           HB       ILE  61   5.374  -5.371  -4.749
  467   1HG1  ILE  61          2HG1      ILE  61   6.234  -3.639  -6.253
  468   2HG1  ILE  61          1HG1      ILE  61   5.226  -4.762  -7.166
  469   1HG2  ILE  61          1HG2      ILE  61   2.560  -4.435  -5.141
  470   2HG2  ILE  61          2HG2      ILE  61   3.158  -6.012  -4.627
  471   3HG2  ILE  61          3HG2      ILE  61   3.232  -5.553  -6.329
  472   1HD1  ILE  61          1HD1      ILE  61   4.633  -2.508  -7.832
  473   2HD1  ILE  61          2HD1      ILE  61   4.437  -2.015  -6.151
  474   3HD1  ILE  61          3HD1      ILE  61   3.304  -3.158  -6.872
  475    H    ASP  62           H        ASP  62   5.675  -5.051  -2.311
  476    HA   ASP  62           HA       ASP  62   3.511  -6.216  -1.023
  477   1HB   ASP  62          2HB       ASP  62   6.171  -6.483  -0.739
  478   2HB   ASP  62          1HB       ASP  62   5.836  -5.511   0.694
  479    H    GLU  63           H        GLU  63   4.998  -3.060  -0.461
  480    HA   GLU  63           HA       GLU  63   3.681  -2.450   1.983
  481   1HB   GLU  63          2HB       GLU  63   4.978  -0.766  -0.153
  482   2HB   GLU  63          1HB       GLU  63   4.142  -0.025   1.211
  483   1HG   GLU  63          2HG       GLU  63   5.589  -1.636   2.668
  484   2HG   GLU  63          1HG       GLU  63   6.601  -1.761   1.229
  485    H    VAL  64           H        VAL  64   2.952  -1.459  -1.386
  486    HA   VAL  64           HA       VAL  64   0.489  -0.187  -0.706
  487    HB   VAL  64           HB       VAL  64   1.688   0.415  -2.755
  488   1HG1  VAL  64          1HG1      VAL  64   1.621  -1.157  -4.701
  489   2HG1  VAL  64          2HG1      VAL  64   1.015  -2.411  -3.620
  490   3HG1  VAL  64          3HG1      VAL  64   2.627  -1.736  -3.373
  491   1HG2  VAL  64          1HG2      VAL  64  -0.856  -0.874  -3.707
  492   2HG2  VAL  64          2HG2      VAL  64  -0.211   0.724  -4.087
  493   3HG2  VAL  64          3HG2      VAL  64  -0.927   0.414  -2.505
  494    H    ASP  65           H        ASP  65   1.353  -3.492  -1.519
  495    HA   ASP  65           HA       ASP  65  -1.316  -4.391  -2.067
  496   1HB   ASP  65          2HB       ASP  65   1.251  -5.483  -2.304
  497   2HB   ASP  65          1HB       ASP  65   0.461  -6.467  -1.074
  498    H    GLU  66           H        GLU  66  -2.839  -4.292  -0.557
  499    HA   GLU  66           HA       GLU  66  -2.302  -4.287   2.258
  500   1HB   GLU  66          2HB       GLU  66  -4.973  -4.755   0.915
  501   2HB   GLU  66          1HB       GLU  66  -4.686  -4.162   2.552
  502   1HG   GLU  66          2HG       GLU  66  -3.446  -2.204   1.486
  503   2HG   GLU  66          1HG       GLU  66  -4.104  -2.747  -0.058
  504    H    ASP  67           H        ASP  67  -3.663  -6.676   0.012
  505    HA   ASP  67           HA       ASP  67  -3.920  -8.670   2.109
  506   1HB   ASP  67          2HB       ASP  67  -4.570 -10.169   0.138
  507   2HB   ASP  67          1HB       ASP  67  -5.639  -8.817   0.499
  508    H    GLY  68           H        GLY  68  -1.786  -8.057  -0.659
  509   1HA   GLY  68          2HA       GLY  68   0.356  -8.823  -1.081
  510   2HA   GLY  68          1HA       GLY  68   0.354  -9.562   0.518
  511    H    SER  69           H        SER  69  -1.723 -10.014  -2.332
  512    HA   SER  69           HA       SER  69  -1.552 -12.910  -2.029
  513   1HB   SER  69          2HB       SER  69  -3.257 -12.922  -3.855
  514   2HB   SER  69          1HB       SER  69  -3.741 -11.984  -2.446
  515    HG   SER  69           HG       SER  69  -3.698 -11.141  -4.881
  516    H    GLY  70           H        GLY  70   0.644 -10.984  -3.296
  517   1HA   GLY  70          2HA       GLY  70   2.333 -11.317  -4.837
  518   2HA   GLY  70          1HA       GLY  70   1.647 -12.908  -5.161
  519    H    THR  71           H        THR  71  -0.345 -10.072  -5.397
  520    HA   THR  71           HA       THR  71  -0.022  -9.753  -8.270
  521    HB   THR  71           HB       THR  71  -2.277 -10.305  -8.872
  522    HG1  THR  71           HG1      THR  71  -3.630  -9.851  -7.322
  523   1HG2  THR  71          1HG2      THR  71  -2.425 -12.697  -8.283
  524   2HG2  THR  71          2HG2      THR  71  -1.223 -12.456  -7.014
  525   3HG2  THR  71          3HG2      THR  71  -0.774 -12.246  -8.708
  526    H    VAL  72           H        VAL  72  -0.908  -7.795  -9.026
  527    HA   VAL  72           HA       VAL  72  -1.757  -5.960  -6.868
  528    HB   VAL  72           HB       VAL  72  -0.667  -5.172  -9.572
  529   1HG1  VAL  72          1HG1      VAL  72  -2.084  -3.541  -8.261
  530   2HG1  VAL  72          2HG1      VAL  72  -0.439  -2.988  -8.571
  531   3HG1  VAL  72          3HG1      VAL  72  -0.874  -3.615  -6.981
  532   1HG2  VAL  72          1HG2      VAL  72   1.379  -4.568  -8.085
  533   2HG2  VAL  72          2HG2      VAL  72   1.173  -6.254  -8.563
  534   3HG2  VAL  72          3HG2      VAL  72   0.704  -5.732  -6.944
  535    H    ASP  73           H        ASP  73  -3.771  -5.317  -6.840
  536    HA   ASP  73           HA       ASP  73  -5.573  -5.877  -9.065
  537   1HB   ASP  73          2HB       ASP  73  -6.047  -4.586  -6.357
  538   2HB   ASP  73          1HB       ASP  73  -7.310  -4.945  -7.531
  539    H    PHE  74           H        PHE  74  -6.997  -4.111  -9.919
  540    HA   PHE  74           HA       PHE  74  -5.495  -1.924 -10.845
  541   1HB   PHE  74          2HB       PHE  74  -7.660  -2.804 -11.853
  542   2HB   PHE  74          1HB       PHE  74  -8.508  -1.891 -10.605
  543    HD1  PHE  74           HD1      PHE  74  -5.418  -1.136 -12.574
  544    HD2  PHE  74           HD2      PHE  74  -9.450  -0.005 -11.635
  545    HE1  PHE  74           HE1      PHE  74  -5.155   0.928 -13.922
  546    HE2  PHE  74           HE2      PHE  74  -9.187   2.058 -12.982
  547    HZ   PHE  74           HZ       PHE  74  -7.040   2.525 -14.127
  548    H    ASP  75           H        ASP  75  -7.456  -2.340  -7.962
  549    HA   ASP  75           HA       ASP  75  -7.596   0.412  -7.206
  550   1HB   ASP  75          2HB       ASP  75  -7.780  -2.117  -5.541
  551   2HB   ASP  75          1HB       ASP  75  -8.113  -0.495  -4.933
  552    H    GLU  76           H        GLU  76  -5.401  -2.275  -6.397
  553    HA   GLU  76           HA       GLU  76  -3.711  -0.752  -4.654
  554   1HB   GLU  76          2HB       GLU  76  -3.006  -3.263  -6.203
  555   2HB   GLU  76          1HB       GLU  76  -2.166  -2.629  -4.789
  556   1HG   GLU  76          2HG       GLU  76  -4.205  -2.959  -3.427
  557   2HG   GLU  76          1HG       GLU  76  -5.046  -3.594  -4.839
  558    H    PHE  77           H        PHE  77  -3.838  -1.363  -8.097
  559    HA   PHE  77           HA       PHE  77  -1.251  -0.496  -8.838
  560   1HB   PHE  77          2HB       PHE  77  -3.343  -1.644 -10.141
  561   2HB   PHE  77          1HB       PHE  77  -3.508   0.014 -10.694
  562    HD1  PHE  77           HD1      PHE  77  -3.065  -0.803 -12.967
  563    HD2  PHE  77           HD2      PHE  77  -0.116  -1.151  -9.854
  564    HE1  PHE  77           HE1      PHE  77  -1.311  -1.195 -14.661
  565    HE2  PHE  77           HE2      PHE  77   1.635  -1.535 -11.560
  566    HZ   PHE  77           HZ       PHE  77   1.034  -1.568 -13.965
  567    H    LEU  78           H        LEU  78  -4.393   1.201  -8.844
  568    HA   LEU  78           HA       LEU  78  -3.246   3.738  -9.553
  569   1HB   LEU  78          2HB       LEU  78  -5.937   2.732  -8.807
  570   2HB   LEU  78          1HB       LEU  78  -5.630   4.440  -8.553
  571    HG   LEU  78           HG       LEU  78  -5.338   4.841 -10.865
  572   1HD1  LEU  78          1HD1      LEU  78  -3.837   2.905 -11.294
  573   2HD1  LEU  78          2HD1      LEU  78  -5.078   3.071 -12.534
  574   3HD1  LEU  78          3HD1      LEU  78  -5.241   1.839 -11.281
  575   1HD2  LEU  78          1HD2      LEU  78  -7.368   3.830 -11.894
  576   2HD2  LEU  78          2HD2      LEU  78  -7.679   4.445 -10.270
  577   3HD2  LEU  78          3HD2      LEU  78  -7.474   2.713 -10.532
  578    H    VAL  79           H        VAL  79  -3.770   2.037  -6.564
  579    HA   VAL  79           HA       VAL  79  -3.832   4.233  -4.773
  580    HB   VAL  79           HB       VAL  79  -3.278   1.310  -4.555
  581   1HG1  VAL  79          1HG1      VAL  79  -2.527   3.301  -2.393
  582   2HG1  VAL  79          2HG1      VAL  79  -1.410   2.259  -3.277
  583   3HG1  VAL  79          3HG1      VAL  79  -2.602   1.549  -2.185
  584   1HG2  VAL  79          1HG2      VAL  79  -5.140   1.352  -3.142
  585   2HG2  VAL  79          2HG2      VAL  79  -5.510   2.659  -4.267
  586   3HG2  VAL  79          3HG2      VAL  79  -4.866   3.027  -2.667
  587    H    MET  80           H        MET  80  -1.158   2.220  -5.997
  588    HA   MET  80           HA       MET  80   1.012   3.234  -4.668
  589   1HB   MET  80          2HB       MET  80   0.621   1.668  -6.944
  590   2HB   MET  80          1HB       MET  80   1.607   3.019  -7.505
  591   1HG   MET  80          2HG       MET  80   3.352   2.531  -6.025
  592   2HG   MET  80          1HG       MET  80   2.302   1.625  -4.935
  593   1HE   MET  80          1HE       MET  80   3.931   1.916  -8.307
  594   2HE   MET  80          2HE       MET  80   2.417   1.273  -8.939
  595   3HE   MET  80          3HE       MET  80   3.885   0.305  -9.034
  596    H    MET  81           H        MET  81  -0.830   4.830  -7.233
  597    HA   MET  81           HA       MET  81   1.041   6.896  -7.806
  598   1HB   MET  81          2HB       MET  81  -1.866   6.459  -8.323
  599   2HB   MET  81          1HB       MET  81  -1.251   8.105  -8.450
  600   1HG   MET  81          2HG       MET  81   0.046   5.753  -9.827
  601   2HG   MET  81          1HG       MET  81  -1.181   6.760 -10.595
  602   1HE   MET  81          1HE       MET  81   1.912   6.347 -11.709
  603   2HE   MET  81          2HE       MET  81   2.214   5.994 -10.008
  604   3HE   MET  81          3HE       MET  81   3.109   7.288 -10.805
  605    H    VAL  82           H        VAL  82  -1.935   6.945  -5.812
  606    HA   VAL  82           HA       VAL  82  -1.461   9.535  -4.728
  607    HB   VAL  82           HB       VAL  82  -3.192   8.958  -3.071
  608   1HG1  VAL  82          1HG1      VAL  82  -4.999   8.399  -4.742
  609   2HG1  VAL  82          2HG1      VAL  82  -3.729   8.136  -5.937
  610   3HG1  VAL  82          3HG1      VAL  82  -3.954   9.735  -5.227
  611   1HG2  VAL  82          1HG2      VAL  82  -3.257   6.228  -4.378
  612   2HG2  VAL  82          2HG2      VAL  82  -4.178   6.770  -2.974
  613   3HG2  VAL  82          3HG2      VAL  82  -2.433   6.544  -2.850
  614    H    ARG  83           H        ARG  83  -0.411   6.329  -3.815
  615    HA   ARG  83           HA       ARG  83   0.297   6.638  -1.148
  616   1HB   ARG  83          2HB       ARG  83   1.536   5.055  -3.392
  617   2HB   ARG  83          1HB       ARG  83   2.232   5.031  -1.773
  618   1HG   ARG  83          2HG       ARG  83  -0.714   4.560  -2.099
  619   2HG   ARG  83          1HG       ARG  83   0.407   3.247  -2.454
  620   1HD   ARG  83          2HD       ARG  83   0.533   4.809   0.129
  621   2HD   ARG  83          1HD       ARG  83  -0.480   3.386  -0.051
  622    HE   ARG  83           HE       ARG  83   1.488   2.052  -0.296
  623   1HH1  ARG  83          2HH1      ARG  83   2.168   5.430   0.344
  624   2HH1  ARG  83          1HH1      ARG  83   3.796   5.130   0.838
  625   1HH2  ARG  83          1HH2      ARG  83   3.626   1.702   0.355
  626   2HH2  ARG  83          2HH2      ARG  83   4.620   3.032   0.845
  627    H    CYS  84           H        CYS  84   1.988   7.715  -4.061
  628    HA   CYS  84           HA       CYS  84   4.423   8.510  -2.860
  629   1HB   CYS  84          2HB       CYS  84   2.989   9.359  -5.368
  630   2HB   CYS  84          1HB       CYS  84   4.488  10.141  -4.869
  631    HG   CYS  84           HG       CYS  84   4.243   7.125  -5.646
  632    H    MET  85           H        MET  85   1.355  10.221  -3.385
  633    HA   MET  85           HA       MET  85   2.209  12.767  -2.471
  634   1HB   MET  85          2HB       MET  85  -0.052  11.911  -3.661
  635   2HB   MET  85          1HB       MET  85  -0.616  11.968  -1.992
  636   1HG   MET  85          2HG       MET  85   0.947  14.299  -3.026
  637   2HG   MET  85          1HG       MET  85  -0.726  14.122  -3.551
  638   1HE   MET  85          1HE       MET  85  -2.356  15.178  -2.667
  639   2HE   MET  85          2HE       MET  85  -2.757  15.513  -0.985
  640   3HE   MET  85          3HE       MET  85  -2.847  13.862  -1.592
  641    H    LYS  86           H        LYS  86   0.071  10.427  -0.783
  642    HA   LYS  86           HA       LYS  86  -0.135   9.864   1.435
  643   1HB   LYS  86          2HB       LYS  86   2.410   9.617   1.176
  644   2HB   LYS  86          1HB       LYS  86   2.523  11.192   1.960
  645   1HG   LYS  86          2HG       LYS  86   2.016  10.337   3.995
  646   2HG   LYS  86          1HG       LYS  86   0.716   9.340   3.347
  647   1HD   LYS  86          2HD       LYS  86   2.396   7.720   2.507
  648   2HD   LYS  86          1HD       LYS  86   3.677   8.704   3.216
  649   1HE   LYS  86          2HE       LYS  86   2.274   8.458   5.422
  650   2HE   LYS  86          1HE       LYS  86   1.568   7.068   4.598
  651   1HZ   LYS  86          1HZ       LYS  86   4.451   7.528   5.142
  652   2HZ   LYS  86          2HZ       LYS  86   3.840   6.238   4.218
  653   3HZ   LYS  86          3HZ       LYS  86   3.456   6.361   5.869
  654    H    ASP  87           H        ASP  87  -0.689  10.750   3.496
  655    HA   ASP  87           HA       ASP  87  -0.958  13.701   3.500
  656   1HB   ASP  87          2HB       ASP  87  -3.011  11.794   3.482
  657   2HB   ASP  87          1HB       ASP  87  -2.927  12.357   5.150
  658    H    ASP  88           H        ASP  88   1.228  12.148   4.635
  659    HA   ASP  88           HA       ASP  88   2.504  12.046   6.533
  660   1HB   ASP  88          2HB       ASP  88   0.580  14.178   7.503
  661   2HB   ASP  88          1HB       ASP  88   2.110  13.758   8.272
  662    H    SER  89           HN       SER  89   1.996   9.933   7.085
  663    HA   SER  89           HA       SER  89  -0.222   9.506   8.978
  664   1HB   SER  89          2HB       SER  89   1.505   7.540   7.456
  665   2HB   SER  89          1HB       SER  89   0.256   7.082   8.611
  666    HG   SER  89           HG       SER  89  -0.818   7.119   6.738
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  -5.929   5.131  11.062
    2   2H    MET   1          2H        MET   1  -6.368   3.754  10.168
    3   3H    MET   1          3H        MET   1  -7.273   4.208  11.531
    4    HA   MET   1           HA       MET   1  -8.400   4.785   9.448
    5   1HB   MET   1          2HB       MET   1  -8.324   6.202  11.719
    6   2HB   MET   1          1HB       MET   1  -7.583   7.397  10.656
    7   1HG   MET   1          2HG       MET   1  -9.599   6.790   9.064
    8   2HG   MET   1          1HG       MET   1 -10.347   6.234  10.560
    9   1HE   MET   1          1HE       MET   1 -11.079   7.492  12.403
   10   2HE   MET   1          2HE       MET   1 -10.825   9.201  12.747
   11   3HE   MET   1          3HE       MET   1  -9.470   8.078  12.854
   12    H    ASN   2           H        ASN   2  -6.498   4.160   7.931
   13    HA   ASN   2           HA       ASN   2  -5.095   6.528   6.892
   14   1HB   ASN   2          2HB       ASN   2  -4.706   3.570   6.581
   15   2HB   ASN   2          1HB       ASN   2  -4.067   4.665   5.355
   16   1HD2  ASN   2          1HD2      ASN   2  -2.869   6.693   6.479
   17   2HD2  ASN   2          2HD2      ASN   2  -1.811   6.270   7.736
   18    H    ASP   3           H        ASP   3  -7.471   7.123   6.339
   19    HA   ASP   3           HA       ASP   3  -8.351   5.953   3.797
   20   1HB   ASP   3          2HB       ASP   3 -10.405   7.215   4.132
   21   2HB   ASP   3          1HB       ASP   3 -10.016   6.322   5.601
   22    H    ILE   4           H        ILE   4  -6.113   8.190   4.553
   23    HA   ILE   4           HA       ILE   4  -6.865  10.455   3.010
   24    HB   ILE   4           HB       ILE   4  -4.480  11.078   3.082
   25   1HG1  ILE   4          2HG1      ILE   4  -3.219   9.296   4.723
   26   2HG1  ILE   4          1HG1      ILE   4  -4.205   8.201   3.754
   27   1HG2  ILE   4          1HG2      ILE   4  -5.378   9.944   5.742
   28   2HG2  ILE   4          2HG2      ILE   4  -6.037  11.420   5.039
   29   3HG2  ILE   4          3HG2      ILE   4  -4.330  11.337   5.471
   30   1HD1  ILE   4          1HD1      ILE   4  -2.592  10.377   2.437
   31   2HD1  ILE   4          2HD1      ILE   4  -3.193   8.875   1.739
   32   3HD1  ILE   4          3HD1      ILE   4  -1.842   8.841   2.871
   33    H    TYR   5           H        TYR   5  -5.336   7.400   2.211
   34    HA   TYR   5           HA       TYR   5  -4.449   8.132  -0.414
   35   1HB   TYR   5          2HB       TYR   5  -5.053   5.407   0.773
   36   2HB   TYR   5          1HB       TYR   5  -4.273   5.675  -0.787
   37    HD1  TYR   5           HD1      TYR   5  -2.011   6.657  -0.919
   38    HD2  TYR   5           HD2      TYR   5  -3.885   5.836   2.860
   39    HE1  TYR   5           HE1      TYR   5   0.173   6.932   0.225
   40    HE2  TYR   5           HE2      TYR   5  -1.702   6.107   4.003
   41    HH   TYR   5           HH       TYR   5   0.737   7.629   2.971
   42    H    LYS   6           H        LYS   6  -7.437   6.915   0.962
   43    HA   LYS   6           HA       LYS   6  -8.703   6.175  -1.491
   44   1HB   LYS   6          2HB       LYS   6  -9.717   6.748   1.288
   45   2HB   LYS   6          1HB       LYS   6 -10.823   6.415  -0.045
   46   1HG   LYS   6          2HG       LYS   6  -9.296   4.335  -0.463
   47   2HG   LYS   6          1HG       LYS   6  -8.763   4.604   1.197
   48   1HD   LYS   6          2HD       LYS   6 -11.704   4.557   0.586
   49   2HD   LYS   6          1HD       LYS   6 -10.826   3.034   0.723
   50   1HE   LYS   6          2HE       LYS   6 -10.368   3.338   2.974
   51   2HE   LYS   6          1HE       LYS   6 -10.421   5.097   2.856
   52   1HZ   LYS   6          1HZ       LYS   6 -12.803   5.001   2.617
   53   2HZ   LYS   6          2HZ       LYS   6 -12.344   4.177   4.031
   54   3HZ   LYS   6          3HZ       LYS   6 -12.781   3.305   2.639
   55    H    ALA   7           H        ALA   7  -8.295   9.200   0.223
   56    HA   ALA   7           HA       ALA   7 -10.442  10.644  -0.931
   57   1HB   ALA   7          1HB       ALA   7  -9.355  11.566   0.996
   58   2HB   ALA   7          2HB       ALA   7  -9.046  12.666  -0.347
   59   3HB   ALA   7          3HB       ALA   7  -7.787  11.554   0.192
   60    H    ALA   8           H        ALA   8  -7.185   9.894  -2.073
   61    HA   ALA   8           HA       ALA   8  -7.235  11.776  -4.255
   62   1HB   ALA   8          1HB       ALA   8  -5.481   9.388  -4.399
   63   2HB   ALA   8          2HB       ALA   8  -5.218  10.487  -3.045
   64   3HB   ALA   8          3HB       ALA   8  -5.103  11.084  -4.701
   65    H    VAL   9           H        VAL   9  -7.714   8.251  -3.963
   66    HA   VAL   9           HA       VAL   9  -8.166   7.791  -6.730
   67    HB   VAL   9           HB       VAL   9  -7.615   6.026  -5.014
   68   1HG1  VAL   9          1HG1      VAL   9  -9.140   6.632  -3.246
   69   2HG1  VAL   9          2HG1      VAL   9  -9.593   5.030  -3.827
   70   3HG1  VAL   9          3HG1      VAL   9 -10.532   6.442  -4.312
   71   1HG2  VAL   9          1HG2      VAL   9 -10.161   5.298  -6.452
   72   2HG2  VAL   9          2HG2      VAL   9  -8.700   4.335  -6.236
   73   3HG2  VAL   9          3HG2      VAL   9  -8.703   5.689  -7.366
   74    H    GLU  10           H        GLU  10 -10.148   9.135  -4.232
   75    HA   GLU  10           HA       GLU  10 -12.668   8.623  -5.561
   76   1HB   GLU  10          2HB       GLU  10 -11.858  10.219  -3.136
   77   2HB   GLU  10          1HB       GLU  10 -13.490  10.313  -3.799
   78   1HG   GLU  10          2HG       GLU  10 -12.289   7.609  -3.307
   79   2HG   GLU  10          1HG       GLU  10 -12.907   8.526  -1.934
   80    H    GLN  11           H        GLN  11 -10.161  10.995  -5.788
   81    HA   GLN  11           HA       GLN  11 -11.924  12.632  -7.507
   82   1HB   GLN  11          2HB       GLN  11 -10.888  14.682  -6.678
   83   2HB   GLN  11          1HB       GLN  11 -11.632  13.796  -5.348
   84   1HG   GLN  11          2HG       GLN  11  -9.272  12.732  -5.039
   85   2HG   GLN  11          1HG       GLN  11  -8.706  14.089  -6.011
   86   1HE2  GLN  11          1HE2      GLN  11 -10.980  13.612  -3.227
   87   2HE2  GLN  11          2HE2      GLN  11 -10.423  14.964  -2.367
   88    H    LEU  12           H        LEU  12  -9.936  10.530  -8.132
   89    HA   LEU  12           HA       LEU  12  -7.581  11.823  -9.159
   90   1HB   LEU  12          2HB       LEU  12  -7.460   9.619 -10.543
   91   2HB   LEU  12          1HB       LEU  12  -7.148   9.599  -8.824
   92    HG   LEU  12           HG       LEU  12  -9.282   8.609  -8.372
   93   1HD1  LEU  12          1HD1      LEU  12 -10.801   8.059 -10.367
   94   2HD1  LEU  12          2HD1      LEU  12  -9.858   9.245 -11.271
   95   3HD1  LEU  12          3HD1      LEU  12 -10.768   9.743  -9.843
   96   1HD2  LEU  12          1HD2      LEU  12  -9.055   6.507  -9.544
   97   2HD2  LEU  12          2HD2      LEU  12  -7.435   7.155  -9.288
   98   3HD2  LEU  12          3HD2      LEU  12  -8.196   7.285 -10.873
   99    H    THR  13           H        THR  13  -7.104  11.262 -11.646
  100    HA   THR  13           HA       THR  13  -9.202  12.684 -13.146
  101    HB   THR  13           HB       THR  13  -7.090  12.513 -14.868
  102    HG1  THR  13           HG1      THR  13  -5.655  11.626 -13.478
  103   1HG2  THR  13          1HG2      THR  13  -7.943  14.628 -14.636
  104   2HG2  THR  13          2HG2      THR  13  -6.490  14.822 -13.655
  105   3HG2  THR  13          3HG2      THR  13  -8.043  14.512 -12.879
  106    H    ASP  14           H        ASP  14  -9.384  12.051 -15.491
  107    HA   ASP  14           HA       ASP  14 -10.113   9.279 -15.675
  108   1HB   ASP  14          2HB       ASP  14 -10.108  11.598 -17.588
  109   2HB   ASP  14          1HB       ASP  14 -10.379   9.960 -18.181
  110    H    GLU  15           H        GLU  15  -7.397  11.263 -16.659
  111    HA   GLU  15           HA       GLU  15  -6.156   9.479 -18.461
  112   1HB   GLU  15          2HB       GLU  15  -4.179  10.817 -18.197
  113   2HB   GLU  15          1HB       GLU  15  -5.560  11.909 -18.133
  114   1HG   GLU  15          2HG       GLU  15  -5.431  11.560 -15.556
  115   2HG   GLU  15          1HG       GLU  15  -3.801  10.970 -15.875
  116    H    GLN  16           H        GLN  16  -6.003   9.795 -14.929
  117    HA   GLN  16           HA       GLN  16  -3.878   8.016 -14.416
  118   1HB   GLN  16          2HB       GLN  16  -6.106   9.180 -12.863
  119   2HB   GLN  16          1HB       GLN  16  -5.498   7.642 -12.252
  120   1HG   GLN  16          2HG       GLN  16  -3.142   8.727 -12.600
  121   2HG   GLN  16          1HG       GLN  16  -4.036  10.247 -12.591
  122   1HE2  GLN  16          1HE2      GLN  16  -5.118  10.881 -10.585
  123   2HE2  GLN  16          2HE2      GLN  16  -4.760  10.112  -9.114
  124    H    LYS  17           H        LYS  17  -7.323   7.474 -14.923
  125    HA   LYS  17           HA       LYS  17  -7.322   4.683 -14.295
  126   1HB   LYS  17          2HB       LYS  17  -9.268   6.237 -16.023
  127   2HB   LYS  17          1HB       LYS  17  -9.540   4.643 -15.323
  128   1HG   LYS  17          2HG       LYS  17  -9.019   7.164 -13.718
  129   2HG   LYS  17          1HG       LYS  17 -10.610   6.457 -13.994
  130   1HD   LYS  17          2HD       LYS  17  -9.192   4.292 -13.082
  131   2HD   LYS  17          1HD       LYS  17  -8.471   5.610 -12.159
  132   1HE   LYS  17          2HE       LYS  17 -10.648   6.299 -11.334
  133   2HE   LYS  17          1HE       LYS  17 -11.456   5.128 -12.375
  134   1HZ   LYS  17          1HZ       LYS  17  -9.641   4.541 -10.100
  135   2HZ   LYS  17          2HZ       LYS  17 -10.223   3.364 -11.178
  136   3HZ   LYS  17          3HZ       LYS  17 -11.304   4.223 -10.188
  137    H    ASN  18           H        ASN  18  -6.066   6.397 -16.949
  138    HA   ASN  18           HA       ASN  18  -6.297   4.049 -18.723
  139   1HB   ASN  18          2HB       ASN  18  -6.060   6.990 -19.226
  140   2HB   ASN  18          1HB       ASN  18  -5.402   5.869 -20.419
  141   1HD2  ASN  18          1HD2      ASN  18  -8.090   7.628 -19.988
  142   2HD2  ASN  18          2HD2      ASN  18  -9.268   6.571 -20.604
  143    H    GLU  19           H        GLU  19  -4.024   6.178 -17.080
  144    HA   GLU  19           HA       GLU  19  -1.663   5.516 -18.490
  145   1HB   GLU  19          2HB       GLU  19  -1.740   6.024 -15.510
  146   2HB   GLU  19          1HB       GLU  19  -0.422   6.349 -16.633
  147   1HG   GLU  19          2HG       GLU  19  -2.499   7.796 -17.726
  148   2HG   GLU  19          1HG       GLU  19  -2.779   7.967 -15.992
  149    H    PHE  20           H        PHE  20  -3.018   4.142 -15.507
  150    HA   PHE  20           HA       PHE  20  -1.086   1.992 -15.450
  151   1HB   PHE  20          2HB       PHE  20  -3.434   2.786 -13.760
  152   2HB   PHE  20          1HB       PHE  20  -2.690   1.202 -13.565
  153    HD1  PHE  20           HD1      PHE  20  -2.176   4.849 -13.275
  154    HD2  PHE  20           HD2      PHE  20  -0.424   0.963 -12.696
  155    HE1  PHE  20           HE1      PHE  20  -0.383   5.854 -11.895
  156    HE2  PHE  20           HE2      PHE  20   1.363   1.972 -11.314
  157    HZ   PHE  20           HZ       PHE  20   1.387   4.422 -10.913
  158    H    LYS  21           H        LYS  21  -4.527   2.348 -16.294
  159    HA   LYS  21           HA       LYS  21  -5.192  -0.367 -16.496
  160   1HB   LYS  21          2HB       LYS  21  -6.867   1.423 -16.602
  161   2HB   LYS  21          1HB       LYS  21  -6.249   1.916 -18.175
  162   1HG   LYS  21          2HG       LYS  21  -6.899  -0.957 -17.965
  163   2HG   LYS  21          1HG       LYS  21  -8.288   0.117 -17.804
  164   1HD   LYS  21          2HD       LYS  21  -6.363   0.730 -19.996
  165   2HD   LYS  21          1HD       LYS  21  -7.379  -0.697 -20.202
  166   1HE   LYS  21          2HE       LYS  21  -8.649   1.866 -19.296
  167   2HE   LYS  21          1HE       LYS  21  -8.239   1.672 -20.999
  168   1HZ   LYS  21          1HZ       LYS  21 -10.482   0.920 -20.566
  169   2HZ   LYS  21          2HZ       LYS  21  -9.924  -0.173 -19.391
  170   3HZ   LYS  21          3HZ       LYS  21  -9.510  -0.392 -21.023
  171    H    ALA  22           H        ALA  22  -3.631   1.774 -18.859
  172    HA   ALA  22           HA       ALA  22  -3.723   0.088 -21.106
  173   1HB   ALA  22          1HB       ALA  22  -1.514   2.002 -20.316
  174   2HB   ALA  22          2HB       ALA  22  -2.974   2.448 -21.200
  175   3HB   ALA  22          3HB       ALA  22  -1.796   1.358 -21.934
  176    H    ALA  23           H        ALA  23  -1.339   0.314 -18.491
  177    HA   ALA  23           HA       ALA  23   0.293  -1.829 -19.531
  178   1HB   ALA  23          1HB       ALA  23   0.803   0.203 -17.806
  179   2HB   ALA  23          2HB       ALA  23   1.766  -1.273 -17.881
  180   3HB   ALA  23          3HB       ALA  23   0.496  -1.108 -16.667
  181    H    PHE  24           H        PHE  24  -2.373  -1.430 -17.322
  182    HA   PHE  24           HA       PHE  24  -2.196  -3.855 -15.895
  183   1HB   PHE  24          2HB       PHE  24  -3.688  -1.824 -15.408
  184   2HB   PHE  24          1HB       PHE  24  -4.793  -2.493 -16.606
  185    HD1  PHE  24           HD1      PHE  24  -5.591  -4.922 -16.289
  186    HD2  PHE  24           HD2      PHE  24  -3.666  -2.652 -13.194
  187    HE1  PHE  24           HE1      PHE  24  -6.485  -6.481 -14.586
  188    HE2  PHE  24           HE2      PHE  24  -4.560  -4.211 -11.494
  189    HZ   PHE  24           HZ       PHE  24  -5.976  -6.115 -12.187
  190    H    ASP  25           H        ASP  25  -3.862  -3.047 -18.969
  191    HA   ASP  25           HA       ASP  25  -5.074  -5.629 -19.200
  192   1HB   ASP  25          2HB       ASP  25  -5.578  -4.999 -21.530
  193   2HB   ASP  25          1HB       ASP  25  -6.061  -3.763 -20.382
  194    H    ILE  26           H        ILE  26  -1.940  -4.377 -20.169
  195    HA   ILE  26           HA       ILE  26  -1.393  -6.646 -21.895
  196    HB   ILE  26           HB       ILE  26   0.921  -5.700 -22.019
  197   1HG1  ILE  26          2HG1      ILE  26  -0.258  -3.425 -20.393
  198   2HG1  ILE  26          1HG1      ILE  26   0.838  -4.633 -19.730
  199   1HG2  ILE  26          1HG2      ILE  26   0.264  -4.133 -23.586
  200   2HG2  ILE  26          2HG2      ILE  26  -0.972  -3.442 -22.534
  201   3HG2  ILE  26          3HG2      ILE  26  -1.266  -4.979 -23.352
  202   1HD1  ILE  26          1HD1      ILE  26   2.656  -3.716 -20.734
  203   2HD1  ILE  26          2HD1      ILE  26   1.647  -2.273 -20.845
  204   3HD1  ILE  26          3HD1      ILE  26   1.778  -3.365 -22.224
  205    H    PHE  27           H        PHE  27  -0.532  -5.635 -18.597
  206    HA   PHE  27           HA       PHE  27   1.314  -7.779 -18.159
  207   1HB   PHE  27          2HB       PHE  27  -0.154  -5.972 -16.228
  208   2HB   PHE  27          1HB       PHE  27   1.004  -7.198 -15.717
  209    HD1  PHE  27           HD1      PHE  27   3.084  -7.077 -17.785
  210    HD2  PHE  27           HD2      PHE  27   0.889  -3.890 -15.919
  211    HE1  PHE  27           HE1      PHE  27   4.933  -5.509 -18.287
  212    HE2  PHE  27           HE2      PHE  27   2.739  -2.325 -16.426
  213    HZ   PHE  27           HZ       PHE  27   4.763  -3.132 -17.608
  214    H    ILE  28           H        ILE  28  -2.174  -7.379 -17.573
  215    HA   ILE  28           HA       ILE  28  -2.322 -10.040 -16.353
  216    HB   ILE  28           HB       ILE  28  -4.636  -9.584 -15.894
  217   1HG1  ILE  28          2HG1      ILE  28  -5.311  -7.080 -16.704
  218   2HG1  ILE  28          1HG1      ILE  28  -4.283  -7.568 -18.051
  219   1HG2  ILE  28          1HG2      ILE  28  -4.430  -7.691 -14.460
  220   2HG2  ILE  28          2HG2      ILE  28  -3.194  -6.960 -15.484
  221   3HG2  ILE  28          3HG2      ILE  28  -2.821  -8.408 -14.551
  222   1HD1  ILE  28          1HD1      ILE  28  -5.706  -9.271 -18.700
  223   2HD1  ILE  28          2HD1      ILE  28  -6.883  -8.144 -18.025
  224   3HD1  ILE  28          3HD1      ILE  28  -6.326  -9.518 -17.068
  225    H    GLN  29           H        GLN  29  -1.871  -9.211 -19.400
  226    HA   GLN  29           HA       GLN  29  -3.914 -10.145 -21.009
  227   1HB   GLN  29          2HB       GLN  29  -1.890  -9.143 -21.926
  228   2HB   GLN  29          1HB       GLN  29  -0.929 -10.514 -21.370
  229   1HG   GLN  29          2HG       GLN  29  -2.112 -12.021 -22.857
  230   2HG   GLN  29          1HG       GLN  29  -3.231 -10.740 -23.328
  231   1HE2  GLN  29          1HE2      GLN  29  -2.036  -8.691 -24.268
  232   2HE2  GLN  29          2HE2      GLN  29  -0.727  -9.003 -25.302
  233    H    ASP  30           H        ASP  30  -1.451 -12.017 -19.279
  234    HA   ASP  30           HA       ASP  30  -2.675 -14.531 -20.211
  235   1HB   ASP  30          2HB       ASP  30  -0.068 -14.045 -18.750
  236   2HB   ASP  30          1HB       ASP  30  -0.650 -15.614 -19.305
  237    H    ALA  31           H        ALA  31  -3.536 -12.564 -17.898
  238    HA   ALA  31           HA       ALA  31  -3.562 -14.493 -15.677
  239   1HB   ALA  31          1HB       ALA  31  -4.630 -11.675 -15.588
  240   2HB   ALA  31          2HB       ALA  31  -2.918 -12.029 -15.345
  241   3HB   ALA  31          3HB       ALA  31  -4.124 -12.700 -14.244
  242    H    GLU  32           H        GLU  32  -5.500 -15.057 -14.639
  243    HA   GLU  32           HA       GLU  32  -7.965 -14.616 -16.220
  244   1HB   GLU  32          2HB       GLU  32  -7.103 -17.202 -14.889
  245   2HB   GLU  32          1HB       GLU  32  -8.641 -16.934 -15.711
  246   1HG   GLU  32          2HG       GLU  32  -7.387 -16.399 -17.805
  247   2HG   GLU  32          1HG       GLU  32  -5.885 -16.800 -16.973
  248    H    ASP  33           H        ASP  33  -7.233 -13.014 -14.068
  249    HA   ASP  33           HA       ASP  33  -9.331 -13.706 -12.120
  250   1HB   ASP  33          2HB       ASP  33  -6.445 -13.170 -11.524
  251   2HB   ASP  33          1HB       ASP  33  -7.677 -12.667 -10.367
  252    H    GLY  34           H        GLY  34  -7.013 -11.205 -13.140
  253   1HA   GLY  34          2HA       GLY  34  -8.000  -9.092 -14.006
  254   2HA   GLY  34          1HA       GLY  34  -9.099  -9.157 -12.629
  255    H    CYS  35           H        CYS  35  -5.626  -9.847 -12.738
  256    HA   CYS  35           HA       CYS  35  -4.894  -7.369 -11.424
  257   1HB   CYS  35          2HB       CYS  35  -3.850  -8.637  -9.474
  258   2HB   CYS  35          1HB       CYS  35  -5.605  -8.477  -9.443
  259    HG   CYS  35           HG       CYS  35  -4.221 -11.104 -10.441
  260    H    ILE  36           H        ILE  36  -2.670  -6.976 -11.508
  261    HA   ILE  36           HA       ILE  36  -1.230  -8.634 -13.425
  262    HB   ILE  36           HB       ILE  36   0.399  -6.902 -13.534
  263   1HG1  ILE  36          2HG1      ILE  36  -0.261  -4.919 -11.716
  264   2HG1  ILE  36          1HG1      ILE  36  -0.474  -6.395 -10.776
  265   1HG2  ILE  36          1HG2      ILE  36  -2.377  -5.759 -13.137
  266   2HG2  ILE  36          2HG2      ILE  36  -1.616  -6.236 -14.655
  267   3HG2  ILE  36          3HG2      ILE  36  -1.028  -4.822 -13.780
  268   1HD1  ILE  36          1HD1      ILE  36   1.932  -6.581 -12.372
  269   2HD1  ILE  36          2HD1      ILE  36   1.756  -6.683 -10.619
  270   3HD1  ILE  36          3HD1      ILE  36   1.963  -5.113 -11.397
  271    H    SER  37           H        SER  37   1.202  -8.981 -12.918
  272    HA   SER  37           HA       SER  37   1.309 -10.478 -10.404
  273   1HB   SER  37          2HB       SER  37   2.055 -11.543 -12.537
  274   2HB   SER  37          1HB       SER  37   3.350 -10.354 -12.636
  275    HG   SER  37           HG       SER  37   4.385 -11.751 -11.444
  276    H    THR  38           H        THR  38   2.000  -9.472  -8.653
  277    HA   THR  38           HA       THR  38   3.337  -7.017  -8.515
  278    HB   THR  38           HB       THR  38   3.872  -7.623  -6.175
  279    HG1  THR  38           HG1      THR  38   4.324  -9.704  -6.092
  280   1HG2  THR  38          1HG2      THR  38   1.453  -8.301  -5.548
  281   2HG2  THR  38          2HG2      THR  38   1.141  -8.230  -7.282
  282   3HG2  THR  38          3HG2      THR  38   1.685  -6.790  -6.425
  283    H    LYS  39           H        LYS  39   4.572 -10.306  -8.735
  284    HA   LYS  39           HA       LYS  39   7.301  -9.788  -8.179
  285   1HB   LYS  39          2HB       LYS  39   6.216 -11.881 -10.084
  286   2HB   LYS  39          1HB       LYS  39   7.774 -11.906  -9.257
  287   1HG   LYS  39          2HG       LYS  39   6.844 -12.484  -7.228
  288   2HG   LYS  39          1HG       LYS  39   5.330 -11.649  -7.566
  289   1HD   LYS  39          2HD       LYS  39   4.691 -13.895  -7.711
  290   2HD   LYS  39          1HD       LYS  39   5.012 -13.490  -9.396
  291   1HE   LYS  39          2HE       LYS  39   6.970 -14.720  -9.466
  292   2HE   LYS  39          1HE       LYS  39   7.287 -14.511  -7.744
  293   1HZ   LYS  39          1HZ       LYS  39   5.094 -16.182  -8.848
  294   2HZ   LYS  39          2HZ       LYS  39   5.567 -16.063  -7.221
  295   3HZ   LYS  39          3HZ       LYS  39   6.601 -16.787  -8.358
  296    H    GLU  40           H        GLU  40   5.336  -9.396 -11.056
  297    HA   GLU  40           HA       GLU  40   7.667  -8.732 -12.706
  298   1HB   GLU  40          2HB       GLU  40   4.730  -8.979 -13.384
  299   2HB   GLU  40          1HB       GLU  40   5.987  -8.547 -14.542
  300   1HG   GLU  40          2HG       GLU  40   7.087 -10.780 -13.441
  301   2HG   GLU  40          1HG       GLU  40   5.372 -11.173 -13.316
  302    H    LEU  41           H        LEU  41   6.291  -6.976 -10.437
  303    HA   LEU  41           HA       LEU  41   5.221  -4.668 -11.634
  304   1HB   LEU  41          2HB       LEU  41   5.955  -5.436  -9.034
  305   2HB   LEU  41          1HB       LEU  41   6.864  -3.983  -9.363
  306    HG   LEU  41           HG       LEU  41   4.814  -3.375  -8.260
  307   1HD1  LEU  41          1HD1      LEU  41   5.657  -2.110 -10.403
  308   2HD1  LEU  41          2HD1      LEU  41   4.085  -1.701  -9.712
  309   3HD1  LEU  41          3HD1      LEU  41   4.181  -2.749 -11.128
  310   1HD2  LEU  41          1HD2      LEU  41   3.271  -5.080  -8.546
  311   2HD2  LEU  41          2HD2      LEU  41   3.622  -5.253 -10.265
  312   3HD2  LEU  41          3HD2      LEU  41   2.643  -3.899  -9.697
  313    H    GLY  42           H        GLY  42   8.512  -5.818 -11.489
  314   1HA   GLY  42          2HA       GLY  42   9.957  -3.434 -11.788
  315   2HA   GLY  42          1HA       GLY  42  10.464  -5.004 -12.407
  316    H    LYS  43           H        LYS  43   8.448  -5.546 -14.235
  317    HA   LYS  43           HA       LYS  43   9.245  -3.972 -16.496
  318   1HB   LYS  43          2HB       LYS  43   6.970  -5.962 -16.218
  319   2HB   LYS  43          1HB       LYS  43   7.567  -5.301 -17.738
  320   1HG   LYS  43          2HG       LYS  43   9.624  -6.434 -17.570
  321   2HG   LYS  43          1HG       LYS  43   9.443  -6.694 -15.834
  322   1HD   LYS  43          2HD       LYS  43   7.898  -8.432 -16.121
  323   2HD   LYS  43          1HD       LYS  43   7.457  -7.901 -17.744
  324   1HE   LYS  43          2HE       LYS  43   8.816  -9.678 -18.305
  325   2HE   LYS  43          1HE       LYS  43  10.041  -8.414 -18.206
  326   1HZ   LYS  43          1HZ       LYS  43   9.286 -10.230 -15.979
  327   2HZ   LYS  43          2HZ       LYS  43  10.519  -9.061 -15.950
  328   3HZ   LYS  43          3HZ       LYS  43  10.654 -10.418 -16.963
  329    H    VAL  44           H        VAL  44   6.635  -3.867 -14.209
  330    HA   VAL  44           HA       VAL  44   4.837  -2.225 -15.708
  331    HB   VAL  44           HB       VAL  44   5.009  -2.489 -12.700
  332   1HG1  VAL  44          1HG1      VAL  44   3.097  -1.342 -14.649
  333   2HG1  VAL  44          2HG1      VAL  44   3.394  -0.901 -12.967
  334   3HG1  VAL  44          3HG1      VAL  44   2.387  -2.296 -13.349
  335   1HG2  VAL  44          1HG2      VAL  44   3.263  -4.171 -14.501
  336   2HG2  VAL  44          2HG2      VAL  44   3.669  -4.438 -12.808
  337   3HG2  VAL  44          3HG2      VAL  44   4.886  -4.698 -14.056
  338    H    MET  45           H        MET  45   7.107  -1.593 -13.031
  339    HA   MET  45           HA       MET  45   6.752   1.180 -12.865
  340   1HB   MET  45          2HB       MET  45   8.972  -0.686 -12.118
  341   2HB   MET  45          1HB       MET  45   9.285   1.050 -12.103
  342   1HG   MET  45          2HG       MET  45   6.856  -0.115 -10.742
  343   2HG   MET  45          1HG       MET  45   8.413  -0.017  -9.918
  344   1HE   MET  45          1HE       MET  45   5.839   1.237  -8.858
  345   2HE   MET  45          2HE       MET  45   5.158   1.628 -10.436
  346   3HE   MET  45          3HE       MET  45   5.476   2.916  -9.276
  347    H    ARG  46           H        ARG  46   8.861  -0.768 -14.949
  348    HA   ARG  46           HA       ARG  46  10.347   1.360 -16.083
  349   1HB   ARG  46          2HB       ARG  46   9.608  -1.356 -17.186
  350   2HB   ARG  46          1HB       ARG  46  10.708  -0.239 -17.996
  351   1HG   ARG  46          2HG       ARG  46  12.235  -0.273 -16.135
  352   2HG   ARG  46          1HG       ARG  46  11.088  -1.177 -15.147
  353   1HD   ARG  46          2HD       ARG  46  11.544  -3.165 -16.185
  354   2HD   ARG  46          1HD       ARG  46  11.824  -2.406 -17.748
  355    HE   ARG  46           HE       ARG  46  13.804  -2.961 -15.718
  356   1HH1  ARG  46          2HH1      ARG  46  12.957  -0.922 -18.428
  357   2HH1  ARG  46          1HH1      ARG  46  14.598  -0.510 -18.791
  358   1HH2  ARG  46          1HH2      ARG  46  15.946  -2.403 -16.214
  359   2HH2  ARG  46          2HH2      ARG  46  16.285  -1.346 -17.543
  360    H    MET  47           H        MET  47   7.209  -0.039 -16.876
  361    HA   MET  47           HA       MET  47   6.814   1.394 -19.324
  362   1HB   MET  47          2HB       MET  47   5.007  -0.090 -17.434
  363   2HB   MET  47          1HB       MET  47   4.314   0.905 -18.714
  364   1HG   MET  47          2HG       MET  47   6.463  -1.131 -19.303
  365   2HG   MET  47          1HG       MET  47   4.760  -1.584 -19.251
  366   1HE   MET  47          1HE       MET  47   7.166   0.603 -22.306
  367   2HE   MET  47          2HE       MET  47   7.173  -1.143 -22.072
  368   3HE   MET  47          3HE       MET  47   7.597  -0.081 -20.734
  369    H    LEU  48           H        LEU  48   6.157   2.040 -15.924
  370    HA   LEU  48           HA       LEU  48   4.576   4.399 -16.320
  371   1HB   LEU  48          2HB       LEU  48   5.948   3.089 -14.019
  372   2HB   LEU  48          1HB       LEU  48   5.496   4.770 -13.856
  373    HG   LEU  48           HG       LEU  48   3.149   4.214 -14.177
  374   1HD1  LEU  48          1HD1      LEU  48   3.690   2.273 -15.771
  375   2HD1  LEU  48          2HD1      LEU  48   2.367   2.010 -14.636
  376   3HD1  LEU  48          3HD1      LEU  48   3.950   1.301 -14.323
  377   1HD2  LEU  48          1HD2      LEU  48   4.825   2.946 -12.104
  378   2HD2  LEU  48          2HD2      LEU  48   3.222   2.229 -12.275
  379   3HD2  LEU  48          3HD2      LEU  48   3.386   3.952 -11.928
  380    H    GLY  49           H        GLY  49   8.000   3.706 -15.990
  381   1HA   GLY  49          2HA       GLY  49   9.459   5.349 -17.201
  382   2HA   GLY  49          1HA       GLY  49   8.620   6.591 -16.281
  383    H    GLN  50           H        GLN  50   9.431   3.537 -14.762
  384    HA   GLN  50           HA       GLN  50  11.758   4.753 -13.413
  385   1HB   GLN  50          2HB       GLN  50   9.767   3.101 -11.867
  386   2HB   GLN  50          1HB       GLN  50  11.009   4.188 -11.254
  387   1HG   GLN  50          2HG       GLN  50   8.642   5.155 -12.880
  388   2HG   GLN  50          1HG       GLN  50   8.623   5.067 -11.120
  389   1HE2  GLN  50          1HE2      GLN  50   8.679   7.458 -13.103
  390   2HE2  GLN  50          2HE2      GLN  50   9.950   8.421 -12.521
  391    H    ASN  51           H        ASN  51  13.381   3.324 -12.878
  392    HA   ASN  51           HA       ASN  51  12.936   0.491 -13.627
  393   1HB   ASN  51          2HB       ASN  51  15.413   0.515 -14.295
  394   2HB   ASN  51          1HB       ASN  51  14.288   1.325 -15.382
  395   1HD2  ASN  51          1HD2      ASN  51  14.226   3.743 -15.285
  396   2HD2  ASN  51          2HD2      ASN  51  15.573   4.592 -14.698
  397    HA   PRO  52           HA       PRO  52  14.579   0.681  -9.316
  398   1HB   PRO  52          2HB       PRO  52  12.616  -0.848  -8.187
  399   2HB   PRO  52          1HB       PRO  52  12.487   0.902  -8.413
  400   1HG   PRO  52          2HG       PRO  52  11.153  -1.287  -9.878
  401   2HG   PRO  52          1HG       PRO  52  10.639   0.390  -9.645
  402   1HD   PRO  52          2HD       PRO  52  11.845  -0.712 -11.983
  403   2HD   PRO  52          1HD       PRO  52  11.521   1.006 -11.660
  404    H    THR  53           H        THR  53  14.296  -1.561  -7.718
  405    HA   THR  53           HA       THR  53  15.678  -3.673  -9.275
  406    HB   THR  53           HB       THR  53  17.006  -4.142  -7.408
  407    HG1  THR  53           HG1      THR  53  16.324  -3.212  -5.298
  408   1HG2  THR  53          1HG2      THR  53  16.361  -1.199  -7.143
  409   2HG2  THR  53          2HG2      THR  53  17.557  -1.903  -8.232
  410   3HG2  THR  53          3HG2      THR  53  17.791  -1.993  -6.486
  411    HA   PRO  54           HA       PRO  54  12.549  -6.562  -8.101
  412   1HB   PRO  54          2HB       PRO  54  13.889  -8.750  -7.139
  413   2HB   PRO  54          1HB       PRO  54  13.810  -8.309  -8.852
  414   1HG   PRO  54          2HG       PRO  54  16.051  -7.996  -6.926
  415   2HG   PRO  54          1HG       PRO  54  16.095  -8.262  -8.675
  416   1HD   PRO  54          2HD       PRO  54  16.506  -5.804  -7.403
  417   2HD   PRO  54          1HD       PRO  54  16.111  -6.010  -9.124
  418    H    GLU  55           H        GLU  55  14.898  -5.896  -5.563
  419    HA   GLU  55           HA       GLU  55  13.170  -6.869  -3.441
  420   1HB   GLU  55          2HB       GLU  55  14.882  -5.983  -1.910
  421   2HB   GLU  55          1HB       GLU  55  15.601  -7.013  -3.145
  422   1HG   GLU  55          2HG       GLU  55  16.407  -5.120  -4.380
  423   2HG   GLU  55          1HG       GLU  55  15.458  -3.999  -3.403
  424    H    GLU  56           H        GLU  56  13.963  -3.799  -4.986
  425    HA   GLU  56           HA       GLU  56  12.634  -2.165  -3.023
  426   1HB   GLU  56          2HB       GLU  56  13.889  -1.708  -5.693
  427   2HB   GLU  56          1HB       GLU  56  12.747  -0.506  -5.092
  428   1HG   GLU  56          2HG       GLU  56  14.040  -0.129  -3.111
  429   2HG   GLU  56          1HG       GLU  56  15.052  -1.538  -3.425
  430    H    LEU  57           H        LEU  57  11.812  -3.309  -6.312
  431    HA   LEU  57           HA       LEU  57   9.303  -2.062  -6.499
  432   1HB   LEU  57          2HB       LEU  57   8.842  -3.493  -8.309
  433   2HB   LEU  57          1HB       LEU  57  10.557  -3.176  -8.363
  434    HG   LEU  57           HG       LEU  57  10.697  -5.474  -7.053
  435   1HD1  LEU  57          1HD1      LEU  57   8.562  -6.249  -6.721
  436   2HD1  LEU  57          2HD1      LEU  57   8.767  -6.850  -8.366
  437   3HD1  LEU  57          3HD1      LEU  57   7.912  -5.336  -8.082
  438   1HD2  LEU  57          1HD2      LEU  57  11.594  -4.931  -9.333
  439   2HD2  LEU  57          2HD2      LEU  57  10.022  -5.356 -10.008
  440   3HD2  LEU  57          3HD2      LEU  57  10.995  -6.585  -9.202
  441    H    GLN  58           H        GLN  58  10.274  -5.110  -4.983
  442    HA   GLN  58           HA       GLN  58   7.609  -6.052  -4.521
  443   1HB   GLN  58          2HB       GLN  58   9.732  -7.462  -4.511
  444   2HB   GLN  58          1HB       GLN  58  10.049  -6.803  -2.906
  445   1HG   GLN  58          2HG       GLN  58   8.883  -8.902  -2.620
  446   2HG   GLN  58          1HG       GLN  58   7.764  -7.605  -2.206
  447   1HE2  GLN  58          1HE2      GLN  58   5.821  -7.470  -3.411
  448   2HE2  GLN  58          2HE2      GLN  58   5.477  -8.444  -4.758
  449    H    GLU  59           H        GLU  59   9.847  -3.990  -2.737
  450    HA   GLU  59           HA       GLU  59   8.520  -4.031  -0.227
  451   1HB   GLU  59          2HB       GLU  59  10.434  -2.129  -1.553
  452   2HB   GLU  59          1HB       GLU  59   9.664  -1.690  -0.029
  453   1HG   GLU  59          2HG       GLU  59  10.579  -3.620   1.081
  454   2HG   GLU  59          1HG       GLU  59  11.152  -4.295  -0.443
  455    H    MET  60           H        MET  60   8.303  -1.752  -2.973
  456    HA   MET  60           HA       MET  60   6.352  -0.073  -1.798
  457   1HB   MET  60          2HB       MET  60   5.899   0.710  -4.116
  458   2HB   MET  60          1HB       MET  60   7.617   0.706  -3.719
  459   1HG   MET  60          2HG       MET  60   7.977  -1.332  -4.946
  460   2HG   MET  60          1HG       MET  60   6.244  -1.581  -5.153
  461   1HE   MET  60          1HE       MET  60   7.135  -0.993  -8.728
  462   2HE   MET  60          2HE       MET  60   5.685  -1.410  -7.818
  463   3HE   MET  60          3HE       MET  60   7.229  -2.135  -7.381
  464    H    ILE  61           H        ILE  61   6.114  -3.104  -3.543
  465    HA   ILE  61           HA       ILE  61   3.279  -2.975  -3.993
  466    HB   ILE  61           HB       ILE  61   5.172  -5.341  -3.973
  467   1HG1  ILE  61          2HG1      ILE  61   3.865  -4.055  -6.368
  468   2HG1  ILE  61          1HG1      ILE  61   5.374  -3.415  -5.716
  469   1HG2  ILE  61          1HG2      ILE  61   3.429  -6.714  -4.524
  470   2HG2  ILE  61          2HG2      ILE  61   2.590  -5.456  -5.430
  471   3HG2  ILE  61          3HG2      ILE  61   2.469  -5.506  -3.673
  472   1HD1  ILE  61          1HD1      ILE  61   6.324  -4.953  -7.106
  473   2HD1  ILE  61          2HD1      ILE  61   4.866  -5.944  -7.166
  474   3HD1  ILE  61          3HD1      ILE  61   5.961  -6.068  -5.789
  475    H    ASP  62           H        ASP  62   5.360  -4.632  -1.617
  476    HA   ASP  62           HA       ASP  62   3.403  -5.952  -0.142
  477   1HB   ASP  62          2HB       ASP  62   6.086  -5.749   0.087
  478   2HB   ASP  62          1HB       ASP  62   5.596  -4.701   1.418
  479    H    GLU  63           H        GLU  63   4.375  -2.558  -0.058
  480    HA   GLU  63           HA       GLU  63   2.845  -1.933   2.312
  481   1HB   GLU  63          2HB       GLU  63   4.044  -0.105   0.217
  482   2HB   GLU  63          1HB       GLU  63   3.358   0.417   1.755
  483   1HG   GLU  63          2HG       GLU  63   5.533  -1.665   1.705
  484   2HG   GLU  63          1HG       GLU  63   5.944   0.044   1.585
  485    H    VAL  64           H        VAL  64   2.401  -1.331  -1.192
  486    HA   VAL  64           HA       VAL  64  -0.120  -0.018  -0.862
  487    HB   VAL  64           HB       VAL  64   1.321   0.353  -2.840
  488   1HG1  VAL  64          1HG1      VAL  64   0.412  -2.392  -3.742
  489   2HG1  VAL  64          2HG1      VAL  64   2.000  -2.075  -3.042
  490   3HG1  VAL  64          3HG1      VAL  64   1.540  -1.311  -4.563
  491   1HG2  VAL  64          1HG2      VAL  64  -1.185  -0.853  -3.942
  492   2HG2  VAL  64          2HG2      VAL  64  -0.472   0.728  -4.256
  493   3HG2  VAL  64          3HG2      VAL  64  -1.344   0.437  -2.751
  494    H    ASP  65           H        ASP  65   0.806  -3.374  -1.540
  495    HA   ASP  65           HA       ASP  65  -1.853  -4.249  -2.134
  496   1HB   ASP  65          2HB       ASP  65   0.710  -5.364  -2.314
  497   2HB   ASP  65          1HB       ASP  65  -0.131  -6.354  -1.125
  498    H    GLU  66           H        GLU  66  -3.327  -3.849  -0.596
  499    HA   GLU  66           HA       GLU  66  -2.918  -3.955   2.197
  500   1HB   GLU  66          2HB       GLU  66  -5.382  -3.948   2.372
  501   2HB   GLU  66          1HB       GLU  66  -4.804  -2.740   1.228
  502   1HG   GLU  66          2HG       GLU  66  -5.153  -4.649  -0.547
  503   2HG   GLU  66          1HG       GLU  66  -6.210  -5.344   0.681
  504    H    ASP  67           H        ASP  67  -4.057  -6.389  -0.098
  505    HA   ASP  67           HA       ASP  67  -4.503  -8.335   2.027
  506   1HB   ASP  67          2HB       ASP  67  -5.061  -9.856   0.046
  507   2HB   ASP  67          1HB       ASP  67  -6.132  -8.487   0.323
  508    H    GLY  68           H        GLY  68  -2.192  -7.719  -0.580
  509   1HA   GLY  68          2HA       GLY  68  -0.038  -8.498  -0.878
  510   2HA   GLY  68          1HA       GLY  68  -0.143  -9.242   0.717
  511    H    SER  69           H        SER  69  -2.045  -9.696  -2.260
  512    HA   SER  69           HA       SER  69  -1.856 -12.587  -1.948
  513   1HB   SER  69          2HB       SER  69  -3.473 -12.648  -3.836
  514   2HB   SER  69          1HB       SER  69  -4.039 -11.674  -2.484
  515    HG   SER  69           HG       SER  69  -3.276 -10.929  -5.046
  516    H    GLY  70           H        GLY  70   0.195 -10.407  -3.280
  517   1HA   GLY  70          2HA       GLY  70   2.020 -10.740  -4.663
  518   2HA   GLY  70          1HA       GLY  70   1.427 -12.362  -5.007
  519    H    THR  71           H        THR  71  -0.827  -9.770  -5.378
  520    HA   THR  71           HA       THR  71  -0.295  -9.451  -8.235
  521    HB   THR  71           HB       THR  71  -2.501 -10.087  -8.937
  522    HG1  THR  71           HG1      THR  71  -3.883  -9.599  -7.387
  523   1HG2  THR  71          1HG2      THR  71  -0.912 -11.945  -8.697
  524   2HG2  THR  71          2HG2      THR  71  -2.549 -12.483  -8.318
  525   3HG2  THR  71          3HG2      THR  71  -1.403 -12.161  -7.015
  526    H    VAL  72           H        VAL  72  -0.935  -7.490  -9.017
  527    HA   VAL  72           HA       VAL  72  -2.073  -5.621  -7.037
  528    HB   VAL  72           HB       VAL  72  -0.802  -4.845  -9.656
  529   1HG1  VAL  72          1HG1      VAL  72  -1.175  -3.406  -7.012
  530   2HG1  VAL  72          2HG1      VAL  72  -2.153  -3.156  -8.459
  531   3HG1  VAL  72          3HG1      VAL  72  -0.443  -2.721  -8.463
  532   1HG2  VAL  72          1HG2      VAL  72   0.511  -5.362  -6.973
  533   2HG2  VAL  72          2HG2      VAL  72   1.266  -4.421  -8.259
  534   3HG2  VAL  72          3HG2      VAL  72   0.899  -6.128  -8.514
  535    H    ASP  73           H        ASP  73  -4.140  -5.169  -7.206
  536    HA   ASP  73           HA       ASP  73  -5.605  -5.664  -9.683
  537   1HB   ASP  73          2HB       ASP  73  -6.451  -4.735  -6.926
  538   2HB   ASP  73          1HB       ASP  73  -7.566  -4.827  -8.289
  539    H    PHE  74           H        PHE  74  -7.182  -3.826 -10.374
  540    HA   PHE  74           HA       PHE  74  -5.629  -1.618 -11.167
  541   1HB   PHE  74          2HB       PHE  74  -7.846  -2.480 -12.183
  542   2HB   PHE  74          1HB       PHE  74  -8.624  -1.427 -10.999
  543    HD1  PHE  74           HD1      PHE  74  -5.465  -1.086 -12.967
  544    HD2  PHE  74           HD2      PHE  74  -9.363   0.500 -12.120
  545    HE1  PHE  74           HE1      PHE  74  -4.996   0.862 -14.432
  546    HE2  PHE  74           HE2      PHE  74  -8.890   2.454 -13.578
  547    HZ   PHE  74           HZ       PHE  74  -6.704   2.632 -14.734
  548    H    ASP  75           H        ASP  75  -7.699  -2.080  -8.351
  549    HA   ASP  75           HA       ASP  75  -7.781   0.653  -7.528
  550   1HB   ASP  75          2HB       ASP  75  -9.188  -1.403  -6.691
  551   2HB   ASP  75          1HB       ASP  75  -7.853  -1.613  -5.558
  552    H    GLU  76           H        GLU  76  -5.648  -2.083  -6.793
  553    HA   GLU  76           HA       GLU  76  -3.963  -0.622  -4.970
  554   1HB   GLU  76          2HB       GLU  76  -3.377  -3.205  -6.444
  555   2HB   GLU  76          1HB       GLU  76  -2.520  -2.587  -5.034
  556   1HG   GLU  76          2HG       GLU  76  -4.568  -2.765  -3.685
  557   2HG   GLU  76          1HG       GLU  76  -5.461  -3.331  -5.095
  558    H    PHE  77           H        PHE  77  -4.051  -1.206  -8.414
  559    HA   PHE  77           HA       PHE  77  -1.375  -0.543  -9.069
  560   1HB   PHE  77          2HB       PHE  77  -3.442  -1.577 -10.457
  561   2HB   PHE  77          1HB       PHE  77  -3.562   0.093 -10.982
  562    HD1  PHE  77           HD1      PHE  77  -3.108  -0.827 -13.247
  563    HD2  PHE  77           HD2      PHE  77  -0.177  -1.013 -10.101
  564    HE1  PHE  77           HE1      PHE  77  -1.332  -1.220 -14.917
  565    HE2  PHE  77           HE2      PHE  77   1.592  -1.389 -11.786
  566    HZ   PHE  77           HZ       PHE  77   1.011  -1.498 -14.196
  567    H    LEU  78           H        LEU  78  -4.382   1.369  -9.156
  568    HA   LEU  78           HA       LEU  78  -3.097   3.813  -9.904
  569   1HB   LEU  78          2HB       LEU  78  -5.821   3.034  -8.981
  570   2HB   LEU  78          1HB       LEU  78  -5.371   4.728  -8.920
  571    HG   LEU  78           HG       LEU  78  -5.196   4.877 -11.268
  572   1HD1  LEU  78          1HD1      LEU  78  -5.086   2.972 -12.765
  573   2HD1  LEU  78          2HD1      LEU  78  -5.347   1.853 -11.428
  574   3HD1  LEU  78          3HD1      LEU  78  -3.846   2.774 -11.528
  575   1HD2  LEU  78          1HD2      LEU  78  -7.515   4.711 -10.562
  576   2HD2  LEU  78          2HD2      LEU  78  -7.432   2.950 -10.583
  577   3HD2  LEU  78          3HD2      LEU  78  -7.329   3.857 -12.093
  578    H    VAL  79           H        VAL  79  -3.913   2.310  -6.828
  579    HA   VAL  79           HA       VAL  79  -3.649   4.561  -5.149
  580    HB   VAL  79           HB       VAL  79  -3.536   1.604  -4.794
  581   1HG1  VAL  79          1HG1      VAL  79  -1.570   2.320  -3.523
  582   2HG1  VAL  79          2HG1      VAL  79  -2.869   1.845  -2.425
  583   3HG1  VAL  79          3HG1      VAL  79  -2.530   3.555  -2.702
  584   1HG2  VAL  79          1HG2      VAL  79  -5.353   2.009  -3.332
  585   2HG2  VAL  79          2HG2      VAL  79  -5.577   3.175  -4.636
  586   3HG2  VAL  79          3HG2      VAL  79  -4.895   3.697  -3.095
  587    H    MET  80           H        MET  80  -1.273   2.154  -6.243
  588    HA   MET  80           HA       MET  80   0.997   2.910  -4.888
  589   1HB   MET  80          2HB       MET  80   0.440   1.279  -7.083
  590   2HB   MET  80          1HB       MET  80   1.614   2.446  -7.690
  591   1HG   MET  80          2HG       MET  80   2.971   1.953  -5.571
  592   2HG   MET  80          1HG       MET  80   1.901   0.569  -5.339
  593   1HE   MET  80          1HE       MET  80   1.483  -1.171  -6.702
  594   2HE   MET  80          2HE       MET  80   2.576  -1.919  -7.863
  595   3HE   MET  80          3HE       MET  80   1.434  -0.690  -8.404
  596    H    MET  81           H        MET  81  -0.576   4.624  -7.544
  597    HA   MET  81           HA       MET  81   1.561   6.330  -8.286
  598   1HB   MET  81          2HB       MET  81  -0.468   6.131  -9.656
  599   2HB   MET  81          1HB       MET  81  -1.424   6.862  -8.370
  600   1HG   MET  81          2HG       MET  81  -0.854   8.933  -9.047
  601   2HG   MET  81          1HG       MET  81   0.861   8.532  -8.971
  602   1HE   MET  81          1HE       MET  81   1.633   6.584 -10.549
  603   2HE   MET  81          2HE       MET  81   2.363   8.037 -11.224
  604   3HE   MET  81          3HE       MET  81   1.611   6.859 -12.297
  605    H    VAL  82           H        VAL  82  -1.220   6.968  -6.129
  606    HA   VAL  82           HA       VAL  82  -0.174   9.433  -5.144
  607    HB   VAL  82           HB       VAL  82  -1.917   9.187  -3.355
  608   1HG1  VAL  82          1HG1      VAL  82  -3.813   8.871  -5.254
  609   2HG1  VAL  82          2HG1      VAL  82  -2.404   9.111  -6.286
  610   3HG1  VAL  82          3HG1      VAL  82  -2.849  10.340  -5.101
  611   1HG2  VAL  82          1HG2      VAL  82  -2.627   6.646  -4.858
  612   2HG2  VAL  82          2HG2      VAL  82  -3.469   7.316  -3.460
  613   3HG2  VAL  82          3HG2      VAL  82  -1.835   6.675  -3.281
  614    H    ARG  83           H        ARG  83   0.200   6.081  -4.202
  615    HA   ARG  83           HA       ARG  83   1.168   6.401  -1.573
  616   1HB   ARG  83          2HB       ARG  83   1.660   4.301  -3.681
  617   2HB   ARG  83          1HB       ARG  83   2.414   4.218  -2.090
  618   1HG   ARG  83          2HG       ARG  83  -0.186   4.733  -1.411
  619   2HG   ARG  83          1HG       ARG  83  -0.397   3.762  -2.869
  620   1HD   ARG  83          2HD       ARG  83   0.167   1.887  -1.771
  621   2HD   ARG  83          1HD       ARG  83   1.675   2.609  -1.222
  622    HE   ARG  83           HE       ARG  83  -0.800   2.392   0.282
  623   1HH1  ARG  83          2HH1      ARG  83   2.272   4.030  -0.052
  624   2HH1  ARG  83          1HH1      ARG  83   2.323   4.531   1.602
  625   1HH2  ARG  83          1HH2      ARG  83  -0.702   3.060   2.446
  626   2HH2  ARG  83          2HH2      ARG  83   0.648   3.985   3.011
  627    H    CYS  84           H        CYS  84   2.647   7.043  -4.661
  628    HA   CYS  84           HA       CYS  84   5.340   7.170  -3.519
  629   1HB   CYS  84          2HB       CYS  84   4.700   6.247  -5.881
  630   2HB   CYS  84          1HB       CYS  84   4.668   7.950  -6.338
  631    HG   CYS  84           HG       CYS  84   7.185   6.334  -5.631
  632    H    MET  85           H        MET  85   2.795   9.299  -4.764
  633    HA   MET  85           HA       MET  85   4.489  11.663  -4.467
  634   1HB   MET  85          2HB       MET  85   1.728  11.180  -5.552
  635   2HB   MET  85          1HB       MET  85   2.246  12.812  -5.133
  636   1HG   MET  85          2HG       MET  85   3.984  11.059  -6.859
  637   2HG   MET  85          1HG       MET  85   2.651  11.974  -7.564
  638   1HE   MET  85          1HE       MET  85   3.825  15.367  -8.023
  639   2HE   MET  85          2HE       MET  85   2.377  14.513  -7.494
  640   3HE   MET  85          3HE       MET  85   3.323  13.880  -8.840
  641    H    LYS  86           H        LYS  86   1.140  10.991  -3.394
  642    HA   LYS  86           HA       LYS  86   1.531  12.716  -1.074
  643   1HB   LYS  86          2HB       LYS  86  -0.589  12.666  -2.507
  644   2HB   LYS  86          1HB       LYS  86  -0.949  11.124  -1.731
  645   1HG   LYS  86          2HG       LYS  86  -0.175  13.266   0.145
  646   2HG   LYS  86          1HG       LYS  86  -1.676  13.575  -0.727
  647   1HD   LYS  86          2HD       LYS  86  -1.293  10.841   0.406
  648   2HD   LYS  86          1HD       LYS  86  -1.630  12.147   1.540
  649   1HE   LYS  86          2HE       LYS  86  -3.321  12.024  -0.912
  650   2HE   LYS  86          1HE       LYS  86  -3.589  10.778   0.307
  651   1HZ   LYS  86          1HZ       LYS  86  -3.749  12.600   1.968
  652   2HZ   LYS  86          2HZ       LYS  86  -4.991  12.610   0.809
  653   3HZ   LYS  86          3HZ       LYS  86  -3.708  13.718   0.692
  654    H    ASP  87           H        ASP  87   2.823  11.697   0.386
  655    HA   ASP  87           HA       ASP  87   1.681   9.708   2.072
  656   1HB   ASP  87          2HB       ASP  87   3.315   7.881   1.656
  657   2HB   ASP  87          1HB       ASP  87   2.261   8.162   0.272
  658    H    ASP  88           H        ASP  88   2.862  12.276   2.403
  659    HA   ASP  88           HA       ASP  88   4.296  13.413   3.779
  660   1HB   ASP  88          2HB       ASP  88   4.343  10.662   4.977
  661   2HB   ASP  88          1HB       ASP  88   5.452  11.895   5.579
  662    H    SER  89           HN       SER  89   5.789  14.090   2.291
  663    HA   SER  89           HA       SER  89   7.885  12.444   1.259
  664   1HB   SER  89          2HB       SER  89   6.970  14.603   0.230
  665   2HB   SER  89          1HB       SER  89   7.956  15.459   1.411
  666    HG   SER  89           HG       SER  89   8.693  13.954  -0.809
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1 -10.956   7.704   7.920
    2   2H    MET   1          2H        MET   1 -11.818   6.865   9.119
    3   3H    MET   1          3H        MET   1 -11.406   6.089   7.664
    4    HA   MET   1           HA       MET   1  -9.547   6.987   9.800
    5   1HB   MET   1          2HB       MET   1 -10.596   4.332   8.852
    6   2HB   MET   1          1HB       MET   1  -8.992   4.428   9.578
    7   1HG   MET   1          2HG       MET   1 -11.386   5.671  10.929
    8   2HG   MET   1          1HG       MET   1 -11.001   3.965  11.150
    9   1HE   MET   1          1HE       MET   1 -11.224   6.707  12.778
   10   2HE   MET   1          2HE       MET   1  -9.883   6.904  13.903
   11   3HE   MET   1          3HE       MET   1 -10.875   5.449  13.971
   12    H    ASN   2           H        ASN   2  -9.652   4.989   6.824
   13    HA   ASN   2           HA       ASN   2  -7.080   6.223   6.021
   14   1HB   ASN   2          2HB       ASN   2  -8.019   3.382   5.543
   15   2HB   ASN   2          1HB       ASN   2  -6.535   4.082   4.896
   16   1HD2  ASN   2          1HD2      ASN   2  -5.578   5.532   7.120
   17   2HD2  ASN   2          2HD2      ASN   2  -5.244   4.457   8.389
   18    H    ASP   3           H        ASP   3  -9.355   7.492   5.301
   19    HA   ASP   3           HA       ASP   3 -10.212   6.588   2.669
   20   1HB   ASP   3          2HB       ASP   3 -11.663   7.799   4.466
   21   2HB   ASP   3          1HB       ASP   3 -10.921   9.265   3.824
   22    H    ILE   4           H        ILE   4  -7.759   8.629   3.959
   23    HA   ILE   4           HA       ILE   4  -7.470  10.616   2.055
   24    HB   ILE   4           HB       ILE   4  -5.123  10.746   2.628
   25   1HG1  ILE   4          2HG1      ILE   4  -4.767   8.210   2.542
   26   2HG1  ILE   4          1HG1      ILE   4  -3.919   9.073   3.816
   27   1HG2  ILE   4          1HG2      ILE   4  -7.238  10.503   4.633
   28   2HG2  ILE   4          2HG2      ILE   4  -6.005  11.747   4.438
   29   3HG2  ILE   4          3HG2      ILE   4  -5.625  10.260   5.305
   30   1HD1  ILE   4          1HD1      ILE   4  -6.263   7.217   4.023
   31   2HD1  ILE   4          2HD1      ILE   4  -6.087   8.495   5.223
   32   3HD1  ILE   4          3HD1      ILE   4  -4.811   7.298   5.018
   33    H    TYR   5           H        TYR   5  -6.652   7.210   1.777
   34    HA   TYR   5           HA       TYR   5  -5.178   7.530  -0.696
   35   1HB   TYR   5          2HB       TYR   5  -6.298   5.027   0.599
   36   2HB   TYR   5          1HB       TYR   5  -5.181   5.067  -0.765
   37    HD1  TYR   5           HD1      TYR   5  -5.520   5.254   2.830
   38    HD2  TYR   5           HD2      TYR   5  -2.888   6.129  -0.451
   39    HE1  TYR   5           HE1      TYR   5  -3.614   5.422   4.403
   40    HE2  TYR   5           HE2      TYR   5  -0.981   6.296   1.123
   41    HH   TYR   5           HH       TYR   5  -0.757   5.082   3.870
   42    H    LYS   6           H        LYS   6  -8.411   6.387   0.253
   43    HA   LYS   6           HA       LYS   6  -9.249   5.840  -2.447
   44   1HB   LYS   6          2HB       LYS   6 -10.574   5.855   0.236
   45   2HB   LYS   6          1HB       LYS   6 -11.576   5.861  -1.215
   46   1HG   LYS   6          2HG       LYS   6 -10.664   3.809  -1.989
   47   2HG   LYS   6          1HG       LYS   6  -9.314   3.891  -0.858
   48   1HD   LYS   6          2HD       LYS   6 -12.015   3.922   0.369
   49   2HD   LYS   6          1HD       LYS   6 -11.549   2.410  -0.410
   50   1HE   LYS   6          2HE       LYS   6 -10.400   1.920   1.470
   51   2HE   LYS   6          1HE       LYS   6  -9.264   3.186   1.005
   52   1HZ   LYS   6          1HZ       LYS   6 -11.667   3.492   2.721
   53   2HZ   LYS   6          2HZ       LYS   6 -10.718   4.788   2.169
   54   3HZ   LYS   6          3HZ       LYS   6 -10.047   3.622   3.204
   55    H    ALA   7           H        ALA   7  -8.848   8.736  -0.738
   56    HA   ALA   7           HA       ALA   7 -11.110  10.189  -1.731
   57   1HB   ALA   7          1HB       ALA   7  -9.629  10.762   0.301
   58   2HB   ALA   7          2HB       ALA   7 -10.142  12.091  -0.739
   59   3HB   ALA   7          3HB       ALA   7  -8.508  11.440  -0.879
   60    H    ALA   8           H        ALA   8  -7.864   9.520  -2.902
   61    HA   ALA   8           HA       ALA   8  -7.988  11.510  -5.009
   62   1HB   ALA   8          1HB       ALA   8  -5.826  10.871  -4.000
   63   2HB   ALA   8          2HB       ALA   8  -5.850  10.561  -5.736
   64   3HB   ALA   8          3HB       ALA   8  -6.045   9.226  -4.598
   65    H    VAL   9           H        VAL   9  -8.249   7.972  -4.758
   66    HA   VAL   9           HA       VAL   9  -8.513   7.468  -7.532
   67    HB   VAL   9           HB       VAL   9  -7.982   5.745  -5.773
   68   1HG1  VAL   9          1HG1      VAL   9  -9.790   4.731  -4.527
   69   2HG1  VAL   9          2HG1      VAL   9 -10.981   5.753  -5.332
   70   3HG1  VAL   9          3HG1      VAL   9  -9.821   6.465  -4.213
   71   1HG2  VAL   9          1HG2      VAL   9 -10.350   5.097  -7.558
   72   2HG2  VAL   9          2HG2      VAL   9  -9.166   3.951  -6.929
   73   3HG2  VAL   9          3HG2      VAL   9  -8.674   5.171  -8.103
   74    H    GLU  10           H        GLU  10 -10.810   8.574  -5.136
   75    HA   GLU  10           HA       GLU  10 -13.122   7.942  -6.753
   76   1HB   GLU  10          2HB       GLU  10 -14.421   9.004  -5.021
   77   2HB   GLU  10          1HB       GLU  10 -13.202   7.983  -4.262
   78   1HG   GLU  10          2HG       GLU  10 -11.805   9.886  -3.774
   79   2HG   GLU  10          1HG       GLU  10 -12.841  10.956  -4.716
   80    H    GLN  11           H        GLN  11 -10.849  10.545  -6.613
   81    HA   GLN  11           HA       GLN  11 -12.627  12.106  -8.384
   82   1HB   GLN  11          2HB       GLN  11 -11.866  14.189  -7.397
   83   2HB   GLN  11          1HB       GLN  11 -12.554  13.161  -6.144
   84   1HG   GLN  11          2HG       GLN  11 -10.053  12.344  -5.870
   85   2HG   GLN  11          1HG       GLN  11  -9.685  13.888  -6.632
   86   1HE2  GLN  11          1HE2      GLN  11  -8.726  14.564  -4.509
   87   2HE2  GLN  11          2HE2      GLN  11  -9.754  15.072  -3.256
   88    H    LEU  12           H        LEU  12 -10.397  10.218  -8.971
   89    HA   LEU  12           HA       LEU  12  -8.223  11.913  -9.903
   90   1HB   LEU  12          2HB       LEU  12  -7.548   9.690 -11.073
   91   2HB   LEU  12          1HB       LEU  12  -7.351   9.869  -9.348
   92    HG   LEU  12           HG       LEU  12  -9.314   8.512  -8.938
   93   1HD1  LEU  12          1HD1      LEU  12  -9.639   8.725 -11.928
   94   2HD1  LEU  12          2HD1      LEU  12 -10.831   9.039 -10.666
   95   3HD1  LEU  12          3HD1      LEU  12 -10.349   7.382 -11.031
   96   1HD2  LEU  12          1HD2      LEU  12  -8.323   6.484  -9.462
   97   2HD2  LEU  12          2HD2      LEU  12  -6.962   7.570  -9.745
   98   3HD2  LEU  12          3HD2      LEU  12  -7.922   6.987 -11.104
   99    H    THR  13           H        THR  13  -7.486  11.319 -12.299
  100    HA   THR  13           HA       THR  13  -9.736  12.143 -14.007
  101    HB   THR  13           HB       THR  13  -7.541  12.232 -15.631
  102    HG1  THR  13           HG1      THR  13  -5.982  11.841 -14.214
  103   1HG2  THR  13          1HG2      THR  13  -7.684  14.653 -14.059
  104   2HG2  THR  13          2HG2      THR  13  -9.302  14.027 -14.372
  105   3HG2  THR  13          3HG2      THR  13  -8.213  14.368 -15.717
  106    H    ASP  14           H        ASP  14  -9.699  11.300 -16.275
  107    HA   ASP  14           HA       ASP  14  -9.889   8.442 -16.264
  108   1HB   ASP  14          2HB       ASP  14 -10.043  10.478 -18.497
  109   2HB   ASP  14          1HB       ASP  14 -10.276   8.748 -18.746
  110    H    GLU  15           H        GLU  15  -7.485  10.793 -17.294
  111    HA   GLU  15           HA       GLU  15  -5.861   8.993 -18.815
  112   1HB   GLU  15          2HB       GLU  15  -5.473  11.720 -17.632
  113   2HB   GLU  15          1HB       GLU  15  -4.063  10.817 -18.189
  114   1HG   GLU  15          2HG       GLU  15  -5.371  10.437 -20.369
  115   2HG   GLU  15          1HG       GLU  15  -6.467  11.693 -19.795
  116    H    GLN  16           H        GLN  16  -6.077   9.862 -15.414
  117    HA   GLN  16           HA       GLN  16  -3.615   8.739 -14.547
  118   1HB   GLN  16          2HB       GLN  16  -4.867  10.285 -13.126
  119   2HB   GLN  16          1HB       GLN  16  -6.217   9.155 -13.044
  120   1HG   GLN  16          2HG       GLN  16  -5.225   7.942 -11.420
  121   2HG   GLN  16          1HG       GLN  16  -3.691   7.895 -12.289
  122   1HE2  GLN  16          1HE2      GLN  16  -5.660  10.449 -10.638
  123   2HE2  GLN  16          2HE2      GLN  16  -4.342  11.121  -9.810
  124    H    LYS  17           H        LYS  17  -6.927   7.459 -14.767
  125    HA   LYS  17           HA       LYS  17  -6.330   4.871 -13.727
  126   1HB   LYS  17          2HB       LYS  17  -8.566   5.699 -15.601
  127   2HB   LYS  17          1HB       LYS  17  -8.491   4.195 -14.685
  128   1HG   LYS  17          2HG       LYS  17  -9.049   5.207 -12.714
  129   2HG   LYS  17          1HG       LYS  17  -8.164   6.683 -13.100
  130   1HD   LYS  17          2HD       LYS  17 -10.315   7.493 -13.308
  131   2HD   LYS  17          1HD       LYS  17 -10.081   6.901 -14.951
  132   1HE   LYS  17          2HE       LYS  17 -12.023   5.771 -14.544
  133   2HE   LYS  17          1HE       LYS  17 -10.952   4.627 -13.738
  134   1HZ   LYS  17          1HZ       LYS  17 -12.872   5.340 -12.376
  135   2HZ   LYS  17          2HZ       LYS  17 -12.258   6.923 -12.382
  136   3HZ   LYS  17          3HZ       LYS  17 -11.376   5.669 -11.650
  137    H    ASN  18           H        ASN  18  -6.543   6.216 -17.004
  138    HA   ASN  18           HA       ASN  18  -6.069   3.801 -18.415
  139   1HB   ASN  18          2HB       ASN  18  -5.733   6.708 -19.138
  140   2HB   ASN  18          1HB       ASN  18  -5.301   5.420 -20.262
  141   1HD2  ASN  18          1HD2      ASN  18  -7.081   6.040 -21.716
  142   2HD2  ASN  18          2HD2      ASN  18  -8.691   5.678 -21.319
  143    H    GLU  19           H        GLU  19  -3.917   6.109 -16.880
  144    HA   GLU  19           HA       GLU  19  -1.497   5.539 -18.154
  145   1HB   GLU  19          2HB       GLU  19  -1.907   7.326 -16.404
  146   2HB   GLU  19          1HB       GLU  19  -1.792   6.055 -15.185
  147   1HG   GLU  19          2HG       GLU  19   0.470   5.587 -15.731
  148   2HG   GLU  19          1HG       GLU  19   0.373   6.479 -17.249
  149    H    PHE  20           H        PHE  20  -2.922   3.995 -15.270
  150    HA   PHE  20           HA       PHE  20  -0.867   1.943 -15.214
  151   1HB   PHE  20          2HB       PHE  20  -3.268   2.593 -13.538
  152   2HB   PHE  20          1HB       PHE  20  -2.494   1.017 -13.400
  153    HD1  PHE  20           HD1      PHE  20  -0.120   0.837 -12.663
  154    HD2  PHE  20           HD2      PHE  20  -2.194   4.598 -12.755
  155    HE1  PHE  20           HE1      PHE  20   1.613   1.824 -11.200
  156    HE2  PHE  20           HE2      PHE  20  -0.452   5.591 -11.305
  157    HZ   PHE  20           HZ       PHE  20   1.452   4.207 -10.522
  158    H    LYS  21           H        LYS  21  -4.349   2.146 -15.941
  159    HA   LYS  21           HA       LYS  21  -4.875  -0.565 -16.336
  160   1HB   LYS  21          2HB       LYS  21  -6.531   1.387 -16.316
  161   2HB   LYS  21          1HB       LYS  21  -6.137   1.587 -18.022
  162   1HG   LYS  21          2HG       LYS  21  -8.011   0.146 -18.049
  163   2HG   LYS  21          1HG       LYS  21  -6.641  -0.951 -18.222
  164   1HD   LYS  21          2HD       LYS  21  -6.688  -1.441 -15.826
  165   2HD   LYS  21          1HD       LYS  21  -8.001  -0.285 -15.596
  166   1HE   LYS  21          2HE       LYS  21  -9.405  -1.635 -17.161
  167   2HE   LYS  21          1HE       LYS  21  -8.109  -2.828 -17.244
  168   1HZ   LYS  21          1HZ       LYS  21  -8.284  -3.147 -14.862
  169   2HZ   LYS  21          2HZ       LYS  21  -9.787  -3.429 -15.605
  170   3HZ   LYS  21          3HZ       LYS  21  -9.511  -1.977 -14.765
  171    H    ALA  22           H        ALA  22  -3.247   1.718 -18.463
  172    HA   ALA  22           HA       ALA  22  -3.444   0.282 -20.888
  173   1HB   ALA  22          1HB       ALA  22  -1.227   2.078 -19.871
  174   2HB   ALA  22          2HB       ALA  22  -2.596   2.564 -20.872
  175   3HB   ALA  22          3HB       ALA  22  -1.358   1.493 -21.529
  176    H    ALA  23           H        ALA  23  -0.852   0.316 -18.434
  177    HA   ALA  23           HA       ALA  23   0.609  -1.857 -19.573
  178   1HB   ALA  23          1HB       ALA  23   1.557  -0.135 -17.986
  179   2HB   ALA  23          2HB       ALA  23   1.932  -1.804 -17.565
  180   3HB   ALA  23          3HB       ALA  23   0.670  -0.938 -16.689
  181    H    PHE  24           H        PHE  24  -1.950  -1.575 -17.174
  182    HA   PHE  24           HA       PHE  24  -1.836  -4.190 -16.102
  183   1HB   PHE  24          2HB       PHE  24  -3.212  -2.075 -15.356
  184   2HB   PHE  24          1HB       PHE  24  -4.443  -2.740 -16.426
  185    HD1  PHE  24           HD1      PHE  24  -4.938  -5.330 -16.111
  186    HD2  PHE  24           HD2      PHE  24  -3.113  -2.815 -13.151
  187    HE1  PHE  24           HE1      PHE  24  -5.592  -6.936 -14.338
  188    HE2  PHE  24           HE2      PHE  24  -3.766  -4.413 -11.382
  189    HZ   PHE  24           HZ       PHE  24  -5.010  -6.467 -11.974
  190    H    ASP  25           H        ASP  25  -3.581  -2.840 -18.890
  191    HA   ASP  25           HA       ASP  25  -5.058  -5.202 -19.479
  192   1HB   ASP  25          2HB       ASP  25  -5.382  -2.717 -20.294
  193   2HB   ASP  25          1HB       ASP  25  -4.352  -3.243 -21.626
  194    H    ILE  26           H        ILE  26  -1.948  -3.943 -20.687
  195    HA   ILE  26           HA       ILE  26  -1.628  -5.955 -22.685
  196    HB   ILE  26           HB       ILE  26   0.777  -5.279 -22.708
  197   1HG1  ILE  26          2HG1      ILE  26  -0.097  -3.354 -20.528
  198   2HG1  ILE  26          1HG1      ILE  26   0.953  -4.745 -20.278
  199   1HG2  ILE  26          1HG2      ILE  26   0.355  -3.112 -23.646
  200   2HG2  ILE  26          2HG2      ILE  26  -1.088  -2.894 -22.655
  201   3HG2  ILE  26          3HG2      ILE  26  -1.083  -4.083 -23.957
  202   1HD1  ILE  26          1HD1      ILE  26   2.413  -3.687 -22.160
  203   2HD1  ILE  26          2HD1      ILE  26   2.479  -2.983 -20.545
  204   3HD1  ILE  26          3HD1      ILE  26   1.514  -2.212 -21.803
  205    H    PHE  27           H        PHE  27  -0.588  -5.723 -19.295
  206    HA   PHE  27           HA       PHE  27   0.856  -8.233 -19.400
  207   1HB   PHE  27          2HB       PHE  27  -0.020  -6.616 -16.987
  208   2HB   PHE  27          1HB       PHE  27   1.115  -7.965 -16.971
  209    HD1  PHE  27           HD1      PHE  27   2.638  -7.413 -19.495
  210    HD2  PHE  27           HD2      PHE  27   1.343  -4.768 -16.360
  211    HE1  PHE  27           HE1      PHE  27   4.478  -5.849 -20.054
  212    HE2  PHE  27           HE2      PHE  27   3.184  -3.202 -16.934
  213    HZ   PHE  27           HZ       PHE  27   4.749  -3.744 -18.774
  214    H    ILE  28           H        ILE  28  -2.282  -7.098 -18.188
  215    HA   ILE  28           HA       ILE  28  -3.089  -9.904 -17.737
  216    HB   ILE  28           HB       ILE  28  -4.160  -7.308 -16.601
  217   1HG1  ILE  28          2HG1      ILE  28  -2.115  -8.232 -15.562
  218   2HG1  ILE  28          1HG1      ILE  28  -3.492  -8.319 -14.463
  219   1HG2  ILE  28          1HG2      ILE  28  -5.523  -9.827 -17.035
  220   2HG2  ILE  28          2HG2      ILE  28  -6.157  -8.311 -16.395
  221   3HG2  ILE  28          3HG2      ILE  28  -5.393  -9.474 -15.312
  222   1HD1  ILE  28          1HD1      ILE  28  -3.762 -10.656 -14.814
  223   2HD1  ILE  28          2HD1      ILE  28  -2.021 -10.428 -14.653
  224   3HD1  ILE  28          3HD1      ILE  28  -2.737 -10.643 -16.250
  225    H    GLN  29           H        GLN  29  -3.026  -9.621 -20.219
  226    HA   GLN  29           HA       GLN  29  -5.336  -8.335 -21.399
  227   1HB   GLN  29          2HB       GLN  29  -3.158  -8.495 -22.595
  228   2HB   GLN  29          1HB       GLN  29  -3.355 -10.247 -22.658
  229   1HG   GLN  29          2HG       GLN  29  -5.257 -10.097 -24.060
  230   2HG   GLN  29          1HG       GLN  29  -5.473  -8.379 -23.723
  231   1HE2  GLN  29          1HE2      GLN  29  -3.768  -6.880 -24.627
  232   2HE2  GLN  29          2HE2      GLN  29  -2.927  -7.347 -26.026
  233    H    ASP  30           H        ASP  30  -4.225 -11.685 -20.911
  234    HA   ASP  30           HA       ASP  30  -6.989 -12.594 -21.452
  235   1HB   ASP  30          2HB       ASP  30  -4.871 -13.375 -22.855
  236   2HB   ASP  30          1HB       ASP  30  -4.700 -14.506 -21.513
  237    H    ALA  31           H        ALA  31  -5.978 -11.625 -18.838
  238    HA   ALA  31           HA       ALA  31  -5.809 -14.069 -17.235
  239   1HB   ALA  31          1HB       ALA  31  -4.601 -11.687 -16.857
  240   2HB   ALA  31          2HB       ALA  31  -4.989 -12.789 -15.536
  241   3HB   ALA  31          3HB       ALA  31  -6.057 -11.433 -15.894
  242    H    GLU  32           H        GLU  32  -7.263 -14.500 -15.527
  243    HA   GLU  32           HA       GLU  32  -9.945 -13.287 -15.849
  244   1HB   GLU  32          2HB       GLU  32 -10.904 -15.518 -15.259
  245   2HB   GLU  32          1HB       GLU  32 -10.040 -15.520 -16.794
  246   1HG   GLU  32          2HG       GLU  32  -8.489 -16.211 -14.328
  247   2HG   GLU  32          1HG       GLU  32  -9.619 -17.413 -14.953
  248    H    ASP  33           H        ASP  33  -8.041 -12.321 -14.072
  249    HA   ASP  33           HA       ASP  33  -9.292 -12.998 -11.486
  250   1HB   ASP  33          2HB       ASP  33  -6.322 -12.530 -11.860
  251   2HB   ASP  33          1HB       ASP  33  -7.149 -12.922 -10.352
  252    H    GLY  34           H        GLY  34  -7.163 -10.710 -13.209
  253   1HA   GLY  34          2HA       GLY  34  -7.580  -8.382 -13.410
  254   2HA   GLY  34          1HA       GLY  34  -8.649  -8.475 -12.013
  255    H    CYS  35           H        CYS  35  -5.304  -9.619 -12.469
  256    HA   CYS  35           HA       CYS  35  -4.222  -7.553 -10.744
  257   1HB   CYS  35          2HB       CYS  35  -3.319  -9.185  -9.074
  258   2HB   CYS  35          1HB       CYS  35  -5.068  -9.002  -9.013
  259    HG   CYS  35           HG       CYS  35  -3.652 -11.454 -10.348
  260    H    ILE  36           H        ILE  36  -2.071  -7.263 -11.053
  261    HA   ILE  36           HA       ILE  36  -0.799  -8.938 -13.098
  262    HB   ILE  36           HB       ILE  36   0.795  -7.195 -13.391
  263   1HG1  ILE  36          2HG1      ILE  36   0.209  -5.162 -11.566
  264   2HG1  ILE  36          1HG1      ILE  36   0.172  -6.630 -10.588
  265   1HG2  ILE  36          1HG2      ILE  36  -1.583  -6.738 -14.153
  266   2HG2  ILE  36          2HG2      ILE  36  -0.577  -5.307 -13.932
  267   3HG2  ILE  36          3HG2      ILE  36  -1.771  -5.744 -12.709
  268   1HD1  ILE  36          1HD1      ILE  36   2.461  -5.418 -10.950
  269   2HD1  ILE  36          2HD1      ILE  36   2.418  -6.175 -12.543
  270   3HD1  ILE  36          3HD1      ILE  36   2.400  -7.177 -11.087
  271    H    SER  37           H        SER  37   1.709  -9.182 -12.706
  272    HA   SER  37           HA       SER  37   1.957 -10.635 -10.177
  273   1HB   SER  37          2HB       SER  37   2.660 -11.572 -12.465
  274   2HB   SER  37          1HB       SER  37   4.043 -10.491 -12.347
  275    HG   SER  37           HG       SER  37   4.657 -12.400 -11.430
  276    H    THR  38           H        THR  38   2.549  -9.436  -8.488
  277    HA   THR  38           HA       THR  38   3.848  -6.976  -8.471
  278    HB   THR  38           HB       THR  38   4.375  -7.386  -6.116
  279    HG1  THR  38           HG1      THR  38   3.608 -10.050  -6.712
  280   1HG2  THR  38          1HG2      THR  38   1.705  -8.164  -7.216
  281   2HG2  THR  38          2HG2      THR  38   2.154  -6.763  -6.245
  282   3HG2  THR  38          3HG2      THR  38   1.990  -8.345  -5.485
  283    H    LYS  39           H        LYS  39   5.271 -10.236  -8.235
  284    HA   LYS  39           HA       LYS  39   7.952  -9.396  -7.864
  285   1HB   LYS  39          2HB       LYS  39   8.579 -11.674  -8.591
  286   2HB   LYS  39          1HB       LYS  39   7.282 -11.701  -7.399
  287   1HG   LYS  39          2HG       LYS  39   5.962 -11.521  -9.864
  288   2HG   LYS  39          1HG       LYS  39   7.274 -12.664 -10.147
  289   1HD   LYS  39          2HD       LYS  39   5.537 -12.892  -7.693
  290   2HD   LYS  39          1HD       LYS  39   5.022 -13.586  -9.229
  291   1HE   LYS  39          2HE       LYS  39   7.815 -14.193  -8.455
  292   2HE   LYS  39          1HE       LYS  39   6.579 -14.905  -7.419
  293   1HZ   LYS  39          1HZ       LYS  39   7.190 -16.316  -9.328
  294   2HZ   LYS  39          2HZ       LYS  39   6.610 -15.116 -10.381
  295   3HZ   LYS  39          3HZ       LYS  39   5.545 -15.903  -9.315
  296    H    GLU  40           H        GLU  40   5.929  -9.619 -10.700
  297    HA   GLU  40           HA       GLU  40   8.250  -9.014 -12.433
  298   1HB   GLU  40          2HB       GLU  40   5.481  -9.983 -13.198
  299   2HB   GLU  40          1HB       GLU  40   6.812  -9.679 -14.314
  300   1HG   GLU  40          2HG       GLU  40   8.148 -11.429 -13.276
  301   2HG   GLU  40          1HG       GLU  40   6.918 -11.677 -12.037
  302    H    LEU  41           H        LEU  41   6.825  -7.122 -10.628
  303    HA   LEU  41           HA       LEU  41   5.144  -5.455 -12.234
  304   1HB   LEU  41          2HB       LEU  41   5.233  -5.599  -9.678
  305   2HB   LEU  41          1HB       LEU  41   6.633  -4.553  -9.787
  306    HG   LEU  41           HG       LEU  41   4.274  -3.589 -11.269
  307   1HD1  LEU  41          1HD1      LEU  41   2.765  -3.525  -9.596
  308   2HD1  LEU  41          2HD1      LEU  41   3.973  -2.978  -8.434
  309   3HD1  LEU  41          3HD1      LEU  41   3.778  -4.700  -8.760
  310   1HD2  LEU  41          1HD2      LEU  41   6.439  -2.356 -10.841
  311   2HD2  LEU  41          2HD2      LEU  41   5.992  -2.292  -9.136
  312   3HD2  LEU  41          3HD2      LEU  41   4.992  -1.480 -10.341
  313    H    GLY  42           H        GLY  42   8.563  -5.836 -12.021
  314   1HA   GLY  42          2HA       GLY  42   9.541  -3.273 -12.521
  315   2HA   GLY  42          1HA       GLY  42  10.287  -4.756 -13.107
  316    H    LYS  43           H        LYS  43   7.931  -5.552 -14.664
  317    HA   LYS  43           HA       LYS  43   8.546  -4.271 -17.135
  318   1HB   LYS  43          2HB       LYS  43   6.133  -5.987 -16.489
  319   2HB   LYS  43          1HB       LYS  43   6.792  -5.650 -18.090
  320   1HG   LYS  43          2HG       LYS  43   8.829  -6.705 -16.285
  321   2HG   LYS  43          1HG       LYS  43   7.465  -7.811 -16.453
  322   1HD   LYS  43          2HD       LYS  43   7.794  -7.089 -19.044
  323   2HD   LYS  43          1HD       LYS  43   9.457  -6.943 -18.474
  324   1HE   LYS  43          2HE       LYS  43   9.408  -9.190 -19.065
  325   2HE   LYS  43          1HE       LYS  43   8.954  -9.290 -17.364
  326   1HZ   LYS  43          1HZ       LYS  43   7.034  -9.162 -19.630
  327   2HZ   LYS  43          2HZ       LYS  43   6.644  -9.358 -17.988
  328   3HZ   LYS  43          3HZ       LYS  43   7.480 -10.582 -18.817
  329    H    VAL  44           H        VAL  44   6.135  -3.721 -14.654
  330    HA   VAL  44           HA       VAL  44   4.665  -1.839 -16.356
  331    HB   VAL  44           HB       VAL  44   2.863  -2.166 -15.034
  332   1HG1  VAL  44          1HG1      VAL  44   2.681  -4.314 -14.153
  333   2HG1  VAL  44          2HG1      VAL  44   4.328  -4.304 -13.521
  334   3HG1  VAL  44          3HG1      VAL  44   4.050  -4.485 -15.252
  335   1HG2  VAL  44          1HG2      VAL  44   3.170  -2.424 -12.448
  336   2HG2  VAL  44          2HG2      VAL  44   3.392  -0.837 -13.182
  337   3HG2  VAL  44          3HG2      VAL  44   4.796  -1.817 -12.754
  338    H    MET  45           H        MET  45   6.870  -1.957 -13.641
  339    HA   MET  45           HA       MET  45   6.633   0.691 -12.711
  340   1HB   MET  45          2HB       MET  45   8.013  -1.403 -11.817
  341   2HB   MET  45          1HB       MET  45   9.311  -0.636 -12.733
  342   1HG   MET  45          2HG       MET  45   9.446   0.289 -10.538
  343   2HG   MET  45          1HG       MET  45   8.687   1.532 -11.531
  344   1HE   MET  45          1HE       MET  45   7.222   1.336  -7.762
  345   2HE   MET  45          2HE       MET  45   8.022   2.439  -8.877
  346   3HE   MET  45          3HE       MET  45   8.829   0.950  -8.392
  347    H    ARG  46           H        ARG  46   8.591  -0.763 -15.293
  348    HA   ARG  46           HA       ARG  46  10.086   1.565 -15.938
  349   1HB   ARG  46          2HB       ARG  46  10.499   0.453 -18.123
  350   2HB   ARG  46          1HB       ARG  46  10.809  -0.607 -16.751
  351   1HG   ARG  46          2HG       ARG  46   8.978  -1.946 -17.189
  352   2HG   ARG  46          1HG       ARG  46   8.068  -0.641 -17.943
  353   1HD   ARG  46          2HD       ARG  46   8.681  -2.085 -19.727
  354   2HD   ARG  46          1HD       ARG  46   9.783  -0.716 -19.829
  355    HE   ARG  46           HE       ARG  46  10.965  -2.738 -18.235
  356   1HH1  ARG  46          2HH1      ARG  46  10.051  -2.066 -21.538
  357   2HH1  ARG  46          1HH1      ARG  46  11.291  -3.064 -22.216
  358   1HH2  ARG  46          1HH2      ARG  46  12.583  -4.043 -19.147
  359   2HH2  ARG  46          2HH2      ARG  46  12.720  -4.182 -20.869
  360    H    MET  47           H        MET  47   6.873   0.458 -16.803
  361    HA   MET  47           HA       MET  47   6.393   2.288 -18.946
  362   1HB   MET  47          2HB       MET  47   4.816   0.388 -17.333
  363   2HB   MET  47          1HB       MET  47   3.912   1.792 -17.893
  364   1HG   MET  47          2HG       MET  47   3.761   0.009 -19.557
  365   2HG   MET  47          1HG       MET  47   4.711   1.343 -20.212
  366   1HE   MET  47          1HE       MET  47   7.490   1.244 -20.424
  367   2HE   MET  47          2HE       MET  47   6.282   0.865 -21.649
  368   3HE   MET  47          3HE       MET  47   7.694  -0.172 -21.464
  369    H    LEU  48           H        LEU  48   6.157   2.447 -15.444
  370    HA   LEU  48           HA       LEU  48   4.634   4.888 -15.325
  371   1HB   LEU  48          2HB       LEU  48   6.078   3.150 -13.396
  372   2HB   LEU  48          1HB       LEU  48   5.844   4.819 -12.935
  373    HG   LEU  48           HG       LEU  48   3.427   4.561 -13.080
  374   1HD1  LEU  48          1HD1      LEU  48   2.657   3.048 -14.575
  375   2HD1  LEU  48          2HD1      LEU  48   2.979   1.826 -13.344
  376   3HD1  LEU  48          3HD1      LEU  48   4.185   2.169 -14.582
  377   1HD2  LEU  48          1HD2      LEU  48   4.044   2.068 -11.625
  378   2HD2  LEU  48          2HD2      LEU  48   3.310   3.559 -11.038
  379   3HD2  LEU  48          3HD2      LEU  48   5.063   3.436 -11.178
  380    H    GLY  49           H        GLY  49   8.028   4.011 -15.452
  381   1HA   GLY  49          2HA       GLY  49   9.509   5.694 -16.508
  382   2HA   GLY  49          1HA       GLY  49   8.754   6.886 -15.459
  383    H    GLN  50           H        GLN  50   9.621   3.642 -14.363
  384    HA   GLN  50           HA       GLN  50  12.129   4.487 -13.184
  385   1HB   GLN  50          2HB       GLN  50  11.380   3.946 -10.836
  386   2HB   GLN  50          1HB       GLN  50  10.713   5.437 -11.496
  387   1HG   GLN  50          2HG       GLN  50   8.907   3.412 -12.259
  388   2HG   GLN  50          1HG       GLN  50   9.321   3.064 -10.582
  389   1HE2  GLN  50          1HE2      GLN  50   8.042   5.637 -12.719
  390   2HE2  GLN  50          2HE2      GLN  50   7.278   6.503 -11.476
  391    H    ASN  51           H        ASN  51  13.457   2.776 -12.805
  392    HA   ASN  51           HA       ASN  51  12.254   0.073 -12.838
  393   1HB   ASN  51          2HB       ASN  51  13.388   0.903 -15.048
  394   2HB   ASN  51          1HB       ASN  51  14.890   0.580 -14.180
  395   1HD2  ASN  51          1HD2      ASN  51  15.566  -1.594 -14.051
  396   2HD2  ASN  51          2HD2      ASN  51  14.618  -2.912 -14.546
  397    HA   PRO  52           HA       PRO  52  15.111   0.260  -9.271
  398   1HB   PRO  52          2HB       PRO  52  13.392  -0.963  -7.529
  399   2HB   PRO  52          1HB       PRO  52  13.370   0.773  -7.874
  400   1HG   PRO  52          2HG       PRO  52  11.480  -1.330  -8.713
  401   2HG   PRO  52          1HG       PRO  52  11.224   0.413  -8.545
  402   1HD   PRO  52          2HD       PRO  52  11.663  -1.036 -10.971
  403   2HD   PRO  52          1HD       PRO  52  11.558   0.728 -10.777
  404    H    THR  53           H        THR  53  15.014  -1.885  -7.449
  405    HA   THR  53           HA       THR  53  15.922  -4.126  -9.143
  406    HB   THR  53           HB       THR  53  17.364  -4.753  -7.407
  407    HG1  THR  53           HG1      THR  53  16.803  -4.651  -5.382
  408   1HG2  THR  53          1HG2      THR  53  17.845  -2.429  -8.313
  409   2HG2  THR  53          2HG2      THR  53  18.562  -2.808  -6.746
  410   3HG2  THR  53          3HG2      THR  53  17.116  -1.802  -6.834
  411    HA   PRO  54           HA       PRO  54  12.657  -6.755  -7.772
  412   1HB   PRO  54          2HB       PRO  54  13.885  -9.077  -6.983
  413   2HB   PRO  54          1HB       PRO  54  13.681  -8.585  -8.672
  414   1HG   PRO  54          2HG       PRO  54  16.111  -8.486  -6.955
  415   2HG   PRO  54          1HG       PRO  54  15.971  -8.757  -8.700
  416   1HD   PRO  54          2HD       PRO  54  16.725  -6.350  -7.526
  417   2HD   PRO  54          1HD       PRO  54  16.079  -6.508  -9.175
  418    H    GLU  55           H        GLU  55  15.285  -6.351  -5.471
  419    HA   GLU  55           HA       GLU  55  13.734  -7.236  -3.182
  420   1HB   GLU  55          2HB       GLU  55  16.474  -6.044  -3.550
  421   2HB   GLU  55          1HB       GLU  55  15.746  -6.142  -1.946
  422   1HG   GLU  55          2HG       GLU  55  15.863  -8.438  -1.880
  423   2HG   GLU  55          1HG       GLU  55  15.639  -8.605  -3.621
  424    H    GLU  56           H        GLU  56  14.637  -4.193  -4.742
  425    HA   GLU  56           HA       GLU  56  13.635  -2.507  -2.636
  426   1HB   GLU  56          2HB       GLU  56  15.278  -2.096  -4.796
  427   2HB   GLU  56          1HB       GLU  56  13.779  -1.337  -5.329
  428   1HG   GLU  56          2HG       GLU  56  13.759   0.181  -3.537
  429   2HG   GLU  56          1HG       GLU  56  14.855  -0.804  -2.568
  430    H    LEU  57           H        LEU  57  12.412  -3.530  -5.835
  431    HA   LEU  57           HA       LEU  57  10.028  -2.017  -5.749
  432   1HB   LEU  57          2HB       LEU  57   9.319  -3.221  -7.619
  433   2HB   LEU  57          1HB       LEU  57  11.056  -3.146  -7.768
  434    HG   LEU  57           HG       LEU  57  10.953  -5.529  -6.634
  435   1HD1  LEU  57          1HD1      LEU  57   8.676  -6.392  -7.978
  436   2HD1  LEU  57          2HD1      LEU  57   8.151  -4.892  -7.216
  437   3HD1  LEU  57          3HD1      LEU  57   8.822  -6.193  -6.232
  438   1HD2  LEU  57          1HD2      LEU  57  10.716  -6.505  -8.939
  439   2HD2  LEU  57          2HD2      LEU  57  11.821  -5.132  -8.873
  440   3HD2  LEU  57          3HD2      LEU  57  10.188  -4.921  -9.508
  441    H    GLN  58           H        GLN  58  10.815  -5.260  -4.550
  442    HA   GLN  58           HA       GLN  58   8.205  -6.139  -3.969
  443   1HB   GLN  58          2HB       GLN  58  10.916  -6.948  -3.241
  444   2HB   GLN  58          1HB       GLN  58   9.756  -7.224  -1.943
  445   1HG   GLN  58          2HG       GLN  58   9.280  -8.089  -4.808
  446   2HG   GLN  58          1HG       GLN  58   9.978  -9.145  -3.581
  447   1HE2  GLN  58          1HE2      GLN  58   6.993  -7.870  -4.824
  448   2HE2  GLN  58          2HE2      GLN  58   5.974  -8.535  -3.640
  449    H    GLU  59           H        GLU  59  10.437  -4.101  -2.108
  450    HA   GLU  59           HA       GLU  59   8.990  -4.042   0.322
  451   1HB   GLU  59          2HB       GLU  59  10.968  -2.189  -0.974
  452   2HB   GLU  59          1HB       GLU  59  10.106  -1.670   0.475
  453   1HG   GLU  59          2HG       GLU  59  11.381  -4.384   0.453
  454   2HG   GLU  59          1HG       GLU  59  12.405  -2.967   0.681
  455    H    MET  60           H        MET  60   8.768  -2.103  -2.631
  456    HA   MET  60           HA       MET  60   6.822  -0.255  -1.685
  457   1HB   MET  60          2HB       MET  60   7.237  -1.144  -4.549
  458   2HB   MET  60          1HB       MET  60   6.500   0.361  -3.999
  459   1HG   MET  60          2HG       MET  60   8.769   0.765  -2.789
  460   2HG   MET  60          1HG       MET  60   9.392  -0.472  -3.882
  461   1HE   MET  60          1HE       MET  60  11.114   1.438  -4.715
  462   2HE   MET  60          2HE       MET  60  10.322   2.521  -3.574
  463   3HE   MET  60          3HE       MET  60  10.579   3.040  -5.238
  464    H    ILE  61           H        ILE  61   6.646  -3.373  -3.321
  465    HA   ILE  61           HA       ILE  61   3.860  -3.429  -3.811
  466    HB   ILE  61           HB       ILE  61   5.726  -5.760  -3.279
  467   1HG1  ILE  61          2HG1      ILE  61   6.519  -4.476  -5.180
  468   2HG1  ILE  61          1HG1      ILE  61   5.727  -5.923  -5.792
  469   1HG2  ILE  61          1HG2      ILE  61   3.107  -5.766  -4.792
  470   2HG2  ILE  61          2HG2      ILE  61   3.216  -6.170  -3.079
  471   3HG2  ILE  61          3HG2      ILE  61   4.061  -7.154  -4.272
  472   1HD1  ILE  61          1HD1      ILE  61   3.662  -4.612  -6.190
  473   2HD1  ILE  61          2HD1      ILE  61   5.032  -3.956  -7.086
  474   3HD1  ILE  61          3HD1      ILE  61   4.483  -3.162  -5.611
  475    H    ASP  62           H        ASP  62   5.753  -4.893  -1.147
  476    HA   ASP  62           HA       ASP  62   3.652  -5.912   0.359
  477   1HB   ASP  62          2HB       ASP  62   6.276  -5.967   0.720
  478   2HB   ASP  62          1HB       ASP  62   5.928  -4.617   1.799
  479    H    GLU  63           H        GLU  63   4.877  -2.603   0.198
  480    HA   GLU  63           HA       GLU  63   3.357  -1.613   2.414
  481   1HB   GLU  63          2HB       GLU  63   4.865  -0.323   0.157
  482   2HB   GLU  63          1HB       GLU  63   3.865   0.645   1.241
  483   1HG   GLU  63          2HG       GLU  63   5.119  -0.087   3.171
  484   2HG   GLU  63          1HG       GLU  63   6.006  -1.270   2.208
  485    H    VAL  64           H        VAL  64   2.962  -1.115  -1.120
  486    HA   VAL  64           HA       VAL  64   0.450   0.174  -0.905
  487    HB   VAL  64           HB       VAL  64   1.874   0.397  -2.895
  488   1HG1  VAL  64          1HG1      VAL  64   1.008  -2.386  -3.687
  489   2HG1  VAL  64          2HG1      VAL  64   2.531  -2.088  -2.850
  490   3HG1  VAL  64          3HG1      VAL  64   2.241  -1.369  -4.433
  491   1HG2  VAL  64          1HG2      VAL  64   0.093   0.654  -4.342
  492   2HG2  VAL  64          2HG2      VAL  64  -0.801   0.422  -2.840
  493   3HG2  VAL  64          3HG2      VAL  64  -0.585  -0.928  -3.954
  494    H    ASP  65           H        ASP  65   1.293  -3.244  -1.463
  495    HA   ASP  65           HA       ASP  65  -1.410  -4.110  -1.860
  496   1HB   ASP  65          2HB       ASP  65   1.129  -5.272  -2.115
  497   2HB   ASP  65          1HB       ASP  65   0.358  -6.173  -0.817
  498    H    GLU  66           H        GLU  66  -2.852  -3.779  -0.280
  499    HA   GLU  66           HA       GLU  66  -2.303  -3.575   2.480
  500   1HB   GLU  66          2HB       GLU  66  -4.937  -4.425   1.243
  501   2HB   GLU  66          1HB       GLU  66  -4.696  -3.696   2.831
  502   1HG   GLU  66          2HG       GLU  66  -3.752  -1.667   1.684
  503   2HG   GLU  66          1HG       GLU  66  -4.199  -2.395   0.141
  504    H    ASP  67           H        ASP  67  -3.568  -6.276   0.556
  505    HA   ASP  67           HA       ASP  67  -3.535  -8.090   2.816
  506   1HB   ASP  67          2HB       ASP  67  -4.118  -9.817   1.043
  507   2HB   ASP  67          1HB       ASP  67  -5.280  -8.510   1.260
  508    H    GLY  68           H        GLY  68  -1.568  -7.544  -0.092
  509   1HA   GLY  68          2HA       GLY  68   0.647  -8.110  -0.491
  510   2HA   GLY  68          1HA       GLY  68   0.733  -8.763   1.143
  511    H    SER  69           H        SER  69  -1.374  -9.571  -1.602
  512    HA   SER  69           HA       SER  69  -1.022 -12.408  -1.158
  513   1HB   SER  69          2HB       SER  69  -2.543 -12.633  -3.121
  514   2HB   SER  69          1HB       SER  69  -3.203 -11.615  -1.846
  515    HG   SER  69           HG       SER  69  -2.435 -10.987  -4.415
  516    H    GLY  70           H        GLY  70   0.600 -10.038  -3.052
  517   1HA   GLY  70          2HA       GLY  70   2.635 -10.490  -4.193
  518   2HA   GLY  70          1HA       GLY  70   2.100 -12.151  -4.438
  519    H    THR  71           H        THR  71  -0.338  -9.818  -4.998
  520    HA   THR  71           HA       THR  71   0.242  -9.589  -7.864
  521    HB   THR  71           HB       THR  71  -1.983 -10.345  -8.498
  522    HG1  THR  71           HG1      THR  71  -3.485 -10.400  -7.054
  523   1HG2  THR  71          1HG2      THR  71  -1.796 -12.724  -7.909
  524   2HG2  THR  71          2HG2      THR  71  -0.669 -12.320  -6.614
  525   3HG2  THR  71          3HG2      THR  71  -0.211 -12.055  -8.298
  526    H    VAL  72           H        VAL  72  -0.165  -7.571  -8.557
  527    HA   VAL  72           HA       VAL  72  -1.513  -5.727  -6.729
  528    HB   VAL  72           HB       VAL  72  -0.309  -5.008  -9.399
  529   1HG1  VAL  72          1HG1      VAL  72  -0.112  -2.803  -8.380
  530   2HG1  VAL  72          2HG1      VAL  72  -0.681  -3.433  -6.834
  531   3HG1  VAL  72          3HG1      VAL  72  -1.775  -3.366  -8.216
  532   1HG2  VAL  72          1HG2      VAL  72   1.035  -5.344  -6.706
  533   2HG2  VAL  72          2HG2      VAL  72   1.726  -4.376  -8.008
  534   3HG2  VAL  72          3HG2      VAL  72   1.482  -6.109  -8.234
  535    H    ASP  73           H        ASP  73  -3.605  -5.380  -6.882
  536    HA   ASP  73           HA       ASP  73  -5.101  -6.100  -9.276
  537   1HB   ASP  73          2HB       ASP  73  -6.165  -4.651  -6.837
  538   2HB   ASP  73          1HB       ASP  73  -7.076  -5.590  -8.018
  539    H    PHE  74           H        PHE  74  -6.669  -4.421 -10.200
  540    HA   PHE  74           HA       PHE  74  -5.228  -2.199 -11.133
  541   1HB   PHE  74          2HB       PHE  74  -7.283  -3.192 -12.221
  542   2HB   PHE  74          1HB       PHE  74  -8.246  -2.333 -11.016
  543    HD1  PHE  74           HD1      PHE  74  -5.146  -1.428 -12.913
  544    HD2  PHE  74           HD2      PHE  74  -9.238  -0.473 -12.026
  545    HE1  PHE  74           HE1      PHE  74  -4.956   0.651 -14.252
  546    HE2  PHE  74           HE2      PHE  74  -9.045   1.605 -13.364
  547    HZ   PHE  74           HZ       PHE  74  -6.905   2.165 -14.479
  548    H    ASP  75           H        ASP  75  -7.332  -2.585  -8.337
  549    HA   ASP  75           HA       ASP  75  -7.600   0.183  -7.690
  550   1HB   ASP  75          2HB       ASP  75  -7.774  -2.287  -5.939
  551   2HB   ASP  75          1HB       ASP  75  -8.195  -0.659  -5.410
  552    H    GLU  76           H        GLU  76  -5.339  -2.375  -6.687
  553    HA   GLU  76           HA       GLU  76  -3.804  -0.696  -4.934
  554   1HB   GLU  76          2HB       GLU  76  -2.958  -3.286  -6.257
  555   2HB   GLU  76          1HB       GLU  76  -2.221  -2.537  -4.841
  556   1HG   GLU  76          2HG       GLU  76  -4.323  -2.821  -3.582
  557   2HG   GLU  76          1HG       GLU  76  -5.083  -3.544  -5.000
  558    H    PHE  77           H        PHE  77  -3.768  -1.441  -8.343
  559    HA   PHE  77           HA       PHE  77  -1.140  -0.653  -9.000
  560   1HB   PHE  77          2HB       PHE  77  -3.144  -1.793 -10.387
  561   2HB   PHE  77          1HB       PHE  77  -3.346  -0.136 -10.932
  562    HD1  PHE  77           HD1      PHE  77  -2.795  -0.943 -13.208
  563    HD2  PHE  77           HD2      PHE  77   0.052  -1.173  -9.989
  564    HE1  PHE  77           HE1      PHE  77  -0.962  -1.264 -14.837
  565    HE2  PHE  77           HE2      PHE  77   1.874  -1.482 -11.626
  566    HZ   PHE  77           HZ       PHE  77   1.372  -1.533 -14.054
  567    H    LEU  78           H        LEU  78  -4.220   1.148  -9.130
  568    HA   LEU  78           HA       LEU  78  -2.990   3.637  -9.858
  569   1HB   LEU  78          2HB       LEU  78  -5.723   2.788  -8.999
  570   2HB   LEU  78          1HB       LEU  78  -5.315   4.493  -8.960
  571    HG   LEU  78           HG       LEU  78  -4.932   4.515 -11.347
  572   1HD1  LEU  78          1HD1      LEU  78  -3.906   2.225 -11.445
  573   2HD1  LEU  78          2HD1      LEU  78  -5.080   2.530 -12.722
  574   3HD1  LEU  78          3HD1      LEU  78  -5.529   1.546 -11.329
  575   1HD2  LEU  78          1HD2      LEU  78  -7.190   3.759 -12.144
  576   2HD2  LEU  78          2HD2      LEU  78  -7.258   4.739 -10.679
  577   3HD2  LEU  78          3HD2      LEU  78  -7.435   2.988 -10.576
  578    H    VAL  79           H        VAL  79  -3.751   2.039  -6.839
  579    HA   VAL  79           HA       VAL  79  -3.668   4.253  -5.088
  580    HB   VAL  79           HB       VAL  79  -3.370   1.298  -4.824
  581   1HG1  VAL  79          1HG1      VAL  79  -2.533   3.239  -2.649
  582   2HG1  VAL  79          2HG1      VAL  79  -1.476   2.101  -3.487
  583   3HG1  VAL  79          3HG1      VAL  79  -2.760   1.502  -2.436
  584   1HG2  VAL  79          1HG2      VAL  79  -5.225   1.544  -3.365
  585   2HG2  VAL  79          2HG2      VAL  79  -5.516   2.709  -4.657
  586   3HG2  VAL  79          3HG2      VAL  79  -4.893   3.256  -3.100
  587    H    MET  80           H        MET  80  -1.125   2.027  -6.196
  588    HA   MET  80           HA       MET  80   1.061   2.885  -4.772
  589   1HB   MET  80          2HB       MET  80   0.652   1.278  -7.014
  590   2HB   MET  80          1HB       MET  80   1.764   2.529  -7.572
  591   1HG   MET  80          2HG       MET  80   3.319   2.045  -5.796
  592   2HG   MET  80          1HG       MET  80   2.165   0.970  -5.008
  593   1HE   MET  80          1HE       MET  80   3.941   1.960  -7.978
  594   2HE   MET  80          2HE       MET  80   3.242   0.858  -9.162
  595   3HE   MET  80          3HE       MET  80   4.850   0.541  -8.516
  596    H    MET  81           H        MET  81  -0.544   4.575  -7.427
  597    HA   MET  81           HA       MET  81   1.538   6.427  -8.000
  598   1HB   MET  81          2HB       MET  81  -0.364   6.070  -9.531
  599   2HB   MET  81          1HB       MET  81  -1.454   6.777  -8.342
  600   1HG   MET  81          2HG       MET  81  -0.699   8.379 -10.149
  601   2HG   MET  81          1HG       MET  81  -0.366   8.923  -8.507
  602   1HE   MET  81          1HE       MET  81   2.522   7.373 -11.685
  603   2HE   MET  81          2HE       MET  81   0.761   7.394 -11.691
  604   3HE   MET  81          3HE       MET  81   1.615   6.174 -10.753
  605    H    VAL  82           H        VAL  82  -1.438   6.804  -6.038
  606    HA   VAL  82           HA       VAL  82  -0.714   9.359  -5.003
  607    HB   VAL  82           HB       VAL  82  -2.475   8.931  -3.284
  608   1HG1  VAL  82          1HG1      VAL  82  -3.294   9.947  -5.236
  609   2HG1  VAL  82          2HG1      VAL  82  -4.325   8.526  -5.071
  610   3HG1  VAL  82          3HG1      VAL  82  -2.989   8.516  -6.221
  611   1HG2  VAL  82          1HG2      VAL  82  -3.769   6.889  -3.350
  612   2HG2  VAL  82          2HG2      VAL  82  -2.073   6.441  -3.170
  613   3HG2  VAL  82          3HG2      VAL  82  -2.860   6.301  -4.743
  614    H    ARG  83           H        ARG  83   0.044   6.085  -4.050
  615    HA   ARG  83           HA       ARG  83   0.851   6.512  -1.381
  616   1HB   ARG  83          2HB       ARG  83   1.713   4.496  -3.456
  617   2HB   ARG  83          1HB       ARG  83   2.353   4.491  -1.812
  618   1HG   ARG  83          2HG       ARG  83  -0.456   4.748  -1.566
  619   2HG   ARG  83          1HG       ARG  83  -0.179   3.486  -2.766
  620   1HD   ARG  83          2HD       ARG  83   1.118   2.188  -1.265
  621   2HD   ARG  83          1HD       ARG  83   1.327   3.536  -0.152
  622    HE   ARG  83           HE       ARG  83  -1.437   2.767  -0.487
  623   1HH1  ARG  83          2HH1      ARG  83   1.547   2.096   1.201
  624   2HH1  ARG  83          1HH1      ARG  83   0.759   1.382   2.566
  625   1HH2  ARG  83          1HH2      ARG  83  -2.448   1.828   1.312
  626   2HH2  ARG  83          2HH2      ARG  83  -1.497   1.229   2.629
  627    H    CYS  84           H        CYS  84   2.351   7.374  -4.400
  628    HA   CYS  84           HA       CYS  84   5.041   7.597  -3.460
  629   1HB   CYS  84          2HB       CYS  84   4.176   7.526  -5.909
  630   2HB   CYS  84          1HB       CYS  84   3.910   9.257  -5.703
  631    HG   CYS  84           HG       CYS  84   6.328   9.534  -6.134
  632    H    MET  85           H        MET  85   2.222   9.706  -3.421
  633    HA   MET  85           HA       MET  85   3.795  11.995  -2.494
  634   1HB   MET  85          2HB       MET  85   1.662  11.980  -4.089
  635   2HB   MET  85          1HB       MET  85   0.809  12.042  -2.547
  636   1HG   MET  85          2HG       MET  85   3.118  13.901  -2.917
  637   2HG   MET  85          1HG       MET  85   1.629  14.267  -3.788
  638   1HE   MET  85          1HE       MET  85   3.271  15.794  -1.340
  639   2HE   MET  85          2HE       MET  85   3.550  14.241  -0.557
  640   3HE   MET  85          3HE       MET  85   2.626  15.487   0.278
  641    H    LYS  86           H        LYS  86   0.944  10.153  -1.339
  642    HA   LYS  86           HA       LYS  86   1.410  11.098   1.389
  643   1HB   LYS  86          2HB       LYS  86  -0.906  10.891   0.249
  644   2HB   LYS  86          1HB       LYS  86  -0.742   9.163   0.561
  645   1HG   LYS  86          2HG       LYS  86  -0.773   9.439   2.880
  646   2HG   LYS  86          1HG       LYS  86  -0.244  11.119   2.787
  647   1HD   LYS  86          2HD       LYS  86  -2.877  10.365   1.568
  648   2HD   LYS  86          1HD       LYS  86  -2.769  10.545   3.319
  649   1HE   LYS  86          2HE       LYS  86  -1.614  12.803   2.832
  650   2HE   LYS  86          1HE       LYS  86  -2.232  12.619   1.190
  651   1HZ   LYS  86          1HZ       LYS  86  -3.943  12.462   3.610
  652   2HZ   LYS  86          2HZ       LYS  86  -4.447  12.555   1.990
  653   3HZ   LYS  86          3HZ       LYS  86  -3.700  13.889   2.728
  654    H    ASP  87           H        ASP  87   1.639   9.673   3.169
  655    HA   ASP  87           HA       ASP  87   2.411   7.832   4.314
  656   1HB   ASP  87          2HB       ASP  87   0.758   6.632   2.705
  657   2HB   ASP  87          1HB       ASP  87   2.205   6.156   1.819
  658    H    ASP  88           H        ASP  88   4.259   9.563   3.518
  659    HA   ASP  88           HA       ASP  88   6.524   9.802   3.290
  660   1HB   ASP  88          2HB       ASP  88   6.640   7.650   4.594
  661   2HB   ASP  88          1HB       ASP  88   6.693   6.789   3.056
  662    H    SER  89           HN       SER  89   7.337  10.637   1.508
  663    HA   SER  89           HA       SER  89   6.620   9.541  -1.091
  664   1HB   SER  89          2HB       SER  89   8.193  11.996  -0.293
  665   2HB   SER  89          1HB       SER  89   7.897  11.526  -1.963
  666    HG   SER  89           HG       SER  89   5.759  11.874  -1.686
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  -3.936   7.530  11.695
    2   2H    MET   1          2H        MET   1  -3.466   8.574  10.439
    3   3H    MET   1          3H        MET   1  -3.126   6.912  10.340
    4    HA   MET   1           HA       MET   1  -5.563   6.474  10.357
    5   1HB   MET   1          2HB       MET   1  -5.503   9.473  10.372
    6   2HB   MET   1          1HB       MET   1  -6.791   8.656   9.486
    7   1HG   MET   1          2HG       MET   1  -6.174   7.743  12.272
    8   2HG   MET   1          1HG       MET   1  -7.081   9.239  12.057
    9   1HE   MET   1          1HE       MET   1  -9.012   9.628  11.129
   10   2HE   MET   1          2HE       MET   1  -9.847   8.777  12.425
   11   3HE   MET   1          3HE       MET   1 -10.336   8.518  10.752
   12    H    ASN   2           H        ASN   2  -4.118   9.120   8.417
   13    HA   ASN   2           HA       ASN   2  -3.693   9.338   6.177
   14   1HB   ASN   2          2HB       ASN   2  -3.343   6.354   6.489
   15   2HB   ASN   2          1HB       ASN   2  -3.051   7.191   4.964
   16   1HD2  ASN   2          1HD2      ASN   2  -1.538   9.248   5.276
   17   2HD2  ASN   2          2HD2      ASN   2  -0.205   9.019   6.302
   18    H    ASP   3           H        ASP   3  -5.997  10.010   6.103
   19    HA   ASP   3           HA       ASP   3  -7.775   8.091   4.760
   20   1HB   ASP   3          2HB       ASP   3  -8.211  10.729   6.134
   21   2HB   ASP   3          1HB       ASP   3  -9.415  10.097   5.008
   22    H    ILE   4           H        ILE   4  -5.854  10.928   4.147
   23    HA   ILE   4           HA       ILE   4  -7.091  11.951   1.854
   24    HB   ILE   4           HB       ILE   4  -4.825  12.829   1.245
   25   1HG1  ILE   4          2HG1      ILE   4  -3.224  12.395   3.385
   26   2HG1  ILE   4          1HG1      ILE   4  -4.062  10.844   3.334
   27   1HG2  ILE   4          1HG2      ILE   4  -6.430  13.876   2.942
   28   2HG2  ILE   4          2HG2      ILE   4  -4.740  14.365   3.063
   29   3HG2  ILE   4          3HG2      ILE   4  -5.399  13.182   4.192
   30   1HD1  ILE   4          1HD1      ILE   4  -1.891  11.107   1.933
   31   2HD1  ILE   4          2HD1      ILE   4  -2.899  12.044   0.830
   32   3HD1  ILE   4          3HD1      ILE   4  -3.291  10.358   1.167
   33    H    TYR   5           H        TYR   5  -5.083   9.109   2.247
   34    HA   TYR   5           HA       TYR   5  -4.241   8.646  -0.381
   35   1HB   TYR   5          2HB       TYR   5  -4.909   6.828   1.916
   36   2HB   TYR   5          1HB       TYR   5  -4.528   6.146   0.337
   37    HD1  TYR   5           HD1      TYR   5  -2.295   5.730  -0.196
   38    HD2  TYR   5           HD2      TYR   5  -3.228   8.701   2.763
   39    HE1  TYR   5           HE1      TYR   5   0.122   6.042   0.257
   40    HE2  TYR   5           HE2      TYR   5  -0.818   9.017   3.208
   41    HH   TYR   5           HH       TYR   5   1.384   7.186   2.786
   42    H    LYS   6           H        LYS   6  -7.305   7.863   1.209
   43    HA   LYS   6           HA       LYS   6  -8.412   6.566  -1.136
   44   1HB   LYS   6          2HB       LYS   6  -9.261   7.040   1.656
   45   2HB   LYS   6          1HB       LYS   6 -10.563   6.995   0.468
   46   1HG   LYS   6          2HG       LYS   6 -10.296   4.736   1.141
   47   2HG   LYS   6          1HG       LYS   6  -9.459   4.839  -0.407
   48   1HD   LYS   6          2HD       LYS   6  -7.796   3.808   0.801
   49   2HD   LYS   6          1HD       LYS   6  -7.406   5.479   1.204
   50   1HE   LYS   6          2HE       LYS   6  -8.246   5.307   3.350
   51   2HE   LYS   6          1HE       LYS   6  -9.426   4.076   2.903
   52   1HZ   LYS   6          1HZ       LYS   6  -7.603   3.192   4.258
   53   2HZ   LYS   6          2HZ       LYS   6  -6.491   3.639   3.053
   54   3HZ   LYS   6          3HZ       LYS   6  -7.671   2.460   2.730
   55    H    ALA   7           H        ALA   7  -8.316   9.791   0.160
   56    HA   ALA   7           HA       ALA   7 -10.650  10.819  -1.110
   57   1HB   ALA   7          1HB       ALA   7  -8.208  12.464  -0.483
   58   2HB   ALA   7          2HB       ALA   7  -9.263  11.870   0.798
   59   3HB   ALA   7          3HB       ALA   7  -9.904  12.947  -0.442
   60    H    ALA   8           H        ALA   8  -7.274  10.450  -2.121
   61    HA   ALA   8           HA       ALA   8  -7.533  12.031  -4.505
   62   1HB   ALA   8          1HB       ALA   8  -5.467   9.914  -4.383
   63   2HB   ALA   8          2HB       ALA   8  -5.398  11.147  -3.125
   64   3HB   ALA   8          3HB       ALA   8  -5.315  11.616  -4.823
   65    H    VAL   9           H        VAL   9  -7.543   8.537  -3.811
   66    HA   VAL   9           HA       VAL   9  -7.829   7.694  -6.503
   67    HB   VAL   9           HB       VAL   9  -7.126   6.233  -4.576
   68   1HG1  VAL   9          1HG1      VAL   9  -8.909   5.179  -3.239
   69   2HG1  VAL   9          2HG1      VAL   9 -10.106   6.219  -4.010
   70   3HG1  VAL   9          3HG1      VAL   9  -8.863   6.920  -2.976
   71   1HG2  VAL   9          1HG2      VAL   9  -8.102   5.496  -6.896
   72   2HG2  VAL   9          2HG2      VAL   9  -9.508   5.004  -5.949
   73   3HG2  VAL   9          3HG2      VAL   9  -7.929   4.290  -5.620
   74    H    GLU  10           H        GLU  10 -10.084   9.021  -4.225
   75    HA   GLU  10           HA       GLU  10 -12.446   8.034  -5.580
   76   1HB   GLU  10          2HB       GLU  10 -11.909   9.795  -3.227
   77   2HB   GLU  10          1HB       GLU  10 -13.473   9.928  -4.032
   78   1HG   GLU  10          2HG       GLU  10 -13.869   7.536  -3.746
   79   2HG   GLU  10          1HG       GLU  10 -12.268   7.330  -3.036
   80    H    GLN  11           H        GLN  11 -10.284  10.708  -5.951
   81    HA   GLN  11           HA       GLN  11 -12.139  11.880  -7.928
   82   1HB   GLN  11          2HB       GLN  11 -11.530  14.134  -7.252
   83   2HB   GLN  11          1HB       GLN  11 -12.176  13.262  -5.864
   84   1HG   GLN  11          2HG       GLN  11  -9.602  12.656  -5.498
   85   2HG   GLN  11          1HG       GLN  11  -9.368  14.144  -6.412
   86   1HE2  GLN  11          1HE2      GLN  11  -8.559  14.111  -3.726
   87   2HE2  GLN  11          2HE2      GLN  11  -9.614  15.065  -2.800
   88    H    LEU  12           H        LEU  12  -9.855  10.058  -8.224
   89    HA   LEU  12           HA       LEU  12  -7.570  11.496  -9.156
   90   1HB   LEU  12          2HB       LEU  12  -7.211   9.261 -10.475
   91   2HB   LEU  12          1HB       LEU  12  -6.984   9.330  -8.745
   92    HG   LEU  12           HG       LEU  12  -9.058   8.199  -8.351
   93   1HD1  LEU  12          1HD1      LEU  12  -9.555   8.773 -11.266
   94   2HD1  LEU  12          2HD1      LEU  12 -10.599   9.101  -9.882
   95   3HD1  LEU  12          3HD1      LEU  12 -10.388   7.447 -10.457
   96   1HD2  LEU  12          1HD2      LEU  12  -7.510   6.990 -10.657
   97   2HD2  LEU  12          2HD2      LEU  12  -8.712   6.106  -9.718
   98   3HD2  LEU  12          3HD2      LEU  12  -7.251   6.708  -8.936
   99    H    THR  13           H        THR  13  -6.801  11.153 -11.519
  100    HA   THR  13           HA       THR  13  -8.910  12.248 -13.246
  101    HB   THR  13           HB       THR  13  -6.676  12.355 -14.779
  102    HG1  THR  13           HG1      THR  13  -5.213  11.632 -13.374
  103   1HG2  THR  13          1HG2      THR  13  -7.775  14.356 -14.560
  104   2HG2  THR  13          2HG2      THR  13  -6.395  14.683 -13.512
  105   3HG2  THR  13          3HG2      THR  13  -7.940  14.200 -12.811
  106    H    ASP  14           H        ASP  14  -8.960  11.564 -15.508
  107    HA   ASP  14           HA       ASP  14  -9.234   8.726 -15.743
  108   1HB   ASP  14          2HB       ASP  14 -10.476  10.641 -17.028
  109   2HB   ASP  14          1HB       ASP  14  -9.096  10.545 -18.123
  110    H    GLU  15           H        GLU  15  -6.764  11.076 -16.577
  111    HA   GLU  15           HA       GLU  15  -5.231   9.424 -18.324
  112   1HB   GLU  15          2HB       GLU  15  -4.790  11.975 -16.853
  113   2HB   GLU  15          1HB       GLU  15  -3.354  11.077 -17.349
  114   1HG   GLU  15          2HG       GLU  15  -4.472  10.917 -19.667
  115   2HG   GLU  15          1HG       GLU  15  -5.561  12.179 -19.091
  116    H    GLN  16           H        GLN  16  -5.246   9.956 -14.832
  117    HA   GLN  16           HA       GLN  16  -2.882   8.575 -14.153
  118   1HB   GLN  16          2HB       GLN  16  -5.237   9.593 -12.758
  119   2HB   GLN  16          1HB       GLN  16  -4.638   8.092 -12.053
  120   1HG   GLN  16          2HG       GLN  16  -2.470   9.009 -11.688
  121   2HG   GLN  16          1HG       GLN  16  -2.806  10.402 -12.716
  122   1HE2  GLN  16          1HE2      GLN  16  -4.721   8.918 -10.034
  123   2HE2  GLN  16          2HE2      GLN  16  -4.842  10.354  -9.140
  124    H    LYS  17           H        LYS  17  -6.228   7.480 -14.529
  125    HA   LYS  17           HA       LYS  17  -5.785   4.779 -13.758
  126   1HB   LYS  17          2HB       LYS  17  -7.945   6.006 -15.493
  127   2HB   LYS  17          1HB       LYS  17  -7.960   4.345 -14.901
  128   1HG   LYS  17          2HG       LYS  17  -8.517   4.968 -12.780
  129   2HG   LYS  17          1HG       LYS  17  -7.492   6.403 -12.825
  130   1HD   LYS  17          2HD       LYS  17  -9.713   7.245 -12.747
  131   2HD   LYS  17          1HD       LYS  17  -9.230   7.396 -14.435
  132   1HE   LYS  17          2HE       LYS  17 -11.340   6.409 -14.630
  133   2HE   LYS  17          1HE       LYS  17 -10.279   5.002 -14.673
  134   1HZ   LYS  17          1HZ       LYS  17 -12.142   4.715 -13.138
  135   2HZ   LYS  17          2HZ       LYS  17 -11.623   6.059 -12.241
  136   3HZ   LYS  17          3HZ       LYS  17 -10.656   4.665 -12.326
  137    H    ASN  18           H        ASN  18  -5.610   6.507 -16.842
  138    HA   ASN  18           HA       ASN  18  -5.387   4.201 -18.502
  139   1HB   ASN  18          2HB       ASN  18  -4.679   7.103 -18.888
  140   2HB   ASN  18          1HB       ASN  18  -4.296   5.898 -20.115
  141   1HD2  ASN  18          1HD2      ASN  18  -6.514   8.174 -19.687
  142   2HD2  ASN  18          2HD2      ASN  18  -7.914   7.391 -20.243
  143    H    GLU  19           H        GLU  19  -3.026   6.097 -16.691
  144    HA   GLU  19           HA       GLU  19  -0.659   5.213 -17.941
  145   1HB   GLU  19          2HB       GLU  19  -0.837   5.634 -14.958
  146   2HB   GLU  19          1HB       GLU  19   0.529   5.935 -16.029
  147   1HG   GLU  19          2HG       GLU  19  -1.269   7.586 -17.159
  148   2HG   GLU  19          1HG       GLU  19  -1.873   7.598 -15.501
  149    H    PHE  20           H        PHE  20  -2.547   3.831 -15.288
  150    HA   PHE  20           HA       PHE  20  -0.775   1.525 -15.079
  151   1HB   PHE  20          2HB       PHE  20  -3.214   2.435 -13.570
  152   2HB   PHE  20          1HB       PHE  20  -2.486   0.854 -13.311
  153    HD1  PHE  20           HD1      PHE  20  -2.144   4.458 -12.806
  154    HD2  PHE  20           HD2      PHE  20  -0.152   0.663 -12.466
  155    HE1  PHE  20           HE1      PHE  20  -0.456   5.476 -11.302
  156    HE2  PHE  20           HE2      PHE  20   1.527   1.678 -10.957
  157    HZ   PHE  20           HZ       PHE  20   1.380   4.086 -10.377
  158    H    LYS  21           H        LYS  21  -4.181   2.176 -15.954
  159    HA   LYS  21           HA       LYS  21  -5.057  -0.431 -16.341
  160   1HB   LYS  21          2HB       LYS  21  -6.528   1.545 -16.422
  161   2HB   LYS  21          1HB       LYS  21  -5.839   1.985 -17.983
  162   1HG   LYS  21          2HG       LYS  21  -6.775  -0.803 -17.849
  163   2HG   LYS  21          1HG       LYS  21  -8.058   0.386 -17.630
  164   1HD   LYS  21          2HD       LYS  21  -6.053   0.555 -19.892
  165   2HD   LYS  21          1HD       LYS  21  -7.588  -0.299 -20.044
  166   1HE   LYS  21          2HE       LYS  21  -8.605   1.945 -19.118
  167   2HE   LYS  21          1HE       LYS  21  -7.089   2.642 -19.687
  168   1HZ   LYS  21          1HZ       LYS  21  -7.529   1.669 -21.873
  169   2HZ   LYS  21          2HZ       LYS  21  -8.753   2.750 -21.406
  170   3HZ   LYS  21          3HZ       LYS  21  -9.017   1.073 -21.315
  171    H    ALA  22           H        ALA  22  -3.158   1.602 -18.530
  172    HA   ALA  22           HA       ALA  22  -3.363   0.004 -20.850
  173   1HB   ALA  22          1HB       ALA  22  -1.315   1.123 -21.589
  174   2HB   ALA  22          2HB       ALA  22  -1.009   1.681 -19.943
  175   3HB   ALA  22          3HB       ALA  22  -2.401   2.292 -20.837
  176    H    ALA  23           H        ALA  23  -0.828   0.091 -18.349
  177    HA   ALA  23           HA       ALA  23   0.593  -2.183 -19.311
  178   1HB   ALA  23          1HB       ALA  23   2.029  -1.802 -17.568
  179   2HB   ALA  23          2HB       ALA  23   0.725  -1.506 -16.416
  180   3HB   ALA  23          3HB       ALA  23   1.209  -0.242 -17.547
  181    H    PHE  24           H        PHE  24  -1.975  -1.683 -16.960
  182    HA   PHE  24           HA       PHE  24  -2.004  -4.221 -15.742
  183   1HB   PHE  24          2HB       PHE  24  -3.292  -2.074 -15.097
  184   2HB   PHE  24          1HB       PHE  24  -4.492  -2.602 -16.273
  185    HD1  PHE  24           HD1      PHE  24  -5.478  -4.959 -16.018
  186    HD2  PHE  24           HD2      PHE  24  -3.237  -2.999 -12.927
  187    HE1  PHE  24           HE1      PHE  24  -6.445  -6.501 -14.339
  188    HE2  PHE  24           HE2      PHE  24  -4.202  -4.536 -11.246
  189    HZ   PHE  24           HZ       PHE  24  -5.807  -6.286 -11.950
  190    H    ASP  25           H        ASP  25  -3.751  -2.986 -18.599
  191    HA   ASP  25           HA       ASP  25  -5.273  -5.313 -19.097
  192   1HB   ASP  25          2HB       ASP  25  -4.538  -2.886 -20.630
  193   2HB   ASP  25          1HB       ASP  25  -5.046  -4.285 -21.575
  194    H    ILE  26           H        ILE  26  -2.035  -4.380 -20.223
  195    HA   ILE  26           HA       ILE  26  -1.811  -6.647 -21.992
  196    HB   ILE  26           HB       ILE  26   0.561  -5.955 -22.236
  197   1HG1  ILE  26          2HG1      ILE  26  -0.192  -3.728 -20.312
  198   2HG1  ILE  26          1HG1      ILE  26   0.823  -5.105 -19.886
  199   1HG2  ILE  26          1HG2      ILE  26  -1.281  -4.947 -23.588
  200   2HG2  ILE  26          2HG2      ILE  26   0.072  -3.842 -23.347
  201   3HG2  ILE  26          3HG2      ILE  26  -1.403  -3.650 -22.398
  202   1HD1  ILE  26          1HD1      ILE  26   2.629  -4.216 -20.906
  203   2HD1  ILE  26          2HD1      ILE  26   1.720  -2.704 -20.941
  204   3HD1  ILE  26          3HD1      ILE  26   1.702  -3.778 -22.341
  205    H    PHE  27           H        PHE  27  -0.711  -5.915 -18.695
  206    HA   PHE  27           HA       PHE  27   0.918  -8.268 -18.489
  207   1HB   PHE  27          2HB       PHE  27  -0.159  -6.387 -16.381
  208   2HB   PHE  27          1HB       PHE  27   0.909  -7.746 -16.024
  209    HD1  PHE  27           HD1      PHE  27   2.700  -7.750 -18.379
  210    HD2  PHE  27           HD2      PHE  27   1.197  -4.462 -16.057
  211    HE1  PHE  27           HE1      PHE  27   4.646  -6.379 -19.061
  212    HE2  PHE  27           HE2      PHE  27   3.144  -3.092 -16.749
  213    HZ   PHE  27           HZ       PHE  27   4.868  -4.050 -18.246
  214    H    ILE  28           H        ILE  28  -2.472  -7.562 -17.774
  215    HA   ILE  28           HA       ILE  28  -2.792 -10.237 -16.585
  216    HB   ILE  28           HB       ILE  28  -5.013  -9.580 -15.945
  217   1HG1  ILE  28          2HG1      ILE  28  -5.454  -6.969 -16.598
  218   2HG1  ILE  28          1HG1      ILE  28  -4.605  -7.525 -18.043
  219   1HG2  ILE  28          1HG2      ILE  28  -3.358  -7.100 -15.498
  220   2HG2  ILE  28          2HG2      ILE  28  -2.948  -8.631 -14.727
  221   3HG2  ILE  28          3HG2      ILE  28  -4.505  -7.871 -14.403
  222   1HD1  ILE  28          1HD1      ILE  28  -6.261  -9.038 -18.605
  223   2HD1  ILE  28          2HD1      ILE  28  -7.240  -7.800 -17.816
  224   3HD1  ILE  28          3HD1      ILE  28  -6.777  -9.255 -16.932
  225    H    GLN  29           H        GLN  29  -2.480  -9.272 -19.612
  226    HA   GLN  29           HA       GLN  29  -4.709  -9.916 -21.107
  227   1HB   GLN  29          2HB       GLN  29  -2.679  -9.035 -22.116
  228   2HB   GLN  29          1HB       GLN  29  -1.806 -10.514 -21.715
  229   1HG   GLN  29          2HG       GLN  29  -3.242 -11.818 -23.179
  230   2HG   GLN  29          1HG       GLN  29  -4.249 -10.406 -23.505
  231   1HE2  GLN  29          1HE2      GLN  29  -2.819  -8.418 -24.347
  232   2HE2  GLN  29          2HE2      GLN  29  -1.667  -8.820 -25.527
  233    H    ASP  30           H        ASP  30  -2.326 -12.111 -19.676
  234    HA   ASP  30           HA       ASP  30  -3.829 -14.440 -20.680
  235   1HB   ASP  30          2HB       ASP  30  -1.069 -14.181 -19.472
  236   2HB   ASP  30          1HB       ASP  30  -1.830 -15.730 -19.839
  237    H    ALA  31           H        ALA  31  -4.441 -12.585 -18.251
  238    HA   ALA  31           HA       ALA  31  -4.451 -14.602 -16.113
  239   1HB   ALA  31          1HB       ALA  31  -4.973 -12.789 -14.606
  240   2HB   ALA  31          2HB       ALA  31  -5.240 -11.685 -15.955
  241   3HB   ALA  31          3HB       ALA  31  -3.618 -12.288 -15.616
  242    H    GLU  32           H        GLU  32  -6.372 -15.063 -14.965
  243    HA   GLU  32           HA       GLU  32  -8.880 -14.444 -16.407
  244   1HB   GLU  32          2HB       GLU  32  -9.667 -16.748 -15.768
  245   2HB   GLU  32          1HB       GLU  32  -8.364 -16.733 -16.952
  246   1HG   GLU  32          2HG       GLU  32  -7.520 -16.816 -14.105
  247   2HG   GLU  32          1HG       GLU  32  -8.315 -18.266 -14.714
  248    H    ASP  33           H        ASP  33  -7.902 -12.957 -14.261
  249    HA   ASP  33           HA       ASP  33  -9.983 -13.484 -12.255
  250   1HB   ASP  33          2HB       ASP  33  -7.609 -14.362 -11.578
  251   2HB   ASP  33          1HB       ASP  33  -7.266 -12.654 -11.297
  252    H    GLY  34           H        GLY  34  -7.405 -11.253 -13.293
  253   1HA   GLY  34          2HA       GLY  34  -8.083  -9.003 -14.034
  254   2HA   GLY  34          1HA       GLY  34  -9.220  -8.989 -12.689
  255    H    CYS  35           H        CYS  35  -5.856 -10.103 -12.715
  256    HA   CYS  35           HA       CYS  35  -4.966  -7.792 -11.153
  257   1HB   CYS  35          2HB       CYS  35  -4.467 -10.582 -10.107
  258   2HB   CYS  35          1HB       CYS  35  -4.154  -9.047  -9.300
  259    HG   CYS  35           HG       CYS  35  -6.412  -9.325  -8.326
  260    H    ILE  36           H        ILE  36  -2.729  -7.457 -11.269
  261    HA   ILE  36           HA       ILE  36  -1.399  -8.955 -13.411
  262    HB   ILE  36           HB       ILE  36   0.261  -7.222 -13.451
  263   1HG1  ILE  36          2HG1      ILE  36  -0.440  -5.282 -11.608
  264   2HG1  ILE  36          1HG1      ILE  36  -0.672  -6.774 -10.697
  265   1HG2  ILE  36          1HG2      ILE  36  -1.604  -6.453 -14.639
  266   2HG2  ILE  36          2HG2      ILE  36  -1.292  -5.128 -13.518
  267   3HG2  ILE  36          3HG2      ILE  36  -2.585  -6.281 -13.185
  268   1HD1  ILE  36          1HD1      ILE  36   1.644  -5.962 -10.459
  269   2HD1  ILE  36          2HD1      ILE  36   1.845  -6.003 -12.211
  270   3HD1  ILE  36          3HD1      ILE  36   1.612  -7.502 -11.313
  271    H    SER  37           H        SER  37   1.041  -9.328 -13.029
  272    HA   SER  37           HA       SER  37   1.257 -10.925 -10.584
  273   1HB   SER  37          2HB       SER  37   2.025 -11.454 -13.147
  274   2HB   SER  37          1HB       SER  37   3.536 -10.873 -12.459
  275    HG   SER  37           HG       SER  37   2.038 -13.137 -11.871
  276    H    THR  38           H        THR  38   1.987  -9.912  -8.830
  277    HA   THR  38           HA       THR  38   3.360  -7.486  -8.691
  278    HB   THR  38           HB       THR  38   4.013  -8.164  -6.396
  279    HG1  THR  38           HG1      THR  38   4.378 -10.234  -6.261
  280   1HG2  THR  38          1HG2      THR  38   1.631  -8.773  -5.648
  281   2HG2  THR  38          2HG2      THR  38   1.215  -8.724  -7.361
  282   3HG2  THR  38          3HG2      THR  38   1.826  -7.277  -6.561
  283    H    LYS  39           H        LYS  39   4.606 -10.786  -8.957
  284    HA   LYS  39           HA       LYS  39   7.348 -10.185  -8.557
  285   1HB   LYS  39          2HB       LYS  39   7.791 -12.339  -9.715
  286   2HB   LYS  39          1HB       LYS  39   6.578 -12.489  -8.446
  287   1HG   LYS  39          2HG       LYS  39   5.141 -11.817 -10.778
  288   2HG   LYS  39          1HG       LYS  39   6.322 -13.025 -11.284
  289   1HD   LYS  39          2HD       LYS  39   4.592 -13.380  -8.827
  290   2HD   LYS  39          1HD       LYS  39   4.091 -13.932 -10.424
  291   1HE   LYS  39          2HE       LYS  39   6.343 -15.168 -10.525
  292   2HE   LYS  39          1HE       LYS  39   6.460 -14.855  -8.793
  293   1HZ   LYS  39          1HZ       LYS  39   4.285 -16.322 -10.186
  294   2HZ   LYS  39          2HZ       LYS  39   4.279 -15.933  -8.531
  295   3HZ   LYS  39          3HZ       LYS  39   5.455 -16.987  -9.155
  296    H    GLU  40           H        GLU  40   5.234  -9.782 -11.305
  297    HA   GLU  40           HA       GLU  40   7.501  -9.234 -13.098
  298   1HB   GLU  40          2HB       GLU  40   4.543  -9.590 -13.594
  299   2HB   GLU  40          1HB       GLU  40   5.669  -9.048 -14.838
  300   1HG   GLU  40          2HG       GLU  40   6.944 -11.089 -14.684
  301   2HG   GLU  40          1HG       GLU  40   6.045 -11.606 -13.257
  302    H    LEU  41           H        LEU  41   6.178  -7.451 -10.821
  303    HA   LEU  41           HA       LEU  41   5.048  -5.164 -11.969
  304   1HB   LEU  41          2HB       LEU  41   5.684  -5.918  -9.437
  305   2HB   LEU  41          1HB       LEU  41   6.902  -4.700  -9.723
  306    HG   LEU  41           HG       LEU  41   4.954  -3.751  -8.596
  307   1HD1  LEU  41          1HD1      LEU  41   5.040  -2.839 -11.481
  308   2HD1  LEU  41          2HD1      LEU  41   6.240  -2.396 -10.270
  309   3HD1  LEU  41          3HD1      LEU  41   4.565  -1.876 -10.082
  310   1HD2  LEU  41          1HD2      LEU  41   3.292  -5.374  -9.515
  311   2HD2  LEU  41          2HD2      LEU  41   3.405  -4.561 -11.077
  312   3HD2  LEU  41          3HD2      LEU  41   2.765  -3.699  -9.679
  313    H    GLY  42           H        GLY  42   8.393  -6.219 -11.862
  314   1HA   GLY  42          2HA       GLY  42   9.761  -3.823 -12.283
  315   2HA   GLY  42          1HA       GLY  42  10.300  -5.397 -12.852
  316    H    LYS  43           H        LYS  43   7.783  -5.676 -14.498
  317    HA   LYS  43           HA       LYS  43   8.801  -4.414 -16.885
  318   1HB   LYS  43          2HB       LYS  43   7.661  -6.759 -16.563
  319   2HB   LYS  43          1HB       LYS  43   6.173  -5.836 -16.765
  320   1HG   LYS  43          2HG       LYS  43   6.505  -5.664 -18.970
  321   2HG   LYS  43          1HG       LYS  43   8.126  -5.021 -18.731
  322   1HD   LYS  43          2HD       LYS  43   8.533  -7.639 -18.105
  323   2HD   LYS  43          1HD       LYS  43   7.262  -7.793 -19.319
  324   1HE   LYS  43          2HE       LYS  43   8.559  -6.738 -20.985
  325   2HE   LYS  43          1HE       LYS  43   9.659  -6.027 -19.804
  326   1HZ   LYS  43          1HZ       LYS  43  10.669  -7.906 -20.932
  327   2HZ   LYS  43          2HZ       LYS  43   9.411  -8.924 -20.416
  328   3HZ   LYS  43          3HZ       LYS  43  10.473  -8.239 -19.280
  329    H    VAL  44           H        VAL  44   6.327  -3.714 -14.537
  330    HA   VAL  44           HA       VAL  44   4.973  -1.847 -16.340
  331    HB   VAL  44           HB       VAL  44   3.126  -2.098 -15.092
  332   1HG1  VAL  44          1HG1      VAL  44   4.330  -4.429 -14.947
  333   2HG1  VAL  44          2HG1      VAL  44   2.879  -4.125 -13.994
  334   3HG1  VAL  44          3HG1      VAL  44   4.469  -4.030 -13.236
  335   1HG2  VAL  44          1HG2      VAL  44   4.928  -1.529 -12.739
  336   2HG2  VAL  44          2HG2      VAL  44   3.240  -1.977 -12.512
  337   3HG2  VAL  44          3HG2      VAL  44   3.649  -0.520 -13.416
  338    H    MET  45           H        MET  45   7.055  -1.842 -13.479
  339    HA   MET  45           HA       MET  45   6.848   0.875 -12.807
  340   1HB   MET  45          2HB       MET  45   9.097   0.646 -11.794
  341   2HB   MET  45          1HB       MET  45   8.035  -0.687 -11.348
  342   1HG   MET  45          2HG       MET  45   9.061  -2.091 -13.103
  343   2HG   MET  45          1HG       MET  45  10.132  -0.761 -13.541
  344   1HE   MET  45          1HE       MET  45  11.957  -2.954 -13.092
  345   2HE   MET  45          2HE       MET  45  13.036  -2.228 -11.903
  346   3HE   MET  45          3HE       MET  45  12.321  -1.225 -13.163
  347    H    ARG  46           H        ARG  46   8.763  -0.770 -15.273
  348    HA   ARG  46           HA       ARG  46  10.210   1.594 -16.071
  349   1HB   ARG  46          2HB       ARG  46  10.960   0.248 -17.978
  350   2HB   ARG  46          1HB       ARG  46  11.126  -0.660 -16.476
  351   1HG   ARG  46          2HG       ARG  46   9.130  -1.932 -16.934
  352   2HG   ARG  46          1HG       ARG  46   8.729  -0.909 -18.313
  353   1HD   ARG  46          2HD       ARG  46  11.256  -1.716 -18.970
  354   2HD   ARG  46          1HD       ARG  46  10.659  -3.134 -18.113
  355    HE   ARG  46           HE       ARG  46   8.631  -2.490 -19.851
  356   1HH1  ARG  46          2HH1      ARG  46  12.045  -3.163 -20.150
  357   2HH1  ARG  46          1HH1      ARG  46  11.905  -3.802 -21.751
  358   1HH2  ARG  46          1HH2      ARG  46   8.474  -3.330 -21.951
  359   2HH2  ARG  46          2HH2      ARG  46   9.890  -3.896 -22.768
  360    H    MET  47           H        MET  47   7.186   0.056 -16.936
  361    HA   MET  47           HA       MET  47   6.722   1.493 -19.370
  362   1HB   MET  47          2HB       MET  47   5.434  -0.577 -17.919
  363   2HB   MET  47          1HB       MET  47   4.264   0.731 -18.087
  364   1HG   MET  47          2HG       MET  47   4.031  -0.653 -20.030
  365   2HG   MET  47          1HG       MET  47   4.870   0.807 -20.552
  366   1HE   MET  47          1HE       MET  47   7.843   0.728 -20.919
  367   2HE   MET  47          2HE       MET  47   6.403   0.855 -21.928
  368   3HE   MET  47          3HE       MET  47   7.671  -0.293 -22.353
  369    H    LEU  48           H        LEU  48   6.045   2.068 -15.966
  370    HA   LEU  48           HA       LEU  48   4.260   4.287 -16.368
  371   1HB   LEU  48          2HB       LEU  48   5.677   3.055 -14.053
  372   2HB   LEU  48          1HB       LEU  48   5.085   4.690 -13.879
  373    HG   LEU  48           HG       LEU  48   2.828   4.006 -14.071
  374   1HD1  LEU  48          1HD1      LEU  48   3.683   1.200 -14.804
  375   2HD1  LEU  48          2HD1      LEU  48   3.355   2.421 -16.033
  376   3HD1  LEU  48          3HD1      LEU  48   2.078   1.916 -14.927
  377   1HD2  LEU  48          1HD2      LEU  48   2.997   1.729 -12.578
  378   2HD2  LEU  48          2HD2      LEU  48   3.228   3.350 -11.922
  379   3HD2  LEU  48          3HD2      LEU  48   4.626   2.374 -12.375
  380    H    GLY  49           H        GLY  49   7.718   3.859 -16.037
  381   1HA   GLY  49          2HA       GLY  49   9.145   5.568 -17.087
  382   2HA   GLY  49          1HA       GLY  49   8.100   6.782 -16.358
  383    H    GLN  50           H        GLN  50   9.139   3.867 -14.676
  384    HA   GLN  50           HA       GLN  50  10.900   5.517 -12.956
  385   1HB   GLN  50          2HB       GLN  50   9.227   3.182 -12.004
  386   2HB   GLN  50          1HB       GLN  50  10.164   4.301 -11.017
  387   1HG   GLN  50          2HG       GLN  50   7.817   5.127 -12.752
  388   2HG   GLN  50          1HG       GLN  50   7.700   4.793 -11.026
  389   1HE2  GLN  50          1HE2      GLN  50   7.803   7.366 -13.017
  390   2HE2  GLN  50          2HE2      GLN  50   8.690   8.461 -12.072
  391    H    ASN  51           H        ASN  51  12.703   4.440 -12.023
  392    HA   ASN  51           HA       ASN  51  13.344   1.792 -13.159
  393   1HB   ASN  51          2HB       ASN  51  14.412   3.916 -14.336
  394   2HB   ASN  51          1HB       ASN  51  15.530   3.824 -12.976
  395   1HD2  ASN  51          1HD2      ASN  51  17.263   2.405 -13.257
  396   2HD2  ASN  51          2HD2      ASN  51  17.297   1.131 -14.378
  397    HA   PRO  52           HA       PRO  52  14.410   2.130  -8.631
  398   1HB   PRO  52          2HB       PRO  52  12.535   0.376  -7.688
  399   2HB   PRO  52          1HB       PRO  52  12.241   2.110  -7.891
  400   1HG   PRO  52          2HG       PRO  52  11.263  -0.163  -9.502
  401   2HG   PRO  52          1HG       PRO  52  10.554   1.441  -9.271
  402   1HD   PRO  52          2HD       PRO  52  12.035   0.550 -11.533
  403   2HD   PRO  52          1HD       PRO  52  11.516   2.215 -11.188
  404    H    THR  53           H        THR  53  14.223  -0.205  -7.121
  405    HA   THR  53           HA       THR  53  16.003  -2.052  -8.596
  406    HB   THR  53           HB       THR  53  17.108  -2.511  -6.591
  407    HG1  THR  53           HG1      THR  53  16.131  -2.585  -4.695
  408   1HG2  THR  53          1HG2      THR  53  17.593  -0.408  -5.505
  409   2HG2  THR  53          2HG2      THR  53  16.073   0.284  -6.073
  410   3HG2  THR  53          3HG2      THR  53  17.353  -0.102  -7.225
  411    HA   PRO  54           HA       PRO  54  13.125  -5.374  -8.060
  412   1HB   PRO  54          2HB       PRO  54  14.606  -7.458  -7.073
  413   2HB   PRO  54          1HB       PRO  54  14.696  -6.886  -8.747
  414   1HG   PRO  54          2HG       PRO  54  16.609  -6.484  -6.513
  415   2HG   PRO  54          1HG       PRO  54  16.908  -6.567  -8.255
  416   1HD   PRO  54          2HD       PRO  54  16.811  -4.219  -6.723
  417   2HD   PRO  54          1HD       PRO  54  16.712  -4.296  -8.497
  418    H    GLU  55           H        GLU  55  15.001  -4.590  -5.207
  419    HA   GLU  55           HA       GLU  55  13.228  -5.940  -3.351
  420   1HB   GLU  55          2HB       GLU  55  15.664  -4.213  -3.122
  421   2HB   GLU  55          1HB       GLU  55  14.592  -4.342  -1.727
  422   1HG   GLU  55          2HG       GLU  55  15.379  -6.862  -3.135
  423   2HG   GLU  55          1HG       GLU  55  16.574  -6.082  -2.100
  424    H    GLU  56           H        GLU  56  13.688  -2.741  -4.733
  425    HA   GLU  56           HA       GLU  56  11.907  -1.354  -2.964
  426   1HB   GLU  56          2HB       GLU  56  13.803  -0.456  -4.590
  427   2HB   GLU  56          1HB       GLU  56  12.459  -0.358  -5.727
  428   1HG   GLU  56          2HG       GLU  56  11.276   1.176  -4.387
  429   2HG   GLU  56          1HG       GLU  56  12.206   0.770  -2.943
  430    H    LEU  57           H        LEU  57  11.618  -2.678  -6.274
  431    HA   LEU  57           HA       LEU  57   8.984  -1.824  -6.763
  432   1HB   LEU  57          2HB       LEU  57   8.970  -3.226  -8.611
  433   2HB   LEU  57          1HB       LEU  57  10.657  -2.825  -8.412
  434    HG   LEU  57           HG       LEU  57  10.752  -5.109  -7.110
  435   1HD1  LEU  57          1HD1      LEU  57   8.054  -5.078  -8.280
  436   2HD1  LEU  57          2HD1      LEU  57   8.713  -6.110  -7.012
  437   3HD1  LEU  57          3HD1      LEU  57   8.986  -6.512  -8.707
  438   1HD2  LEU  57          1HD2      LEU  57  11.795  -4.474  -9.342
  439   2HD2  LEU  57          2HD2      LEU  57  10.354  -5.137 -10.112
  440   3HD2  LEU  57          3HD2      LEU  57  11.405  -6.183  -9.158
  441    H    GLN  58           H        GLN  58  10.219  -4.752  -5.174
  442    HA   GLN  58           HA       GLN  58   7.599  -5.922  -4.871
  443   1HB   GLN  58          2HB       GLN  58   9.742  -7.246  -4.931
  444   2HB   GLN  58          1HB       GLN  58  10.108  -6.611  -3.327
  445   1HG   GLN  58          2HG       GLN  58   9.053  -8.744  -2.996
  446   2HG   GLN  58          1HG       GLN  58   7.860  -7.520  -2.569
  447   1HE2  GLN  58          1HE2      GLN  58   5.908  -7.461  -3.790
  448   2HE2  GLN  58          2HE2      GLN  58   5.597  -8.491  -5.103
  449    H    GLU  59           H        GLU  59   9.679  -3.823  -2.954
  450    HA   GLU  59           HA       GLU  59   8.306  -4.091  -0.477
  451   1HB   GLU  59          2HB       GLU  59  10.293  -2.195  -1.620
  452   2HB   GLU  59          1HB       GLU  59   9.334  -1.621  -0.254
  453   1HG   GLU  59          2HG       GLU  59  10.681  -4.320  -0.180
  454   2HG   GLU  59          1HG       GLU  59  11.554  -2.853   0.267
  455    H    MET  60           H        MET  60   7.984  -1.790  -3.184
  456    HA   MET  60           HA       MET  60   5.970  -0.204  -1.946
  457   1HB   MET  60          2HB       MET  60   5.538   0.701  -4.196
  458   2HB   MET  60          1HB       MET  60   7.263   0.669  -3.838
  459   1HG   MET  60          2HG       MET  60   7.516  -1.400  -5.128
  460   2HG   MET  60          1HG       MET  60   5.782  -1.437  -5.444
  461   1HE   MET  60          1HE       MET  60   7.572  -1.044  -8.583
  462   2HE   MET  60          2HE       MET  60   5.839  -0.732  -8.620
  463   3HE   MET  60          3HE       MET  60   6.484  -1.943  -7.516
  464    H    ILE  61           H        ILE  61   5.913  -3.171  -3.802
  465    HA   ILE  61           HA       ILE  61   3.107  -3.193  -4.359
  466    HB   ILE  61           HB       ILE  61   5.138  -5.438  -4.206
  467   1HG1  ILE  61          2HG1      ILE  61   3.757  -4.355  -6.658
  468   2HG1  ILE  61          1HG1      ILE  61   5.207  -3.577  -6.022
  469   1HG2  ILE  61          1HG2      ILE  61   2.794  -6.212  -3.753
  470   2HG2  ILE  61          2HG2      ILE  61   3.459  -6.854  -5.253
  471   3HG2  ILE  61          3HG2      ILE  61   2.309  -5.519  -5.301
  472   1HD1  ILE  61          1HD1      ILE  61   6.254  -5.093  -7.388
  473   2HD1  ILE  61          2HD1      ILE  61   4.901  -6.223  -7.342
  474   3HD1  ILE  61          3HD1      ILE  61   6.035  -6.149  -5.993
  475    H    ASP  62           H        ASP  62   5.134  -4.730  -1.857
  476    HA   ASP  62           HA       ASP  62   3.071  -6.013  -0.439
  477   1HB   ASP  62          2HB       ASP  62   5.697  -6.111  -0.165
  478   2HB   ASP  62          1HB       ASP  62   5.403  -4.860   1.043
  479    H    GLU  63           H        GLU  63   4.216  -2.684  -0.371
  480    HA   GLU  63           HA       GLU  63   2.821  -1.917   2.011
  481   1HB   GLU  63          2HB       GLU  63   4.148  -0.414  -0.230
  482   2HB   GLU  63          1HB       GLU  63   3.183   0.439   0.976
  483   1HG   GLU  63          2HG       GLU  63   4.561  -0.581   2.773
  484   2HG   GLU  63          1HG       GLU  63   5.554  -1.366   1.544
  485    H    VAL  64           H        VAL  64   2.161  -1.424  -1.475
  486    HA   VAL  64           HA       VAL  64  -0.365  -0.165  -1.020
  487    HB   VAL  64           HB       VAL  64   0.937   0.197  -3.090
  488   1HG1  VAL  64          1HG1      VAL  64   1.701  -2.193  -3.299
  489   2HG1  VAL  64          2HG1      VAL  64   1.076  -1.506  -4.797
  490   3HG1  VAL  64          3HG1      VAL  64   0.078  -2.608  -3.849
  491   1HG2  VAL  64          1HG2      VAL  64  -1.764   0.073  -2.809
  492   2HG2  VAL  64          2HG2      VAL  64  -1.531  -1.078  -4.124
  493   3HG2  VAL  64          3HG2      VAL  64  -0.964   0.582  -4.295
  494    H    ASP  65           H        ASP  65   0.617  -3.504  -1.726
  495    HA   ASP  65           HA       ASP  65  -2.066  -4.489  -2.010
  496   1HB   ASP  65          2HB       ASP  65   0.485  -5.506  -2.519
  497   2HB   ASP  65          1HB       ASP  65  -0.116  -6.495  -1.193
  498    H    GLU  66           H        GLU  66  -3.334  -4.091  -0.275
  499    HA   GLU  66           HA       GLU  66  -2.578  -4.121   2.433
  500   1HB   GLU  66          2HB       GLU  66  -5.329  -4.814   1.372
  501   2HB   GLU  66          1HB       GLU  66  -4.931  -4.161   2.960
  502   1HG   GLU  66          2HG       GLU  66  -3.872  -2.188   1.616
  503   2HG   GLU  66          1HG       GLU  66  -4.861  -2.787   0.284
  504    H    ASP  67           H        ASP  67  -3.903  -6.660   0.361
  505    HA   ASP  67           HA       ASP  67  -3.841  -8.625   2.507
  506   1HB   ASP  67          2HB       ASP  67  -4.595 -10.201   0.668
  507   2HB   ASP  67          1HB       ASP  67  -5.688  -8.868   1.026
  508    H    GLY  68           H        GLY  68  -2.015  -7.867  -0.431
  509   1HA   GLY  68          2HA       GLY  68   0.124  -8.469  -1.058
  510   2HA   GLY  68          1HA       GLY  68   0.341  -9.163   0.546
  511    H    SER  69           H        SER  69  -1.901  -9.855  -2.124
  512    HA   SER  69           HA       SER  69  -1.549 -12.715  -1.757
  513   1HB   SER  69          2HB       SER  69  -3.258 -12.867  -3.582
  514   2HB   SER  69          1HB       SER  69  -3.783 -11.937  -2.182
  515    HG   SER  69           HG       SER  69  -4.042 -10.328  -3.502
  516    H    GLY  70           H        GLY  70   0.424 -10.602  -3.269
  517   1HA   GLY  70          2HA       GLY  70   2.129 -10.958  -4.789
  518   2HA   GLY  70          1HA       GLY  70   1.536 -12.601  -5.015
  519    H    THR  71           H        THR  71  -0.801 -10.094  -5.326
  520    HA   THR  71           HA       THR  71  -0.491  -9.881  -8.227
  521    HB   THR  71           HB       THR  71  -2.722 -10.586  -8.731
  522    HG1  THR  71           HG1      THR  71  -3.062 -10.890  -5.926
  523   1HG2  THR  71          1HG2      THR  71  -1.493 -12.540  -6.763
  524   2HG2  THR  71          2HG2      THR  71  -1.108 -12.422  -8.481
  525   3HG2  THR  71          3HG2      THR  71  -2.715 -12.941  -7.972
  526    H    VAL  72           H        VAL  72  -0.809  -7.836  -8.824
  527    HA   VAL  72           HA       VAL  72  -1.967  -5.972  -6.884
  528    HB   VAL  72           HB       VAL  72  -0.805  -5.226  -9.563
  529   1HG1  VAL  72          1HG1      VAL  72  -0.571  -3.079  -8.613
  530   2HG1  VAL  72          2HG1      VAL  72  -0.712  -3.692  -6.966
  531   3HG1  VAL  72          3HG1      VAL  72  -2.135  -3.626  -8.008
  532   1HG2  VAL  72          1HG2      VAL  72   0.883  -6.598  -8.428
  533   2HG2  VAL  72          2HG2      VAL  72   0.659  -5.676  -6.939
  534   3HG2  VAL  72          3HG2      VAL  72   1.355  -4.898  -8.361
  535    H    ASP  73           H        ASP  73  -3.990  -5.333  -6.992
  536    HA   ASP  73           HA       ASP  73  -5.629  -5.930  -9.334
  537   1HB   ASP  73          2HB       ASP  73  -6.271  -4.695  -6.638
  538   2HB   ASP  73          1HB       ASP  73  -7.465  -4.950  -7.909
  539    H    PHE  74           H        PHE  74  -7.013  -4.160 -10.271
  540    HA   PHE  74           HA       PHE  74  -5.437  -2.008 -11.142
  541   1HB   PHE  74          2HB       PHE  74  -7.576  -2.878 -12.231
  542   2HB   PHE  74          1HB       PHE  74  -8.452  -1.892 -11.058
  543    HD1  PHE  74           HD1      PHE  74  -5.234  -1.292 -12.876
  544    HD2  PHE  74           HD2      PHE  74  -9.286  -0.033 -12.217
  545    HE1  PHE  74           HE1      PHE  74  -4.841   0.712 -14.269
  546    HE2  PHE  74           HE2      PHE  74  -8.889   1.975 -13.613
  547    HZ   PHE  74           HZ       PHE  74  -6.667   2.348 -14.641
  548    H    ASP  75           H        ASP  75  -7.600  -2.298  -8.372
  549    HA   ASP  75           HA       ASP  75  -7.669   0.478  -7.710
  550   1HB   ASP  75          2HB       ASP  75  -9.180  -1.447  -6.821
  551   2HB   ASP  75          1HB       ASP  75  -7.886  -1.706  -5.650
  552    H    GLU  76           H        GLU  76  -5.611  -2.248  -6.711
  553    HA   GLU  76           HA       GLU  76  -4.003  -0.710  -4.899
  554   1HB   GLU  76          2HB       GLU  76  -3.302  -3.315  -6.279
  555   2HB   GLU  76          1HB       GLU  76  -2.531  -2.646  -4.842
  556   1HG   GLU  76          2HG       GLU  76  -4.616  -2.854  -3.578
  557   2HG   GLU  76          1HG       GLU  76  -5.463  -3.416  -5.017
  558    H    PHE  77           H        PHE  77  -3.933  -1.434  -8.317
  559    HA   PHE  77           HA       PHE  77  -1.269  -0.719  -8.911
  560   1HB   PHE  77          2HB       PHE  77  -3.302  -1.792 -10.332
  561   2HB   PHE  77          1HB       PHE  77  -3.390  -0.135 -10.907
  562    HD1  PHE  77           HD1      PHE  77  -2.834  -1.032 -13.147
  563    HD2  PHE  77           HD2      PHE  77  -0.083  -1.329  -9.853
  564    HE1  PHE  77           HE1      PHE  77  -0.980  -1.486 -14.722
  565    HE2  PHE  77           HE2      PHE  77   1.762  -1.778 -11.435
  566    HZ   PHE  77           HZ       PHE  77   1.319  -1.860 -13.874
  567    H    LEU  78           H        LEU  78  -4.295   1.161  -9.145
  568    HA   LEU  78           HA       LEU  78  -3.002   3.611  -9.860
  569   1HB   LEU  78          2HB       LEU  78  -5.754   2.819  -9.025
  570   2HB   LEU  78          1HB       LEU  78  -5.317   4.517  -8.961
  571    HG   LEU  78           HG       LEU  78  -5.014   4.627 -11.315
  572   1HD1  LEU  78          1HD1      LEU  78  -5.313   1.615 -11.442
  573   2HD1  LEU  78          2HD1      LEU  78  -3.759   2.447 -11.466
  574   3HD1  LEU  78          3HD1      LEU  78  -4.915   2.705 -12.771
  575   1HD2  LEU  78          1HD2      LEU  78  -7.350   4.630 -10.782
  576   2HD2  LEU  78          2HD2      LEU  78  -7.371   2.880 -10.571
  577   3HD2  LEU  78          3HD2      LEU  78  -7.168   3.571 -12.180
  578    H    VAL  79           H        VAL  79  -3.917   2.114  -6.811
  579    HA   VAL  79           HA       VAL  79  -3.728   4.367  -5.124
  580    HB   VAL  79           HB       VAL  79  -3.575   1.406  -4.747
  581   1HG1  VAL  79          1HG1      VAL  79  -3.087   1.713  -2.333
  582   2HG1  VAL  79          2HG1      VAL  79  -2.763   3.421  -2.630
  583   3HG1  VAL  79          3HG1      VAL  79  -1.725   2.188  -3.350
  584   1HG2  VAL  79          1HG2      VAL  79  -5.110   3.465  -3.161
  585   2HG2  VAL  79          2HG2      VAL  79  -5.503   1.766  -3.426
  586   3HG2  VAL  79          3HG2      VAL  79  -5.670   2.926  -4.744
  587    H    MET  80           H        MET  80  -1.308   1.933  -6.048
  588    HA   MET  80           HA       MET  80   0.895   2.693  -4.610
  589   1HB   MET  80          2HB       MET  80   0.437   1.034  -6.792
  590   2HB   MET  80          1HB       MET  80   1.624   2.194  -7.387
  591   1HG   MET  80          2HG       MET  80   2.931   1.753  -5.235
  592   2HG   MET  80          1HG       MET  80   1.848   0.386  -4.973
  593   1HE   MET  80          1HE       MET  80   1.156  -1.053  -6.638
  594   2HE   MET  80          2HE       MET  80   2.394  -2.177  -7.194
  595   3HE   MET  80          3HE       MET  80   1.701  -1.014  -8.321
  596    H    MET  81           H        MET  81  -0.544   4.440  -7.311
  597    HA   MET  81           HA       MET  81   1.670   6.080  -7.969
  598   1HB   MET  81          2HB       MET  81  -0.262   5.932  -9.452
  599   2HB   MET  81          1HB       MET  81  -1.297   6.646  -8.219
  600   1HG   MET  81          2HG       MET  81  -0.513   8.273  -9.988
  601   2HG   MET  81          1HG       MET  81  -0.119   8.749  -8.338
  602   1HE   MET  81          1HE       MET  81   0.893   7.229 -11.586
  603   2HE   MET  81          2HE       MET  81   1.675   5.959 -10.649
  604   3HE   MET  81          3HE       MET  81   2.657   7.091 -11.577
  605    H    VAL  82           H        VAL  82  -1.214   6.888  -6.003
  606    HA   VAL  82           HA       VAL  82  -0.199   9.338  -5.022
  607    HB   VAL  82           HB       VAL  82  -1.950   9.119  -3.249
  608   1HG1  VAL  82          1HG1      VAL  82  -3.761   9.423  -4.750
  609   2HG1  VAL  82          2HG1      VAL  82  -3.059   8.332  -5.946
  610   3HG1  VAL  82          3HG1      VAL  82  -2.337   9.916  -5.665
  611   1HG2  VAL  82          1HG2      VAL  82  -2.649   6.517  -4.638
  612   2HG2  VAL  82          2HG2      VAL  82  -3.387   7.194  -3.184
  613   3HG2  VAL  82          3HG2      VAL  82  -1.734   6.581  -3.131
  614    H    ARG  83           H        ARG  83   0.217   6.029  -3.924
  615    HA   ARG  83           HA       ARG  83   1.098   6.470  -1.298
  616   1HB   ARG  83          2HB       ARG  83   1.928   4.338  -3.280
  617   2HB   ARG  83          1HB       ARG  83   2.334   4.311  -1.565
  618   1HG   ARG  83          2HG       ARG  83  -0.311   4.687  -1.331
  619   2HG   ARG  83          1HG       ARG  83  -0.302   3.877  -2.899
  620   1HD   ARG  83          2HD       ARG  83  -0.422   2.054  -1.460
  621   2HD   ARG  83          1HD       ARG  83   1.315   2.188  -1.699
  622    HE   ARG  83           HE       ARG  83   1.532   2.820   0.528
  623   1HH1  ARG  83          2HH1      ARG  83  -1.819   2.998  -0.455
  624   2HH1  ARG  83          1HH1      ARG  83  -2.402   3.279   1.149
  625   1HH2  ARG  83          1HH2      ARG  83   0.739   3.192   2.620
  626   2HH2  ARG  83          2HH2      ARG  83  -0.962   3.390   2.883
  627    H    CYS  84           H        CYS  84   2.822   6.690  -4.377
  628    HA   CYS  84           HA       CYS  84   5.314   7.379  -2.955
  629   1HB   CYS  84          2HB       CYS  84   5.100   5.664  -4.952
  630   2HB   CYS  84          1HB       CYS  84   5.184   7.129  -5.931
  631    HG   CYS  84           HG       CYS  84   7.449   7.637  -4.417
  632    H    MET  85           H        MET  85   2.946   8.693  -5.230
  633    HA   MET  85           HA       MET  85   4.332  11.008  -6.024
  634   1HB   MET  85          2HB       MET  85   2.045  10.010  -6.845
  635   2HB   MET  85          1HB       MET  85   1.361  11.066  -5.610
  636   1HG   MET  85          2HG       MET  85   2.929  12.878  -6.710
  637   2HG   MET  85          1HG       MET  85   2.874  11.795  -8.099
  638   1HE   MET  85          1HE       MET  85   1.555  14.222  -5.943
  639   2HE   MET  85          2HE       MET  85  -0.122  14.581  -6.348
  640   3HE   MET  85          3HE       MET  85   1.167  15.091  -7.434
  641    H    LYS  86           H        LYS  86   1.863  10.653  -3.460
  642    HA   LYS  86           HA       LYS  86   2.949  13.101  -2.189
  643   1HB   LYS  86          2HB       LYS  86   0.751  13.405  -1.162
  644   2HB   LYS  86          1HB       LYS  86   0.588  13.304  -2.915
  645   1HG   LYS  86          2HG       LYS  86  -0.458  11.256  -2.842
  646   2HG   LYS  86          1HG       LYS  86   0.417  10.745  -1.398
  647   1HD   LYS  86          2HD       LYS  86  -1.858  11.077  -0.726
  648   2HD   LYS  86          1HD       LYS  86  -0.948  12.452  -0.101
  649   1HE   LYS  86          2HE       LYS  86  -2.701  13.592  -1.080
  650   2HE   LYS  86          1HE       LYS  86  -1.621  13.496  -2.470
  651   1HZ   LYS  86          1HZ       LYS  86  -2.775  11.507  -3.195
  652   2HZ   LYS  86          2HZ       LYS  86  -3.865  12.800  -3.033
  653   3HZ   LYS  86          3HZ       LYS  86  -3.806  11.582  -1.850
  654    H    ASP  87           H        ASP  87   2.694  13.144   0.216
  655    HA   ASP  87           HA       ASP  87   3.264  12.298   2.277
  656   1HB   ASP  87          2HB       ASP  87   1.038  11.011   1.598
  657   2HB   ASP  87          1HB       ASP  87   2.128   9.626   1.584
  658    H    ASP  88           H        ASP  88   5.021  11.784  -0.161
  659    HA   ASP  88           HA       ASP  88   6.644   9.604   1.017
  660   1HB   ASP  88          2HB       ASP  88   5.473   9.370  -1.388
  661   2HB   ASP  88          1HB       ASP  88   6.933  10.228  -1.877
  662    H    SER  89           HN       SER  89   6.820  12.447  -1.151
  663    HA   SER  89           HA       SER  89   9.625  12.845  -0.738
  664   1HB   SER  89          2HB       SER  89   8.297  13.653  -2.741
  665   2HB   SER  89          1HB       SER  89   7.640  14.914  -1.700
  666    HG   SER  89           HG       SER  89   9.421  15.819  -2.555
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  -3.920  10.523  10.367
    2   2H    MET   1          2H        MET   1  -4.251   9.574   8.997
    3   3H    MET   1          3H        MET   1  -4.388  11.266   8.916
    4    HA   MET   1           HA       MET   1  -1.973  11.437   9.391
    5   1HB   MET   1          2HB       MET   1  -2.345   8.467   9.339
    6   2HB   MET   1          1HB       MET   1  -0.848   9.127   8.679
    7   1HG   MET   1          2HG       MET   1  -0.742  10.504  10.881
    8   2HG   MET   1          1HG       MET   1  -1.917   9.338  11.488
    9   1HE   MET   1          1HE       MET   1  -0.173   9.071  13.312
   10   2HE   MET   1          2HE       MET   1   1.217   9.874  12.585
   11   3HE   MET   1          3HE       MET   1   1.370   8.218  13.166
   12    H    ASN   2           H        ASN   2  -3.304   8.994   7.125
   13    HA   ASN   2           HA       ASN   2  -2.526  10.769   4.891
   14   1HB   ASN   2          2HB       ASN   2  -2.053   7.793   5.139
   15   2HB   ASN   2          1HB       ASN   2  -2.002   8.648   3.596
   16   1HD2  ASN   2          1HD2      ASN   2  -0.434  10.604   3.557
   17   2HD2  ASN   2          2HD2      ASN   2   1.008  10.452   4.440
   18    H    ASP   3           H        ASP   3  -4.755  11.436   4.962
   19    HA   ASP   3           HA       ASP   3  -6.759   9.436   4.192
   20   1HB   ASP   3          2HB       ASP   3  -6.908  12.297   5.107
   21   2HB   ASP   3          1HB       ASP   3  -8.287  11.525   4.323
   22    H    ILE   4           H        ILE   4  -4.967  12.139   2.883
   23    HA   ILE   4           HA       ILE   4  -6.475  12.720   0.601
   24    HB   ILE   4           HB       ILE   4  -4.538  13.745  -0.338
   25   1HG1  ILE   4          2HG1      ILE   4  -3.002  11.774   0.014
   26   2HG1  ILE   4          1HG1      ILE   4  -2.270  13.330   0.382
   27   1HG2  ILE   4          1HG2      ILE   4  -3.869  15.209   1.431
   28   2HG2  ILE   4          2HG2      ILE   4  -4.197  13.984   2.658
   29   3HG2  ILE   4          3HG2      ILE   4  -5.529  14.725   1.773
   30   1HD1  ILE   4          1HD1      ILE   4  -1.640  11.934   2.189
   31   2HD1  ILE   4          2HD1      ILE   4  -3.249  11.225   2.312
   32   3HD1  ILE   4          3HD1      ILE   4  -2.978  12.892   2.822
   33    H    TYR   5           H        TYR   5  -4.410   9.986   1.264
   34    HA   TYR   5           HA       TYR   5  -3.771   9.085  -1.299
   35   1HB   TYR   5          2HB       TYR   5  -4.294   7.684   1.307
   36   2HB   TYR   5          1HB       TYR   5  -4.053   6.737  -0.160
   37    HD1  TYR   5           HD1      TYR   5  -1.899   5.851  -0.153
   38    HD2  TYR   5           HD2      TYR   5  -2.489   9.921   1.076
   39    HE1  TYR   5           HE1      TYR   5   0.551   6.144   0.064
   40    HE2  TYR   5           HE2      TYR   5  -0.046  10.216   1.288
   41    HH   TYR   5           HH       TYR   5   2.131   8.561  -0.063
   42    H    LYS   6           H        LYS   6  -6.719   8.576   0.613
   43    HA   LYS   6           HA       LYS   6  -7.991   7.040  -1.508
   44   1HB   LYS   6          2HB       LYS   6  -9.012   8.017   1.169
   45   2HB   LYS   6          1HB       LYS   6  -9.952   7.034   0.047
   46   1HG   LYS   6          2HG       LYS   6  -7.212   6.128   0.903
   47   2HG   LYS   6          1HG       LYS   6  -8.601   5.845   1.951
   48   1HD   LYS   6          2HD       LYS   6  -8.965   3.981   0.724
   49   2HD   LYS   6          1HD       LYS   6  -9.529   5.066  -0.547
   50   1HE   LYS   6          2HE       LYS   6  -7.268   5.182  -1.489
   51   2HE   LYS   6          1HE       LYS   6  -6.655   4.163  -0.187
   52   1HZ   LYS   6          1HZ       LYS   6  -8.191   2.415  -0.933
   53   2HZ   LYS   6          2HZ       LYS   6  -7.059   2.834  -2.126
   54   3HZ   LYS   6          3HZ       LYS   6  -8.659   3.392  -2.238
   55    H    ALA   7           H        ALA   7  -8.043  10.324  -0.248
   56    HA   ALA   7           HA       ALA   7 -10.436  11.160  -1.560
   57   1HB   ALA   7          1HB       ALA   7  -8.145  12.969  -0.803
   58   2HB   ALA   7          2HB       ALA   7  -9.257  12.308   0.395
   59   3HB   ALA   7          3HB       ALA   7  -9.863  13.358  -0.886
   60    H    ALA   8           H        ALA   8  -7.117  10.822  -2.605
   61    HA   ALA   8           HA       ALA   8  -7.469  12.494  -4.957
   62   1HB   ALA   8          1HB       ALA   8  -5.186  11.934  -5.489
   63   2HB   ALA   8          2HB       ALA   8  -5.188  10.612  -4.321
   64   3HB   ALA   8          3HB       ALA   8  -5.270  12.283  -3.761
   65    H    VAL   9           H        VAL   9  -7.134   9.020  -4.235
   66    HA   VAL   9           HA       VAL   9  -7.254   8.138  -6.923
   67    HB   VAL   9           HB       VAL   9  -6.457   6.743  -5.002
   68   1HG1  VAL   9          1HG1      VAL   9  -9.424   6.437  -4.442
   69   2HG1  VAL   9          2HG1      VAL   9  -8.284   7.321  -3.427
   70   3HG1  VAL   9          3HG1      VAL   9  -8.118   5.578  -3.625
   71   1HG2  VAL   9          1HG2      VAL   9  -8.713   5.270  -6.327
   72   2HG2  VAL   9          2HG2      VAL   9  -7.051   4.748  -6.050
   73   3HG2  VAL   9          3HG2      VAL   9  -7.409   5.918  -7.320
   74    H    GLU  10           H        GLU  10  -9.760   9.084  -4.659
   75    HA   GLU  10           HA       GLU  10 -11.913   7.869  -6.133
   76   1HB   GLU  10          2HB       GLU  10 -13.388   9.076  -4.635
   77   2HB   GLU  10          1HB       GLU  10 -12.066   8.376  -3.701
   78   1HG   GLU  10          2HG       GLU  10 -11.036  10.443  -3.354
   79   2HG   GLU  10          1HG       GLU  10 -11.815  11.183  -4.751
   80    H    GLN  11           H        GLN  11 -10.105  10.834  -6.377
   81    HA   GLN  11           HA       GLN  11 -12.113  11.914  -8.255
   82   1HB   GLN  11          2HB       GLN  11 -11.122  14.107  -7.891
   83   2HB   GLN  11          1HB       GLN  11 -11.556  13.388  -6.342
   84   1HG   GLN  11          2HG       GLN  11  -9.236  12.706  -5.970
   85   2HG   GLN  11          1HG       GLN  11  -8.776  13.317  -7.558
   86   1HE2  GLN  11          1HE2      GLN  11  -9.061  14.183  -4.260
   87   2HE2  GLN  11          2HE2      GLN  11  -8.918  15.863  -4.452
   88    H    LEU  12           H        LEU  12  -9.908   9.850  -8.762
   89    HA   LEU  12           HA       LEU  12  -7.826  10.955 -10.282
   90   1HB   LEU  12          2HB       LEU  12  -9.235   8.306 -10.430
   91   2HB   LEU  12          1HB       LEU  12  -7.929   8.710 -11.521
   92    HG   LEU  12           HG       LEU  12  -7.848   8.161  -8.578
   93   1HD1  LEU  12          1HD1      LEU  12  -5.678   7.021  -9.520
   94   2HD1  LEU  12          2HD1      LEU  12  -6.472   7.233 -11.081
   95   3HD1  LEU  12          3HD1      LEU  12  -7.250   6.277  -9.819
   96   1HD2  LEU  12          1HD2      LEU  12  -5.895   9.854 -10.159
   97   2HD2  LEU  12          2HD2      LEU  12  -5.473   9.067  -8.638
   98   3HD2  LEU  12          3HD2      LEU  12  -6.740  10.294  -8.676
   99    H    THR  13           H        THR  13  -7.513  11.139 -12.528
  100    HA   THR  13           HA       THR  13  -9.905  12.001 -13.984
  101    HB   THR  13           HB       THR  13  -7.807  12.395 -15.706
  102    HG1  THR  13           HG1      THR  13  -6.091  12.101 -14.537
  103   1HG2  THR  13          1HG2      THR  13  -9.305  14.013 -13.736
  104   2HG2  THR  13          2HG2      THR  13  -9.073  14.261 -15.467
  105   3HG2  THR  13          3HG2      THR  13  -7.807  14.729 -14.334
  106    H    ASP  14           H        ASP  14  -9.879  11.507 -16.403
  107    HA   ASP  14           HA       ASP  14 -10.113   8.693 -16.785
  108   1HB   ASP  14          2HB       ASP  14 -10.150  11.041 -18.684
  109   2HB   ASP  14          1HB       ASP  14 -10.284   9.378 -19.255
  110    H    GLU  15           H        GLU  15  -7.595  11.065 -17.411
  111    HA   GLU  15           HA       GLU  15  -5.938   9.343 -19.016
  112   1HB   GLU  15          2HB       GLU  15  -5.456  11.950 -17.575
  113   2HB   GLU  15          1HB       GLU  15  -4.155  11.085 -18.393
  114   1HG   GLU  15          2HG       GLU  15  -4.988  11.520 -20.485
  115   2HG   GLU  15          1HG       GLU  15  -6.665  11.466 -19.942
  116    H    GLN  16           H        GLN  16  -6.335   9.978 -15.589
  117    HA   GLN  16           HA       GLN  16  -3.893   8.772 -14.714
  118   1HB   GLN  16          2HB       GLN  16  -5.667  10.322 -13.446
  119   2HB   GLN  16          1HB       GLN  16  -6.291   8.752 -12.942
  120   1HG   GLN  16          2HG       GLN  16  -4.716   8.974 -11.296
  121   2HG   GLN  16          1HG       GLN  16  -3.643   8.342 -12.543
  122   1HE2  GLN  16          1HE2      GLN  16  -4.906  11.486 -11.298
  123   2HE2  GLN  16          2HE2      GLN  16  -3.496  12.358 -11.663
  124    H    LYS  17           H        LYS  17  -7.264   7.652 -14.971
  125    HA   LYS  17           HA       LYS  17  -6.887   5.040 -13.992
  126   1HB   LYS  17          2HB       LYS  17  -8.844   6.025 -16.091
  127   2HB   LYS  17          1HB       LYS  17  -8.927   4.458 -15.290
  128   1HG   LYS  17          2HG       LYS  17  -9.072   7.154 -13.905
  129   2HG   LYS  17          1HG       LYS  17 -10.436   6.081 -14.212
  130   1HD   LYS  17          2HD       LYS  17  -8.547   4.452 -12.949
  131   2HD   LYS  17          1HD       LYS  17  -8.466   5.981 -12.074
  132   1HE   LYS  17          2HE       LYS  17 -11.029   4.471 -12.669
  133   2HE   LYS  17          1HE       LYS  17 -10.176   4.430 -11.126
  134   1HZ   LYS  17          1HZ       LYS  17 -11.574   6.696 -12.403
  135   2HZ   LYS  17          2HZ       LYS  17 -10.378   6.965 -11.227
  136   3HZ   LYS  17          3HZ       LYS  17 -11.767   6.071 -10.839
  137    H    ASN  18           H        ASN  18  -6.698   6.359 -17.295
  138    HA   ASN  18           HA       ASN  18  -6.076   3.885 -18.565
  139   1HB   ASN  18          2HB       ASN  18  -5.878   6.769 -19.356
  140   2HB   ASN  18          1HB       ASN  18  -5.083   5.545 -20.346
  141   1HD2  ASN  18          1HD2      ASN  18  -7.787   7.262 -20.482
  142   2HD2  ASN  18          2HD2      ASN  18  -8.896   6.105 -21.040
  143    H    GLU  19           H        GLU  19  -4.124   6.285 -16.914
  144    HA   GLU  19           HA       GLU  19  -1.586   5.763 -17.932
  145   1HB   GLU  19          2HB       GLU  19  -2.207   7.528 -16.220
  146   2HB   GLU  19          1HB       GLU  19  -2.164   6.251 -15.005
  147   1HG   GLU  19          2HG       GLU  19   0.022   6.986 -14.863
  148   2HG   GLU  19          1HG       GLU  19   0.203   5.759 -16.115
  149    H    PHE  20           H        PHE  20  -3.220   4.174 -15.180
  150    HA   PHE  20           HA       PHE  20  -1.144   2.116 -15.081
  151   1HB   PHE  20          2HB       PHE  20  -3.485   2.835 -13.344
  152   2HB   PHE  20          1HB       PHE  20  -2.711   1.260 -13.192
  153    HD1  PHE  20           HD1      PHE  20  -2.289   4.896 -12.775
  154    HD2  PHE  20           HD2      PHE  20  -0.401   1.055 -12.397
  155    HE1  PHE  20           HE1      PHE  20  -0.485   5.910 -11.411
  156    HE2  PHE  20           HE2      PHE  20   1.390   2.064 -11.026
  157    HZ   PHE  20           HZ       PHE  20   1.355   4.497 -10.535
  158    H    LYS  21           H        LYS  21  -4.617   2.411 -15.803
  159    HA   LYS  21           HA       LYS  21  -5.280  -0.282 -16.062
  160   1HB   LYS  21          2HB       LYS  21  -6.934   1.544 -16.116
  161   2HB   LYS  21          1HB       LYS  21  -6.352   2.017 -17.707
  162   1HG   LYS  21          2HG       LYS  21  -7.020  -0.841 -17.496
  163   2HG   LYS  21          1HG       LYS  21  -8.398   0.231 -17.243
  164   1HD   LYS  21          2HD       LYS  21  -7.478   1.463 -19.375
  165   2HD   LYS  21          1HD       LYS  21  -6.658  -0.070 -19.675
  166   1HE   LYS  21          2HE       LYS  21  -8.678  -0.426 -20.778
  167   2HE   LYS  21          1HE       LYS  21  -9.040  -1.097 -19.189
  168   1HZ   LYS  21          1HZ       LYS  21  -9.643   1.692 -20.013
  169   2HZ   LYS  21          2HZ       LYS  21 -10.092   0.944 -18.555
  170   3HZ   LYS  21          3HZ       LYS  21 -10.768   0.424 -20.024
  171    H    ALA  22           H        ALA  22  -3.661   1.844 -18.392
  172    HA   ALA  22           HA       ALA  22  -3.850   0.208 -20.676
  173   1HB   ALA  22          1HB       ALA  22  -1.775   1.369 -21.433
  174   2HB   ALA  22          2HB       ALA  22  -1.627   2.080 -19.825
  175   3HB   ALA  22          3HB       ALA  22  -3.008   2.486 -20.846
  176    H    ALA  23           H        ALA  23  -1.233   0.443 -18.270
  177    HA   ALA  23           HA       ALA  23   0.260  -1.776 -19.249
  178   1HB   ALA  23          1HB       ALA  23   1.514  -0.320 -17.903
  179   2HB   ALA  23          2HB       ALA  23   1.212  -1.680 -16.823
  180   3HB   ALA  23          3HB       ALA  23   0.249  -0.210 -16.679
  181    H    PHE  24           H        PHE  24  -2.250  -1.357 -16.816
  182    HA   PHE  24           HA       PHE  24  -2.158  -3.884 -15.594
  183   1HB   PHE  24          2HB       PHE  24  -3.531  -1.792 -14.945
  184   2HB   PHE  24          1HB       PHE  24  -4.726  -2.386 -16.096
  185    HD1  PHE  24           HD1      PHE  24  -5.680  -4.717 -15.788
  186    HD2  PHE  24           HD2      PHE  24  -3.306  -2.767 -12.791
  187    HE1  PHE  24           HE1      PHE  24  -6.529  -6.300 -14.081
  188    HE2  PHE  24           HE2      PHE  24  -4.154  -4.343 -11.086
  189    HZ   PHE  24           HZ       PHE  24  -5.769  -6.107 -11.728
  190    H    ASP  25           H        ASP  25  -4.034  -2.748 -18.401
  191    HA   ASP  25           HA       ASP  25  -5.448  -5.134 -18.891
  192   1HB   ASP  25          2HB       ASP  25  -4.809  -2.690 -20.456
  193   2HB   ASP  25          1HB       ASP  25  -5.336  -4.107 -21.362
  194    H    ILE  26           H        ILE  26  -2.262  -4.073 -20.064
  195    HA   ILE  26           HA       ILE  26  -1.984  -6.337 -21.836
  196    HB   ILE  26           HB       ILE  26   0.356  -5.552 -22.126
  197   1HG1  ILE  26          2HG1      ILE  26  -0.458  -3.336 -20.218
  198   2HG1  ILE  26          1HG1      ILE  26   0.608  -4.668 -19.784
  199   1HG2  ILE  26          1HG2      ILE  26  -1.555  -4.639 -23.453
  200   2HG2  ILE  26          2HG2      ILE  26  -0.242  -3.478 -23.255
  201   3HG2  ILE  26          3HG2      ILE  26  -1.703  -3.331 -22.279
  202   1HD1  ILE  26          1HD1      ILE  26   1.386  -3.286 -22.262
  203   2HD1  ILE  26          2HD1      ILE  26   2.373  -3.766 -20.882
  204   3HD1  ILE  26          3HD1      ILE  26   1.445  -2.267 -20.823
  205    H    PHE  27           H        PHE  27  -0.847  -5.538 -18.568
  206    HA   PHE  27           HA       PHE  27   0.861  -7.839 -18.381
  207   1HB   PHE  27          2HB       PHE  27  -0.200  -5.950 -16.273
  208   2HB   PHE  27          1HB       PHE  27   0.900  -7.284 -15.920
  209    HD1  PHE  27           HD1      PHE  27   1.003  -3.932 -16.211
  210    HD2  PHE  27           HD2      PHE  27   2.762  -7.357 -18.114
  211    HE1  PHE  27           HE1      PHE  27   2.903  -2.533 -16.983
  212    HE2  PHE  27           HE2      PHE  27   4.660  -5.962 -18.873
  213    HZ   PHE  27           HZ       PHE  27   4.729  -3.551 -18.311
  214    H    ILE  28           H        ILE  28  -2.517  -7.186 -17.517
  215    HA   ILE  28           HA       ILE  28  -2.743  -9.837 -16.275
  216    HB   ILE  28           HB       ILE  28  -4.967  -9.244 -15.622
  217   1HG1  ILE  28          2HG1      ILE  28  -5.625  -6.739 -16.366
  218   2HG1  ILE  28          1HG1      ILE  28  -4.677  -7.203 -17.780
  219   1HG2  ILE  28          1HG2      ILE  28  -3.561  -6.620 -15.294
  220   2HG2  ILE  28          2HG2      ILE  28  -2.848  -8.068 -14.591
  221   3HG2  ILE  28          3HG2      ILE  28  -4.468  -7.560 -14.111
  222   1HD1  ILE  28          1HD1      ILE  28  -6.389  -8.439 -18.549
  223   2HD1  ILE  28          2HD1      ILE  28  -7.362  -7.924 -17.170
  224   3HD1  ILE  28          3HD1      ILE  28  -6.390  -9.393 -17.066
  225    H    GLN  29           H        GLN  29  -2.796  -8.672 -19.384
  226    HA   GLN  29           HA       GLN  29  -5.001  -9.730 -20.669
  227   1HB   GLN  29          2HB       GLN  29  -3.328  -8.415 -21.852
  228   2HB   GLN  29          1HB       GLN  29  -2.124  -9.679 -21.613
  229   1HG   GLN  29          2HG       GLN  29  -3.379 -11.222 -22.994
  230   2HG   GLN  29          1HG       GLN  29  -4.722 -10.085 -23.118
  231   1HE2  GLN  29          1HE2      GLN  29  -3.992  -7.819 -24.063
  232   2HE2  GLN  29          2HE2      GLN  29  -2.900  -7.884 -25.361
  233    H    ASP  30           H        ASP  30  -2.057 -11.410 -19.626
  234    HA   ASP  30           HA       ASP  30  -3.178 -13.973 -20.559
  235   1HB   ASP  30          2HB       ASP  30  -0.389 -13.209 -19.672
  236   2HB   ASP  30          1HB       ASP  30  -0.878 -14.853 -20.082
  237    H    ALA  31           H        ALA  31  -3.952 -12.414 -18.037
  238    HA   ALA  31           HA       ALA  31  -3.193 -14.361 -15.966
  239   1HB   ALA  31          1HB       ALA  31  -3.024 -11.843 -15.568
  240   2HB   ALA  31          2HB       ALA  31  -3.911 -12.767 -14.355
  241   3HB   ALA  31          3HB       ALA  31  -4.787 -11.829 -15.565
  242    H    GLU  32           H        GLU  32  -4.803 -15.329 -14.641
  243    HA   GLU  32           HA       GLU  32  -7.430 -15.603 -15.984
  244   1HB   GLU  32          2HB       GLU  32  -5.856 -17.586 -14.325
  245   2HB   GLU  32          1HB       GLU  32  -7.532 -17.835 -14.815
  246   1HG   GLU  32          2HG       GLU  32  -5.533 -17.102 -16.921
  247   2HG   GLU  32          1HG       GLU  32  -5.529 -18.753 -16.302
  248    H    ASP  33           H        ASP  33  -6.913 -13.479 -14.172
  249    HA   ASP  33           HA       ASP  33  -8.957 -14.041 -12.168
  250   1HB   ASP  33          2HB       ASP  33  -6.097 -13.463 -11.497
  251   2HB   ASP  33          1HB       ASP  33  -7.369 -12.833 -10.452
  252    H    GLY  34           H        GLY  34  -6.566 -11.643 -13.270
  253   1HA   GLY  34          2HA       GLY  34  -7.464  -9.606 -14.367
  254   2HA   GLY  34          1HA       GLY  34  -8.670  -9.559 -13.084
  255    H    CYS  35           H        CYS  35  -5.199 -10.247 -12.865
  256    HA   CYS  35           HA       CYS  35  -4.663  -7.684 -11.567
  257   1HB   CYS  35          2HB       CYS  35  -3.473  -8.986  -9.684
  258   2HB   CYS  35          1HB       CYS  35  -5.230  -8.862  -9.603
  259    HG   CYS  35           HG       CYS  35  -4.637 -11.381  -9.271
  260    H    ILE  36           H        ILE  36  -2.449  -7.140 -11.550
  261    HA   ILE  36           HA       ILE  36  -0.893  -8.547 -13.573
  262    HB   ILE  36           HB       ILE  36   0.575  -6.691 -13.607
  263   1HG1  ILE  36          2HG1      ILE  36  -0.163  -4.897 -11.615
  264   2HG1  ILE  36          1HG1      ILE  36  -0.203  -6.455 -10.790
  265   1HG2  ILE  36          1HG2      ILE  36  -1.603  -6.158 -14.562
  266   2HG2  ILE  36          2HG2      ILE  36  -0.952  -4.731 -13.758
  267   3HG2  ILE  36          3HG2      ILE  36  -2.214  -5.682 -12.978
  268   1HD1  ILE  36          1HD1      ILE  36   2.056  -6.740 -10.942
  269   2HD1  ILE  36          2HD1      ILE  36   2.075  -4.990 -11.164
  270   3HD1  ILE  36          3HD1      ILE  36   2.127  -6.056 -12.569
  271    H    SER  37           H        SER  37   1.567  -8.694 -13.080
  272    HA   SER  37           HA       SER  37   1.816 -10.422 -10.739
  273   1HB   SER  37          2HB       SER  37   2.708 -11.187 -12.906
  274   2HB   SER  37          1HB       SER  37   3.796  -9.804 -12.947
  275    HG   SER  37           HG       SER  37   4.764 -11.731 -12.109
  276    H    THR  38           H        THR  38   2.235  -9.445  -8.866
  277    HA   THR  38           HA       THR  38   3.291  -6.910  -8.424
  278    HB   THR  38           HB       THR  38   3.872  -7.739  -6.127
  279    HG1  THR  38           HG1      THR  38   4.143  -9.788  -5.903
  280   1HG2  THR  38          1HG2      THR  38   1.187  -8.255  -7.382
  281   2HG2  THR  38          2HG2      THR  38   1.672  -6.943  -6.311
  282   3HG2  THR  38          3HG2      THR  38   1.450  -8.567  -5.667
  283    H    LYS  39           H        LYS  39   5.035 -10.029  -8.292
  284    HA   LYS  39           HA       LYS  39   7.592  -8.990  -7.781
  285   1HB   LYS  39          2HB       LYS  39   8.466 -11.117  -8.710
  286   2HB   LYS  39          1HB       LYS  39   7.147 -11.374  -7.570
  287   1HG   LYS  39          2HG       LYS  39   5.798 -11.123  -9.959
  288   2HG   LYS  39          1HG       LYS  39   7.271 -11.957 -10.452
  289   1HD   LYS  39          2HD       LYS  39   6.900 -13.692  -8.779
  290   2HD   LYS  39          1HD       LYS  39   5.493 -12.830  -8.154
  291   1HE   LYS  39          2HE       LYS  39   4.220 -13.256 -10.098
  292   2HE   LYS  39          1HE       LYS  39   5.647 -13.662 -11.051
  293   1HZ   LYS  39          1HZ       LYS  39   4.710 -15.250  -8.723
  294   2HZ   LYS  39          2HZ       LYS  39   5.926 -15.669  -9.834
  295   3HZ   LYS  39          3HZ       LYS  39   4.303 -15.605 -10.332
  296    H    GLU  40           H        GLU  40   5.743  -9.049 -10.743
  297    HA   GLU  40           HA       GLU  40   8.115  -8.185 -12.278
  298   1HB   GLU  40          2HB       GLU  40   5.413  -9.181 -13.212
  299   2HB   GLU  40          1HB       GLU  40   6.690  -8.607 -14.282
  300   1HG   GLU  40          2HG       GLU  40   8.207 -10.354 -13.412
  301   2HG   GLU  40          1HG       GLU  40   6.921 -10.936 -12.354
  302    H    LEU  41           H        LEU  41   6.490  -6.504 -10.359
  303    HA   LEU  41           HA       LEU  41   4.863  -4.705 -11.816
  304   1HB   LEU  41          2HB       LEU  41   5.140  -4.993  -9.249
  305   2HB   LEU  41          1HB       LEU  41   6.453  -3.849  -9.424
  306    HG   LEU  41           HG       LEU  41   3.811  -3.114 -10.603
  307   1HD1  LEU  41          1HD1      LEU  41   4.364  -2.706  -7.665
  308   2HD1  LEU  41          2HD1      LEU  41   3.483  -4.119  -8.244
  309   3HD1  LEU  41          3HD1      LEU  41   2.843  -2.502  -8.535
  310   1HD2  LEU  41          1HD2      LEU  41   4.537  -0.897 -10.039
  311   2HD2  LEU  41          2HD2      LEU  41   5.946  -1.724 -10.700
  312   3HD2  LEU  41          3HD2      LEU  41   5.786  -1.513  -8.956
  313    H    GLY  42           H        GLY  42   8.339  -4.962 -11.449
  314   1HA   GLY  42          2HA       GLY  42   9.178  -2.375 -12.076
  315   2HA   GLY  42          1HA       GLY  42  10.059  -3.840 -12.505
  316    H    LYS  43           H        LYS  43   7.952  -4.948 -14.156
  317    HA   LYS  43           HA       LYS  43   8.600  -3.787 -16.664
  318   1HB   LYS  43          2HB       LYS  43   7.729  -6.208 -15.976
  319   2HB   LYS  43          1HB       LYS  43   6.163  -5.488 -16.360
  320   1HG   LYS  43          2HG       LYS  43   6.611  -5.392 -18.574
  321   2HG   LYS  43          1HG       LYS  43   8.283  -4.903 -18.320
  322   1HD   LYS  43          2HD       LYS  43   8.872  -7.003 -18.904
  323   2HD   LYS  43          1HD       LYS  43   8.189  -7.529 -17.366
  324   1HE   LYS  43          2HE       LYS  43   6.317  -7.108 -19.662
  325   2HE   LYS  43          1HE       LYS  43   7.331  -8.550 -19.673
  326   1HZ   LYS  43          1HZ       LYS  43   6.499  -9.130 -17.492
  327   2HZ   LYS  43          2HZ       LYS  43   5.206  -8.943 -18.578
  328   3HZ   LYS  43          3HZ       LYS  43   5.549  -7.725 -17.444
  329    H    VAL  44           H        VAL  44   6.017  -3.254 -14.372
  330    HA   VAL  44           HA       VAL  44   4.449  -1.704 -16.297
  331    HB   VAL  44           HB       VAL  44   2.645  -1.969 -14.936
  332   1HG1  VAL  44          1HG1      VAL  44   2.575  -4.096 -13.967
  333   2HG1  VAL  44          2HG1      VAL  44   4.233  -3.988 -13.375
  334   3HG1  VAL  44          3HG1      VAL  44   3.926  -4.239 -15.092
  335   1HG2  VAL  44          1HG2      VAL  44   3.005  -2.142 -12.333
  336   2HG2  VAL  44          2HG2      VAL  44   3.090  -0.569 -13.124
  337   3HG2  VAL  44          3HG2      VAL  44   4.572  -1.424 -12.696
  338    H    MET  45           H        MET  45   6.552  -1.271 -13.515
  339    HA   MET  45           HA       MET  45   5.958   1.474 -13.050
  340   1HB   MET  45          2HB       MET  45   7.310  -0.334 -11.614
  341   2HB   MET  45          1HB       MET  45   8.676   0.443 -12.414
  342   1HG   MET  45          2HG       MET  45   7.733   2.668 -11.684
  343   2HG   MET  45          1HG       MET  45   6.543   1.784 -10.729
  344   1HE   MET  45          1HE       MET  45   7.221   1.382  -7.976
  345   2HE   MET  45          2HE       MET  45   8.263  -0.032  -8.096
  346   3HE   MET  45          3HE       MET  45   6.911   0.152  -9.209
  347    H    ARG  46           H        ARG  46   8.242  -0.203 -15.179
  348    HA   ARG  46           HA       ARG  46   9.865   1.998 -15.862
  349   1HB   ARG  46          2HB       ARG  46  10.371   0.785 -17.956
  350   2HB   ARG  46          1HB       ARG  46  10.462  -0.277 -16.552
  351   1HG   ARG  46          2HG       ARG  46   8.259  -1.183 -17.030
  352   2HG   ARG  46          1HG       ARG  46   8.031  -0.037 -18.350
  353   1HD   ARG  46          2HD       ARG  46  10.318  -2.011 -18.290
  354   2HD   ARG  46          1HD       ARG  46   8.763  -2.389 -19.023
  355    HE   ARG  46           HE       ARG  46   9.613   0.041 -20.118
  356   1HH1  ARG  46          2HH1      ARG  46  10.646  -3.293 -20.005
  357   2HH1  ARG  46          1HH1      ARG  46  11.443  -3.229 -21.539
  358   1HH2  ARG  46          1HH2      ARG  46  10.663   0.102 -22.129
  359   2HH2  ARG  46          2HH2      ARG  46  11.454  -1.314 -22.738
  360    H    MET  47           H        MET  47   6.677   1.003 -16.975
  361    HA   MET  47           HA       MET  47   6.478   2.873 -19.138
  362   1HB   MET  47          2HB       MET  47   4.432   1.296 -17.562
  363   2HB   MET  47          1HB       MET  47   3.976   2.415 -18.848
  364   1HG   MET  47          2HG       MET  47   5.944   0.140 -19.217
  365   2HG   MET  47          1HG       MET  47   4.229   0.026 -19.611
  366   1HE   MET  47          1HE       MET  47   7.751   1.240 -21.437
  367   2HE   MET  47          2HE       MET  47   6.844   0.217 -22.548
  368   3HE   MET  47          3HE       MET  47   7.012  -0.261 -20.860
  369    H    LEU  48           H        LEU  48   5.817   2.926 -15.690
  370    HA   LEU  48           HA       LEU  48   4.354   5.390 -15.628
  371   1HB   LEU  48          2HB       LEU  48   5.698   3.649 -13.606
  372   2HB   LEU  48          1HB       LEU  48   5.278   5.285 -13.156
  373    HG   LEU  48           HG       LEU  48   2.975   4.855 -13.282
  374   1HD1  LEU  48          1HD1      LEU  48   3.786   2.581 -15.077
  375   2HD1  LEU  48          2HD1      LEU  48   2.601   3.854 -15.367
  376   3HD1  LEU  48          3HD1      LEU  48   2.227   2.538 -14.253
  377   1HD2  LEU  48          1HD2      LEU  48   3.039   2.238 -12.360
  378   2HD2  LEU  48          2HD2      LEU  48   3.272   3.680 -11.369
  379   3HD2  LEU  48          3HD2      LEU  48   4.669   2.822 -12.019
  380    H    GLY  49           H        GLY  49   7.755   4.483 -15.484
  381   1HA   GLY  49          2HA       GLY  49   9.222   6.324 -16.427
  382   2HA   GLY  49          1HA       GLY  49   8.502   7.335 -15.184
  383    H    GLN  50           H        GLN  50   8.903   4.215 -13.928
  384    HA   GLN  50           HA       GLN  50  11.609   4.842 -12.897
  385   1HB   GLN  50          2HB       GLN  50   9.352   3.695 -11.236
  386   2HB   GLN  50          1HB       GLN  50  10.970   4.117 -10.677
  387   1HG   GLN  50          2HG       GLN  50  10.290   6.224 -10.286
  388   2HG   GLN  50          1HG       GLN  50   9.867   6.407 -11.988
  389   1HE2  GLN  50          1HE2      GLN  50   7.627   6.124 -12.604
  390   2HE2  GLN  50          2HE2      GLN  50   6.390   5.985 -11.449
  391    H    ASN  51           H        ASN  51  12.977   3.099 -12.592
  392    HA   ASN  51           HA       ASN  51  11.891   0.412 -13.141
  393   1HB   ASN  51          2HB       ASN  51  13.976  -0.032 -14.539
  394   2HB   ASN  51          1HB       ASN  51  12.752   0.998 -15.277
  395   1HD2  ASN  51          1HD2      ASN  51  16.073   0.821 -14.464
  396   2HD2  ASN  51          2HD2      ASN  51  16.457   2.457 -14.705
  397    HA   PRO  52           HA       PRO  52  14.788   0.248  -9.571
  398   1HB   PRO  52          2HB       PRO  52  13.021  -0.911  -7.832
  399   2HB   PRO  52          1HB       PRO  52  13.145   0.837  -8.085
  400   1HG   PRO  52          2HG       PRO  52  11.047  -1.039  -8.963
  401   2HG   PRO  52          1HG       PRO  52  10.955   0.706  -8.691
  402   1HD   PRO  52          2HD       PRO  52  11.183  -0.635 -11.208
  403   2HD   PRO  52          1HD       PRO  52  11.244   1.119 -10.916
  404    H    THR  53           H        THR  53  14.559  -1.977  -7.872
  405    HA   THR  53           HA       THR  53  15.164  -4.200  -9.720
  406    HB   THR  53           HB       THR  53  16.597  -5.072  -8.084
  407    HG1  THR  53           HG1      THR  53  16.142  -5.014  -6.030
  408   1HG2  THR  53          1HG2      THR  53  18.006  -3.278  -7.329
  409   2HG2  THR  53          2HG2      THR  53  16.672  -2.128  -7.403
  410   3HG2  THR  53          3HG2      THR  53  17.339  -2.801  -8.891
  411    HA   PRO  54           HA       PRO  54  11.672  -6.503  -8.328
  412   1HB   PRO  54          2HB       PRO  54  12.641  -9.008  -7.776
  413   2HB   PRO  54          1HB       PRO  54  12.414  -8.368  -9.412
  414   1HG   PRO  54          2HG       PRO  54  14.922  -8.714  -7.853
  415   2HG   PRO  54          1HG       PRO  54  14.658  -8.798  -9.602
  416   1HD   PRO  54          2HD       PRO  54  15.762  -6.616  -8.246
  417   2HD   PRO  54          1HD       PRO  54  15.065  -6.552  -9.880
  418    H    GLU  55           H        GLU  55  14.429  -6.525  -6.167
  419    HA   GLU  55           HA       GLU  55  12.934  -7.426  -3.847
  420   1HB   GLU  55          2HB       GLU  55  15.711  -6.247  -4.134
  421   2HB   GLU  55          1HB       GLU  55  15.026  -6.818  -2.613
  422   1HG   GLU  55          2HG       GLU  55  14.894  -9.067  -3.401
  423   2HG   GLU  55          1HG       GLU  55  15.187  -8.576  -5.070
  424    H    GLU  56           H        GLU  56  14.011  -4.381  -5.283
  425    HA   GLU  56           HA       GLU  56  13.323  -2.723  -3.047
  426   1HB   GLU  56          2HB       GLU  56  14.906  -2.249  -5.088
  427   2HB   GLU  56          1HB       GLU  56  13.422  -1.693  -5.861
  428   1HG   GLU  56          2HG       GLU  56  13.029  -0.090  -4.082
  429   2HG   GLU  56          1HG       GLU  56  14.393  -0.722  -3.158
  430    H    LEU  57           H        LEU  57  11.676  -3.619  -6.082
  431    HA   LEU  57           HA       LEU  57   9.411  -1.923  -5.578
  432   1HB   LEU  57          2HB       LEU  57   8.398  -3.032  -7.488
  433   2HB   LEU  57          1HB       LEU  57  10.016  -2.486  -7.847
  434    HG   LEU  57           HG       LEU  57  10.609  -5.013  -7.208
  435   1HD1  LEU  57          1HD1      LEU  57   8.715  -6.406  -8.286
  436   2HD1  LEU  57          2HD1      LEU  57   7.688  -5.009  -7.970
  437   3HD1  LEU  57          3HD1      LEU  57   8.468  -5.850  -6.631
  438   1HD2  LEU  57          1HD2      LEU  57   9.378  -4.148  -9.845
  439   2HD2  LEU  57          2HD2      LEU  57  10.469  -5.515  -9.619
  440   3HD2  LEU  57          3HD2      LEU  57  11.051  -3.870  -9.363
  441    H    GLN  58           H        GLN  58  10.259  -5.208  -4.715
  442    HA   GLN  58           HA       GLN  58   7.638  -6.200  -4.281
  443   1HB   GLN  58          2HB       GLN  58  10.373  -7.066  -3.634
  444   2HB   GLN  58          1HB       GLN  58   9.148  -7.604  -2.484
  445   1HG   GLN  58          2HG       GLN  58   8.838  -7.908  -5.483
  446   2HG   GLN  58          1HG       GLN  58   9.535  -9.162  -4.458
  447   1HE2  GLN  58          1HE2      GLN  58   6.544  -7.742  -5.528
  448   2HE2  GLN  58          2HE2      GLN  58   5.515  -8.674  -4.553
  449    H    GLU  59           H        GLU  59   9.902  -4.475  -2.139
  450    HA   GLU  59           HA       GLU  59   8.421  -4.839   0.245
  451   1HB   GLU  59          2HB       GLU  59   9.750  -3.019   1.179
  452   2HB   GLU  59          1HB       GLU  59  10.773  -4.105   0.243
  453   1HG   GLU  59          2HG       GLU  59  11.482  -2.327  -0.937
  454   2HG   GLU  59          1HG       GLU  59   9.855  -2.170  -1.590
  455    H    MET  60           H        MET  60   8.189  -2.361  -2.292
  456    HA   MET  60           HA       MET  60   6.309  -0.771  -0.791
  457   1HB   MET  60          2HB       MET  60   6.049   0.542  -2.839
  458   2HB   MET  60          1HB       MET  60   7.755   0.274  -2.492
  459   1HG   MET  60          2HG       MET  60   7.954  -1.372  -4.192
  460   2HG   MET  60          1HG       MET  60   6.204  -1.537  -4.347
  461   1HE   MET  60          1HE       MET  60   8.749   1.981  -4.864
  462   2HE   MET  60          2HE       MET  60   9.223   0.934  -6.199
  463   3HE   MET  60          3HE       MET  60   9.229   0.308  -4.552
  464    H    ILE  61           H        ILE  61   6.123  -3.427  -3.056
  465    HA   ILE  61           HA       ILE  61   3.342  -3.132  -3.691
  466    HB   ILE  61           HB       ILE  61   5.202  -5.514  -3.873
  467   1HG1  ILE  61          2HG1      ILE  61   3.949  -3.995  -6.147
  468   2HG1  ILE  61          1HG1      ILE  61   5.398  -3.367  -5.362
  469   1HG2  ILE  61          1HG2      ILE  61   3.092  -6.004  -5.572
  470   2HG2  ILE  61          2HG2      ILE  61   2.279  -5.288  -4.183
  471   3HG2  ILE  61          3HG2      ILE  61   3.279  -6.725  -3.974
  472   1HD1  ILE  61          1HD1      ILE  61   6.606  -5.420  -5.838
  473   2HD1  ILE  61          2HD1      ILE  61   5.902  -4.818  -7.339
  474   3HD1  ILE  61          3HD1      ILE  61   5.148  -6.167  -6.489
  475    H    ASP  62           H        ASP  62   5.163  -5.208  -1.433
  476    HA   ASP  62           HA       ASP  62   2.999  -6.571  -0.293
  477   1HB   ASP  62          2HB       ASP  62   5.626  -6.751   0.094
  478   2HB   ASP  62          1HB       ASP  62   5.247  -5.737   1.487
  479    H    GLU  63           H        GLU  63   4.301  -3.357   0.382
  480    HA   GLU  63           HA       GLU  63   2.761  -2.872   2.739
  481   1HB   GLU  63          2HB       GLU  63   4.212  -1.059   0.813
  482   2HB   GLU  63          1HB       GLU  63   3.296  -0.428   2.183
  483   1HG   GLU  63          2HG       GLU  63   4.651  -1.716   3.744
  484   2HG   GLU  63          1HG       GLU  63   5.505  -2.494   2.412
  485    H    VAL  64           H        VAL  64   2.347  -1.786  -0.656
  486    HA   VAL  64           HA       VAL  64  -0.159  -0.511  -0.176
  487    HB   VAL  64           HB       VAL  64   1.261   0.077  -2.105
  488   1HG1  VAL  64          1HG1      VAL  64   0.416  -2.594  -3.257
  489   2HG1  VAL  64          2HG1      VAL  64   2.016  -2.260  -2.595
  490   3HG1  VAL  64          3HG1      VAL  64   1.455  -1.392  -4.022
  491   1HG2  VAL  64          1HG2      VAL  64  -0.507   0.454  -3.620
  492   2HG2  VAL  64          2HG2      VAL  64  -1.326   0.286  -2.065
  493   3HG2  VAL  64          3HG2      VAL  64  -1.307  -1.061  -3.202
  494    H    ASP  65           H        ASP  65   0.739  -3.786  -1.148
  495    HA   ASP  65           HA       ASP  65  -1.952  -4.611  -1.766
  496   1HB   ASP  65          2HB       ASP  65   0.534  -5.667  -2.295
  497   2HB   ASP  65          1HB       ASP  65  -0.046  -6.727  -1.014
  498    H    GLU  66           H        GLU  66  -3.380  -4.441  -0.146
  499    HA   GLU  66           HA       GLU  66  -2.865  -4.723   2.601
  500   1HB   GLU  66          2HB       GLU  66  -5.306  -4.927   2.871
  501   2HB   GLU  66          1HB       GLU  66  -4.881  -3.616   1.773
  502   1HG   GLU  66          2HG       GLU  66  -5.137  -5.501  -0.073
  503   2HG   GLU  66          1HG       GLU  66  -6.139  -6.269   1.158
  504    H    ASP  67           H        ASP  67  -3.840  -7.119   0.193
  505    HA   ASP  67           HA       ASP  67  -3.973  -9.205   2.247
  506   1HB   ASP  67          2HB       ASP  67  -4.612 -10.668   0.243
  507   2HB   ASP  67          1HB       ASP  67  -5.763  -9.425   0.723
  508    H    GLY  68           H        GLY  68  -2.016  -8.241  -0.529
  509   1HA   GLY  68          2HA       GLY  68   0.140  -8.826  -1.119
  510   2HA   GLY  68          1HA       GLY  68   0.281  -9.650   0.432
  511    H    SER  69           H        SER  69  -1.877 -10.102  -2.359
  512    HA   SER  69           HA       SER  69  -1.598 -12.979  -2.202
  513   1HB   SER  69          2HB       SER  69  -3.190 -12.968  -4.126
  514   2HB   SER  69          1HB       SER  69  -3.780 -12.090  -2.719
  515    HG   SER  69           HG       SER  69  -4.099 -10.712  -4.375
  516    H    GLY  70           H        GLY  70   0.424 -10.722  -3.510
  517   1HA   GLY  70          2HA       GLY  70   2.255 -11.028  -4.899
  518   2HA   GLY  70          1HA       GLY  70   1.666 -12.645  -5.275
  519    H    THR  71           H        THR  71  -0.638 -10.107  -5.580
  520    HA   THR  71           HA       THR  71  -0.106  -9.667  -8.420
  521    HB   THR  71           HB       THR  71  -2.263 -10.380  -9.170
  522    HG1  THR  71           HG1      THR  71  -2.837 -10.922  -6.441
  523   1HG2  THR  71          1HG2      THR  71  -0.638 -12.202  -8.932
  524   2HG2  THR  71          2HG2      THR  71  -2.266 -12.787  -8.585
  525   3HG2  THR  71          3HG2      THR  71  -1.147 -12.455  -7.261
  526    H    VAL  72           H        VAL  72  -0.569  -7.613  -8.980
  527    HA   VAL  72           HA       VAL  72  -1.792  -5.897  -6.951
  528    HB   VAL  72           HB       VAL  72  -0.657  -5.037  -9.615
  529   1HG1  VAL  72          1HG1      VAL  72  -0.384  -2.883  -8.409
  530   2HG1  VAL  72          2HG1      VAL  72  -1.158  -3.597  -6.994
  531   3HG1  VAL  72          3HG1      VAL  72  -2.073  -3.387  -8.487
  532   1HG2  VAL  72          1HG2      VAL  72   0.709  -5.406  -6.934
  533   2HG2  VAL  72          2HG2      VAL  72   1.398  -4.481  -8.268
  534   3HG2  VAL  72          3HG2      VAL  72   1.113  -6.211  -8.451
  535    H    ASP  73           H        ASP  73  -3.824  -5.286  -6.995
  536    HA   ASP  73           HA       ASP  73  -5.486  -5.845  -9.343
  537   1HB   ASP  73          2HB       ASP  73  -6.202  -4.769  -6.594
  538   2HB   ASP  73          1HB       ASP  73  -7.362  -5.158  -7.865
  539    H    PHE  74           H        PHE  74  -7.004  -4.052 -10.078
  540    HA   PHE  74           HA       PHE  74  -5.515  -1.795 -10.846
  541   1HB   PHE  74          2HB       PHE  74  -7.671  -2.687 -11.912
  542   2HB   PHE  74          1HB       PHE  74  -8.521  -1.746 -10.685
  543    HD1  PHE  74           HD1      PHE  74  -5.375  -1.088 -12.608
  544    HD2  PHE  74           HD2      PHE  74  -9.387   0.170 -11.723
  545    HE1  PHE  74           HE1      PHE  74  -5.041   0.956 -13.972
  546    HE2  PHE  74           HE2      PHE  74  -9.045   2.218 -13.082
  547    HZ   PHE  74           HZ       PHE  74  -6.873   2.608 -14.204
  548    H    ASP  75           H        ASP  75  -7.559  -2.347  -8.037
  549    HA   ASP  75           HA       ASP  75  -7.739   0.374  -7.182
  550   1HB   ASP  75          2HB       ASP  75  -7.925  -2.197  -5.581
  551   2HB   ASP  75          1HB       ASP  75  -8.356  -0.596  -4.980
  552    H    GLU  76           H        GLU  76  -5.510  -2.301  -6.500
  553    HA   GLU  76           HA       GLU  76  -3.895  -0.798  -4.641
  554   1HB   GLU  76          2HB       GLU  76  -3.187  -3.353  -6.104
  555   2HB   GLU  76          1HB       GLU  76  -2.425  -2.723  -4.644
  556   1HG   GLU  76          2HG       GLU  76  -4.456  -3.047  -3.363
  557   2HG   GLU  76          1HG       GLU  76  -5.364  -3.458  -4.815
  558    H    PHE  77           H        PHE  77  -3.964  -1.345  -8.083
  559    HA   PHE  77           HA       PHE  77  -1.296  -0.631  -8.727
  560   1HB   PHE  77          2HB       PHE  77  -3.298  -1.694 -10.162
  561   2HB   PHE  77          1HB       PHE  77  -3.521  -0.014 -10.621
  562    HD1  PHE  77           HD1      PHE  77  -3.007  -0.803 -12.943
  563    HD2  PHE  77           HD2      PHE  77  -0.093  -0.958  -9.784
  564    HE1  PHE  77           HE1      PHE  77  -1.194  -1.032 -14.614
  565    HE2  PHE  77           HE2      PHE  77   1.708  -1.176 -11.458
  566    HZ   PHE  77           HZ       PHE  77   1.163  -1.218 -13.878
  567    H    LEU  78           H        LEU  78  -4.339   1.222  -8.753
  568    HA   LEU  78           HA       LEU  78  -3.115   3.705  -9.462
  569   1HB   LEU  78          2HB       LEU  78  -5.808   2.863  -8.490
  570   2HB   LEU  78          1HB       LEU  78  -5.383   4.563  -8.422
  571    HG   LEU  78           HG       LEU  78  -5.312   4.764 -10.755
  572   1HD1  LEU  78          1HD1      LEU  78  -5.065   2.935 -12.309
  573   2HD1  LEU  78          2HD1      LEU  78  -5.289   1.745 -11.027
  574   3HD1  LEU  78          3HD1      LEU  78  -3.833   2.738 -11.065
  575   1HD2  LEU  78          1HD2      LEU  78  -7.371   2.574 -10.394
  576   2HD2  LEU  78          2HD2      LEU  78  -7.427   3.937 -11.511
  577   3HD2  LEU  78          3HD2      LEU  78  -7.602   4.210  -9.778
  578    H    VAL  79           H        VAL  79  -3.805   2.090  -6.409
  579    HA   VAL  79           HA       VAL  79  -3.518   4.308  -4.674
  580    HB   VAL  79           HB       VAL  79  -3.245   1.335  -4.363
  581   1HG1  VAL  79          1HG1      VAL  79  -2.733   1.696  -1.943
  582   2HG1  VAL  79          2HG1      VAL  79  -2.451   3.403  -2.292
  583   3HG1  VAL  79          3HG1      VAL  79  -1.409   2.173  -3.010
  584   1HG2  VAL  79          1HG2      VAL  79  -4.838   3.258  -2.679
  585   2HG2  VAL  79          2HG2      VAL  79  -5.171   1.564  -3.043
  586   3HG2  VAL  79          3HG2      VAL  79  -5.409   2.795  -4.282
  587    H    MET  80           H        MET  80  -1.157   1.851  -5.727
  588    HA   MET  80           HA       MET  80   1.136   2.705  -4.485
  589   1HB   MET  80          2HB       MET  80   0.545   0.901  -6.497
  590   2HB   MET  80          1HB       MET  80   1.628   2.042  -7.290
  591   1HG   MET  80          2HG       MET  80   2.412   1.185  -4.558
  592   2HG   MET  80          1HG       MET  80   2.511  -0.046  -5.816
  593   1HE   MET  80          1HE       MET  80   4.110   1.829  -8.625
  594   2HE   MET  80          2HE       MET  80   3.068   0.531  -8.049
  595   3HE   MET  80          3HE       MET  80   4.817   0.336  -7.993
  596    H    MET  81           H        MET  81  -0.508   4.261  -7.184
  597    HA   MET  81           HA       MET  81   1.607   5.895  -8.109
  598   1HB   MET  81          2HB       MET  81  -0.531   5.563  -9.334
  599   2HB   MET  81          1HB       MET  81  -1.356   6.519  -8.106
  600   1HG   MET  81          2HG       MET  81   0.107   8.446  -8.626
  601   2HG   MET  81          1HG       MET  81   0.911   7.493  -9.872
  602   1HE   MET  81          1HE       MET  81  -2.318   8.361  -8.368
  603   2HE   MET  81          2HE       MET  81  -3.215   7.225  -9.372
  604   3HE   MET  81          3HE       MET  81  -3.376   8.957  -9.655
  605    H    VAL  82           H        VAL  82  -1.105   6.701  -5.918
  606    HA   VAL  82           HA       VAL  82  -0.065   9.242  -5.169
  607    HB   VAL  82           HB       VAL  82  -1.707   9.110  -3.284
  608   1HG1  VAL  82          1HG1      VAL  82  -2.831   8.265  -5.968
  609   2HG1  VAL  82          2HG1      VAL  82  -2.293   9.901  -5.590
  610   3HG1  VAL  82          3HG1      VAL  82  -3.659   9.202  -4.723
  611   1HG2  VAL  82          1HG2      VAL  82  -1.489   6.585  -3.062
  612   2HG2  VAL  82          2HG2      VAL  82  -2.484   6.453  -4.513
  613   3HG2  VAL  82          3HG2      VAL  82  -3.143   7.199  -3.056
  614    H    ARG  83           H        ARG  83   0.469   5.996  -3.969
  615    HA   ARG  83           HA       ARG  83   1.563   6.659  -1.434
  616   1HB   ARG  83          2HB       ARG  83   2.177   4.277  -3.205
  617   2HB   ARG  83          1HB       ARG  83   2.579   4.415  -1.495
  618   1HG   ARG  83          2HG       ARG  83  -0.154   5.034  -1.633
  619   2HG   ARG  83          1HG       ARG  83   0.054   3.674  -2.733
  620   1HD   ARG  83          2HD       ARG  83   0.705   2.234  -1.059
  621   2HD   ARG  83          1HD       ARG  83   1.423   3.515  -0.088
  622    HE   ARG  83           HE       ARG  83  -1.406   3.836  -0.207
  623   1HH1  ARG  83          2HH1      ARG  83   1.087   1.843   1.214
  624   2HH1  ARG  83          1HH1      ARG  83   0.144   1.444   2.609
  625   1HH2  ARG  83          1HH2      ARG  83  -2.621   3.299   1.629
  626   2HH2  ARG  83          2HH2      ARG  83  -1.950   2.265   2.845
  627    H    CYS  84           H        CYS  84   2.933   6.449  -4.681
  628    HA   CYS  84           HA       CYS  84   5.642   6.957  -3.697
  629   1HB   CYS  84          2HB       CYS  84   4.464   6.303  -6.381
  630   2HB   CYS  84          1HB       CYS  84   6.085   6.989  -6.266
  631    HG   CYS  84           HG       CYS  84   5.978   4.251  -6.091
  632    H    MET  85           H        MET  85   3.125   8.593  -5.611
  633    HA   MET  85           HA       MET  85   4.695  10.912  -6.193
  634   1HB   MET  85          2HB       MET  85   1.835  10.140  -6.476
  635   2HB   MET  85          1HB       MET  85   2.198  11.865  -6.443
  636   1HG   MET  85          2HG       MET  85   3.775   9.996  -8.206
  637   2HG   MET  85          1HG       MET  85   2.228  10.651  -8.742
  638   1HE   MET  85          1HE       MET  85   4.363  12.569 -10.881
  639   2HE   MET  85          2HE       MET  85   2.722  13.090 -10.504
  640   3HE   MET  85          3HE       MET  85   3.099  11.370 -10.571
  641    H    LYS  86           H        LYS  86   2.076  10.302  -3.846
  642    HA   LYS  86           HA       LYS  86   1.645  11.197  -1.777
  643   1HB   LYS  86          2HB       LYS  86   4.140  11.052  -1.437
  644   2HB   LYS  86          1HB       LYS  86   4.252  12.713  -2.015
  645   1HG   LYS  86          2HG       LYS  86   4.142  12.885   0.358
  646   2HG   LYS  86          1HG       LYS  86   2.525  13.301  -0.213
  647   1HD   LYS  86          2HD       LYS  86   1.630  11.213   0.423
  648   2HD   LYS  86          1HD       LYS  86   3.222  10.461   0.521
  649   1HE   LYS  86          2HE       LYS  86   2.725  12.791   2.310
  650   2HE   LYS  86          1HE       LYS  86   1.892  11.289   2.707
  651   1HZ   LYS  86          1HZ       LYS  86   4.812  11.504   2.215
  652   2HZ   LYS  86          2HZ       LYS  86   3.968  10.131   2.752
  653   3HZ   LYS  86          3HZ       LYS  86   4.099  11.497   3.753
  654    H    ASP  87           H        ASP  87   0.241  12.760  -1.309
  655    HA   ASP  87           HA       ASP  87   0.033  15.042  -3.126
  656   1HB   ASP  87          2HB       ASP  87  -1.888  13.467  -2.065
  657   2HB   ASP  87          1HB       ASP  87  -1.872  14.758  -0.864
  658    H    ASP  88           H        ASP  88   2.260  15.530  -1.930
  659    HA   ASP  88           HA       ASP  88   1.797  17.108   0.508
  660   1HB   ASP  88          2HB       ASP  88   4.264  17.229   0.652
  661   2HB   ASP  88          1HB       ASP  88   3.690  15.564   0.588
  662    H    SER  89           HN       SER  89   2.810  17.434  -2.858
  663    HA   SER  89           HA       SER  89   3.517  20.213  -2.655
  664   1HB   SER  89          2HB       SER  89   4.393  18.645  -4.421
  665   2HB   SER  89          1HB       SER  89   2.791  18.667  -5.153
  666    HG   SER  89           HG       SER  89   3.207  20.576  -5.926
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1  -5.476  13.598   7.937
    2   2H    MET   1          2H        MET   1  -5.837  12.463   9.149
    3   3H    MET   1          3H        MET   1  -6.854  13.801   8.906
    4    HA   MET   1           HA       MET   1  -7.848  11.807   7.981
    5   1HB   MET   1          2HB       MET   1  -6.933  14.028   6.169
    6   2HB   MET   1          1HB       MET   1  -7.870  12.688   5.508
    7   1HG   MET   1          2HG       MET   1  -9.733  13.155   6.902
    8   2HG   MET   1          1HG       MET   1  -8.783  14.199   7.960
    9   1HE   MET   1          1HE       MET   1 -11.305  16.598   6.521
   10   2HE   MET   1          2HE       MET   1 -11.099  15.206   7.582
   11   3HE   MET   1          3HE       MET   1 -11.747  14.980   5.959
   12    H    ASN   2           H        ASN   2  -7.343   9.793   7.424
   13    HA   ASN   2           HA       ASN   2  -4.862   9.315   5.874
   14   1HB   ASN   2          2HB       ASN   2  -4.865   7.048   6.893
   15   2HB   ASN   2          1HB       ASN   2  -4.737   8.329   8.098
   16   1HD2  ASN   2          1HD2      ASN   2  -6.904   5.845   6.782
   17   2HD2  ASN   2          2HD2      ASN   2  -8.057   5.952   8.022
   18    H    ASP   3           H        ASP   3  -7.789   9.811   5.000
   19    HA   ASP   3           HA       ASP   3  -8.177   7.305   3.477
   20   1HB   ASP   3          2HB       ASP   3 -10.135   9.517   4.149
   21   2HB   ASP   3          1HB       ASP   3 -10.499   8.144   3.104
   22    H    ILE   4           H        ILE   4  -6.231   9.403   2.802
   23    HA   ILE   4           HA       ILE   4  -7.331  10.840   0.535
   24    HB   ILE   4           HB       ILE   4  -5.028  11.644   0.186
   25   1HG1  ILE   4          2HG1      ILE   4  -3.488  10.937   2.267
   26   2HG1  ILE   4          1HG1      ILE   4  -4.446   9.462   2.150
   27   1HG2  ILE   4          1HG2      ILE   4  -5.947  11.717   3.076
   28   2HG2  ILE   4          2HG2      ILE   4  -6.477  12.805   1.793
   29   3HG2  ILE   4          3HG2      ILE   4  -4.802  12.840   2.344
   30   1HD1  ILE   4          1HD1      ILE   4  -3.732  10.160  -0.501
   31   2HD1  ILE   4          2HD1      ILE   4  -3.139   8.797   0.447
   32   3HD1  ILE   4          3HD1      ILE   4  -2.271  10.331   0.472
   33    H    TYR   5           H        TYR   5  -5.713   7.819   1.097
   34    HA   TYR   5           HA       TYR   5  -4.674   7.373  -1.512
   35   1HB   TYR   5          2HB       TYR   5  -5.594   5.283   0.478
   36   2HB   TYR   5          1HB       TYR   5  -4.472   5.046  -0.862
   37    HD1  TYR   5           HD1      TYR   5  -2.228   6.152  -0.833
   38    HD2  TYR   5           HD2      TYR   5  -4.885   6.302   2.539
   39    HE1  TYR   5           HE1      TYR   5  -0.355   6.876   0.611
   40    HE2  TYR   5           HE2      TYR   5  -3.011   7.023   3.984
   41    HH   TYR   5           HH       TYR   5  -0.148   6.627   3.621
   42    H    LYS   6           H        LYS   6  -7.818   6.915  -0.031
   43    HA   LYS   6           HA       LYS   6  -8.881   5.545  -2.399
   44   1HB   LYS   6          2HB       LYS   6 -10.045   6.171   0.320
   45   2HB   LYS   6          1HB       LYS   6 -11.004   5.498  -0.997
   46   1HG   LYS   6          2HG       LYS   6 -10.331   3.508  -0.082
   47   2HG   LYS   6          1HG       LYS   6  -8.899   3.801  -1.068
   48   1HD   LYS   6          2HD       LYS   6  -8.009   3.342   1.067
   49   2HD   LYS   6          1HD       LYS   6  -8.003   5.102   0.991
   50   1HE   LYS   6          2HE       LYS   6  -9.086   4.939   2.993
   51   2HE   LYS   6          1HE       LYS   6 -10.501   4.663   1.979
   52   1HZ   LYS   6          1HZ       LYS   6  -8.743   2.554   3.116
   53   2HZ   LYS   6          2HZ       LYS   6 -10.099   2.283   2.127
   54   3HZ   LYS   6          3HZ       LYS   6 -10.293   2.959   3.673
   55    H    ALA   7           H        ALA   7  -9.080   8.624  -0.683
   56    HA   ALA   7           HA       ALA   7 -11.280   9.675  -2.189
   57   1HB   ALA   7          1HB       ALA   7 -10.849  10.642  -0.043
   58   2HB   ALA   7          2HB       ALA   7 -10.487  11.881  -1.245
   59   3HB   ALA   7          3HB       ALA   7  -9.174  10.995  -0.469
   60    H    ALA   8           H        ALA   8  -7.771   9.695  -2.584
   61    HA   ALA   8           HA       ALA   8  -7.768  11.678  -4.677
   62   1HB   ALA   8          1HB       ALA   8  -5.781  11.328  -3.280
   63   2HB   ALA   8          2HB       ALA   8  -5.413  11.039  -4.980
   64   3HB   ALA   8          3HB       ALA   8  -5.641   9.678  -3.884
   65    H    VAL   9           H        VAL   9  -7.530   8.126  -4.559
   66    HA   VAL   9           HA       VAL   9  -7.162   7.738  -7.338
   67    HB   VAL   9           HB       VAL   9  -6.737   6.020  -5.550
   68   1HG1  VAL   9          1HG1      VAL   9  -8.621   4.653  -4.788
   69   2HG1  VAL   9          2HG1      VAL   9  -9.745   5.665  -5.694
   70   3HG1  VAL   9          3HG1      VAL   9  -8.865   6.334  -4.321
   71   1HG2  VAL   9          1HG2      VAL   9  -7.009   5.571  -8.066
   72   2HG2  VAL   9          2HG2      VAL   9  -8.622   4.980  -7.671
   73   3HG2  VAL   9          3HG2      VAL   9  -7.201   4.187  -6.992
   74    H    GLU  10           H        GLU  10 -10.048   8.314  -5.425
   75    HA   GLU  10           HA       GLU  10 -11.857   7.502  -7.537
   76   1HB   GLU  10          2HB       GLU  10 -13.629   8.199  -6.049
   77   2HB   GLU  10          1HB       GLU  10 -12.440   7.281  -5.127
   78   1HG   GLU  10          2HG       GLU  10 -11.566   9.212  -4.096
   79   2HG   GLU  10          1HG       GLU  10 -12.282  10.289  -5.292
   80    H    GLN  11           H        GLN  11 -10.189  10.428  -6.641
   81    HA   GLN  11           HA       GLN  11 -11.911  11.954  -8.506
   82   1HB   GLN  11          2HB       GLN  11 -11.474  13.941  -7.267
   83   2HB   GLN  11          1HB       GLN  11 -11.907  12.702  -6.091
   84   1HG   GLN  11          2HG       GLN  11  -9.449  12.270  -5.747
   85   2HG   GLN  11          1HG       GLN  11  -9.112  13.657  -6.782
   86   1HE2  GLN  11          1HE2      GLN  11 -11.082  12.851  -3.856
   87   2HE2  GLN  11          2HE2      GLN  11 -10.826  14.350  -3.103
   88    H    LEU  12           H        LEU  12  -9.189  10.360  -8.812
   89    HA   LEU  12           HA       LEU  12  -7.300  12.369  -9.604
   90   1HB   LEU  12          2HB       LEU  12  -6.292  10.341 -10.901
   91   2HB   LEU  12          1HB       LEU  12  -6.186  10.424  -9.160
   92    HG   LEU  12           HG       LEU  12  -7.943   8.794  -8.916
   93   1HD1  LEU  12          1HD1      LEU  12  -8.228   9.096 -11.914
   94   2HD1  LEU  12          2HD1      LEU  12  -9.458   9.379 -10.684
   95   3HD1  LEU  12          3HD1      LEU  12  -8.911   7.738 -11.020
   96   1HD2  LEU  12          1HD2      LEU  12  -6.871   6.871  -9.946
   97   2HD2  LEU  12          2HD2      LEU  12  -5.622   8.008  -9.442
   98   3HD2  LEU  12          3HD2      LEU  12  -6.086   7.904 -11.141
   99    H    THR  13           H        THR  13  -6.351  12.048 -11.999
  100    HA   THR  13           HA       THR  13  -8.465  12.985 -13.745
  101    HB   THR  13           HB       THR  13  -6.318  12.788 -15.388
  102    HG1  THR  13           HG1      THR  13  -4.887  11.985 -13.952
  103   1HG2  THR  13          1HG2      THR  13  -7.250  14.888 -15.234
  104   2HG2  THR  13          2HG2      THR  13  -5.759  15.158 -14.331
  105   3HG2  THR  13          3HG2      THR  13  -7.272  14.869 -13.471
  106    H    ASP  14           H        ASP  14  -8.655  12.138 -15.979
  107    HA   ASP  14           HA       ASP  14  -9.182   9.317 -15.952
  108   1HB   ASP  14          2HB       ASP  14 -10.454  11.048 -17.315
  109   2HB   ASP  14          1HB       ASP  14  -9.055  11.104 -18.389
  110    H    GLU  15           H        GLU  15  -6.573  11.387 -17.005
  111    HA   GLU  15           HA       GLU  15  -5.221   9.540 -18.690
  112   1HB   GLU  15          2HB       GLU  15  -3.357  11.043 -18.586
  113   2HB   GLU  15          1HB       GLU  15  -4.818  12.025 -18.606
  114   1HG   GLU  15          2HG       GLU  15  -3.994  13.056 -16.776
  115   2HG   GLU  15          1HG       GLU  15  -4.385  11.582 -15.895
  116    H    GLN  16           H        GLN  16  -5.271  10.051 -15.223
  117    HA   GLN  16           HA       GLN  16  -2.965   8.436 -14.635
  118   1HB   GLN  16          2HB       GLN  16  -5.101   9.797 -13.065
  119   2HB   GLN  16          1HB       GLN  16  -4.290   8.431 -12.299
  120   1HG   GLN  16          2HG       GLN  16  -2.167   9.466 -12.429
  121   2HG   GLN  16          1HG       GLN  16  -2.716  10.629 -13.635
  122   1HE2  GLN  16          1HE2      GLN  16  -4.072   9.682 -10.420
  123   2HE2  GLN  16          2HE2      GLN  16  -4.118  11.269  -9.821
  124    H    LYS  17           H        LYS  17  -6.478   7.952 -14.656
  125    HA   LYS  17           HA       LYS  17  -6.519   5.313 -13.639
  126   1HB   LYS  17          2HB       LYS  17  -8.427   6.712 -15.533
  127   2HB   LYS  17          1HB       LYS  17  -8.741   5.151 -14.774
  128   1HG   LYS  17          2HG       LYS  17  -8.928   6.073 -12.639
  129   2HG   LYS  17          1HG       LYS  17  -7.973   7.493 -13.062
  130   1HD   LYS  17          2HD       LYS  17 -10.060   8.463 -13.110
  131   2HD   LYS  17          1HD       LYS  17 -10.007   7.869 -14.768
  132   1HE   LYS  17          2HE       LYS  17 -10.952   5.899 -12.776
  133   2HE   LYS  17          1HE       LYS  17 -12.012   7.289 -13.006
  134   1HZ   LYS  17          1HZ       LYS  17 -12.538   5.491 -14.540
  135   2HZ   LYS  17          2HZ       LYS  17 -10.963   5.547 -15.173
  136   3HZ   LYS  17          3HZ       LYS  17 -12.011   6.869 -15.377
  137    H    ASN  18           H        ASN  18  -6.337   6.591 -16.950
  138    HA   ASN  18           HA       ASN  18  -6.264   3.997 -18.192
  139   1HB   ASN  18          2HB       ASN  18  -5.825   6.811 -19.141
  140   2HB   ASN  18          1HB       ASN  18  -5.363   5.456 -20.169
  141   1HD2  ASN  18          1HD2      ASN  18  -8.183   6.700 -18.297
  142   2HD2  ASN  18          2HD2      ASN  18  -9.347   6.040 -19.341
  143    H    GLU  19           H        GLU  19  -3.879   6.201 -16.884
  144    HA   GLU  19           HA       GLU  19  -1.554   5.341 -18.176
  145   1HB   GLU  19          2HB       GLU  19  -1.738   7.268 -16.556
  146   2HB   GLU  19          1HB       GLU  19  -1.748   6.086 -15.248
  147   1HG   GLU  19          2HG       GLU  19   0.459   5.419 -15.660
  148   2HG   GLU  19          1HG       GLU  19   0.434   6.019 -17.318
  149    H    PHE  20           H        PHE  20  -3.058   4.104 -15.181
  150    HA   PHE  20           HA       PHE  20  -1.176   1.895 -15.033
  151   1HB   PHE  20          2HB       PHE  20  -3.503   2.803 -13.362
  152   2HB   PHE  20          1HB       PHE  20  -2.780   1.213 -13.122
  153    HD1  PHE  20           HD1      PHE  20  -2.249   4.849 -12.874
  154    HD2  PHE  20           HD2      PHE  20  -0.490   0.977 -12.311
  155    HE1  PHE  20           HE1      PHE  20  -0.420   5.874 -11.550
  156    HE2  PHE  20           HE2      PHE  20   1.335   1.989 -10.979
  157    HZ   PHE  20           HZ       PHE  20   1.374   4.443 -10.601
  158    H    LYS  21           H        LYS  21  -4.670   2.316 -15.644
  159    HA   LYS  21           HA       LYS  21  -5.429  -0.342 -15.890
  160   1HB   LYS  21          2HB       LYS  21  -7.020   1.530 -15.926
  161   2HB   LYS  21          1HB       LYS  21  -6.443   1.994 -17.524
  162   1HG   LYS  21          2HG       LYS  21  -7.235  -0.842 -17.283
  163   2HG   LYS  21          1HG       LYS  21  -8.556   0.307 -17.074
  164   1HD   LYS  21          2HD       LYS  21  -6.653   0.719 -19.352
  165   2HD   LYS  21          1HD       LYS  21  -7.881  -0.539 -19.494
  166   1HE   LYS  21          2HE       LYS  21  -9.658   1.006 -19.282
  167   2HE   LYS  21          1HE       LYS  21  -8.605   2.255 -18.618
  168   1HZ   LYS  21          1HZ       LYS  21  -7.510   2.447 -20.743
  169   2HZ   LYS  21          2HZ       LYS  21  -9.183   2.665 -20.943
  170   3HZ   LYS  21          3HZ       LYS  21  -8.456   1.196 -21.389
  171    H    ALA  22           H        ALA  22  -3.781   1.703 -18.271
  172    HA   ALA  22           HA       ALA  22  -4.064   0.022 -20.527
  173   1HB   ALA  22          1HB       ALA  22  -2.011   1.177 -21.368
  174   2HB   ALA  22          2HB       ALA  22  -1.840   1.940 -19.787
  175   3HB   ALA  22          3HB       ALA  22  -3.247   2.295 -20.789
  176    H    ALA  23           H        ALA  23  -1.355   0.331 -18.230
  177    HA   ALA  23           HA       ALA  23   0.122  -1.895 -19.205
  178   1HB   ALA  23          1HB       ALA  23   0.165  -0.511 -16.507
  179   2HB   ALA  23          2HB       ALA  23   1.233  -0.190 -17.875
  180   3HB   ALA  23          3HB       ALA  23   1.333  -1.729 -17.021
  181    H    PHE  24           H        PHE  24  -2.346  -1.470 -16.745
  182    HA   PHE  24           HA       PHE  24  -2.191  -3.961 -15.450
  183   1HB   PHE  24          2HB       PHE  24  -3.574  -1.881 -14.820
  184   2HB   PHE  24          1HB       PHE  24  -4.773  -2.484 -15.960
  185    HD1  PHE  24           HD1      PHE  24  -5.719  -4.821 -15.629
  186    HD2  PHE  24           HD2      PHE  24  -3.355  -2.821 -12.657
  187    HE1  PHE  24           HE1      PHE  24  -6.569  -6.379 -13.902
  188    HE2  PHE  24           HE2      PHE  24  -4.204  -4.376 -10.933
  189    HZ   PHE  24           HZ       PHE  24  -5.814  -6.149 -11.553
  190    H    ASP  25           H        ASP  25  -4.118  -2.915 -18.257
  191    HA   ASP  25           HA       ASP  25  -5.527  -5.319 -18.665
  192   1HB   ASP  25          2HB       ASP  25  -5.871  -2.977 -19.733
  193   2HB   ASP  25          1HB       ASP  25  -4.728  -3.541 -20.950
  194    H    ILE  26           H        ILE  26  -2.407  -4.239 -20.011
  195    HA   ILE  26           HA       ILE  26  -2.118  -6.534 -21.708
  196    HB   ILE  26           HB       ILE  26   0.239  -5.769 -21.984
  197   1HG1  ILE  26          2HG1      ILE  26  -0.597  -3.530 -20.110
  198   2HG1  ILE  26          1HG1      ILE  26   0.480  -4.849 -19.659
  199   1HG2  ILE  26          1HG2      ILE  26  -0.349  -3.678 -23.123
  200   2HG2  ILE  26          2HG2      ILE  26  -1.850  -3.580 -22.201
  201   3HG2  ILE  26          3HG2      ILE  26  -1.617  -4.879 -23.371
  202   1HD1  ILE  26          1HD1      ILE  26   1.330  -3.600 -22.144
  203   2HD1  ILE  26          2HD1      ILE  26   2.238  -3.856 -20.654
  204   3HD1  ILE  26          3HD1      ILE  26   1.225  -2.423 -20.834
  205    H    PHE  27           H        PHE  27  -0.957  -5.713 -18.452
  206    HA   PHE  27           HA       PHE  27   0.727  -8.015 -18.210
  207   1HB   PHE  27          2HB       PHE  27  -0.422  -6.130 -16.149
  208   2HB   PHE  27          1HB       PHE  27   0.664  -7.458 -15.746
  209    HD1  PHE  27           HD1      PHE  27   2.509  -7.451 -18.079
  210    HD2  PHE  27           HD2      PHE  27   0.883  -4.183 -15.813
  211    HE1  PHE  27           HE1      PHE  27   4.439  -6.042 -18.725
  212    HE2  PHE  27           HE2      PHE  27   2.816  -2.778 -16.465
  213    HZ   PHE  27           HZ       PHE  27   4.594  -3.705 -17.918
  214    H    ILE  28           H        ILE  28  -2.681  -7.382 -17.478
  215    HA   ILE  28           HA       ILE  28  -2.935 -10.072 -16.299
  216    HB   ILE  28           HB       ILE  28  -5.163  -9.449 -15.610
  217   1HG1  ILE  28          2HG1      ILE  28  -5.607  -6.817 -16.162
  218   2HG1  ILE  28          1HG1      ILE  28  -4.777  -7.318 -17.635
  219   1HG2  ILE  28          1HG2      ILE  28  -3.097  -8.568 -14.370
  220   2HG2  ILE  28          2HG2      ILE  28  -4.633  -7.769 -14.030
  221   3HG2  ILE  28          3HG2      ILE  28  -3.462  -7.008 -15.107
  222   1HD1  ILE  28          1HD1      ILE  28  -6.429  -8.850 -18.210
  223   2HD1  ILE  28          2HD1      ILE  28  -7.393  -7.586 -17.441
  224   3HD1  ILE  28          3HD1      ILE  28  -6.971  -9.045 -16.543
  225    H    GLN  29           H        GLN  29  -2.739  -9.069 -19.330
  226    HA   GLN  29           HA       GLN  29  -5.045  -9.747 -20.715
  227   1HB   GLN  29          2HB       GLN  29  -3.131  -8.778 -21.848
  228   2HB   GLN  29          1HB       GLN  29  -2.153 -10.202 -21.493
  229   1HG   GLN  29          2HG       GLN  29  -3.577 -11.592 -22.887
  230   2HG   GLN  29          1HG       GLN  29  -4.695 -10.252 -23.148
  231   1HE2  GLN  29          1HE2      GLN  29  -3.408  -8.158 -24.034
  232   2HE2  GLN  29          2HE2      GLN  29  -2.322  -8.490 -25.296
  233    H    ASP  30           H        ASP  30  -2.519 -11.865 -19.436
  234    HA   ASP  30           HA       ASP  30  -3.871 -14.247 -20.483
  235   1HB   ASP  30          2HB       ASP  30  -1.914 -15.476 -19.682
  236   2HB   ASP  30          1HB       ASP  30  -1.417 -14.105 -20.671
  237    H    ALA  31           H        ALA  31  -4.229 -12.360 -17.774
  238    HA   ALA  31           HA       ALA  31  -4.728 -14.605 -15.945
  239   1HB   ALA  31          1HB       ALA  31  -4.856 -12.959 -14.186
  240   2HB   ALA  31          2HB       ALA  31  -4.842 -11.640 -15.358
  241   3HB   ALA  31          3HB       ALA  31  -3.404 -12.637 -15.135
  242    H    GLU  32           H        GLU  32  -6.711 -14.854 -14.894
  243    HA   GLU  32           HA       GLU  32  -9.011 -13.450 -16.124
  244   1HB   GLU  32          2HB       GLU  32  -8.732 -16.395 -15.483
  245   2HB   GLU  32          1HB       GLU  32 -10.278 -15.620 -15.828
  246   1HG   GLU  32          2HG       GLU  32  -7.920 -15.423 -17.714
  247   2HG   GLU  32          1HG       GLU  32  -9.101 -16.727 -17.817
  248    H    ASP  33           H        ASP  33  -7.771 -12.579 -13.801
  249    HA   ASP  33           HA       ASP  33  -9.795 -13.235 -11.743
  250   1HB   ASP  33          2HB       ASP  33  -7.452 -14.153 -11.290
  251   2HB   ASP  33          1HB       ASP  33  -6.946 -12.474 -11.104
  252    H    GLY  34           H        GLY  34  -7.438 -10.821 -12.879
  253   1HA   GLY  34          2HA       GLY  34  -8.237  -8.546 -13.321
  254   2HA   GLY  34          1HA       GLY  34  -9.235  -8.688 -11.877
  255    H    CYS  35           H        CYS  35  -5.855  -9.672 -12.322
  256    HA   CYS  35           HA       CYS  35  -4.814  -7.428 -10.811
  257   1HB   CYS  35          2HB       CYS  35  -3.801  -8.884  -9.042
  258   2HB   CYS  35          1HB       CYS  35  -5.557  -8.764  -8.939
  259    HG   CYS  35           HG       CYS  35  -5.555 -11.234  -9.073
  260    H    ILE  36           H        ILE  36  -2.626  -7.146 -11.110
  261    HA   ILE  36           HA       ILE  36  -1.401  -8.842 -13.162
  262    HB   ILE  36           HB       ILE  36   0.295  -7.127 -13.358
  263   1HG1  ILE  36          2HG1      ILE  36  -0.409  -5.033 -11.704
  264   2HG1  ILE  36          1HG1      ILE  36  -0.659  -6.434 -10.661
  265   1HG2  ILE  36          1HG2      ILE  36  -2.529  -6.077 -13.110
  266   2HG2  ILE  36          2HG2      ILE  36  -1.668  -6.552 -14.573
  267   3HG2  ILE  36          3HG2      ILE  36  -1.203  -5.083 -13.716
  268   1HD1  ILE  36          1HD1      ILE  36   1.814  -6.597 -12.235
  269   2HD1  ILE  36          2HD1      ILE  36   1.563  -6.857 -10.507
  270   3HD1  ILE  36          3HD1      ILE  36   1.780  -5.221 -11.133
  271    H    SER  37           H        SER  37   1.126  -9.072 -12.797
  272    HA   SER  37           HA       SER  37   1.402 -10.563 -10.291
  273   1HB   SER  37          2HB       SER  37   2.078 -11.682 -12.371
  274   2HB   SER  37          1HB       SER  37   3.233 -10.395 -12.698
  275    HG   SER  37           HG       SER  37   3.247 -12.359 -10.676
  276    H    THR  38           H        THR  38   2.249  -9.611  -8.576
  277    HA   THR  38           HA       THR  38   3.439  -7.075  -8.483
  278    HB   THR  38           HB       THR  38   4.224  -7.697  -6.225
  279    HG1  THR  38           HG1      THR  38   4.849  -9.745  -6.291
  280   1HG2  THR  38          1HG2      THR  38   1.457  -8.584  -7.034
  281   2HG2  THR  38          2HG2      THR  38   1.935  -7.035  -6.348
  282   3HG2  THR  38          3HG2      THR  38   1.967  -8.486  -5.351
  283    H    LYS  39           H        LYS  39   4.803 -10.246  -9.057
  284    HA   LYS  39           HA       LYS  39   7.558  -9.539  -8.739
  285   1HB   LYS  39          2HB       LYS  39   6.407 -11.768 -10.438
  286   2HB   LYS  39          1HB       LYS  39   8.049 -11.657  -9.803
  287   1HG   LYS  39          2HG       LYS  39   7.396 -12.165  -7.638
  288   2HG   LYS  39          1HG       LYS  39   5.772 -11.519  -7.867
  289   1HD   LYS  39          2HD       LYS  39   5.378 -13.825  -7.837
  290   2HD   LYS  39          1HD       LYS  39   5.499 -13.491  -9.565
  291   1HE   LYS  39          2HE       LYS  39   6.906 -15.356  -9.293
  292   2HE   LYS  39          1HE       LYS  39   8.035 -14.003  -9.252
  293   1HZ   LYS  39          1HZ       LYS  39   8.336 -15.674  -7.448
  294   2HZ   LYS  39          2HZ       LYS  39   6.830 -15.203  -6.820
  295   3HZ   LYS  39          3HZ       LYS  39   8.109 -14.086  -6.897
  296    H    GLU  40           H        GLU  40   5.260  -9.430 -11.404
  297    HA   GLU  40           HA       GLU  40   7.301  -8.786 -13.368
  298   1HB   GLU  40          2HB       GLU  40   5.731  -9.220 -14.937
  299   2HB   GLU  40          1HB       GLU  40   4.886  -9.990 -13.602
  300   1HG   GLU  40          2HG       GLU  40   3.687  -7.816 -13.190
  301   2HG   GLU  40          1HG       GLU  40   4.442  -7.177 -14.648
  302    H    LEU  41           H        LEU  41   6.199  -6.976 -10.920
  303    HA   LEU  41           HA       LEU  41   5.240  -4.579 -11.968
  304   1HB   LEU  41          2HB       LEU  41   6.051  -5.457  -9.476
  305   2HB   LEU  41          1HB       LEU  41   7.175  -4.169  -9.832
  306    HG   LEU  41           HG       LEU  41   5.249  -3.354  -8.553
  307   1HD1  LEU  41          1HD1      LEU  41   4.755  -1.444  -9.904
  308   2HD1  LEU  41          2HD1      LEU  41   5.023  -2.346 -11.395
  309   3HD1  LEU  41          3HD1      LEU  41   6.385  -1.949 -10.349
  310   1HD2  LEU  41          1HD2      LEU  41   3.637  -5.066  -9.466
  311   2HD2  LEU  41          2HD2      LEU  41   3.578  -4.134 -10.962
  312   3HD2  LEU  41          3HD2      LEU  41   2.999  -3.420  -9.456
  313    H    GLY  42           H        GLY  42   8.478  -5.908 -12.102
  314   1HA   GLY  42          2HA       GLY  42  10.006  -3.600 -12.530
  315   2HA   GLY  42          1HA       GLY  42  10.378  -5.191 -13.190
  316    H    LYS  43           H        LYS  43   8.028  -5.513 -14.767
  317    HA   LYS  43           HA       LYS  43   8.787  -4.108 -17.147
  318   1HB   LYS  43          2HB       LYS  43   6.293  -5.741 -16.594
  319   2HB   LYS  43          1HB       LYS  43   6.862  -5.231 -18.182
  320   1HG   LYS  43          2HG       LYS  43   8.546  -6.904 -16.303
  321   2HG   LYS  43          1HG       LYS  43   7.476  -7.610 -17.512
  322   1HD   LYS  43          2HD       LYS  43   8.737  -5.950 -19.141
  323   2HD   LYS  43          1HD       LYS  43   9.990  -6.025 -17.902
  324   1HE   LYS  43          2HE       LYS  43   9.802  -8.564 -18.043
  325   2HE   LYS  43          1HE       LYS  43   8.817  -8.322 -19.485
  326   1HZ   LYS  43          1HZ       LYS  43  11.605  -7.383 -19.081
  327   2HZ   LYS  43          2HZ       LYS  43  10.654  -7.040 -20.447
  328   3HZ   LYS  43          3HZ       LYS  43  11.104  -8.641 -20.102
  329    H    VAL  44           H        VAL  44   6.632  -3.397 -14.554
  330    HA   VAL  44           HA       VAL  44   5.019  -1.510 -16.094
  331    HB   VAL  44           HB       VAL  44   4.914  -1.713 -13.104
  332   1HG1  VAL  44          1HG1      VAL  44   2.543  -1.610 -14.904
  333   2HG1  VAL  44          2HG1      VAL  44   3.575  -0.182 -14.843
  334   3HG1  VAL  44          3HG1      VAL  44   2.829  -0.794 -13.366
  335   1HG2  VAL  44          1HG2      VAL  44   3.041  -3.513 -14.427
  336   2HG2  VAL  44          2HG2      VAL  44   4.111  -3.823 -13.064
  337   3HG2  VAL  44          3HG2      VAL  44   4.711  -4.003 -14.709
  338    H    MET  45           H        MET  45   7.396  -1.548 -13.465
  339    HA   MET  45           HA       MET  45   7.500   1.130 -12.784
  340   1HB   MET  45          2HB       MET  45   9.647  -0.981 -12.910
  341   2HB   MET  45          1HB       MET  45  10.017   0.666 -12.399
  342   1HG   MET  45          2HG       MET  45   7.717  -0.829 -11.161
  343   2HG   MET  45          1HG       MET  45   9.361  -1.084 -10.581
  344   1HE   MET  45          1HE       MET  45   6.555   1.843  -9.072
  345   2HE   MET  45          2HE       MET  45   6.502   0.139  -9.515
  346   3HE   MET  45          3HE       MET  45   6.299   1.370 -10.758
  347    H    ARG  46           H        ARG  46   9.094  -0.520 -15.503
  348    HA   ARG  46           HA       ARG  46  10.543   1.761 -16.415
  349   1HB   ARG  46          2HB       ARG  46  10.832   0.504 -18.518
  350   2HB   ARG  46          1HB       ARG  46  11.190  -0.490 -17.109
  351   1HG   ARG  46          2HG       ARG  46   9.579  -1.965 -17.655
  352   2HG   ARG  46          1HG       ARG  46   8.379  -0.683 -17.795
  353   1HD   ARG  46          2HD       ARG  46   8.566  -1.753 -19.951
  354   2HD   ARG  46          1HD       ARG  46   9.296  -0.157 -20.072
  355    HE   ARG  46           HE       ARG  46  11.265  -2.117 -19.406
  356   1HH1  ARG  46          2HH1      ARG  46   9.304  -0.929 -22.041
  357   2HH1  ARG  46          1HH1      ARG  46  10.433  -1.407 -23.262
  358   1HH2  ARG  46          1HH2      ARG  46  12.730  -2.735 -21.025
  359   2HH2  ARG  46          2HH2      ARG  46  12.366  -2.426 -22.691
  360    H    MET  47           H        MET  47   7.269   0.629 -16.944
  361    HA   MET  47           HA       MET  47   6.726   2.432 -19.141
  362   1HB   MET  47          2HB       MET  47   5.003   0.623 -17.449
  363   2HB   MET  47          1HB       MET  47   4.309   1.734 -18.630
  364   1HG   MET  47          2HG       MET  47   6.511  -0.192 -19.380
  365   2HG   MET  47          1HG       MET  47   4.813  -0.663 -19.434
  366   1HE   MET  47          1HE       MET  47   7.638   1.420 -20.653
  367   2HE   MET  47          2HE       MET  47   7.225   1.750 -22.333
  368   3HE   MET  47          3HE       MET  47   7.424   0.085 -21.795
  369    H    LEU  48           H        LEU  48   6.340   2.435 -15.637
  370    HA   LEU  48           HA       LEU  48   4.619   4.728 -15.511
  371   1HB   LEU  48          2HB       LEU  48   6.116   3.051 -13.592
  372   2HB   LEU  48          1HB       LEU  48   5.873   4.710 -13.098
  373    HG   LEU  48           HG       LEU  48   4.084   3.501 -12.147
  374   1HD1  LEU  48          1HD1      LEU  48   2.349   4.782 -12.893
  375   2HD1  LEU  48          2HD1      LEU  48   2.573   4.291 -14.571
  376   3HD1  LEU  48          3HD1      LEU  48   3.599   5.544 -13.873
  377   1HD2  LEU  48          1HD2      LEU  48   3.028   2.336 -14.655
  378   2HD2  LEU  48          2HD2      LEU  48   3.139   1.625 -13.043
  379   3HD2  LEU  48          3HD2      LEU  48   4.553   1.649 -14.098
  380    H    GLY  49           H        GLY  49   8.071   4.186 -15.597
  381   1HA   GLY  49          2HA       GLY  49   9.419   6.007 -16.591
  382   2HA   GLY  49          1HA       GLY  49   8.528   7.115 -15.555
  383    H    GLN  50           H        GLN  50   9.625   3.960 -14.441
  384    HA   GLN  50           HA       GLN  50  11.781   5.246 -12.873
  385   1HB   GLN  50          2HB       GLN  50   9.945   3.121 -11.749
  386   2HB   GLN  50          1HB       GLN  50  11.154   4.066 -10.885
  387   1HG   GLN  50          2HG       GLN  50   8.729   5.286 -12.237
  388   2HG   GLN  50          1HG       GLN  50   8.775   4.844 -10.532
  389   1HE2  GLN  50          1HE2      GLN  50   8.793   7.566 -12.148
  390   2HE2  GLN  50          2HE2      GLN  50  10.008   8.449 -11.359
  391    H    ASN  51           H        ASN  51  13.359   3.662 -12.009
  392    HA   ASN  51           HA       ASN  51  13.441   1.085 -13.409
  393   1HB   ASN  51          2HB       ASN  51  14.640   2.952 -14.757
  394   2HB   ASN  51          1HB       ASN  51  15.877   2.852 -13.505
  395   1HD2  ASN  51          1HD2      ASN  51  17.540   1.482 -14.144
  396   2HD2  ASN  51          2HD2      ASN  51  17.341   0.064 -15.055
  397    HA   PRO  52           HA       PRO  52  15.206   0.990  -9.105
  398   1HB   PRO  52          2HB       PRO  52  13.182  -0.395  -7.897
  399   2HB   PRO  52          1HB       PRO  52  13.217   1.368  -8.033
  400   1HG   PRO  52          2HG       PRO  52  11.539  -0.588  -9.458
  401   2HG   PRO  52          1HG       PRO  52  11.256   1.132  -9.161
  402   1HD   PRO  52          2HD       PRO  52  12.192  -0.079 -11.587
  403   2HD   PRO  52          1HD       PRO  52  12.011   1.657 -11.247
  404    H    THR  53           H        THR  53  14.778  -1.315  -7.601
  405    HA   THR  53           HA       THR  53  15.898  -3.430  -9.340
  406    HB   THR  53           HB       THR  53  17.158  -4.189  -7.515
  407    HG1  THR  53           HG1      THR  53  16.364  -4.235  -5.577
  408   1HG2  THR  53          1HG2      THR  53  18.215  -2.235  -6.491
  409   2HG2  THR  53          2HG2      THR  53  16.852  -1.228  -6.976
  410   3HG2  THR  53          3HG2      THR  53  17.905  -1.935  -8.201
  411    HA   PRO  54           HA       PRO  54  12.476  -6.075  -8.438
  412   1HB   PRO  54          2HB       PRO  54  13.593  -8.470  -7.711
  413   2HB   PRO  54          1HB       PRO  54  13.550  -7.860  -9.372
  414   1HG   PRO  54          2HG       PRO  54  15.820  -7.935  -7.448
  415   2HG   PRO  54          1HG       PRO  54  15.831  -8.078  -9.213
  416   1HD   PRO  54          2HD       PRO  54  16.514  -5.777  -7.801
  417   2HD   PRO  54          1HD       PRO  54  16.025  -5.804  -9.510
  418    H    GLU  55           H        GLU  55  14.875  -5.820  -5.896
  419    HA   GLU  55           HA       GLU  55  13.150  -6.873  -3.815
  420   1HB   GLU  55          2HB       GLU  55  15.787  -5.383  -3.659
  421   2HB   GLU  55          1HB       GLU  55  14.949  -6.103  -2.284
  422   1HG   GLU  55          2HG       GLU  55  15.035  -8.317  -3.499
  423   2HG   GLU  55          1HG       GLU  55  16.078  -7.549  -4.695
  424    H    GLU  56           H        GLU  56  14.166  -3.717  -5.063
  425    HA   GLU  56           HA       GLU  56  12.974  -2.155  -2.990
  426   1HB   GLU  56          2HB       GLU  56  13.876  -1.504  -5.795
  427   2HB   GLU  56          1HB       GLU  56  13.144  -0.299  -4.735
  428   1HG   GLU  56          2HG       GLU  56  14.917  -1.079  -2.996
  429   2HG   GLU  56          1HG       GLU  56  15.747  -1.775  -4.388
  430    H    LEU  57           H        LEU  57  11.924  -2.936  -6.327
  431    HA   LEU  57           HA       LEU  57   9.476  -1.574  -6.233
  432   1HB   LEU  57          2HB       LEU  57   8.809  -2.862  -8.130
  433   2HB   LEU  57          1HB       LEU  57  10.491  -2.433  -8.302
  434    HG   LEU  57           HG       LEU  57  10.874  -4.856  -7.293
  435   1HD1  LEU  57          1HD1      LEU  57   7.997  -4.753  -7.983
  436   2HD1  LEU  57          2HD1      LEU  57   8.852  -5.848  -6.897
  437   3HD1  LEU  57          3HD1      LEU  57   8.865  -6.142  -8.636
  438   1HD2  LEU  57          1HD2      LEU  57  11.596  -4.085  -9.519
  439   2HD2  LEU  57          2HD2      LEU  57   9.960  -4.308 -10.138
  440   3HD2  LEU  57          3HD2      LEU  57  10.906  -5.706  -9.627
  441    H    GLN  58           H        GLN  58  10.327  -4.843  -5.162
  442    HA   GLN  58           HA       GLN  58   7.728  -5.836  -4.742
  443   1HB   GLN  58          2HB       GLN  58   9.832  -7.200  -4.642
  444   2HB   GLN  58          1HB       GLN  58  10.166  -6.477  -3.069
  445   1HG   GLN  58          2HG       GLN  58   9.064  -8.590  -2.677
  446   2HG   GLN  58          1HG       GLN  58   7.913  -7.313  -2.294
  447   1HE2  GLN  58          1HE2      GLN  58   6.009  -7.133  -3.614
  448   2HE2  GLN  58          2HE2      GLN  58   5.643  -8.239  -4.847
  449    H    GLU  59           H        GLU  59   9.892  -4.025  -2.567
  450    HA   GLU  59           HA       GLU  59   8.259  -4.058  -0.273
  451   1HB   GLU  59          2HB       GLU  59  10.426  -2.231  -1.259
  452   2HB   GLU  59          1HB       GLU  59   9.497  -1.793   0.176
  453   1HG   GLU  59          2HG       GLU  59  10.701  -4.543  -0.092
  454   2HG   GLU  59          1HG       GLU  59  11.668  -3.191   0.499
  455    H    MET  60           H        MET  60   8.344  -1.826  -3.033
  456    HA   MET  60           HA       MET  60   6.481   0.058  -2.019
  457   1HB   MET  60          2HB       MET  60   6.922  -0.637  -4.932
  458   2HB   MET  60          1HB       MET  60   6.274   0.869  -4.284
  459   1HG   MET  60          2HG       MET  60   8.532   1.004  -2.986
  460   2HG   MET  60          1HG       MET  60   9.095  -0.170  -4.174
  461   1HE   MET  60          1HE       MET  60  10.671   2.006  -6.419
  462   2HE   MET  60          2HE       MET  60   9.651   0.663  -6.929
  463   3HE   MET  60          3HE       MET  60  10.550   0.552  -5.417
  464    H    ILE  61           H        ILE  61   6.140  -2.926  -3.846
  465    HA   ILE  61           HA       ILE  61   3.344  -2.705  -4.367
  466    HB   ILE  61           HB       ILE  61   5.097  -5.172  -4.203
  467   1HG1  ILE  61          2HG1      ILE  61   4.089  -3.981  -6.758
  468   2HG1  ILE  61          1HG1      ILE  61   5.447  -3.189  -5.956
  469   1HG2  ILE  61          1HG2      ILE  61   3.039  -6.168  -4.184
  470   2HG2  ILE  61          2HG2      ILE  61   3.091  -5.801  -5.908
  471   3HG2  ILE  61          3HG2      ILE  61   2.224  -4.732  -4.806
  472   1HD1  ILE  61          1HD1      ILE  61   6.019  -5.031  -7.658
  473   2HD1  ILE  61          2HD1      ILE  61   5.418  -6.167  -6.453
  474   3HD1  ILE  61          3HD1      ILE  61   6.797  -5.134  -6.082
  475    H    ASP  62           H        ASP  62   5.218  -4.438  -1.872
  476    HA   ASP  62           HA       ASP  62   3.147  -5.683  -0.500
  477   1HB   ASP  62          2HB       ASP  62   5.646  -4.452   0.690
  478   2HB   ASP  62          1HB       ASP  62   4.604  -5.623   1.493
  479    H    GLU  63           H        GLU  63   4.264  -2.331  -0.277
  480    HA   GLU  63           HA       GLU  63   2.864  -1.517   2.010
  481   1HB   GLU  63          2HB       GLU  63   3.764  -0.058  -0.462
  482   2HB   GLU  63          1HB       GLU  63   2.827   0.769   0.782
  483   1HG   GLU  63          2HG       GLU  63   5.192  -0.858   1.634
  484   2HG   GLU  63          1HG       GLU  63   5.480   0.716   0.892
  485    H    VAL  64           H        VAL  64   1.825  -1.436  -1.412
  486    HA   VAL  64           HA       VAL  64  -0.847  -0.567  -0.676
  487    HB   VAL  64           HB       VAL  64  -1.335  -0.517  -3.022
  488   1HG1  VAL  64          1HG1      VAL  64   0.289   1.190  -2.027
  489   2HG1  VAL  64          2HG1      VAL  64   0.309   1.027  -3.783
  490   3HG1  VAL  64          3HG1      VAL  64   1.575   0.273  -2.813
  491   1HG2  VAL  64          1HG2      VAL  64   1.303  -1.933  -3.506
  492   2HG2  VAL  64          2HG2      VAL  64   0.099  -1.489  -4.715
  493   3HG2  VAL  64          3HG2      VAL  64  -0.264  -2.744  -3.529
  494    H    ASP  65           H        ASP  65   0.765  -3.599  -1.336
  495    HA   ASP  65           HA       ASP  65  -1.629  -5.103  -1.862
  496   1HB   ASP  65          2HB       ASP  65   1.107  -5.590  -2.128
  497   2HB   ASP  65          1HB       ASP  65   0.599  -6.681  -0.844
  498    H    GLU  66           H        GLU  66  -2.938  -4.433  -0.117
  499    HA   GLU  66           HA       GLU  66  -2.347  -4.690   2.624
  500   1HB   GLU  66          2HB       GLU  66  -5.067  -5.103   1.359
  501   2HB   GLU  66          1HB       GLU  66  -4.729  -4.606   3.017
  502   1HG   GLU  66          2HG       GLU  66  -3.525  -2.587   2.021
  503   2HG   GLU  66          1HG       GLU  66  -4.245  -3.043   0.476
  504    H    ASP  67           H        ASP  67  -3.746  -6.984   0.329
  505    HA   ASP  67           HA       ASP  67  -4.052  -9.068   2.312
  506   1HB   ASP  67          2HB       ASP  67  -4.563 -10.497   0.263
  507   2HB   ASP  67          1HB       ASP  67  -5.652  -9.144   0.557
  508    H    GLY  68           H        GLY  68  -1.770  -8.285  -0.284
  509   1HA   GLY  68          2HA       GLY  68   0.421  -8.952  -0.593
  510   2HA   GLY  68          1HA       GLY  68   0.339  -9.775   0.963
  511    H    SER  69           H        SER  69  -1.567 -10.171  -2.013
  512    HA   SER  69           HA       SER  69  -1.215 -13.062  -1.858
  513   1HB   SER  69          2HB       SER  69  -2.879 -13.139  -3.667
  514   2HB   SER  69          1HB       SER  69  -3.449 -12.170  -2.313
  515    HG   SER  69           HG       SER  69  -3.470 -10.487  -3.574
  516    H    GLY  70           H        GLY  70   0.642 -10.655  -3.158
  517   1HA   GLY  70          2HA       GLY  70   2.454 -10.807  -4.594
  518   2HA   GLY  70          1HA       GLY  70   1.980 -12.462  -4.968
  519    H    THR  71           H        THR  71  -0.441  -9.993  -5.190
  520    HA   THR  71           HA       THR  71  -0.054  -9.638  -8.071
  521    HB   THR  71           HB       THR  71  -2.309 -10.292  -8.633
  522    HG1  THR  71           HG1      THR  71  -2.609 -10.889  -5.872
  523   1HG2  THR  71          1HG2      THR  71  -0.601 -12.092  -8.512
  524   2HG2  THR  71          2HG2      THR  71  -2.221 -12.691  -8.155
  525   3HG2  THR  71          3HG2      THR  71  -1.077 -12.406  -6.842
  526    H    VAL  72           H        VAL  72  -0.621  -7.641  -8.746
  527    HA   VAL  72           HA       VAL  72  -1.747  -5.821  -6.723
  528    HB   VAL  72           HB       VAL  72  -0.641  -4.978  -9.395
  529   1HG1  VAL  72          1HG1      VAL  72  -0.797  -3.604  -6.695
  530   2HG1  VAL  72          2HG1      VAL  72  -1.937  -3.359  -8.019
  531   3HG1  VAL  72          3HG1      VAL  72  -0.251  -2.876  -8.206
  532   1HG2  VAL  72          1HG2      VAL  72   0.889  -5.461  -6.818
  533   2HG2  VAL  72          2HG2      VAL  72   1.529  -4.596  -8.216
  534   3HG2  VAL  72          3HG2      VAL  72   1.124  -6.308  -8.348
  535    H    ASP  73           H        ASP  73  -3.839  -5.417  -6.804
  536    HA   ASP  73           HA       ASP  73  -5.389  -5.944  -9.216
  537   1HB   ASP  73          2HB       ASP  73  -6.086  -5.113  -6.399
  538   2HB   ASP  73          1HB       ASP  73  -7.281  -5.037  -7.695
  539    H    PHE  74           H        PHE  74  -6.991  -4.165  -9.919
  540    HA   PHE  74           HA       PHE  74  -5.529  -1.920 -10.751
  541   1HB   PHE  74          2HB       PHE  74  -7.701  -2.811 -11.758
  542   2HB   PHE  74          1HB       PHE  74  -8.534  -1.889 -10.506
  543    HD1  PHE  74           HD1      PHE  74  -5.419  -1.138 -12.438
  544    HD2  PHE  74           HD2      PHE  74  -9.474  -0.024 -11.576
  545    HE1  PHE  74           HE1      PHE  74  -5.145   0.920 -13.793
  546    HE2  PHE  74           HE2      PHE  74  -9.195   2.036 -12.927
  547    HZ   PHE  74           HZ       PHE  74  -7.032   2.506 -14.037
  548    H    ASP  75           H        ASP  75  -7.441  -2.449  -7.851
  549    HA   ASP  75           HA       ASP  75  -7.607   0.288  -7.035
  550   1HB   ASP  75          2HB       ASP  75  -7.675  -2.237  -5.350
  551   2HB   ASP  75          1HB       ASP  75  -8.133  -0.626  -4.800
  552    H    GLU  76           H        GLU  76  -5.406  -2.401  -6.260
  553    HA   GLU  76           HA       GLU  76  -3.680  -0.908  -4.544
  554   1HB   GLU  76          2HB       GLU  76  -3.040  -3.410  -6.131
  555   2HB   GLU  76          1HB       GLU  76  -2.157  -2.801  -4.733
  556   1HG   GLU  76          2HG       GLU  76  -3.987  -3.244  -3.261
  557   2HG   GLU  76          1HG       GLU  76  -5.096  -3.510  -4.605
  558    H    PHE  77           H        PHE  77  -3.789  -1.532  -8.000
  559    HA   PHE  77           HA       PHE  77  -1.206  -0.707  -8.738
  560   1HB   PHE  77          2HB       PHE  77  -3.269  -1.778 -10.084
  561   2HB   PHE  77          1HB       PHE  77  -3.498  -0.099 -10.544
  562    HD1  PHE  77           HD1      PHE  77  -3.079  -0.860 -12.869
  563    HD2  PHE  77           HD2      PHE  77  -0.038  -1.114  -9.831
  564    HE1  PHE  77           HE1      PHE  77  -1.345  -1.104 -14.610
  565    HE2  PHE  77           HE2      PHE  77   1.688  -1.343 -11.591
  566    HZ   PHE  77           HZ       PHE  77   1.030  -1.347 -13.979
  567    H    LEU  78           H        LEU  78  -4.272   1.122  -8.780
  568    HA   LEU  78           HA       LEU  78  -3.042   3.621  -9.418
  569   1HB   LEU  78          2HB       LEU  78  -5.757   2.741  -8.563
  570   2HB   LEU  78          1HB       LEU  78  -5.351   4.437  -8.390
  571    HG   LEU  78           HG       LEU  78  -5.133   4.730 -10.731
  572   1HD1  LEU  78          1HD1      LEU  78  -5.276   1.724 -11.061
  573   2HD1  LEU  78          2HD1      LEU  78  -3.781   2.658 -11.105
  574   3HD1  LEU  78          3HD1      LEU  78  -5.017   2.917 -12.336
  575   1HD2  LEU  78          1HD2      LEU  78  -7.373   2.743 -10.250
  576   2HD2  LEU  78          2HD2      LEU  78  -7.267   3.844 -11.624
  577   3HD2  LEU  78          3HD2      LEU  78  -7.466   4.485  -9.993
  578    H    VAL  79           H        VAL  79  -3.793   1.951  -6.419
  579    HA   VAL  79           HA       VAL  79  -3.609   4.105  -4.610
  580    HB   VAL  79           HB       VAL  79  -3.324   1.139  -4.426
  581   1HG1  VAL  79          1HG1      VAL  79  -2.466   3.031  -2.216
  582   2HG1  VAL  79          2HG1      VAL  79  -1.418   1.914  -3.091
  583   3HG1  VAL  79          3HG1      VAL  79  -2.691   1.289  -2.042
  584   1HG2  VAL  79          1HG2      VAL  79  -5.467   2.548  -4.213
  585   2HG2  VAL  79          2HG2      VAL  79  -4.833   3.061  -2.649
  586   3HG2  VAL  79          3HG2      VAL  79  -5.168   1.355  -2.949
  587    H    MET  80           H        MET  80  -1.119   1.850  -5.804
  588    HA   MET  80           HA       MET  80   1.108   2.717  -4.419
  589   1HB   MET  80          2HB       MET  80   0.632   1.041  -6.598
  590   2HB   MET  80          1HB       MET  80   1.747   2.257  -7.219
  591   1HG   MET  80          2HG       MET  80   3.359   1.785  -5.522
  592   2HG   MET  80          1HG       MET  80   2.202   0.836  -4.591
  593   1HE   MET  80          1HE       MET  80   3.917   1.503  -7.657
  594   2HE   MET  80          2HE       MET  80   3.446   0.216  -8.764
  595   3HE   MET  80          3HE       MET  80   4.942   0.074  -7.843
  596    H    MET  81           H        MET  81  -0.540   4.297  -7.093
  597    HA   MET  81           HA       MET  81   1.541   6.159  -7.727
  598   1HB   MET  81          2HB       MET  81  -0.457   5.443  -9.187
  599   2HB   MET  81          1HB       MET  81  -1.393   6.606  -8.250
  600   1HG   MET  81          2HG       MET  81   0.923   8.005  -8.924
  601   2HG   MET  81          1HG       MET  81   0.551   7.080 -10.377
  602   1HE   MET  81          1HE       MET  81  -2.201   6.505 -10.267
  603   2HE   MET  81          2HE       MET  81  -1.960   7.404 -11.763
  604   3HE   MET  81          3HE       MET  81  -3.290   7.833 -10.690
  605    H    VAL  82           H        VAL  82  -1.419   6.357  -5.732
  606    HA   VAL  82           HA       VAL  82  -0.949   9.116  -5.048
  607    HB   VAL  82           HB       VAL  82  -2.822   8.861  -3.473
  608   1HG1  VAL  82          1HG1      VAL  82  -4.536   8.398  -5.150
  609   2HG1  VAL  82          2HG1      VAL  82  -3.356   7.565  -6.161
  610   3HG1  VAL  82          3HG1      VAL  82  -3.215   9.302  -5.889
  611   1HG2  VAL  82          1HG2      VAL  82  -2.927   5.980  -4.406
  612   2HG2  VAL  82          2HG2      VAL  82  -3.966   6.751  -3.208
  613   3HG2  VAL  82          3HG2      VAL  82  -2.261   6.479  -2.852
  614    H    ARG  83           H        ARG  83  -0.244   6.008  -3.510
  615    HA   ARG  83           HA       ARG  83   0.485   7.166  -0.988
  616   1HB   ARG  83          2HB       ARG  83   1.505   4.963  -0.482
  617   2HB   ARG  83          1HB       ARG  83  -0.160   4.829  -1.039
  618   1HG   ARG  83          2HG       ARG  83   0.484   3.500  -2.729
  619   2HG   ARG  83          1HG       ARG  83   1.581   4.745  -3.316
  620   1HD   ARG  83          2HD       ARG  83   2.636   3.453  -0.935
  621   2HD   ARG  83          1HD       ARG  83   2.296   2.276  -2.198
  622    HE   ARG  83           HE       ARG  83   3.657   4.360  -3.437
  623   1HH1  ARG  83          2HH1      ARG  83   4.232   2.071  -0.865
  624   2HH1  ARG  83          1HH1      ARG  83   5.943   2.024  -1.118
  625   1HH2  ARG  83          1HH2      ARG  83   5.903   4.286  -3.748
  626   2HH2  ARG  83          2HH2      ARG  83   6.887   3.274  -2.745
  627    H    CYS  84           H        CYS  84   2.250   6.374  -3.954
  628    HA   CYS  84           HA       CYS  84   4.854   6.796  -2.852
  629   1HB   CYS  84          2HB       CYS  84   5.689   6.628  -5.039
  630   2HB   CYS  84          1HB       CYS  84   4.245   5.621  -5.081
  631    HG   CYS  84           HG       CYS  84   2.985   7.677  -6.217
  632    H    MET  85           H        MET  85   2.351   8.893  -4.109
  633    HA   MET  85           HA       MET  85   4.087  11.222  -4.279
  634   1HB   MET  85          2HB       MET  85   1.956  10.721  -5.704
  635   2HB   MET  85          1HB       MET  85   1.081  11.336  -4.302
  636   1HG   MET  85          2HG       MET  85   1.714  13.479  -4.703
  637   2HG   MET  85          1HG       MET  85   3.367  13.009  -5.096
  638   1HE   MET  85          1HE       MET  85  -0.076  11.737  -6.773
  639   2HE   MET  85          2HE       MET  85  -0.298  13.128  -7.831
  640   3HE   MET  85          3HE       MET  85  -0.210  13.361  -6.087
  641    H    LYS  86           H        LYS  86   1.297  10.179  -2.300
  642    HA   LYS  86           HA       LYS  86   2.332  11.866  -0.095
  643   1HB   LYS  86          2HB       LYS  86   0.212  12.748  -1.251
  644   2HB   LYS  86          1HB       LYS  86  -0.603  11.362  -0.529
  645   1HG   LYS  86          2HG       LYS  86   1.083  12.787   1.391
  646   2HG   LYS  86          1HG       LYS  86  -0.177  13.815   0.709
  647   1HD   LYS  86          2HD       LYS  86  -1.907  12.303   1.395
  648   2HD   LYS  86          1HD       LYS  86  -0.736  11.051   1.812
  649   1HE   LYS  86          2HE       LYS  86   0.032  12.245   3.711
  650   2HE   LYS  86          1HE       LYS  86  -0.708  13.750   3.167
  651   1HZ   LYS  86          1HZ       LYS  86  -2.878  12.813   3.528
  652   2HZ   LYS  86          2HZ       LYS  86  -1.965  12.661   4.953
  653   3HZ   LYS  86          3HZ       LYS  86  -2.212  11.311   3.950
  654    H    ASP  87           H        ASP  87   2.853  10.692   1.586
  655    HA   ASP  87           HA       ASP  87   1.217   8.721   2.791
  656   1HB   ASP  87          2HB       ASP  87   1.910   7.351   0.848
  657   2HB   ASP  87          1HB       ASP  87   3.600   7.628   1.261
  658    H    ASP  88           H        ASP  88   4.529   9.823   2.210
  659    HA   ASP  88           HA       ASP  88   5.212   9.354   5.039
  660   1HB   ASP  88          2HB       ASP  88   6.678   8.853   2.790
  661   2HB   ASP  88          1HB       ASP  88   7.284  10.447   3.242
  662    H    SER  89           HN       SER  89   5.490  11.907   2.553
  663    HA   SER  89           HA       SER  89   5.387  13.917   4.727
  664   1HB   SER  89          2HB       SER  89   7.521  13.682   3.217
  665   2HB   SER  89          1HB       SER  89   6.540  14.534   2.027
  666    HG   SER  89           HG       SER  89   7.672  15.419   4.374
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1  -7.520   6.187  11.918
    2   2H    MET   1          2H        MET   1  -6.566   7.487  11.381
    3   3H    MET   1          3H        MET   1  -6.427   5.963  10.642
    4    HA   MET   1           HA       MET   1  -8.705   6.127   9.831
    5   1HB   MET   1          2HB       MET   1  -8.973   8.009  11.828
    6   2HB   MET   1          1HB       MET   1  -8.878   9.018  10.386
    7   1HG   MET   1          2HG       MET   1 -10.855   8.227   9.533
    8   2HG   MET   1          1HG       MET   1 -10.622   6.615  10.208
    9   1HE   MET   1          1HE       MET   1 -13.277   6.908  10.538
   10   2HE   MET   1          2HE       MET   1 -13.658   6.916  12.258
   11   3HE   MET   1          3HE       MET   1 -12.404   5.839  11.646
   12    H    ASN   2           H        ASN   2  -7.224   5.776   8.099
   13    HA   ASN   2           HA       ASN   2  -6.096   8.186   6.827
   14   1HB   ASN   2          2HB       ASN   2  -5.445   5.277   6.744
   15   2HB   ASN   2          1HB       ASN   2  -5.139   6.223   5.288
   16   1HD2  ASN   2          1HD2      ASN   2  -4.806   7.088   8.790
   17   2HD2  ASN   2          2HD2      ASN   2  -3.179   7.551   8.658
   18    H    ASP   3           H        ASP   3  -8.062   9.003   6.044
   19    HA   ASP   3           HA       ASP   3  -9.506   7.398   4.046
   20   1HB   ASP   3          2HB       ASP   3 -10.203  10.148   5.099
   21   2HB   ASP   3          1HB       ASP   3 -11.238   9.076   4.155
   22    H    ILE   4           H        ILE   4  -7.340  10.108   4.318
   23    HA   ILE   4           HA       ILE   4  -7.783  11.513   1.977
   24    HB   ILE   4           HB       ILE   4  -5.494  12.262   2.061
   25   1HG1  ILE   4          2HG1      ILE   4  -4.499   9.954   2.402
   26   2HG1  ILE   4          1HG1      ILE   4  -3.774  11.221   3.380
   27   1HG2  ILE   4          1HG2      ILE   4  -6.233  13.485   3.789
   28   2HG2  ILE   4          2HG2      ILE   4  -5.496  12.290   4.855
   29   3HG2  ILE   4          3HG2      ILE   4  -7.196  12.145   4.413
   30   1HD1  ILE   4          1HD1      ILE   4  -5.658   9.034   4.247
   31   2HD1  ILE   4          2HD1      ILE   4  -5.464  10.498   5.211
   32   3HD1  ILE   4          3HD1      ILE   4  -4.078   9.452   4.906
   33    H    TYR   5           H        TYR   5  -6.216   8.390   2.363
   34    HA   TYR   5           HA       TYR   5  -5.002   8.241  -0.200
   35   1HB   TYR   5          2HB       TYR   5  -5.878   6.130   1.771
   36   2HB   TYR   5          1HB       TYR   5  -5.153   5.715   0.219
   37    HD1  TYR   5           HD1      TYR   5  -4.600   7.518   3.412
   38    HD2  TYR   5           HD2      TYR   5  -2.804   6.014  -0.188
   39    HE1  TYR   5           HE1      TYR   5  -2.354   7.968   4.347
   40    HE2  TYR   5           HE2      TYR   5  -0.552   6.460   0.749
   41    HH   TYR   5           HH       TYR   5   0.231   6.712   3.611
   42    H    LYS   6           H        LYS   6  -8.080   6.852   1.004
   43    HA   LYS   6           HA       LYS   6  -8.909   5.926  -1.563
   44   1HB   LYS   6          2HB       LYS   6 -11.016   5.420  -0.537
   45   2HB   LYS   6          1HB       LYS   6  -9.747   5.038   0.623
   46   1HG   LYS   6          2HG       LYS   6 -10.193   6.969   1.922
   47   2HG   LYS   6          1HG       LYS   6 -11.139   7.718   0.638
   48   1HD   LYS   6          2HD       LYS   6 -13.018   6.750   1.400
   49   2HD   LYS   6          1HD       LYS   6 -12.278   5.153   1.280
   50   1HE   LYS   6          2HE       LYS   6 -11.425   6.867   3.564
   51   2HE   LYS   6          1HE       LYS   6 -13.054   6.196   3.634
   52   1HZ   LYS   6          1HZ       LYS   6 -11.448   4.710   4.650
   53   2HZ   LYS   6          2HZ       LYS   6 -10.557   4.643   3.206
   54   3HZ   LYS   6          3HZ       LYS   6 -12.127   3.995   3.271
   55    H    ALA   7           H        ALA   7  -9.229   8.982   0.112
   56    HA   ALA   7           HA       ALA   7 -11.365  10.052  -1.438
   57   1HB   ALA   7          1HB       ALA   7 -10.463  10.930   0.794
   58   2HB   ALA   7          2HB       ALA   7 -10.858  12.136  -0.432
   59   3HB   ALA   7          3HB       ALA   7  -9.177  11.682  -0.150
   60    H    ALA   8           H        ALA   8  -7.924   9.722  -1.975
   61    HA   ALA   8           HA       ALA   8  -7.808  11.670  -4.114
   62   1HB   ALA   8          1HB       ALA   8  -5.524  10.854  -4.453
   63   2HB   ALA   8          2HB       ALA   8  -5.826   9.511  -3.351
   64   3HB   ALA   8          3HB       ALA   8  -5.816  11.166  -2.742
   65    H    VAL   9           H        VAL   9  -7.848   8.115  -3.882
   66    HA   VAL   9           HA       VAL   9  -7.724   7.663  -6.695
   67    HB   VAL   9           HB       VAL   9  -7.171   5.959  -4.922
   68   1HG1  VAL   9          1HG1      VAL   9 -10.195   5.782  -4.733
   69   2HG1  VAL   9          2HG1      VAL   9  -9.104   6.313  -3.454
   70   3HG1  VAL   9          3HG1      VAL   9  -9.063   4.640  -4.008
   71   1HG2  VAL   9          1HG2      VAL   9  -7.672   5.463  -7.374
   72   2HG2  VAL   9          2HG2      VAL   9  -9.292   4.997  -6.856
   73   3HG2  VAL   9          3HG2      VAL   9  -7.889   4.110  -6.264
   74    H    GLU  10           H        GLU  10 -10.279   8.605  -4.560
   75    HA   GLU  10           HA       GLU  10 -12.434   7.724  -6.284
   76   1HB   GLU  10          2HB       GLU  10 -12.243   9.235  -3.707
   77   2HB   GLU  10          1HB       GLU  10 -13.722   9.358  -4.660
   78   1HG   GLU  10          2HG       GLU  10 -12.484   6.682  -3.992
   79   2HG   GLU  10          1HG       GLU  10 -13.620   7.477  -2.902
   80    H    GLN  11           H        GLN  11 -10.389  10.530  -6.025
   81    HA   GLN  11           HA       GLN  11 -12.122  11.913  -7.987
   82   1HB   GLN  11          2HB       GLN  11 -11.515  14.056  -7.028
   83   2HB   GLN  11          1HB       GLN  11 -12.195  13.027  -5.768
   84   1HG   GLN  11          2HG       GLN  11  -9.701  12.351  -5.333
   85   2HG   GLN  11          1HG       GLN  11  -9.329  13.838  -6.199
   86   1HE2  GLN  11          1HE2      GLN  11  -8.437  14.403  -3.913
   87   2HE2  GLN  11          2HE2      GLN  11  -9.530  15.104  -2.820
   88    H    LEU  12           H        LEU  12  -9.726  10.130  -8.361
   89    HA   LEU  12           HA       LEU  12  -7.554  11.832  -9.196
   90   1HB   LEU  12          2HB       LEU  12  -6.931   9.643 -10.512
   91   2HB   LEU  12          1HB       LEU  12  -6.709   9.753  -8.782
   92    HG   LEU  12           HG       LEU  12  -8.688   8.426  -8.391
   93   1HD1  LEU  12          1HD1      LEU  12  -9.797   7.425 -10.535
   94   2HD1  LEU  12          2HD1      LEU  12  -9.109   8.834 -11.343
   95   3HD1  LEU  12          3HD1      LEU  12 -10.256   9.048 -10.021
   96   1HD2  LEU  12          1HD2      LEU  12  -6.983   7.260 -10.611
   97   2HD2  LEU  12          2HD2      LEU  12  -8.010   6.325  -9.525
   98   3HD2  LEU  12          3HD2      LEU  12  -6.620   7.200  -8.886
   99    H    THR  13           H        THR  13  -6.742  11.481 -11.606
  100    HA   THR  13           HA       THR  13  -8.932  12.452 -13.290
  101    HB   THR  13           HB       THR  13  -6.788  12.527 -14.935
  102    HG1  THR  13           HG1      THR  13  -5.121  12.042 -13.779
  103   1HG2  THR  13          1HG2      THR  13  -7.954  14.411 -12.952
  104   2HG2  THR  13          2HG2      THR  13  -7.838  14.543 -14.707
  105   3HG2  THR  13          3HG2      THR  13  -6.428  14.877 -13.703
  106    H    ASP  14           H        ASP  14  -9.056  11.705 -15.532
  107    HA   ASP  14           HA       ASP  14  -9.356   8.860 -15.668
  108   1HB   ASP  14          2HB       ASP  14  -9.627  11.099 -17.664
  109   2HB   ASP  14          1HB       ASP  14  -9.735   9.413 -18.169
  110    H    GLU  15           H        GLU  15  -6.926  11.184 -16.671
  111    HA   GLU  15           HA       GLU  15  -5.444   9.452 -18.399
  112   1HB   GLU  15          2HB       GLU  15  -4.683  11.969 -16.903
  113   2HB   GLU  15          1HB       GLU  15  -3.585  11.122 -17.993
  114   1HG   GLU  15          2HG       GLU  15  -4.648  11.888 -19.842
  115   2HG   GLU  15          1HG       GLU  15  -6.244  11.592 -19.154
  116    H    GLN  16           H        GLN  16  -5.314  10.221 -14.949
  117    HA   GLN  16           HA       GLN  16  -2.909   8.934 -14.270
  118   1HB   GLN  16          2HB       GLN  16  -4.509  10.424 -12.827
  119   2HB   GLN  16          1HB       GLN  16  -5.286   8.894 -12.431
  120   1HG   GLN  16          2HG       GLN  16  -2.467   8.505 -12.210
  121   2HG   GLN  16          1HG       GLN  16  -2.871   9.993 -11.353
  122   1HE2  GLN  16          1HE2      GLN  16  -4.392   6.724 -11.728
  123   2HE2  GLN  16          2HE2      GLN  16  -4.726   6.543 -10.075
  124    H    LYS  17           H        LYS  17  -6.239   7.731 -14.449
  125    HA   LYS  17           HA       LYS  17  -5.652   5.079 -13.572
  126   1HB   LYS  17          2HB       LYS  17  -7.973   6.064 -15.256
  127   2HB   LYS  17          1HB       LYS  17  -7.884   4.513 -14.422
  128   1HG   LYS  17          2HG       LYS  17  -8.089   5.484 -12.309
  129   2HG   LYS  17          1HG       LYS  17  -7.485   7.047 -12.858
  130   1HD   LYS  17          2HD       LYS  17  -9.725   7.563 -12.754
  131   2HD   LYS  17          1HD       LYS  17  -9.680   6.912 -14.392
  132   1HE   LYS  17          2HE       LYS  17 -10.127   4.616 -13.237
  133   2HE   LYS  17          1HE       LYS  17 -10.652   5.592 -11.866
  134   1HZ   LYS  17          1HZ       LYS  17 -11.705   5.806 -14.636
  135   2HZ   LYS  17          2HZ       LYS  17 -12.226   6.718 -13.300
  136   3HZ   LYS  17          3HZ       LYS  17 -12.492   5.041 -13.343
  137    H    ASN  18           H        ASN  18  -5.796   6.668 -16.732
  138    HA   ASN  18           HA       ASN  18  -5.630   4.324 -18.327
  139   1HB   ASN  18          2HB       ASN  18  -4.959   7.216 -18.849
  140   2HB   ASN  18          1HB       ASN  18  -4.690   5.971 -20.067
  141   1HD2  ASN  18          1HD2      ASN  18  -6.766   8.264 -19.849
  142   2HD2  ASN  18          2HD2      ASN  18  -8.249   7.484 -20.121
  143    H    GLU  19           H        GLU  19  -3.168   6.285 -16.732
  144    HA   GLU  19           HA       GLU  19  -0.882   5.413 -18.122
  145   1HB   GLU  19          2HB       GLU  19  -0.900   5.881 -15.137
  146   2HB   GLU  19          1HB       GLU  19   0.422   6.141 -16.273
  147   1HG   GLU  19          2HG       GLU  19  -1.491   7.759 -17.344
  148   2HG   GLU  19          1HG       GLU  19  -1.883   7.868 -15.626
  149    H    PHE  20           H        PHE  20  -2.439   4.077 -15.224
  150    HA   PHE  20           HA       PHE  20  -0.665   1.775 -15.191
  151   1HB   PHE  20          2HB       PHE  20  -2.920   2.734 -13.451
  152   2HB   PHE  20          1HB       PHE  20  -2.273   1.104 -13.279
  153    HD1  PHE  20           HD1      PHE  20  -1.531   4.710 -12.947
  154    HD2  PHE  20           HD2      PHE  20   0.003   0.722 -12.492
  155    HE1  PHE  20           HE1      PHE  20   0.369   5.585 -11.632
  156    HE2  PHE  20           HE2      PHE  20   1.894   1.595 -11.162
  157    HZ   PHE  20           HZ       PHE  20   2.084   4.032 -10.735
  158    H    LYS  21           H        LYS  21  -4.094   2.432 -15.897
  159    HA   LYS  21           HA       LYS  21  -5.002  -0.195 -16.174
  160   1HB   LYS  21          2HB       LYS  21  -6.471   1.800 -16.184
  161   2HB   LYS  21          1HB       LYS  21  -5.896   2.194 -17.803
  162   1HG   LYS  21          2HG       LYS  21  -6.834  -0.587 -17.493
  163   2HG   LYS  21          1HG       LYS  21  -8.090   0.630 -17.264
  164   1HD   LYS  21          2HD       LYS  21  -7.053   1.684 -19.449
  165   2HD   LYS  21          1HD       LYS  21  -6.442   0.049 -19.703
  166   1HE   LYS  21          2HE       LYS  21  -8.471  -0.310 -20.672
  167   2HE   LYS  21          1HE       LYS  21  -9.034  -0.471 -19.009
  168   1HZ   LYS  21          1HZ       LYS  21  -9.045   2.019 -20.629
  169   2HZ   LYS  21          2HZ       LYS  21  -9.532   1.909 -19.005
  170   3HZ   LYS  21          3HZ       LYS  21 -10.402   1.090 -20.214
  171    H    ALA  22           H        ALA  22  -3.209   1.818 -18.468
  172    HA   ALA  22           HA       ALA  22  -3.560   0.228 -20.776
  173   1HB   ALA  22          1HB       ALA  22  -2.584   2.460 -20.922
  174   2HB   ALA  22          2HB       ALA  22  -1.450   1.276 -21.570
  175   3HB   ALA  22          3HB       ALA  22  -1.201   1.941 -19.956
  176    H    ALA  23           H        ALA  23  -0.896   0.270 -18.406
  177    HA   ALA  23           HA       ALA  23   0.434  -2.027 -19.448
  178   1HB   ALA  23          1HB       ALA  23   1.564  -0.332 -18.027
  179   2HB   ALA  23          2HB       ALA  23   1.743  -1.964 -17.385
  180   3HB   ALA  23          3HB       ALA  23   0.583  -0.853 -16.657
  181    H    PHE  24           H        PHE  24  -2.039  -1.493 -17.014
  182    HA   PHE  24           HA       PHE  24  -2.019  -4.048 -15.800
  183   1HB   PHE  24          2HB       PHE  24  -3.206  -1.887 -15.033
  184   2HB   PHE  24          1HB       PHE  24  -4.495  -2.357 -16.137
  185    HD1  PHE  24           HD1      PHE  24  -5.601  -4.625 -15.842
  186    HD2  PHE  24           HD2      PHE  24  -2.953  -2.930 -12.919
  187    HE1  PHE  24           HE1      PHE  24  -6.482  -6.190 -14.134
  188    HE2  PHE  24           HE2      PHE  24  -3.835  -4.490 -11.214
  189    HZ   PHE  24           HZ       PHE  24  -5.603  -6.117 -11.819
  190    H    ASP  25           H        ASP  25  -3.896  -2.729 -18.528
  191    HA   ASP  25           HA       ASP  25  -5.488  -5.041 -18.954
  192   1HB   ASP  25          2HB       ASP  25  -4.911  -2.544 -20.444
  193   2HB   ASP  25          1HB       ASP  25  -5.504  -3.906 -21.395
  194    H    ILE  26           H        ILE  26  -2.321  -4.101 -20.235
  195    HA   ILE  26           HA       ILE  26  -2.267  -6.201 -22.204
  196    HB   ILE  26           HB       ILE  26   0.146  -5.620 -22.441
  197   1HG1  ILE  26          2HG1      ILE  26  -0.473  -3.525 -20.333
  198   2HG1  ILE  26          1HG1      ILE  26   0.482  -4.976 -20.035
  199   1HG2  ILE  26          1HG2      ILE  26  -1.645  -3.178 -22.368
  200   2HG2  ILE  26          2HG2      ILE  26  -1.748  -4.420 -23.615
  201   3HG2  ILE  26          3HG2      ILE  26  -0.274  -3.469 -23.439
  202   1HD1  ILE  26          1HD1      ILE  26   2.139  -4.279 -21.670
  203   2HD1  ILE  26          2HD1      ILE  26   1.883  -2.965 -20.520
  204   3HD1  ILE  26          3HD1      ILE  26   1.154  -2.887 -22.125
  205    H    PHE  27           H        PHE  27  -1.036  -5.852 -18.896
  206    HA   PHE  27           HA       PHE  27   0.418  -8.340 -18.968
  207   1HB   PHE  27          2HB       PHE  27  -0.402  -6.604 -16.628
  208   2HB   PHE  27          1HB       PHE  27   0.648  -8.017 -16.510
  209    HD1  PHE  27           HD1      PHE  27   2.181  -7.726 -19.087
  210    HD2  PHE  27           HD2      PHE  27   1.098  -4.824 -16.106
  211    HE1  PHE  27           HE1      PHE  27   4.111  -6.323 -19.751
  212    HE2  PHE  27           HE2      PHE  27   3.029  -3.422 -16.781
  213    HZ   PHE  27           HZ       PHE  27   4.533  -4.172 -18.599
  214    H    ILE  28           H        ILE  28  -2.818  -7.352 -17.905
  215    HA   ILE  28           HA       ILE  28  -3.347 -10.095 -16.971
  216    HB   ILE  28           HB       ILE  28  -5.350  -9.278 -15.963
  217   1HG1  ILE  28          2HG1      ILE  28  -5.599  -6.583 -16.385
  218   2HG1  ILE  28          1HG1      ILE  28  -5.041  -7.127 -17.968
  219   1HG2  ILE  28          1HG2      ILE  28  -3.259  -8.693 -14.781
  220   2HG2  ILE  28          2HG2      ILE  28  -4.518  -7.488 -14.509
  221   3HG2  ILE  28          3HG2      ILE  28  -3.209  -7.156 -15.644
  222   1HD1  ILE  28          1HD1      ILE  28  -6.907  -8.458 -18.323
  223   2HD1  ILE  28          2HD1      ILE  28  -7.623  -7.152 -17.378
  224   3HD1  ILE  28          3HD1      ILE  28  -7.207  -8.679 -16.599
  225    H    GLN  29           H        GLN  29  -3.308  -8.703 -19.894
  226    HA   GLN  29           HA       GLN  29  -5.715  -8.913 -21.173
  227   1HB   GLN  29          2HB       GLN  29  -3.622  -8.256 -22.294
  228   2HB   GLN  29          1HB       GLN  29  -3.057  -9.924 -22.216
  229   1HG   GLN  29          2HG       GLN  29  -4.851 -10.672 -23.650
  230   2HG   GLN  29          1HG       GLN  29  -5.618  -9.085 -23.601
  231   1HE2  GLN  29          1HE2      GLN  29  -4.157  -7.225 -24.476
  232   2HE2  GLN  29          2HE2      GLN  29  -3.173  -7.594 -25.808
  233    H    ASP  30           H        ASP  30  -3.503 -11.586 -20.416
  234    HA   ASP  30           HA       ASP  30  -5.644 -13.503 -21.129
  235   1HB   ASP  30          2HB       ASP  30  -3.110 -13.444 -22.127
  236   2HB   ASP  30          1HB       ASP  30  -2.895 -14.529 -20.755
  237    H    ALA  31           H        ALA  31  -5.642 -12.143 -18.633
  238    HA   ALA  31           HA       ALA  31  -4.705 -14.147 -16.691
  239   1HB   ALA  31          1HB       ALA  31  -5.851 -11.383 -16.218
  240   2HB   ALA  31          2HB       ALA  31  -4.133 -11.781 -16.251
  241   3HB   ALA  31          3HB       ALA  31  -5.167 -12.450 -14.991
  242    H    GLU  32           H        GLU  32  -6.118 -14.872 -15.016
  243    HA   GLU  32           HA       GLU  32  -8.986 -14.854 -15.766
  244   1HB   GLU  32          2HB       GLU  32  -9.091 -17.155 -14.753
  245   2HB   GLU  32          1HB       GLU  32  -8.125 -17.060 -16.224
  246   1HG   GLU  32          2HG       GLU  32  -6.107 -17.296 -15.080
  247   2HG   GLU  32          1HG       GLU  32  -6.775 -16.683 -13.569
  248    H    ASP  33           H        ASP  33  -7.753 -12.971 -14.006
  249    HA   ASP  33           HA       ASP  33  -9.317 -13.496 -11.593
  250   1HB   ASP  33          2HB       ASP  33  -6.334 -13.071 -11.586
  251   2HB   ASP  33          1HB       ASP  33  -7.331 -12.697 -10.182
  252    H    GLY  34           H        GLY  34  -7.086 -11.231 -13.206
  253   1HA   GLY  34          2HA       GLY  34  -7.827  -9.028 -13.873
  254   2HA   GLY  34          1HA       GLY  34  -8.921  -9.022 -12.492
  255    H    CYS  35           H        CYS  35  -5.487  -9.892 -12.729
  256    HA   CYS  35           HA       CYS  35  -4.611  -7.520 -11.309
  257   1HB   CYS  35          2HB       CYS  35  -3.594  -8.840  -9.434
  258   2HB   CYS  35          1HB       CYS  35  -5.355  -8.787  -9.396
  259    HG   CYS  35           HG       CYS  35  -5.424 -11.225 -10.302
  260    H    ILE  36           H        ILE  36  -2.353  -7.251 -11.349
  261    HA   ILE  36           HA       ILE  36  -1.011  -8.890 -13.376
  262    HB   ILE  36           HB       ILE  36   0.641  -7.177 -13.520
  263   1HG1  ILE  36          2HG1      ILE  36   0.025  -5.175 -11.700
  264   2HG1  ILE  36          1HG1      ILE  36  -0.184  -6.646 -10.750
  265   1HG2  ILE  36          1HG2      ILE  36  -1.583  -6.614 -14.490
  266   2HG2  ILE  36          2HG2      ILE  36  -0.684  -5.185 -13.983
  267   3HG2  ILE  36          3HG2      ILE  36  -2.004  -5.795 -12.986
  268   1HD1  ILE  36          1HD1      ILE  36   2.246  -5.392 -11.339
  269   2HD1  ILE  36          2HD1      ILE  36   2.204  -6.785 -12.417
  270   3HD1  ILE  36          3HD1      ILE  36   2.044  -7.014 -10.674
  271    H    SER  37           H        SER  37   1.435  -9.254 -12.896
  272    HA   SER  37           HA       SER  37   1.549 -10.743 -10.376
  273   1HB   SER  37          2HB       SER  37   2.422 -11.385 -12.883
  274   2HB   SER  37          1HB       SER  37   3.904 -10.776 -12.155
  275    HG   SER  37           HG       SER  37   2.353 -12.998 -11.508
  276    H    THR  38           H        THR  38   2.291  -9.737  -8.626
  277    HA   THR  38           HA       THR  38   3.619  -7.275  -8.531
  278    HB   THR  38           HB       THR  38   4.246  -7.864  -6.210
  279    HG1  THR  38           HG1      THR  38   4.570  -9.886  -5.834
  280   1HG2  THR  38          1HG2      THR  38   1.490  -8.410  -7.248
  281   2HG2  THR  38          2HG2      THR  38   2.066  -7.061  -6.271
  282   3HG2  THR  38          3HG2      THR  38   1.830  -8.644  -5.534
  283    H    LYS  39           H        LYS  39   4.889 -10.565  -8.680
  284    HA   LYS  39           HA       LYS  39   7.627  -9.947  -8.284
  285   1HB   LYS  39          2HB       LYS  39   8.069 -12.141  -9.375
  286   2HB   LYS  39          1HB       LYS  39   6.856 -12.247  -8.102
  287   1HG   LYS  39          2HG       LYS  39   5.329 -11.684 -10.342
  288   2HG   LYS  39          1HG       LYS  39   6.586 -12.740 -10.985
  289   1HD   LYS  39          2HD       LYS  39   4.923 -14.247 -10.265
  290   2HD   LYS  39          1HD       LYS  39   6.077 -14.245  -8.932
  291   1HE   LYS  39          2HE       LYS  39   4.691 -12.947  -7.559
  292   2HE   LYS  39          1HE       LYS  39   3.778 -12.304  -8.924
  293   1HZ   LYS  39          1HZ       LYS  39   2.839 -14.508  -9.280
  294   2HZ   LYS  39          2HZ       LYS  39   2.490 -13.941  -7.718
  295   3HZ   LYS  39          3HZ       LYS  39   3.701 -15.109  -7.948
  296    H    GLU  40           H        GLU  40   5.525  -9.772 -11.088
  297    HA   GLU  40           HA       GLU  40   7.793  -9.176 -12.860
  298   1HB   GLU  40          2HB       GLU  40   4.862  -9.672 -13.436
  299   2HB   GLU  40          1HB       GLU  40   6.049  -9.232 -14.663
  300   1HG   GLU  40          2HG       GLU  40   7.359 -11.233 -14.172
  301   2HG   GLU  40          1HG       GLU  40   6.265 -11.657 -12.855
  302    H    LEU  41           H        LEU  41   6.611  -7.333 -10.697
  303    HA   LEU  41           HA       LEU  41   5.202  -5.198 -11.816
  304   1HB   LEU  41          2HB       LEU  41   6.427  -5.724  -9.367
  305   2HB   LEU  41          1HB       LEU  41   7.239  -4.296  -9.956
  306    HG   LEU  41           HG       LEU  41   5.390  -3.657  -8.530
  307   1HD1  LEU  41          1HD1      LEU  41   5.801  -2.156 -10.382
  308   2HD1  LEU  41          2HD1      LEU  41   4.053  -2.296 -10.173
  309   3HD1  LEU  41          3HD1      LEU  41   4.861  -3.175 -11.472
  310   1HD2  LEU  41          1HD2      LEU  41   3.930  -5.629 -10.234
  311   2HD2  LEU  41          2HD2      LEU  41   3.028  -4.221  -9.670
  312   3HD2  LEU  41          3HD2      LEU  41   3.782  -5.312  -8.506
  313    H    GLY  42           H        GLY  42   8.609  -6.038 -12.052
  314   1HA   GLY  42          2HA       GLY  42   9.748  -3.634 -12.853
  315   2HA   GLY  42          1HA       GLY  42  10.294  -5.217 -13.386
  316    H    LYS  43           H        LYS  43   7.866  -5.961 -14.741
  317    HA   LYS  43           HA       LYS  43   8.362  -4.826 -17.297
  318   1HB   LYS  43          2HB       LYS  43   6.044  -6.499 -16.299
  319   2HB   LYS  43          1HB       LYS  43   6.310  -6.077 -17.990
  320   1HG   LYS  43          2HG       LYS  43   8.447  -7.433 -16.339
  321   2HG   LYS  43          1HG       LYS  43   7.218  -8.355 -17.204
  322   1HD   LYS  43          2HD       LYS  43   8.147  -7.929 -19.236
  323   2HD   LYS  43          1HD       LYS  43   8.520  -6.256 -18.819
  324   1HE   LYS  43          2HE       LYS  43  10.359  -7.242 -17.295
  325   2HE   LYS  43          1HE       LYS  43  10.117  -8.739 -18.194
  326   1HZ   LYS  43          1HZ       LYS  43  10.805  -6.100 -19.373
  327   2HZ   LYS  43          2HZ       LYS  43  10.560  -7.538 -20.244
  328   3HZ   LYS  43          3HZ       LYS  43  11.871  -7.403 -19.172
  329    H    VAL  44           H        VAL  44   6.128  -3.987 -14.723
  330    HA   VAL  44           HA       VAL  44   4.638  -2.203 -16.504
  331    HB   VAL  44           HB       VAL  44   2.890  -2.370 -15.100
  332   1HG1  VAL  44          1HG1      VAL  44   3.980  -4.726 -15.115
  333   2HG1  VAL  44          2HG1      VAL  44   2.722  -4.395 -13.926
  334   3HG1  VAL  44          3HG1      VAL  44   4.418  -4.368 -13.446
  335   1HG2  VAL  44          1HG2      VAL  44   4.897  -1.861 -12.905
  336   2HG2  VAL  44          2HG2      VAL  44   3.236  -2.309 -12.532
  337   3HG2  VAL  44          3HG2      VAL  44   3.566  -0.835 -13.442
  338    H    MET  45           H        MET  45   6.799  -2.009 -13.684
  339    HA   MET  45           HA       MET  45   6.573   0.833 -13.443
  340   1HB   MET  45          2HB       MET  45   8.442   0.700 -11.887
  341   2HB   MET  45          1HB       MET  45   7.278  -0.576 -11.542
  342   1HG   MET  45          2HG       MET  45   8.779  -2.034 -13.105
  343   2HG   MET  45          1HG       MET  45  10.001  -0.798 -12.805
  344   1HE   MET  45          1HE       MET  45  11.466  -2.188 -12.122
  345   2HE   MET  45          2HE       MET  45  11.102  -3.699 -11.294
  346   3HE   MET  45          3HE       MET  45  11.804  -2.357 -10.394
  347    H    ARG  46           H        ARG  46   8.912  -1.315 -15.055
  348    HA   ARG  46           HA       ARG  46  10.697   0.768 -15.843
  349   1HB   ARG  46          2HB       ARG  46  10.256  -1.955 -17.091
  350   2HB   ARG  46          1HB       ARG  46  11.605  -0.875 -17.444
  351   1HG   ARG  46          2HG       ARG  46  11.220  -1.338 -14.568
  352   2HG   ARG  46          1HG       ARG  46  11.595  -2.807 -15.467
  353   1HD   ARG  46          2HD       ARG  46  13.412  -1.181 -16.583
  354   2HD   ARG  46          1HD       ARG  46  13.254  -0.372 -15.028
  355    HE   ARG  46           HE       ARG  46  14.325  -2.177 -14.028
  356   1HH1  ARG  46          2HH1      ARG  46  13.306  -3.027 -17.262
  357   2HH1  ARG  46          1HH1      ARG  46  14.150  -4.536 -17.265
  358   1HH2  ARG  46          1HH2      ARG  46  15.423  -4.164 -14.058
  359   2HH2  ARG  46          2HH2      ARG  46  15.345  -5.179 -15.458
  360    H    MET  47           H        MET  47   7.756  -0.565 -17.229
  361    HA   MET  47           HA       MET  47   8.053   0.773 -19.776
  362   1HB   MET  47          2HB       MET  47   5.774  -0.693 -18.442
  363   2HB   MET  47          1HB       MET  47   5.564   0.160 -19.971
  364   1HG   MET  47          2HG       MET  47   7.692  -1.946 -19.503
  365   2HG   MET  47          1HG       MET  47   6.123  -2.284 -20.232
  366   1HE   MET  47          1HE       MET  47   9.626  -1.130 -20.576
  367   2HE   MET  47          2HE       MET  47   9.807  -1.243 -22.324
  368   3HE   MET  47          3HE       MET  47   9.223  -2.634 -21.414
  369    H    LEU  48           H        LEU  48   6.558   1.449 -16.665
  370    HA   LEU  48           HA       LEU  48   4.990   3.693 -17.514
  371   1HB   LEU  48          2HB       LEU  48   5.766   2.449 -14.944
  372   2HB   LEU  48          1HB       LEU  48   5.395   4.156 -14.882
  373    HG   LEU  48           HG       LEU  48   3.145   3.810 -15.474
  374   1HD1  LEU  48          1HD1      LEU  48   2.760   1.101 -16.021
  375   2HD1  LEU  48          2HD1      LEU  48   4.235   1.505 -16.899
  376   3HD1  LEU  48          3HD1      LEU  48   2.753   2.409 -17.204
  377   1HD2  LEU  48          1HD2      LEU  48   3.172   3.074 -13.281
  378   2HD2  LEU  48          2HD2      LEU  48   4.284   1.750 -13.629
  379   3HD2  LEU  48          3HD2      LEU  48   2.580   1.610 -14.068
  380    H    GLY  49           H        GLY  49   8.286   3.221 -16.444
  381   1HA   GLY  49          2HA       GLY  49   9.867   4.940 -17.359
  382   2HA   GLY  49          1HA       GLY  49   8.782   6.138 -16.668
  383    H    GLN  50           H        GLN  50   9.557   3.121 -15.021
  384    HA   GLN  50           HA       GLN  50  11.296   4.594 -13.131
  385   1HB   GLN  50          2HB       GLN  50   9.288   2.495 -12.292
  386   2HB   GLN  50          1HB       GLN  50  10.261   3.529 -11.248
  387   1HG   GLN  50          2HG       GLN  50   8.183   4.569 -13.192
  388   2HG   GLN  50          1HG       GLN  50   7.868   4.277 -11.485
  389   1HE2  GLN  50          1HE2      GLN  50   8.214   6.843 -13.313
  390   2HE2  GLN  50          2HE2      GLN  50   9.214   7.830 -12.364
  391    H    ASN  51           H        ASN  51  13.154   3.588 -12.654
  392    HA   ASN  51           HA       ASN  51  13.412   0.718 -13.365
  393   1HB   ASN  51          2HB       ASN  51  15.404   2.956 -13.811
  394   2HB   ASN  51          1HB       ASN  51  15.802   1.244 -13.960
  395   1HD2  ASN  51          1HD2      ASN  51  15.571   0.431 -16.049
  396   2HD2  ASN  51          2HD2      ASN  51  14.543   1.076 -17.235
  397    HA   PRO  52           HA       PRO  52  14.823   1.446  -8.982
  398   1HB   PRO  52          2HB       PRO  52  12.907  -0.048  -7.732
  399   2HB   PRO  52          1HB       PRO  52  12.713   1.668  -8.115
  400   1HG   PRO  52          2HG       PRO  52  11.477  -0.692  -9.386
  401   2HG   PRO  52          1HG       PRO  52  10.897   0.977  -9.307
  402   1HD   PRO  52          2HD       PRO  52  12.165  -0.283 -11.527
  403   2HD   PRO  52          1HD       PRO  52  11.771   1.443 -11.360
  404    H    THR  53           H        THR  53  14.582  -0.680  -7.198
  405    HA   THR  53           HA       THR  53  16.121  -2.823  -8.541
  406    HB   THR  53           HB       THR  53  17.307  -3.149  -6.543
  407    HG1  THR  53           HG1      THR  53  16.439  -2.912  -4.622
  408   1HG2  THR  53          1HG2      THR  53  16.574  -0.215  -6.491
  409   2HG2  THR  53          2HG2      THR  53  17.837  -0.941  -7.486
  410   3HG2  THR  53          3HG2      THR  53  17.990  -0.936  -5.728
  411    HA   PRO  54           HA       PRO  54  13.033  -5.786  -7.414
  412   1HB   PRO  54          2HB       PRO  54  14.387  -7.853  -6.232
  413   2HB   PRO  54          1HB       PRO  54  14.428  -7.507  -7.968
  414   1HG   PRO  54          2HG       PRO  54  16.497  -7.014  -5.900
  415   2HG   PRO  54          1HG       PRO  54  16.684  -7.324  -7.633
  416   1HD   PRO  54          2HD       PRO  54  16.861  -4.813  -6.378
  417   2HD   PRO  54          1HD       PRO  54  16.683  -5.087  -8.126
  418    H    GLU  55           H        GLU  55  15.121  -4.807  -4.777
  419    HA   GLU  55           HA       GLU  55  13.362  -5.772  -2.682
  420   1HB   GLU  55          2HB       GLU  55  15.784  -3.954  -2.617
  421   2HB   GLU  55          1HB       GLU  55  14.896  -4.473  -1.185
  422   1HG   GLU  55          2HG       GLU  55  15.335  -6.846  -1.808
  423   2HG   GLU  55          1HG       GLU  55  16.302  -6.283  -3.171
  424    H    GLU  56           H        GLU  56  14.083  -2.728  -4.343
  425    HA   GLU  56           HA       GLU  56  12.442  -1.096  -2.644
  426   1HB   GLU  56          2HB       GLU  56  13.838  -0.687  -5.267
  427   2HB   GLU  56          1HB       GLU  56  12.642   0.487  -4.718
  428   1HG   GLU  56          2HG       GLU  56  13.869   0.751  -2.591
  429   2HG   GLU  56          1HG       GLU  56  15.068  -0.420  -3.138
  430    H    LEU  57           H        LEU  57  11.971  -2.672  -5.814
  431    HA   LEU  57           HA       LEU  57   9.437  -1.541  -6.356
  432   1HB   LEU  57          2HB       LEU  57   9.249  -3.044  -8.106
  433   2HB   LEU  57          1HB       LEU  57  10.974  -2.826  -7.945
  434    HG   LEU  57           HG       LEU  57  10.837  -5.013  -6.496
  435   1HD1  LEU  57          1HD1      LEU  57   8.131  -4.747  -7.614
  436   2HD1  LEU  57          2HD1      LEU  57   8.706  -5.778  -6.303
  437   3HD1  LEU  57          3HD1      LEU  57   8.884  -6.300  -7.978
  438   1HD2  LEU  57          1HD2      LEU  57  10.387  -5.146  -9.491
  439   2HD2  LEU  57          2HD2      LEU  57  11.274  -6.301  -8.497
  440   3HD2  LEU  57          3HD2      LEU  57  11.919  -4.680  -8.752
  441    H    GLN  58           H        GLN  58  10.402  -4.437  -4.550
  442    HA   GLN  58           HA       GLN  58   7.733  -5.413  -4.185
  443   1HB   GLN  58          2HB       GLN  58  10.409  -6.185  -3.325
  444   2HB   GLN  58          1HB       GLN  58   9.216  -6.388  -2.042
  445   1HG   GLN  58          2HG       GLN  58   8.852  -7.426  -4.869
  446   2HG   GLN  58          1HG       GLN  58   9.452  -8.404  -3.532
  447   1HE2  GLN  58          1HE2      GLN  58   6.606  -7.481  -5.142
  448   2HE2  GLN  58          2HE2      GLN  58   5.492  -7.914  -3.938
  449    H    GLU  59           H        GLU  59   9.716  -3.037  -2.552
  450    HA   GLU  59           HA       GLU  59   8.291  -2.966  -0.082
  451   1HB   GLU  59          2HB       GLU  59  10.214  -1.147  -1.477
  452   2HB   GLU  59          1HB       GLU  59   9.277  -0.510  -0.126
  453   1HG   GLU  59          2HG       GLU  59  10.112  -2.240   1.350
  454   2HG   GLU  59          1HG       GLU  59  10.910  -3.061   0.009
  455    H    MET  60           H        MET  60   8.076  -1.018  -3.066
  456    HA   MET  60           HA       MET  60   5.925   0.615  -2.145
  457   1HB   MET  60          2HB       MET  60   5.675   1.286  -4.513
  458   2HB   MET  60          1HB       MET  60   7.352   1.377  -3.976
  459   1HG   MET  60          2HG       MET  60   7.892  -0.704  -5.071
  460   2HG   MET  60          1HG       MET  60   6.194  -1.015  -5.432
  461   1HE   MET  60          1HE       MET  60   6.145  -1.350  -7.726
  462   2HE   MET  60          2HE       MET  60   7.900  -1.354  -7.878
  463   3HE   MET  60          3HE       MET  60   6.928  -0.408  -9.002
  464    H    ILE  61           H        ILE  61   6.077  -2.548  -3.591
  465    HA   ILE  61           HA       ILE  61   3.271  -2.604  -4.322
  466    HB   ILE  61           HB       ILE  61   5.409  -4.747  -4.260
  467   1HG1  ILE  61          2HG1      ILE  61   5.721  -3.118  -6.032
  468   2HG1  ILE  61          1HG1      ILE  61   5.094  -4.600  -6.748
  469   1HG2  ILE  61          1HG2      ILE  61   3.360  -5.906  -3.873
  470   2HG2  ILE  61          2HG2      ILE  61   3.660  -6.044  -5.605
  471   3HG2  ILE  61          3HG2      ILE  61   2.480  -4.879  -5.005
  472   1HD1  ILE  61          1HD1      ILE  61   3.562  -2.062  -6.129
  473   2HD1  ILE  61          2HD1      ILE  61   2.775  -3.577  -6.571
  474   3HD1  ILE  61          3HD1      ILE  61   3.854  -2.777  -7.713
  475    H    ASP  62           H        ASP  62   5.348  -3.974  -1.791
  476    HA   ASP  62           HA       ASP  62   3.401  -5.508  -0.458
  477   1HB   ASP  62          2HB       ASP  62   5.947  -5.460  -0.085
  478   2HB   ASP  62          1HB       ASP  62   5.638  -4.085   0.977
  479    H    GLU  63           H        GLU  63   4.351  -2.092  -0.036
  480    HA   GLU  63           HA       GLU  63   2.713  -1.581   2.218
  481   1HB   GLU  63          2HB       GLU  63   3.067   0.775   1.744
  482   2HB   GLU  63          1HB       GLU  63   4.573  -0.110   1.518
  483   1HG   GLU  63          2HG       GLU  63   4.180  -0.168  -0.914
  484   2HG   GLU  63          1HG       GLU  63   2.673   0.720  -0.694
  485    H    VAL  64           H        VAL  64   2.073  -1.365  -1.262
  486    HA   VAL  64           HA       VAL  64  -0.563  -0.229  -0.843
  487    HB   VAL  64           HB       VAL  64   0.724   0.376  -2.854
  488   1HG1  VAL  64          1HG1      VAL  64   0.951  -1.305  -4.679
  489   2HG1  VAL  64          2HG1      VAL  64   0.369  -2.550  -3.574
  490   3HG1  VAL  64          3HG1      VAL  64   1.895  -1.727  -3.252
  491   1HG2  VAL  64          1HG2      VAL  64  -1.936  -0.077  -2.687
  492   2HG2  VAL  64          2HG2      VAL  64  -1.533  -1.181  -3.999
  493   3HG2  VAL  64          3HG2      VAL  64  -1.160   0.535  -4.147
  494    H    ASP  65           H        ASP  65   0.807  -3.429  -1.429
  495    HA   ASP  65           HA       ASP  65  -1.748  -4.671  -1.940
  496   1HB   ASP  65          2HB       ASP  65   0.924  -5.425  -2.298
  497   2HB   ASP  65          1HB       ASP  65   0.324  -6.500  -1.040
  498    H    GLU  66           H        GLU  66  -3.151  -4.456  -0.291
  499    HA   GLU  66           HA       GLU  66  -2.450  -4.556   2.475
  500   1HB   GLU  66          2HB       GLU  66  -5.188  -5.068   1.287
  501   2HB   GLU  66          1HB       GLU  66  -4.817  -4.520   2.922
  502   1HG   GLU  66          2HG       GLU  66  -3.848  -2.439   1.998
  503   2HG   GLU  66          1HG       GLU  66  -4.247  -2.985   0.370
  504    H    ASP  67           H        ASP  67  -3.836  -6.911   0.223
  505    HA   ASP  67           HA       ASP  67  -3.989  -8.993   2.232
  506   1HB   ASP  67          2HB       ASP  67  -4.540 -10.452   0.207
  507   2HB   ASP  67          1HB       ASP  67  -5.668  -9.146   0.565
  508    H    GLY  68           H        GLY  68  -1.841  -8.148  -0.457
  509   1HA   GLY  68          2HA       GLY  68   0.338  -8.780  -0.886
  510   2HA   GLY  68          1HA       GLY  68   0.363  -9.572   0.689
  511    H    SER  69           H        SER  69  -1.650 -10.051  -2.205
  512    HA   SER  69           HA       SER  69  -1.356 -12.937  -1.985
  513   1HB   SER  69          2HB       SER  69  -2.959 -12.983  -3.890
  514   2HB   SER  69          1HB       SER  69  -3.553 -12.064  -2.510
  515    HG   SER  69           HG       SER  69  -3.619 -10.380  -3.758
  516    H    GLY  70           H        GLY  70   0.673 -10.705  -3.274
  517   1HA   GLY  70          2HA       GLY  70   2.488 -10.977  -4.684
  518   2HA   GLY  70          1HA       GLY  70   1.933 -12.613  -5.028
  519    H    THR  71           H        THR  71  -0.396 -10.090  -5.368
  520    HA   THR  71           HA       THR  71   0.097  -9.742  -8.230
  521    HB   THR  71           HB       THR  71  -2.103 -10.431  -8.906
  522    HG1  THR  71           HG1      THR  71  -2.584 -10.947  -6.153
  523   1HG2  THR  71          1HG2      THR  71  -2.078 -12.828  -8.309
  524   2HG2  THR  71          2HG2      THR  71  -0.944 -12.488  -7.001
  525   3HG2  THR  71          3HG2      THR  71  -0.455 -12.247  -8.679
  526    H    VAL  72           H        VAL  72  -0.417  -7.730  -8.894
  527    HA   VAL  72           HA       VAL  72  -1.602  -5.928  -6.901
  528    HB   VAL  72           HB       VAL  72  -0.416  -5.120  -9.553
  529   1HG1  VAL  72          1HG1      VAL  72  -0.083  -2.984  -8.384
  530   2HG1  VAL  72          2HG1      VAL  72  -0.745  -3.677  -6.904
  531   3HG1  VAL  72          3HG1      VAL  72  -1.779  -3.459  -8.315
  532   1HG2  VAL  72          1HG2      VAL  72   1.321  -6.380  -8.434
  533   2HG2  VAL  72          2HG2      VAL  72   0.959  -5.602  -6.893
  534   3HG2  VAL  72          3HG2      VAL  72   1.676  -4.668  -8.205
  535    H    ASP  73           H        ASP  73  -3.654  -5.378  -7.009
  536    HA   ASP  73           HA       ASP  73  -5.239  -5.962  -9.392
  537   1HB   ASP  73          2HB       ASP  73  -6.130  -4.641  -6.810
  538   2HB   ASP  73          1HB       ASP  73  -7.162  -5.358  -8.048
  539    H    PHE  74           H        PHE  74  -6.723  -4.199 -10.241
  540    HA   PHE  74           HA       PHE  74  -5.215  -1.978 -11.068
  541   1HB   PHE  74          2HB       PHE  74  -7.311  -2.893 -12.183
  542   2HB   PHE  74          1HB       PHE  74  -8.233  -1.994 -10.977
  543    HD1  PHE  74           HD1      PHE  74  -5.068  -1.191 -12.815
  544    HD2  PHE  74           HD2      PHE  74  -9.149  -0.119 -12.032
  545    HE1  PHE  74           HE1      PHE  74  -4.783   0.870 -14.148
  546    HE2  PHE  74           HE2      PHE  74  -8.864   1.947 -13.366
  547    HZ   PHE  74           HZ       PHE  74  -6.680   2.445 -14.427
  548    H    ASP  75           H        ASP  75  -7.290  -2.444  -8.269
  549    HA   ASP  75           HA       ASP  75  -7.491   0.311  -7.528
  550   1HB   ASP  75          2HB       ASP  75  -8.806  -1.834  -6.664
  551   2HB   ASP  75          1HB       ASP  75  -7.528  -1.836  -5.448
  552    H    GLU  76           H        GLU  76  -5.284  -2.345  -6.678
  553    HA   GLU  76           HA       GLU  76  -3.688  -0.800  -4.854
  554   1HB   GLU  76          2HB       GLU  76  -2.937  -3.337  -6.342
  555   2HB   GLU  76          1HB       GLU  76  -2.129  -2.680  -4.919
  556   1HG   GLU  76          2HG       GLU  76  -4.173  -2.987  -3.588
  557   2HG   GLU  76          1HG       GLU  76  -5.025  -3.587  -5.009
  558    H    PHE  77           H        PHE  77  -3.678  -1.442  -8.293
  559    HA   PHE  77           HA       PHE  77  -1.065  -0.561  -8.939
  560   1HB   PHE  77          2HB       PHE  77  -3.080  -1.749 -10.318
  561   2HB   PHE  77          1HB       PHE  77  -3.256  -0.099 -10.890
  562    HD1  PHE  77           HD1      PHE  77  -2.694  -0.844 -13.143
  563    HD2  PHE  77           HD2      PHE  77   0.116  -1.270  -9.909
  564    HE1  PHE  77           HE1      PHE  77  -0.864  -1.222 -14.767
  565    HE2  PHE  77           HE2      PHE  77   1.931  -1.638 -11.541
  566    HZ   PHE  77           HZ       PHE  77   1.446  -1.619 -13.972
  567    H    LEU  78           H        LEU  78  -4.217   1.101  -8.958
  568    HA   LEU  78           HA       LEU  78  -3.102   3.646  -9.719
  569   1HB   LEU  78          2HB       LEU  78  -5.784   2.602  -9.002
  570   2HB   LEU  78          1HB       LEU  78  -5.511   4.318  -8.761
  571    HG   LEU  78           HG       LEU  78  -5.213   4.709 -11.063
  572   1HD1  LEU  78          1HD1      LEU  78  -4.959   1.708 -11.432
  573   2HD1  LEU  78          2HD1      LEU  78  -3.623   2.857 -11.475
  574   3HD1  LEU  78          3HD1      LEU  78  -4.874   2.916 -12.715
  575   1HD2  LEU  78          1HD2      LEU  78  -7.549   4.189 -10.477
  576   2HD2  LEU  78          2HD2      LEU  78  -7.255   2.480 -10.802
  577   3HD2  LEU  78          3HD2      LEU  78  -7.186   3.652 -12.118
  578    H    VAL  79           H        VAL  79  -3.823   2.028  -6.696
  579    HA   VAL  79           HA       VAL  79  -3.841   4.294  -4.991
  580    HB   VAL  79           HB       VAL  79  -3.549   1.352  -4.654
  581   1HG1  VAL  79          1HG1      VAL  79  -2.692   3.317  -2.510
  582   2HG1  VAL  79          2HG1      VAL  79  -1.635   2.180  -3.352
  583   3HG1  VAL  79          3HG1      VAL  79  -2.907   1.579  -2.286
  584   1HG2  VAL  79          1HG2      VAL  79  -5.671   2.818  -4.495
  585   2HG2  VAL  79          2HG2      VAL  79  -5.034   3.341  -2.936
  586   3HG2  VAL  79          3HG2      VAL  79  -5.403   1.638  -3.212
  587    H    MET  80           H        MET  80  -1.269   2.108  -6.070
  588    HA   MET  80           HA       MET  80   0.908   2.946  -4.628
  589   1HB   MET  80          2HB       MET  80   0.511   1.411  -6.924
  590   2HB   MET  80          1HB       MET  80   1.614   2.687  -7.437
  591   1HG   MET  80          2HG       MET  80   2.828   2.112  -5.153
  592   2HG   MET  80          1HG       MET  80   2.007   0.566  -5.361
  593   1HE   MET  80          1HE       MET  80   1.990  -0.786  -7.361
  594   2HE   MET  80          2HE       MET  80   3.214  -0.849  -8.627
  595   3HE   MET  80          3HE       MET  80   1.947   0.374  -8.695
  596    H    MET  81           H        MET  81  -0.731   4.714  -7.203
  597    HA   MET  81           HA       MET  81   1.311   6.587  -7.796
  598   1HB   MET  81          2HB       MET  81  -1.623   6.437  -8.240
  599   2HB   MET  81          1HB       MET  81  -0.905   8.045  -8.280
  600   1HG   MET  81          2HG       MET  81   0.242   5.723  -9.818
  601   2HG   MET  81          1HG       MET  81  -0.974   6.802 -10.502
  602   1HE   MET  81          1HE       MET  81   2.250   6.267 -11.501
  603   2HE   MET  81          2HE       MET  81   2.430   5.954  -9.776
  604   3HE   MET  81          3HE       MET  81   3.388   7.222 -10.538
  605    H    VAL  82           H        VAL  82  -1.569   6.951  -5.712
  606    HA   VAL  82           HA       VAL  82  -0.739   9.433  -4.591
  607    HB   VAL  82           HB       VAL  82  -2.487   9.010  -2.877
  608   1HG1  VAL  82          1HG1      VAL  82  -4.389   8.799  -4.535
  609   2HG1  VAL  82          2HG1      VAL  82  -3.178   8.473  -5.776
  610   3HG1  VAL  82          3HG1      VAL  82  -3.190  10.026  -4.940
  611   1HG2  VAL  82          1HG2      VAL  82  -2.939   6.398  -4.347
  612   2HG2  VAL  82          2HG2      VAL  82  -3.784   6.975  -2.910
  613   3HG2  VAL  82          3HG2      VAL  82  -2.085   6.510  -2.807
  614    H    ARG  83           H        ARG  83  -0.142   6.080  -3.748
  615    HA   ARG  83           HA       ARG  83   0.769   6.382  -1.102
  616   1HB   ARG  83          2HB       ARG  83   1.545   4.410  -3.262
  617   2HB   ARG  83          1HB       ARG  83   2.126   4.302  -1.601
  618   1HG   ARG  83          2HG       ARG  83  -0.810   4.631  -1.950
  619   2HG   ARG  83          1HG       ARG  83  -0.131   3.079  -2.439
  620   1HD   ARG  83          2HD       ARG  83   0.808   2.707  -0.263
  621   2HD   ARG  83          1HD       ARG  83   0.455   4.356   0.239
  622    HE   ARG  83           HE       ARG  83  -1.986   3.182  -0.440
  623   1HH1  ARG  83          2HH1      ARG  83   0.585   2.717   1.876
  624   2HH1  ARG  83          1HH1      ARG  83  -0.455   2.041   3.083
  625   1HH2  ARG  83          1HH2      ARG  83  -3.331   2.291   1.155
  626   2HH2  ARG  83          2HH2      ARG  83  -2.666   1.799   2.676
  627    H    CYS  84           H        CYS  84   2.417   6.731  -4.216
  628    HA   CYS  84           HA       CYS  84   5.048   7.079  -3.204
  629   1HB   CYS  84          2HB       CYS  84   4.298   6.630  -5.639
  630   2HB   CYS  84          1HB       CYS  84   4.059   8.373  -5.738
  631    HG   CYS  84           HG       CYS  84   6.497   8.451  -6.190
  632    H    MET  85           H        MET  85   2.438   9.365  -3.996
  633    HA   MET  85           HA       MET  85   3.934  11.732  -3.458
  634   1HB   MET  85          2HB       MET  85   1.672  11.479  -4.714
  635   2HB   MET  85          1HB       MET  85   0.949  11.545  -3.106
  636   1HG   MET  85          2HG       MET  85   2.986  13.618  -3.578
  637   2HG   MET  85          1HG       MET  85   1.582  13.746  -4.636
  638   1HE   MET  85          1HE       MET  85   1.697  16.098  -3.349
  639   2HE   MET  85          2HE       MET  85   0.306  16.347  -2.297
  640   3HE   MET  85          3HE       MET  85   0.079  15.629  -3.890
  641    H    LYS  86           H        LYS  86   1.531   9.918  -1.537
  642    HA   LYS  86           HA       LYS  86   1.270   9.647   0.723
  643   1HB   LYS  86          2HB       LYS  86   3.901   9.608   0.565
  644   2HB   LYS  86          1HB       LYS  86   3.760  11.186   1.344
  645   1HG   LYS  86          2HG       LYS  86   3.750   9.917   3.250
  646   2HG   LYS  86          1HG       LYS  86   2.033   9.774   2.874
  647   1HD   LYS  86          2HD       LYS  86   2.601   7.535   3.129
  648   2HD   LYS  86          1HD       LYS  86   2.848   7.737   1.395
  649   1HE   LYS  86          2HE       LYS  86   5.244   8.118   1.757
  650   2HE   LYS  86          1HE       LYS  86   5.017   7.991   3.502
  651   1HZ   LYS  86          1HZ       LYS  86   5.807   5.913   2.543
  652   2HZ   LYS  86          2HZ       LYS  86   4.446   5.844   1.528
  653   3HZ   LYS  86          3HZ       LYS  86   4.260   5.723   3.213
  654    H    ASP  87           H        ASP  87  -0.110  10.721   1.944
  655    HA   ASP  87           HA       ASP  87  -0.482  13.572   1.576
  656   1HB   ASP  87          2HB       ASP  87  -2.294  11.715   1.939
  657   2HB   ASP  87          1HB       ASP  87  -1.937  11.965   3.648
  658    H    ASP  88           H        ASP  88   0.871  11.429   4.010
  659    HA   ASP  88           HA       ASP  88   2.194  11.854   5.836
  660   1HB   ASP  88          2HB       ASP  88   2.992  13.834   4.340
  661   2HB   ASP  88          1HB       ASP  88   1.980  14.822   5.393
  662    H    SER  89           HN       SER  89   0.962  11.244   7.501
  663    HA   SER  89           HA       SER  89  -0.730  13.301   8.778
  664   1HB   SER  89          2HB       SER  89  -2.021  11.480   7.448
  665   2HB   SER  89          1HB       SER  89  -1.553  10.407   8.764
  666    HG   SER  89           HG       SER  89  -3.487  12.262   8.692
  Start of MODEL   23
    1   1H    MET   1          1H        MET   1  -8.679   4.323  10.150
    2   2H    MET   1          2H        MET   1  -8.992   2.681   9.844
    3   3H    MET   1          3H        MET   1 -10.018   3.569  10.865
    4    HA   MET   1           HA       MET   1 -11.191   3.425   8.867
    5   1HB   MET   1          2HB       MET   1 -10.698   5.793   9.930
    6   2HB   MET   1          1HB       MET   1  -9.797   6.050   8.436
    7   1HG   MET   1          2HG       MET   1 -11.823   5.411   7.137
    8   2HG   MET   1          1HG       MET   1 -12.715   5.243   8.648
    9   1HE   MET   1          1HE       MET   1 -12.115   7.406   5.765
   10   2HE   MET   1          2HE       MET   1 -10.518   7.566   6.490
   11   3HE   MET   1          3HE       MET   1 -11.563   8.978   6.359
   12    H    ASN   2           H        ASN   2  -7.874   4.582   8.237
   13    HA   ASN   2           HA       ASN   2  -6.604   4.626   6.314
   14   1HB   ASN   2          2HB       ASN   2  -6.086   2.393   5.465
   15   2HB   ASN   2          1HB       ASN   2  -6.181   2.384   7.224
   16   1HD2  ASN   2          1HD2      ASN   2  -8.182   1.446   8.198
   17   2HD2  ASN   2          2HD2      ASN   2  -9.104   0.330   7.312
   18    H    ASP   3           H        ASP   3  -9.272   5.540   5.801
   19    HA   ASP   3           HA       ASP   3  -9.751   4.551   3.053
   20   1HB   ASP   3          2HB       ASP   3 -11.511   5.547   5.206
   21   2HB   ASP   3          1HB       ASP   3 -11.886   6.158   3.598
   22    H    ILE   4           H        ILE   4  -7.676   6.542   4.001
   23    HA   ILE   4           HA       ILE   4  -8.570   9.079   2.923
   24    HB   ILE   4           HB       ILE   4  -6.252   9.834   3.369
   25   1HG1  ILE   4          2HG1      ILE   4  -5.114   7.881   4.930
   26   2HG1  ILE   4          1HG1      ILE   4  -5.846   6.917   3.648
   27   1HG2  ILE   4          1HG2      ILE   4  -7.467   8.297   5.681
   28   2HG2  ILE   4          2HG2      ILE   4  -8.030   9.873   5.122
   29   3HG2  ILE   4          3HG2      ILE   4  -6.407   9.703   5.792
   30   1HD1  ILE   4          1HD1      ILE   4  -4.198   9.362   3.015
   31   2HD1  ILE   4          2HD1      ILE   4  -4.610   8.012   1.958
   32   3HD1  ILE   4          3HD1      ILE   4  -3.443   7.788   3.261
   33    H    TYR   5           H        TYR   5  -6.601   6.357   1.867
   34    HA   TYR   5           HA       TYR   5  -5.520   7.589  -0.468
   35   1HB   TYR   5          2HB       TYR   5  -6.011   4.658   0.126
   36   2HB   TYR   5          1HB       TYR   5  -5.049   5.275  -1.218
   37    HD1  TYR   5           HD1      TYR   5  -3.117   6.935  -0.598
   38    HD2  TYR   5           HD2      TYR   5  -4.987   4.258   2.194
   39    HE1  TYR   5           HE1      TYR   5  -1.150   7.122   0.900
   40    HE2  TYR   5           HE2      TYR   5  -3.024   4.450   3.692
   41    HH   TYR   5           HH       TYR   5  -0.990   6.680   3.782
   42    H    LYS   6           H        LYS   6  -8.551   5.964   0.242
   43    HA   LYS   6           HA       LYS   6  -9.409   5.482  -2.417
   44   1HB   LYS   6          2HB       LYS   6 -10.698   5.586   0.254
   45   2HB   LYS   6          1HB       LYS   6 -11.757   5.821  -1.138
   46   1HG   LYS   6          2HG       LYS   6 -10.442   3.734  -2.095
   47   2HG   LYS   6          1HG       LYS   6 -10.115   3.425  -0.389
   48   1HD   LYS   6          2HD       LYS   6 -12.925   4.096  -1.118
   49   2HD   LYS   6          1HD       LYS   6 -12.330   2.512  -1.613
   50   1HE   LYS   6          2HE       LYS   6 -11.687   3.333   1.168
   51   2HE   LYS   6          1HE       LYS   6 -13.383   2.989   0.834
   52   1HZ   LYS   6          1HZ       LYS   6 -11.100   1.177   0.257
   53   2HZ   LYS   6          2HZ       LYS   6 -12.733   0.847  -0.081
   54   3HZ   LYS   6          3HZ       LYS   6 -12.209   1.000   1.528
   55    H    ALA   7           H        ALA   7  -9.540   8.335  -0.349
   56    HA   ALA   7           HA       ALA   7 -11.394   9.844  -1.876
   57   1HB   ALA   7          1HB       ALA   7  -9.167  10.689  -0.014
   58   2HB   ALA   7          2HB       ALA   7 -10.889  10.580   0.349
   59   3HB   ALA   7          3HB       ALA   7 -10.298  11.825  -0.751
   60    H    ALA   8           H        ALA   8  -7.943   9.242  -2.228
   61    HA   ALA   8           HA       ALA   8  -7.479  11.361  -4.122
   62   1HB   ALA   8          1HB       ALA   8  -5.653  10.425  -2.739
   63   2HB   ALA   8          2HB       ALA   8  -5.300  10.311  -4.463
   64   3HB   ALA   8          3HB       ALA   8  -5.828   8.882  -3.575
   65    H    VAL   9           H        VAL   9  -7.966   7.829  -4.349
   66    HA   VAL   9           HA       VAL   9  -7.757   7.722  -7.190
   67    HB   VAL   9           HB       VAL   9  -7.513   5.762  -5.611
   68   1HG1  VAL   9          1HG1      VAL   9  -9.660   4.576  -5.055
   69   2HG1  VAL   9          2HG1      VAL   9 -10.531   6.024  -5.561
   70   3HG1  VAL   9          3HG1      VAL   9  -9.428   6.093  -4.187
   71   1HG2  VAL   9          1HG2      VAL   9  -9.522   5.466  -7.869
   72   2HG2  VAL   9          2HG2      VAL   9  -8.543   4.169  -7.184
   73   3HG2  VAL   9          3HG2      VAL   9  -7.769   5.489  -8.059
   74    H    GLU  10           H        GLU  10 -10.278   8.694  -5.029
   75    HA   GLU  10           HA       GLU  10 -12.437   8.349  -6.932
   76   1HB   GLU  10          2HB       GLU  10 -12.175   9.324  -4.134
   77   2HB   GLU  10          1HB       GLU  10 -13.519   9.961  -5.082
   78   1HG   GLU  10          2HG       GLU  10 -14.397   7.781  -5.493
   79   2HG   GLU  10          1HG       GLU  10 -12.921   7.002  -4.921
   80    H    GLN  11           H        GLN  11 -10.051  10.776  -6.244
   81    HA   GLN  11           HA       GLN  11 -11.605  12.752  -7.808
   82   1HB   GLN  11          2HB       GLN  11 -10.419  14.510  -6.660
   83   2HB   GLN  11          1HB       GLN  11 -11.100  13.414  -5.460
   84   1HG   GLN  11          2HG       GLN  11  -8.886  12.255  -5.325
   85   2HG   GLN  11          1HG       GLN  11  -8.224  13.461  -6.427
   86   1HE2  GLN  11          1HE2      GLN  11  -9.772  13.123  -3.204
   87   2HE2  GLN  11          2HE2      GLN  11  -9.099  14.544  -2.566
   88    H    LEU  12           H        LEU  12  -9.407  10.564  -8.540
   89    HA   LEU  12           HA       LEU  12  -7.333  12.211  -9.721
   90   1HB   LEU  12          2HB       LEU  12  -6.779   9.981 -10.912
   91   2HB   LEU  12          1HB       LEU  12  -6.462  10.147  -9.202
   92    HG   LEU  12           HG       LEU  12  -8.413   8.819  -8.667
   93   1HD1  LEU  12          1HD1      LEU  12 -10.018   9.421 -10.310
   94   2HD1  LEU  12          2HD1      LEU  12  -9.642   7.733 -10.655
   95   3HD1  LEU  12          3HD1      LEU  12  -8.930   9.013 -11.637
   96   1HD2  LEU  12          1HD2      LEU  12  -7.690   6.696  -9.598
   97   2HD2  LEU  12          2HD2      LEU  12  -6.263   7.691  -9.308
   98   3HD2  LEU  12          3HD2      LEU  12  -6.898   7.514 -10.945
   99    H    THR  13           H        THR  13  -6.824  11.629 -12.171
  100    HA   THR  13           HA       THR  13  -9.212  12.468 -13.659
  101    HB   THR  13           HB       THR  13  -7.232  12.444 -15.521
  102    HG1  THR  13           HG1      THR  13  -5.510  11.989 -14.363
  103   1HG2  THR  13          1HG2      THR  13  -7.970  14.554 -15.519
  104   2HG2  THR  13          2HG2      THR  13  -6.931  14.888 -14.134
  105   3HG2  THR  13          3HG2      THR  13  -8.598  14.370 -13.881
  106    H    ASP  14           H        ASP  14  -9.508  11.567 -15.859
  107    HA   ASP  14           HA       ASP  14  -9.776   8.717 -15.756
  108   1HB   ASP  14          2HB       ASP  14 -10.249  10.799 -17.877
  109   2HB   ASP  14          1HB       ASP  14 -10.322   9.082 -18.276
  110    H    GLU  15           H        GLU  15  -7.461  10.969 -17.124
  111    HA   GLU  15           HA       GLU  15  -6.077   9.119 -18.805
  112   1HB   GLU  15          2HB       GLU  15  -5.294  11.771 -17.588
  113   2HB   GLU  15          1HB       GLU  15  -4.195  10.836 -18.601
  114   1HG   GLU  15          2HG       GLU  15  -5.189  12.117 -20.242
  115   2HG   GLU  15          1HG       GLU  15  -6.333  10.776 -20.210
  116    H    GLN  16           H        GLN  16  -5.885   9.979 -15.403
  117    HA   GLN  16           HA       GLN  16  -3.375   8.744 -14.840
  118   1HB   GLN  16          2HB       GLN  16  -5.484  10.057 -13.340
  119   2HB   GLN  16          1HB       GLN  16  -4.931   8.604 -12.507
  120   1HG   GLN  16          2HG       GLN  16  -2.798   9.420 -12.203
  121   2HG   GLN  16          1HG       GLN  16  -2.848  10.396 -13.670
  122   1HE2  GLN  16          1HE2      GLN  16  -4.711  10.260 -10.569
  123   2HE2  GLN  16          2HE2      GLN  16  -4.707  11.939 -10.334
  124    H    LYS  17           H        LYS  17  -6.758   7.683 -14.627
  125    HA   LYS  17           HA       LYS  17  -6.243   5.091 -13.583
  126   1HB   LYS  17          2HB       LYS  17  -8.558   6.071 -15.278
  127   2HB   LYS  17          1HB       LYS  17  -8.514   4.535 -14.414
  128   1HG   LYS  17          2HG       LYS  17  -8.649   5.549 -12.320
  129   2HG   LYS  17          1HG       LYS  17  -7.987   7.077 -12.904
  130   1HD   LYS  17          2HD       LYS  17 -10.242   7.621 -12.685
  131   2HD   LYS  17          1HD       LYS  17 -10.173   7.126 -14.375
  132   1HE   LYS  17          2HE       LYS  17 -10.573   4.745 -12.935
  133   2HE   LYS  17          1HE       LYS  17 -11.641   5.924 -12.177
  134   1HZ   LYS  17          1HZ       LYS  17 -11.494   5.457 -15.105
  135   2HZ   LYS  17          2HZ       LYS  17 -12.619   6.427 -14.277
  136   3HZ   LYS  17          3HZ       LYS  17 -12.644   4.738 -14.085
  137    H    ASN  18           H        ASN  18  -6.643   6.343 -16.886
  138    HA   ASN  18           HA       ASN  18  -6.385   3.847 -18.222
  139   1HB   ASN  18          2HB       ASN  18  -6.300   6.710 -19.011
  140   2HB   ASN  18          1HB       ASN  18  -5.531   5.562 -20.106
  141   1HD2  ASN  18          1HD2      ASN  18  -8.641   6.373 -18.548
  142   2HD2  ASN  18          2HD2      ASN  18  -9.595   5.474 -19.626
  143    H    GLU  19           H        GLU  19  -4.037   6.199 -17.052
  144    HA   GLU  19           HA       GLU  19  -1.756   5.408 -18.462
  145   1HB   GLU  19          2HB       GLU  19  -1.942   7.371 -16.877
  146   2HB   GLU  19          1HB       GLU  19  -1.782   6.224 -15.548
  147   1HG   GLU  19          2HG       GLU  19   0.414   5.633 -16.155
  148   2HG   GLU  19          1HG       GLU  19   0.229   6.264 -17.791
  149    H    PHE  20           H        PHE  20  -2.997   4.203 -15.343
  150    HA   PHE  20           HA       PHE  20  -1.007   2.113 -15.173
  151   1HB   PHE  20          2HB       PHE  20  -3.406   2.901 -13.551
  152   2HB   PHE  20          1HB       PHE  20  -2.652   1.328 -13.303
  153    HD1  PHE  20           HD1      PHE  20  -2.211   4.974 -13.037
  154    HD2  PHE  20           HD2      PHE  20  -0.377   1.140 -12.422
  155    HE1  PHE  20           HE1      PHE  20  -0.450   6.041 -11.662
  156    HE2  PHE  20           HE2      PHE  20   1.377   2.193 -11.032
  157    HZ   PHE  20           HZ       PHE  20   1.350   4.649 -10.657
  158    H    LYS  21           H        LYS  21  -4.513   2.265 -15.812
  159    HA   LYS  21           HA       LYS  21  -5.079  -0.433 -16.055
  160   1HB   LYS  21          2HB       LYS  21  -6.703   1.525 -16.185
  161   2HB   LYS  21          1HB       LYS  21  -6.270   1.642 -17.888
  162   1HG   LYS  21          2HG       LYS  21  -8.217   0.254 -17.802
  163   2HG   LYS  21          1HG       LYS  21  -6.858  -0.834 -18.073
  164   1HD   LYS  21          2HD       LYS  21  -6.765  -1.215 -15.583
  165   2HD   LYS  21          1HD       LYS  21  -8.263  -0.294 -15.446
  166   1HE   LYS  21          2HE       LYS  21  -8.072  -2.621 -17.349
  167   2HE   LYS  21          1HE       LYS  21  -8.416  -2.889 -15.642
  168   1HZ   LYS  21          1HZ       LYS  21  -9.986  -1.265 -17.564
  169   2HZ   LYS  21          2HZ       LYS  21 -10.251  -1.237 -15.886
  170   3HZ   LYS  21          3HZ       LYS  21 -10.478  -2.676 -16.761
  171    H    ALA  22           H        ALA  22  -3.515   1.692 -18.416
  172    HA   ALA  22           HA       ALA  22  -3.673   0.033 -20.687
  173   1HB   ALA  22          1HB       ALA  22  -2.859   2.332 -20.852
  174   2HB   ALA  22          2HB       ALA  22  -1.630   1.222 -21.459
  175   3HB   ALA  22          3HB       ALA  22  -1.462   1.931 -19.853
  176    H    ALA  23           H        ALA  23  -1.072   0.323 -18.260
  177    HA   ALA  23           HA       ALA  23   0.435  -1.909 -19.205
  178   1HB   ALA  23          1HB       ALA  23   0.415  -0.558 -16.490
  179   2HB   ALA  23          2HB       ALA  23   1.489  -0.175 -17.835
  180   3HB   ALA  23          3HB       ALA  23   1.613  -1.736 -17.026
  181    H    PHE  24           H        PHE  24  -2.129  -1.457 -16.841
  182    HA   PHE  24           HA       PHE  24  -2.018  -3.926 -15.510
  183   1HB   PHE  24          2HB       PHE  24  -3.460  -1.850 -14.985
  184   2HB   PHE  24          1HB       PHE  24  -4.601  -2.508 -16.155
  185    HD1  PHE  24           HD1      PHE  24  -5.407  -4.931 -15.816
  186    HD2  PHE  24           HD2      PHE  24  -3.408  -2.662 -12.772
  187    HE1  PHE  24           HE1      PHE  24  -6.285  -6.475 -14.087
  188    HE2  PHE  24           HE2      PHE  24  -4.283  -4.203 -11.046
  189    HZ   PHE  24           HZ       PHE  24  -5.723  -6.104 -11.703
  190    H    ASP  25           H        ASP  25  -3.693  -2.974 -18.502
  191    HA   ASP  25           HA       ASP  25  -5.056  -5.430 -18.908
  192   1HB   ASP  25          2HB       ASP  25  -4.419  -3.054 -20.595
  193   2HB   ASP  25          1HB       ASP  25  -4.934  -4.533 -21.407
  194    H    ILE  26           H        ILE  26  -1.951  -4.215 -20.208
  195    HA   ILE  26           HA       ILE  26  -1.452  -6.484 -21.844
  196    HB   ILE  26           HB       ILE  26   0.926  -5.707 -21.861
  197   1HG1  ILE  26          2HG1      ILE  26  -0.132  -3.504 -20.062
  198   2HG1  ILE  26          1HG1      ILE  26   0.917  -4.810 -19.518
  199   1HG2  ILE  26          1HG2      ILE  26  -1.100  -3.487 -22.256
  200   2HG2  ILE  26          2HG2      ILE  26  -0.857  -4.817 -23.389
  201   3HG2  ILE  26          3HG2      ILE  26   0.447  -3.669 -23.084
  202   1HD1  ILE  26          1HD1      ILE  26   2.671  -3.534 -20.116
  203   2HD1  ILE  26          2HD1      ILE  26   1.617  -2.356 -20.897
  204   3HD1  ILE  26          3HD1      ILE  26   2.184  -3.765 -21.795
  205    H    PHE  27           H        PHE  27  -0.571  -5.756 -18.477
  206    HA   PHE  27           HA       PHE  27   1.016  -8.153 -18.191
  207   1HB   PHE  27          2HB       PHE  27  -0.064  -6.203 -16.143
  208   2HB   PHE  27          1HB       PHE  27   0.961  -7.581 -15.744
  209    HD1  PHE  27           HD1      PHE  27   3.017  -7.734 -17.686
  210    HD2  PHE  27           HD2      PHE  27   1.130  -4.203 -16.131
  211    HE1  PHE  27           HE1      PHE  27   5.017  -6.402 -18.284
  212    HE2  PHE  27           HE2      PHE  27   3.132  -2.872 -16.732
  213    HZ   PHE  27           HZ       PHE  27   5.076  -3.970 -17.807
  214    H    ILE  28           H        ILE  28  -2.337  -7.241 -17.599
  215    HA   ILE  28           HA       ILE  28  -2.878  -9.920 -16.490
  216    HB   ILE  28           HB       ILE  28  -3.613  -7.595 -15.434
  217   1HG1  ILE  28          2HG1      ILE  28  -4.026  -9.932 -14.602
  218   2HG1  ILE  28          1HG1      ILE  28  -5.285  -8.768 -14.191
  219   1HG2  ILE  28          1HG2      ILE  28  -4.934  -7.116 -17.632
  220   2HG2  ILE  28          2HG2      ILE  28  -5.678  -6.737 -16.080
  221   3HG2  ILE  28          3HG2      ILE  28  -6.137  -8.202 -16.940
  222   1HD1  ILE  28          1HD1      ILE  28  -6.323 -10.836 -14.961
  223   2HD1  ILE  28          2HD1      ILE  28  -5.367 -10.796 -16.441
  224   3HD1  ILE  28          3HD1      ILE  28  -6.603  -9.571 -16.158
  225    H    GLN  29           H        GLN  29  -2.282  -9.566 -19.243
  226    HA   GLN  29           HA       GLN  29  -4.734  -9.601 -20.773
  227   1HB   GLN  29          2HB       GLN  29  -2.545  -8.776 -21.686
  228   2HB   GLN  29          1HB       GLN  29  -1.956 -10.437 -21.639
  229   1HG   GLN  29          2HG       GLN  29  -3.383 -11.141 -23.330
  230   2HG   GLN  29          1HG       GLN  29  -4.553  -9.857 -23.019
  231   1HE2  GLN  29          1HE2      GLN  29  -3.861  -7.595 -23.674
  232   2HE2  GLN  29          2HE2      GLN  29  -2.779  -7.422 -24.970
  233    H    ASP  30           H        ASP  30  -2.219 -11.993 -19.953
  234    HA   ASP  30           HA       ASP  30  -3.844 -14.189 -20.936
  235   1HB   ASP  30          2HB       ASP  30  -1.189 -13.883 -20.856
  236   2HB   ASP  30          1HB       ASP  30  -1.406 -14.698 -19.308
  237    H    ALA  31           H        ALA  31  -3.972 -12.422 -18.114
  238    HA   ALA  31           HA       ALA  31  -4.566 -14.747 -16.412
  239   1HB   ALA  31          1HB       ALA  31  -3.295 -13.354 -15.090
  240   2HB   ALA  31          2HB       ALA  31  -4.901 -12.729 -14.713
  241   3HB   ALA  31          3HB       ALA  31  -3.879 -11.889 -15.881
  242    H    GLU  32           H        GLU  32  -6.539 -14.882 -15.270
  243    HA   GLU  32           HA       GLU  32  -8.763 -13.300 -16.424
  244   1HB   GLU  32          2HB       GLU  32 -10.182 -15.341 -16.249
  245   2HB   GLU  32          1HB       GLU  32  -8.860 -15.520 -17.401
  246   1HG   GLU  32          2HG       GLU  32  -7.521 -16.663 -15.621
  247   2HG   GLU  32          1HG       GLU  32  -8.922 -16.573 -14.556
  248    H    ASP  33           H        ASP  33  -7.295 -12.804 -13.973
  249    HA   ASP  33           HA       ASP  33  -9.370 -13.387 -11.943
  250   1HB   ASP  33          2HB       ASP  33  -6.817 -14.095 -11.695
  251   2HB   ASP  33          1HB       ASP  33  -6.656 -12.423 -11.157
  252    H    GLY  34           H        GLY  34  -7.168 -10.893 -13.189
  253   1HA   GLY  34          2HA       GLY  34  -7.969  -8.642 -13.573
  254   2HA   GLY  34          1HA       GLY  34  -9.025  -8.829 -12.176
  255    H    CYS  35           H        CYS  35  -5.615  -9.766 -12.372
  256    HA   CYS  35           HA       CYS  35  -4.747  -7.456 -10.814
  257   1HB   CYS  35          2HB       CYS  35  -3.991 -10.105  -9.655
  258   2HB   CYS  35          1HB       CYS  35  -4.134  -8.537  -8.866
  259    HG   CYS  35           HG       CYS  35  -6.537 -10.420  -9.517
  260    H    ILE  36           H        ILE  36  -2.615  -6.976 -11.182
  261    HA   ILE  36           HA       ILE  36  -1.265  -8.535 -13.231
  262    HB   ILE  36           HB       ILE  36   0.328  -6.773 -13.368
  263   1HG1  ILE  36          2HG1      ILE  36  -0.206  -4.883 -11.419
  264   2HG1  ILE  36          1HG1      ILE  36  -0.369  -6.400 -10.532
  265   1HG2  ILE  36          1HG2      ILE  36  -2.118  -6.282 -14.028
  266   2HG2  ILE  36          2HG2      ILE  36  -1.035  -4.902 -13.847
  267   3HG2  ILE  36          3HG2      ILE  36  -2.179  -5.298 -12.565
  268   1HD1  ILE  36          1HD1      ILE  36   2.020  -5.542 -12.194
  269   2HD1  ILE  36          2HD1      ILE  36   1.855  -7.118 -11.420
  270   3HD1  ILE  36          3HD1      ILE  36   1.959  -5.659 -10.436
  271    H    SER  37           H        SER  37   1.105  -9.049 -12.937
  272    HA   SER  37           HA       SER  37   1.394 -10.555 -10.454
  273   1HB   SER  37          2HB       SER  37   2.043 -11.230 -12.977
  274   2HB   SER  37          1HB       SER  37   3.580 -10.537 -12.468
  275    HG   SER  37           HG       SER  37   3.554 -12.700 -11.912
  276    H    THR  38           H        THR  38   2.103  -9.423  -8.756
  277    HA   THR  38           HA       THR  38   3.540  -7.047  -8.726
  278    HB   THR  38           HB       THR  38   4.153  -7.574  -6.408
  279    HG1  THR  38           HG1      THR  38   3.175 -10.159  -7.050
  280   1HG2  THR  38          1HG2      THR  38   1.378  -8.282  -7.341
  281   2HG2  THR  38          2HG2      THR  38   1.938  -6.799  -6.570
  282   3HG2  THR  38          3HG2      THR  38   1.790  -8.280  -5.628
  283    H    LYS  39           H        LYS  39   4.755 -10.384  -8.756
  284    HA   LYS  39           HA       LYS  39   7.503  -9.791  -8.440
  285   1HB   LYS  39          2HB       LYS  39   7.917 -12.023  -9.386
  286   2HB   LYS  39          1HB       LYS  39   6.627 -12.073  -8.187
  287   1HG   LYS  39          2HG       LYS  39   5.201 -11.575 -10.472
  288   2HG   LYS  39          1HG       LYS  39   6.514 -12.572 -11.098
  289   1HD   LYS  39          2HD       LYS  39   5.207 -13.473  -8.572
  290   2HD   LYS  39          1HD       LYS  39   4.284 -13.648 -10.065
  291   1HE   LYS  39          2HE       LYS  39   6.406 -14.733 -11.044
  292   2HE   LYS  39          1HE       LYS  39   6.967 -14.851  -9.376
  293   1HZ   LYS  39          1HZ       LYS  39   5.824 -16.861 -10.050
  294   2HZ   LYS  39          2HZ       LYS  39   4.430 -15.973 -10.441
  295   3HZ   LYS  39          3HZ       LYS  39   4.952 -16.075  -8.828
  296    H    GLU  40           H        GLU  40   5.363  -9.623 -11.205
  297    HA   GLU  40           HA       GLU  40   7.631  -9.139 -13.022
  298   1HB   GLU  40          2HB       GLU  40   4.686  -9.498 -13.641
  299   2HB   GLU  40          1HB       GLU  40   5.980  -9.332 -14.828
  300   1HG   GLU  40          2HG       GLU  40   7.059 -11.373 -13.680
  301   2HG   GLU  40          1HG       GLU  40   5.494 -11.607 -12.899
  302    H    LEU  41           H        LEU  41   6.340  -7.252 -10.892
  303    HA   LEU  41           HA       LEU  41   5.159  -5.125 -12.393
  304   1HB   LEU  41          2HB       LEU  41   5.050  -5.649  -9.830
  305   2HB   LEU  41          1HB       LEU  41   6.499  -4.669  -9.763
  306    HG   LEU  41           HG       LEU  41   4.254  -3.458 -11.253
  307   1HD1  LEU  41          1HD1      LEU  41   3.353  -4.769  -9.128
  308   2HD1  LEU  41          2HD1      LEU  41   2.782  -3.140  -9.492
  309   3HD1  LEU  41          3HD1      LEU  41   4.029  -3.386  -8.269
  310   1HD2  LEU  41          1HD2      LEU  41   5.040  -1.474 -10.153
  311   2HD2  LEU  41          2HD2      LEU  41   6.473  -2.391 -10.616
  312   3HD2  LEU  41          3HD2      LEU  41   5.913  -2.415  -8.942
  313    H    GLY  42           H        GLY  42   8.393  -6.180 -12.045
  314   1HA   GLY  42          2HA       GLY  42   9.856  -3.789 -12.074
  315   2HA   GLY  42          1HA       GLY  42  10.383  -5.304 -12.806
  316    H    LYS  43           H        LYS  43   8.138  -5.521 -14.626
  317    HA   LYS  43           HA       LYS  43   9.128  -3.910 -16.799
  318   1HB   LYS  43          2HB       LYS  43   6.633  -5.634 -16.708
  319   2HB   LYS  43          1HB       LYS  43   7.451  -5.041 -18.153
  320   1HG   LYS  43          2HG       LYS  43   8.717  -6.889 -16.101
  321   2HG   LYS  43          1HG       LYS  43   8.011  -7.424 -17.626
  322   1HD   LYS  43          2HD       LYS  43  10.194  -5.335 -17.510
  323   2HD   LYS  43          1HD       LYS  43  10.547  -7.058 -17.620
  324   1HE   LYS  43          2HE       LYS  43  10.266  -6.928 -19.849
  325   2HE   LYS  43          1HE       LYS  43   8.569  -6.536 -19.576
  326   1HZ   LYS  43          1HZ       LYS  43   9.221  -4.193 -19.347
  327   2HZ   LYS  43          2HZ       LYS  43   9.605  -4.820 -20.878
  328   3HZ   LYS  43          3HZ       LYS  43  10.824  -4.606 -19.715
  329    H    VAL  44           H        VAL  44   6.586  -3.648 -14.448
  330    HA   VAL  44           HA       VAL  44   4.940  -1.774 -15.869
  331    HB   VAL  44           HB       VAL  44   5.093  -2.154 -12.869
  332   1HG1  VAL  44          1HG1      VAL  44   2.856  -1.285 -12.880
  333   2HG1  VAL  44          2HG1      VAL  44   2.767  -1.368 -14.638
  334   3HG1  VAL  44          3HG1      VAL  44   3.830  -0.194 -13.863
  335   1HG2  VAL  44          1HG2      VAL  44   4.693  -4.263 -14.446
  336   2HG2  VAL  44          2HG2      VAL  44   3.073  -3.574 -14.564
  337   3HG2  VAL  44          3HG2      VAL  44   3.725  -4.023 -12.991
  338    H    MET  45           H        MET  45   7.320  -1.548 -13.232
  339    HA   MET  45           HA       MET  45   7.281   1.235 -12.893
  340   1HB   MET  45          2HB       MET  45   9.527  -0.754 -12.486
  341   2HB   MET  45          1HB       MET  45   9.607   0.933 -11.980
  342   1HG   MET  45          2HG       MET  45   7.167  -0.502 -11.125
  343   2HG   MET  45          1HG       MET  45   8.664  -1.087 -10.400
  344   1HE   MET  45          1HE       MET  45   6.515   1.522  -8.101
  345   2HE   MET  45          2HE       MET  45   6.898  -0.187  -8.292
  346   3HE   MET  45          3HE       MET  45   5.889   0.621  -9.489
  347    H    ARG  46           H        ARG  46   9.182  -0.819 -15.083
  348    HA   ARG  46           HA       ARG  46  10.866   1.172 -16.155
  349   1HB   ARG  46          2HB       ARG  46   9.761  -1.357 -17.395
  350   2HB   ARG  46          1HB       ARG  46  10.967  -0.335 -18.180
  351   1HG   ARG  46          2HG       ARG  46  12.559  -0.709 -16.442
  352   2HG   ARG  46          1HG       ARG  46  11.342  -1.425 -15.389
  353   1HD   ARG  46          2HD       ARG  46  11.268  -3.418 -16.603
  354   2HD   ARG  46          1HD       ARG  46  11.896  -2.667 -18.065
  355    HE   ARG  46           HE       ARG  46  13.909  -2.510 -16.124
  356   1HH1  ARG  46          2HH1      ARG  46  12.135  -4.944 -17.887
  357   2HH1  ARG  46          1HH1      ARG  46  13.422  -6.098 -17.838
  358   1HH2  ARG  46          1HH2      ARG  46  15.587  -4.034 -16.077
  359   2HH2  ARG  46          2HH2      ARG  46  15.373  -5.585 -16.818
  360    H    MET  47           H        MET  47   7.577   0.206 -16.966
  361    HA   MET  47           HA       MET  47   7.366   1.950 -19.264
  362   1HB   MET  47          2HB       MET  47   5.292   0.429 -17.673
  363   2HB   MET  47          1HB       MET  47   4.927   1.376 -19.114
  364   1HG   MET  47          2HG       MET  47   6.979  -0.852 -19.074
  365   2HG   MET  47          1HG       MET  47   5.295  -1.097 -19.537
  366   1HE   MET  47          1HE       MET  47   8.542  -0.355 -22.230
  367   2HE   MET  47          2HE       MET  47   7.654  -1.792 -21.732
  368   3HE   MET  47          3HE       MET  47   8.529  -0.847 -20.531
  369    H    LEU  48           H        LEU  48   6.736   2.163 -15.827
  370    HA   LEU  48           HA       LEU  48   5.050   4.480 -15.898
  371   1HB   LEU  48          2HB       LEU  48   6.443   2.874 -13.850
  372   2HB   LEU  48          1HB       LEU  48   6.192   4.551 -13.435
  373    HG   LEU  48           HG       LEU  48   3.866   4.317 -13.374
  374   1HD1  LEU  48          1HD1      LEU  48   3.079   3.363 -15.301
  375   2HD1  LEU  48          2HD1      LEU  48   2.999   1.917 -14.295
  376   3HD1  LEU  48          3HD1      LEU  48   4.379   2.173 -15.366
  377   1HD2  LEU  48          1HD2      LEU  48   4.465   3.136 -11.472
  378   2HD2  LEU  48          2HD2      LEU  48   5.330   1.900 -12.385
  379   3HD2  LEU  48          3HD2      LEU  48   3.565   1.881 -12.327
  380    H    GLY  49           H        GLY  49   8.496   3.907 -15.812
  381   1HA   GLY  49          2HA       GLY  49   9.802   5.775 -16.881
  382   2HA   GLY  49          1HA       GLY  49   8.981   6.832 -15.741
  383    H    GLN  50           H        GLN  50  10.152   3.607 -14.880
  384    HA   GLN  50           HA       GLN  50  12.611   4.605 -13.709
  385   1HB   GLN  50          2HB       GLN  50  11.991   3.819 -11.388
  386   2HB   GLN  50          1HB       GLN  50  11.183   5.294 -11.914
  387   1HG   GLN  50          2HG       GLN  50   9.520   3.202 -12.788
  388   2HG   GLN  50          1HG       GLN  50  10.024   2.740 -11.164
  389   1HE2  GLN  50          1HE2      GLN  50   8.234   5.168 -13.019
  390   2HE2  GLN  50          2HE2      GLN  50   7.556   5.948 -11.673
  391    H    ASN  51           H        ASN  51  14.082   3.007 -13.293
  392    HA   ASN  51           HA       ASN  51  13.183   0.238 -13.846
  393   1HB   ASN  51          2HB       ASN  51  15.621  -0.072 -14.653
  394   2HB   ASN  51          1HB       ASN  51  14.501   0.780 -15.713
  395   1HD2  ASN  51          1HD2      ASN  51  14.744   3.140 -15.908
  396   2HD2  ASN  51          2HD2      ASN  51  16.175   3.909 -15.414
  397    HA   PRO  52           HA       PRO  52  15.128   0.193  -9.681
  398   1HB   PRO  52          2HB       PRO  52  13.076  -1.109  -8.431
  399   2HB   PRO  52          1HB       PRO  52  13.134   0.645  -8.649
  400   1HG   PRO  52          2HG       PRO  52  11.464  -1.363 -10.024
  401   2HG   PRO  52          1HG       PRO  52  11.171   0.363  -9.770
  402   1HD   PRO  52          2HD       PRO  52  12.102  -0.879 -12.166
  403   2HD   PRO  52          1HD       PRO  52  11.983   0.866 -11.840
  404    H    THR  53           H        THR  53  14.680  -2.034  -8.079
  405    HA   THR  53           HA       THR  53  15.747  -4.242  -9.735
  406    HB   THR  53           HB       THR  53  17.058  -4.920  -7.922
  407    HG1  THR  53           HG1      THR  53  16.371  -4.836  -5.930
  408   1HG2  THR  53          1HG2      THR  53  18.132  -2.937  -6.970
  409   2HG2  THR  53          2HG2      THR  53  16.764  -1.942  -7.469
  410   3HG2  THR  53          3HG2      THR  53  17.799  -2.691  -8.685
  411    HA   PRO  54           HA       PRO  54  12.335  -6.798  -8.583
  412   1HB   PRO  54          2HB       PRO  54  13.452  -9.163  -7.766
  413   2HB   PRO  54          1HB       PRO  54  13.371  -8.635  -9.454
  414   1HG   PRO  54          2HG       PRO  54  15.690  -8.662  -7.594
  415   2HG   PRO  54          1HG       PRO  54  15.651  -8.847  -9.355
  416   1HD   PRO  54          2HD       PRO  54  16.371  -6.514  -7.988
  417   2HD   PRO  54          1HD       PRO  54  15.906  -6.593  -9.703
  418    H    GLU  55           H        GLU  55  14.806  -6.463  -6.121
  419    HA   GLU  55           HA       GLU  55  13.114  -7.365  -3.943
  420   1HB   GLU  55          2HB       GLU  55  15.769  -5.901  -3.889
  421   2HB   GLU  55          1HB       GLU  55  14.966  -6.628  -2.497
  422   1HG   GLU  55          2HG       GLU  55  14.982  -8.803  -3.979
  423   2HG   GLU  55          1HG       GLU  55  16.279  -7.976  -4.841
  424    H    GLU  56           H        GLU  56  14.101  -4.325  -5.443
  425    HA   GLU  56           HA       GLU  56  13.009  -2.622  -3.407
  426   1HB   GLU  56          2HB       GLU  56  14.762  -2.174  -5.400
  427   2HB   GLU  56          1HB       GLU  56  13.291  -1.596  -6.182
  428   1HG   GLU  56          2HG       GLU  56  14.122   0.316  -5.071
  429   2HG   GLU  56          1HG       GLU  56  12.872  -0.290  -3.984
  430    H    LEU  57           H        LEU  57  11.893  -3.648  -6.650
  431    HA   LEU  57           HA       LEU  57   9.500  -2.177  -6.678
  432   1HB   LEU  57          2HB       LEU  57   8.776  -3.598  -8.442
  433   2HB   LEU  57          1HB       LEU  57  10.487  -3.318  -8.645
  434    HG   LEU  57           HG       LEU  57  10.685  -5.639  -7.381
  435   1HD1  LEU  57          1HD1      LEU  57   8.613  -6.939  -8.568
  436   2HD1  LEU  57          2HD1      LEU  57   7.825  -5.419  -8.147
  437   3HD1  LEU  57          3HD1      LEU  57   8.579  -6.399  -6.889
  438   1HD2  LEU  57          1HD2      LEU  57  11.464  -5.169  -9.671
  439   2HD2  LEU  57          2HD2      LEU  57   9.816  -5.341 -10.274
  440   3HD2  LEU  57          3HD2      LEU  57  10.659  -6.738  -9.605
  441    H    GLN  58           H        GLN  58  10.242  -5.376  -5.334
  442    HA   GLN  58           HA       GLN  58   7.562  -6.095  -4.715
  443   1HB   GLN  58          2HB       GLN  58  10.255  -7.039  -3.800
  444   2HB   GLN  58          1HB       GLN  58   8.820  -7.547  -2.912
  445   1HG   GLN  58          2HG       GLN  58   9.400  -7.990  -5.855
  446   2HG   GLN  58          1HG       GLN  58   9.263  -9.218  -4.600
  447   1HE2  GLN  58          1HE2      GLN  58   6.907  -8.418  -3.279
  448   2HE2  GLN  58          2HE2      GLN  58   5.607  -8.506  -4.361
  449    H    GLU  59           H        GLU  59  10.074  -4.357  -2.909
  450    HA   GLU  59           HA       GLU  59   8.791  -4.244  -0.406
  451   1HB   GLU  59          2HB       GLU  59  10.767  -2.412  -1.760
  452   2HB   GLU  59          1HB       GLU  59  10.134  -2.063  -0.151
  453   1HG   GLU  59          2HG       GLU  59  11.257  -4.788  -0.750
  454   2HG   GLU  59          1HG       GLU  59  12.348  -3.453  -0.383
  455    H    MET  60           H        MET  60   8.490  -2.178  -3.271
  456    HA   MET  60           HA       MET  60   6.805  -0.212  -2.071
  457   1HB   MET  60          2HB       MET  60   6.959  -0.986  -4.995
  458   2HB   MET  60          1HB       MET  60   6.332   0.525  -4.339
  459   1HG   MET  60          2HG       MET  60   8.623   0.917  -3.326
  460   2HG   MET  60          1HG       MET  60   9.190  -0.466  -4.260
  461   1HE   MET  60          1HE       MET  60  10.691   1.464  -6.931
  462   2HE   MET  60          2HE       MET  60  10.180  -0.194  -6.622
  463   3HE   MET  60          3HE       MET  60  10.933   0.742  -5.334
  464    H    ILE  61           H        ILE  61   6.223  -3.163  -3.906
  465    HA   ILE  61           HA       ILE  61   3.395  -2.952  -4.064
  466    HB   ILE  61           HB       ILE  61   5.182  -5.398  -4.133
  467   1HG1  ILE  61          2HG1      ILE  61   3.785  -4.176  -6.492
  468   2HG1  ILE  61          1HG1      ILE  61   5.267  -3.425  -5.898
  469   1HG2  ILE  61          1HG2      ILE  61   3.343  -6.671  -4.826
  470   2HG2  ILE  61          2HG2      ILE  61   2.401  -5.249  -5.276
  471   3HG2  ILE  61          3HG2      ILE  61   2.630  -5.654  -3.576
  472   1HD1  ILE  61          1HD1      ILE  61   5.032  -5.713  -7.563
  473   2HD1  ILE  61          2HD1      ILE  61   5.643  -6.273  -6.006
  474   3HD1  ILE  61          3HD1      ILE  61   6.504  -5.015  -6.890
  475    H    ASP  62           H        ASP  62   5.532  -4.693  -1.801
  476    HA   ASP  62           HA       ASP  62   3.608  -5.927  -0.216
  477   1HB   ASP  62          2HB       ASP  62   6.396  -4.967   0.285
  478   2HB   ASP  62          1HB       ASP  62   5.424  -5.492   1.661
  479    H    GLU  63           H        GLU  63   4.776  -2.591  -0.120
  480    HA   GLU  63           HA       GLU  63   3.428  -1.910   2.325
  481   1HB   GLU  63          2HB       GLU  63   4.730  -0.277   0.150
  482   2HB   GLU  63          1HB       GLU  63   3.886   0.475   1.505
  483   1HG   GLU  63          2HG       GLU  63   5.347  -0.672   3.098
  484   2HG   GLU  63          1HG       GLU  63   6.153  -1.522   1.779
  485    H    VAL  64           H        VAL  64   2.733  -1.259  -1.134
  486    HA   VAL  64           HA       VAL  64   0.285   0.113  -0.588
  487    HB   VAL  64           HB       VAL  64   1.572   0.467  -2.670
  488   1HG1  VAL  64          1HG1      VAL  64   1.565  -1.188  -4.434
  489   2HG1  VAL  64          2HG1      VAL  64   0.531  -2.259  -3.490
  490   3HG1  VAL  64          3HG1      VAL  64   2.189  -1.951  -2.972
  491   1HG2  VAL  64          1HG2      VAL  64  -0.980   0.805  -2.427
  492   2HG2  VAL  64          2HG2      VAL  64  -1.134  -0.668  -3.384
  493   3HG2  VAL  64          3HG2      VAL  64  -0.324   0.744  -4.063
  494    H    ASP  65           H        ASP  65   1.069  -3.266  -1.318
  495    HA   ASP  65           HA       ASP  65  -1.652  -4.092  -1.676
  496   1HB   ASP  65          2HB       ASP  65   0.845  -5.276  -2.079
  497   2HB   ASP  65          1HB       ASP  65   0.131  -6.204  -0.763
  498    H    GLU  66           H        GLU  66  -3.044  -3.817  -0.069
  499    HA   GLU  66           HA       GLU  66  -2.412  -3.754   2.685
  500   1HB   GLU  66          2HB       GLU  66  -4.860  -3.893   3.046
  501   2HB   GLU  66          1HB       GLU  66  -4.427  -2.686   1.839
  502   1HG   GLU  66          2HG       GLU  66  -4.766  -5.117   0.428
  503   2HG   GLU  66          1HG       GLU  66  -6.121  -5.009   1.548
  504    H    ASP  67           H        ASP  67  -3.392  -6.371   0.561
  505    HA   ASP  67           HA       ASP  67  -3.550  -8.241   2.824
  506   1HB   ASP  67          2HB       ASP  67  -4.360  -9.851   1.026
  507   2HB   ASP  67          1HB       ASP  67  -5.415  -8.481   1.368
  508    H    GLY  68           H        GLY  68  -1.676  -7.565  -0.088
  509   1HA   GLY  68          2HA       GLY  68   0.446  -8.251  -0.697
  510   2HA   GLY  68          1HA       GLY  68   0.604  -9.002   0.889
  511    H    SER  69           H        SER  69  -1.692  -9.533  -1.772
  512    HA   SER  69           HA       SER  69  -1.531 -12.398  -1.500
  513   1HB   SER  69          2HB       SER  69  -3.067 -12.359  -3.509
  514   2HB   SER  69          1HB       SER  69  -3.660 -11.489  -2.096
  515    HG   SER  69           HG       SER  69  -3.755  -9.819  -3.365
  516    H    GLY  70           H        GLY  70   0.318 -10.106  -3.224
  517   1HA   GLY  70          2HA       GLY  70   2.245 -10.616  -4.482
  518   2HA   GLY  70          1HA       GLY  70   1.609 -12.235  -4.766
  519    H    THR  71           H        THR  71  -0.706  -9.758  -5.174
  520    HA   THR  71           HA       THR  71  -0.186  -9.431  -8.038
  521    HB   THR  71           HB       THR  71  -2.421 -10.100  -8.679
  522    HG1  THR  71           HG1      THR  71  -3.944 -10.587  -7.233
  523   1HG2  THR  71          1HG2      THR  71  -2.360 -12.508  -8.100
  524   2HG2  THR  71          2HG2      THR  71  -1.160 -12.165  -6.852
  525   3HG2  THR  71          3HG2      THR  71  -0.765 -11.904  -8.552
  526    H    VAL  72           H        VAL  72  -0.612  -7.393  -8.671
  527    HA   VAL  72           HA       VAL  72  -1.785  -5.568  -6.707
  528    HB   VAL  72           HB       VAL  72  -0.733  -4.784  -9.420
  529   1HG1  VAL  72          1HG1      VAL  72  -0.487  -2.631  -8.437
  530   2HG1  VAL  72          2HG1      VAL  72  -0.672  -3.270  -6.803
  531   3HG1  VAL  72          3HG1      VAL  72  -2.062  -3.204  -7.888
  532   1HG2  VAL  72          1HG2      VAL  72   1.048  -6.076  -8.371
  533   2HG2  VAL  72          2HG2      VAL  72   0.810  -5.221  -6.844
  534   3HG2  VAL  72          3HG2      VAL  72   1.443  -4.358  -8.247
  535    H    ASP  73           H        ASP  73  -3.851  -5.060  -6.735
  536    HA   ASP  73           HA       ASP  73  -5.527  -5.704  -9.028
  537   1HB   ASP  73          2HB       ASP  73  -6.126  -4.499  -6.312
  538   2HB   ASP  73          1HB       ASP  73  -7.352  -4.733  -7.558
  539    H    PHE  74           H        PHE  74  -7.014  -3.997  -9.929
  540    HA   PHE  74           HA       PHE  74  -5.546  -1.830 -10.916
  541   1HB   PHE  74          2HB       PHE  74  -7.679  -2.782 -11.902
  542   2HB   PHE  74          1HB       PHE  74  -8.558  -1.828 -10.707
  543    HD1  PHE  74           HD1      PHE  74  -5.433  -1.070 -12.615
  544    HD2  PHE  74           HD2      PHE  74  -9.540  -0.054 -11.885
  545    HE1  PHE  74           HE1      PHE  74  -5.191   0.939 -14.044
  546    HE2  PHE  74           HE2      PHE  74  -9.298   1.955 -13.315
  547    HZ   PHE  74           HZ       PHE  74  -7.126   2.452 -14.394
  548    H    ASP  75           H        ASP  75  -7.511  -2.098  -8.009
  549    HA   ASP  75           HA       ASP  75  -7.606   0.717  -7.456
  550   1HB   ASP  75          2HB       ASP  75  -8.098  -1.753  -5.794
  551   2HB   ASP  75          1HB       ASP  75  -8.099  -0.144  -5.071
  552    H    GLU  76           H        GLU  76  -5.526  -1.983  -6.418
  553    HA   GLU  76           HA       GLU  76  -3.853  -0.416  -4.699
  554   1HB   GLU  76          2HB       GLU  76  -3.212  -3.030  -6.094
  555   2HB   GLU  76          1HB       GLU  76  -2.345  -2.340  -4.723
  556   1HG   GLU  76          2HG       GLU  76  -4.379  -2.500  -3.336
  557   2HG   GLU  76          1HG       GLU  76  -5.270  -3.158  -4.707
  558    H    PHE  77           H        PHE  77  -3.938  -1.092  -8.119
  559    HA   PHE  77           HA       PHE  77  -1.290  -0.365  -8.820
  560   1HB   PHE  77          2HB       PHE  77  -3.354  -1.475 -10.159
  561   2HB   PHE  77          1HB       PHE  77  -3.522   0.183 -10.712
  562    HD1  PHE  77           HD1      PHE  77  -3.068  -0.719 -12.982
  563    HD2  PHE  77           HD2      PHE  77  -0.115  -0.876  -9.852
  564    HE1  PHE  77           HE1      PHE  77  -1.293  -1.113 -14.657
  565    HE2  PHE  77           HE2      PHE  77   1.647  -1.259 -11.539
  566    HZ   PHE  77           HZ       PHE  77   1.060  -1.385 -13.944
  567    H    LEU  78           H        LEU  78  -4.358   1.450  -9.020
  568    HA   LEU  78           HA       LEU  78  -3.119   3.931  -9.730
  569   1HB   LEU  78          2HB       LEU  78  -5.861   3.097  -8.870
  570   2HB   LEU  78          1HB       LEU  78  -5.447   4.802  -8.880
  571    HG   LEU  78           HG       LEU  78  -5.203   4.841 -11.230
  572   1HD1  LEU  78          1HD1      LEU  78  -3.818   2.766 -11.371
  573   2HD1  LEU  78          2HD1      LEU  78  -5.050   2.856 -12.628
  574   3HD1  LEU  78          3HD1      LEU  78  -5.293   1.812 -11.227
  575   1HD2  LEU  78          1HD2      LEU  78  -7.551   4.609 -10.463
  576   2HD2  LEU  78          2HD2      LEU  78  -7.420   2.858 -10.632
  577   3HD2  LEU  78          3HD2      LEU  78  -7.313   3.892 -12.058
  578    H    VAL  79           H        VAL  79  -3.981   2.386  -6.696
  579    HA   VAL  79           HA       VAL  79  -3.843   4.647  -5.000
  580    HB   VAL  79           HB       VAL  79  -3.707   1.687  -4.626
  581   1HG1  VAL  79          1HG1      VAL  79  -2.857   3.681  -2.506
  582   2HG1  VAL  79          2HG1      VAL  79  -1.851   2.417  -3.218
  583   3HG1  VAL  79          3HG1      VAL  79  -3.228   1.983  -2.205
  584   1HG2  VAL  79          1HG2      VAL  79  -5.586   2.106  -3.193
  585   2HG2  VAL  79          2HG2      VAL  79  -5.808   3.114  -4.622
  586   3HG2  VAL  79          3HG2      VAL  79  -5.224   3.831  -3.121
  587    H    MET  80           H        MET  80  -1.397   2.214  -5.900
  588    HA   MET  80           HA       MET  80   0.790   3.024  -4.459
  589   1HB   MET  80          2HB       MET  80   0.375   1.332  -6.620
  590   2HB   MET  80          1HB       MET  80   1.525   2.515  -7.241
  591   1HG   MET  80          2HG       MET  80   2.812   2.137  -5.031
  592   2HG   MET  80          1HG       MET  80   1.814   0.695  -4.852
  593   1HE   MET  80          1HE       MET  80   1.270  -0.737  -6.656
  594   2HE   MET  80          2HE       MET  80   2.649  -1.762  -6.265
  595   3HE   MET  80          3HE       MET  80   2.345  -1.308  -7.940
  596    H    MET  81           H        MET  81  -0.537   4.563  -7.364
  597    HA   MET  81           HA       MET  81   1.629   6.397  -7.744
  598   1HB   MET  81          2HB       MET  81  -0.014   5.775  -9.522
  599   2HB   MET  81          1HB       MET  81  -1.243   6.690  -8.652
  600   1HG   MET  81          2HG       MET  81   0.361   8.686  -8.781
  601   2HG   MET  81          1HG       MET  81   1.285   7.737  -9.944
  602   1HE   MET  81          1HE       MET  81  -2.051   8.825  -8.804
  603   2HE   MET  81          2HE       MET  81  -2.826   7.564  -9.761
  604   3HE   MET  81          3HE       MET  81  -3.001   9.251 -10.234
  605    H    VAL  82           H        VAL  82  -1.705   6.936  -6.539
  606    HA   VAL  82           HA       VAL  82  -1.258   9.582  -5.663
  607    HB   VAL  82           HB       VAL  82  -3.291   9.281  -4.270
  608   1HG1  VAL  82          1HG1      VAL  82  -3.370   9.814  -6.723
  609   2HG1  VAL  82          2HG1      VAL  82  -4.805   8.974  -6.134
  610   3HG1  VAL  82          3HG1      VAL  82  -3.577   8.091  -7.040
  611   1HG2  VAL  82          1HG2      VAL  82  -3.345   6.462  -5.367
  612   2HG2  VAL  82          2HG2      VAL  82  -4.444   7.180  -4.190
  613   3HG2  VAL  82          3HG2      VAL  82  -2.770   6.847  -3.744
  614    H    ARG  83           H        ARG  83  -0.570   6.513  -4.153
  615    HA   ARG  83           HA       ARG  83  -0.419   7.129  -1.462
  616   1HB   ARG  83          2HB       ARG  83   1.127   5.256  -3.217
  617   2HB   ARG  83          1HB       ARG  83   1.628   5.480  -1.541
  618   1HG   ARG  83          2HG       ARG  83  -1.086   5.176  -1.264
  619   2HG   ARG  83          1HG       ARG  83  -0.749   4.111  -2.629
  620   1HD   ARG  83          2HD       ARG  83   0.624   2.721  -1.386
  621   2HD   ARG  83          1HD       ARG  83   1.069   3.993  -0.255
  622    HE   ARG  83           HE       ARG  83  -1.700   3.382   0.000
  623   1HH1  ARG  83          2HH1      ARG  83   1.483   2.126   0.692
  624   2HH1  ARG  83          1HH1      ARG  83   0.959   1.203   2.059
  625   1HH2  ARG  83          1HH2      ARG  83  -2.365   2.165   1.796
  626   2HH2  ARG  83          2HH2      ARG  83  -1.212   1.225   2.684
  627    H    CYS  84           H        CYS  84   1.801   8.051  -4.040
  628    HA   CYS  84           HA       CYS  84   4.016   8.804  -2.446
  629   1HB   CYS  84          2HB       CYS  84   3.065   9.736  -5.159
  630   2HB   CYS  84          1HB       CYS  84   4.539  10.350  -4.410
  631    HG   CYS  84           HG       CYS  84   5.648   8.089  -4.669
  632    H    MET  85           H        MET  85   1.175  10.606  -3.571
  633    HA   MET  85           HA       MET  85   1.992  13.012  -2.128
  634   1HB   MET  85          2HB       MET  85   0.753  12.840  -4.439
  635   2HB   MET  85          1HB       MET  85  -0.684  12.675  -3.430
  636   1HG   MET  85          2HG       MET  85  -0.270  14.787  -2.351
  637   2HG   MET  85          1HG       MET  85   1.326  14.914  -3.092
  638   1HE   MET  85          1HE       MET  85  -0.308  17.580  -3.691
  639   2HE   MET  85          2HE       MET  85  -1.416  16.532  -2.807
  640   3HE   MET  85          3HE       MET  85  -1.916  17.236  -4.343
  641    H    LYS  86           H        LYS  86  -0.195  10.314  -1.797
  642    HA   LYS  86           HA       LYS  86  -1.765   9.684  -0.292
  643   1HB   LYS  86          2HB       LYS  86  -1.108  10.003   2.114
  644   2HB   LYS  86          1HB       LYS  86   0.105   9.234   1.101
  645   1HG   LYS  86          2HG       LYS  86   1.221  11.463   0.841
  646   2HG   LYS  86          1HG       LYS  86   0.067  12.129   1.999
  647   1HD   LYS  86          2HD       LYS  86   1.022  11.040   3.780
  648   2HD   LYS  86          1HD       LYS  86   1.496   9.647   2.805
  649   1HE   LYS  86          2HE       LYS  86   2.820  12.315   2.368
  650   2HE   LYS  86          1HE       LYS  86   3.356  11.265   3.679
  651   1HZ   LYS  86          1HZ       LYS  86   4.619  10.858   1.666
  652   2HZ   LYS  86          2HZ       LYS  86   3.194  10.514   0.807
  653   3HZ   LYS  86          3HZ       LYS  86   3.698   9.492   2.068
  654    H    ASP  87           H        ASP  87  -3.040  10.448   1.780
  655    HA   ASP  87           HA       ASP  87  -4.257  13.027   1.020
  656   1HB   ASP  87          2HB       ASP  87  -5.363  10.477   1.622
  657   2HB   ASP  87          1HB       ASP  87  -5.841  11.577   2.917
  658    H    ASP  88           H        ASP  88  -3.529  11.088   3.937
  659    HA   ASP  88           HA       ASP  88  -2.459  13.380   5.317
  660   1HB   ASP  88          2HB       ASP  88  -5.121  13.376   5.481
  661   2HB   ASP  88          1HB       ASP  88  -4.796  12.204   6.757
  662    H    SER  89           HN       SER  89  -0.648  12.197   5.737
  663    HA   SER  89           HA       SER  89  -0.903  10.126   7.793
  664   1HB   SER  89          2HB       SER  89  -0.755   9.179   5.313
  665   2HB   SER  89          1HB       SER  89   0.960   9.507   5.539
  666    HG   SER  89           HG       SER  89  -0.501   7.489   6.492
  Start of MODEL   24
    1   1H    MET   1          1H        MET   1  -8.658   1.188   6.628
    2   2H    MET   1          2H        MET   1  -8.017   2.076   7.927
    3   3H    MET   1          3H        MET   1  -8.384   0.430   8.121
    4    HA   MET   1           HA       MET   1  -5.987   0.822   7.874
    5   1HB   MET   1          2HB       MET   1  -7.250  -1.274   7.059
    6   2HB   MET   1          1HB       MET   1  -7.068  -0.605   5.438
    7   1HG   MET   1          2HG       MET   1  -4.696  -0.708   5.544
    8   2HG   MET   1          1HG       MET   1  -4.705  -0.934   7.294
    9   1HE   MET   1          1HE       MET   1  -3.179  -4.133   6.370
   10   2HE   MET   1          2HE       MET   1  -2.940  -2.388   6.355
   11   3HE   MET   1          3HE       MET   1  -3.260  -3.238   4.845
   12    H    ASN   2           H        ASN   2  -6.121   3.245   7.358
   13    HA   ASN   2           HA       ASN   2  -5.434   5.031   6.100
   14   1HB   ASN   2          2HB       ASN   2  -4.014   2.733   4.804
   15   2HB   ASN   2          1HB       ASN   2  -3.963   4.315   4.030
   16   1HD2  ASN   2          1HD2      ASN   2  -3.485   6.182   5.795
   17   2HD2  ASN   2          2HD2      ASN   2  -2.218   5.820   6.865
   18    H    ASP   3           H        ASP   3  -7.476   5.700   5.452
   19    HA   ASP   3           HA       ASP   3  -8.501   4.713   2.877
   20   1HB   ASP   3          2HB       ASP   3  -9.739   6.370   5.074
   21   2HB   ASP   3          1HB       ASP   3 -10.508   6.149   3.501
   22    H    ILE   4           H        ILE   4  -6.737   7.366   4.164
   23    HA   ILE   4           HA       ILE   4  -7.630   9.468   2.507
   24    HB   ILE   4           HB       ILE   4  -5.444  10.531   2.958
   25   1HG1  ILE   4          2HG1      ILE   4  -4.147   8.975   4.781
   26   2HG1  ILE   4          1HG1      ILE   4  -4.754   7.734   3.684
   27   1HG2  ILE   4          1HG2      ILE   4  -7.408  10.360   4.641
   28   2HG2  ILE   4          2HG2      ILE   4  -5.834  10.863   5.258
   29   3HG2  ILE   4          3HG2      ILE   4  -6.386   9.206   5.497
   30   1HD1  ILE   4          1HD1      ILE   4  -3.418  10.184   2.565
   31   2HD1  ILE   4          2HD1      ILE   4  -3.556   8.573   1.860
   32   3HD1  ILE   4          3HD1      ILE   4  -2.435   8.861   3.192
   33    H    TYR   5           H        TYR   5  -5.458   6.788   1.885
   34    HA   TYR   5           HA       TYR   5  -4.265   7.815  -0.500
   35   1HB   TYR   5          2HB       TYR   5  -4.649   4.970   0.470
   36   2HB   TYR   5          1HB       TYR   5  -3.725   5.406  -0.967
   37    HD1  TYR   5           HD1      TYR   5  -1.571   6.538  -0.794
   38    HD2  TYR   5           HD2      TYR   5  -3.864   5.594   2.713
   39    HE1  TYR   5           HE1      TYR   5   0.403   7.016   0.629
   40    HE2  TYR   5           HE2      TYR   5  -1.892   6.072   4.132
   41    HH   TYR   5           HH       TYR   5   0.574   6.126   3.900
   42    H    LYS   6           H        LYS   6  -7.214   6.036   0.220
   43    HA   LYS   6           HA       LYS   6  -7.880   5.394  -2.491
   44   1HB   LYS   6          2HB       LYS   6  -9.081   5.038   0.144
   45   2HB   LYS   6          1HB       LYS   6 -10.277   5.432  -1.092
   46   1HG   LYS   6          2HG       LYS   6 -10.128   3.099  -1.271
   47   2HG   LYS   6          1HG       LYS   6  -9.014   3.645  -2.526
   48   1HD   LYS   6          2HD       LYS   6  -7.429   3.571  -0.239
   49   2HD   LYS   6          1HD       LYS   6  -8.458   2.149  -0.073
   50   1HE   LYS   6          2HE       LYS   6  -6.968   2.805  -2.626
   51   2HE   LYS   6          1HE       LYS   6  -6.292   1.780  -1.362
   52   1HZ   LYS   6          1HZ       LYS   6  -8.726   1.304  -2.984
   53   2HZ   LYS   6          2HZ       LYS   6  -8.387   0.428  -1.567
   54   3HZ   LYS   6          3HZ       LYS   6  -7.329   0.348  -2.893
   55    H    ALA   7           H        ALA   7  -8.174   8.266  -0.579
   56    HA   ALA   7           HA       ALA   7 -10.415   9.462  -1.832
   57   1HB   ALA   7          1HB       ALA   7  -9.221  10.217   0.304
   58   2HB   ALA   7          2HB       ALA   7  -9.736  11.486  -0.807
   59   3HB   ALA   7          3HB       ALA   7  -8.044  10.989  -0.760
   60    H    ALA   8           H        ALA   8  -7.007   9.249  -2.737
   61    HA   ALA   8           HA       ALA   8  -7.135  11.246  -4.801
   62   1HB   ALA   8          1HB       ALA   8  -4.938  10.348  -5.493
   63   2HB   ALA   8          2HB       ALA   8  -5.132   9.020  -4.350
   64   3HB   ALA   8          3HB       ALA   8  -4.994  10.677  -3.761
   65    H    VAL   9           H        VAL   9  -7.227   7.685  -4.757
   66    HA   VAL   9           HA       VAL   9  -7.456   7.388  -7.580
   67    HB   VAL   9           HB       VAL   9  -6.736   5.591  -5.967
   68   1HG1  VAL   9          1HG1      VAL   9  -8.423   5.836  -4.254
   69   2HG1  VAL   9          2HG1      VAL   9  -8.593   4.234  -4.967
   70   3HG1  VAL   9          3HG1      VAL   9  -9.714   5.521  -5.411
   71   1HG2  VAL   9          1HG2      VAL   9  -7.398   3.929  -7.441
   72   2HG2  VAL   9          2HG2      VAL   9  -7.779   5.353  -8.409
   73   3HG2  VAL   9          3HG2      VAL   9  -9.058   4.520  -7.526
   74    H    GLU  10           H        GLU  10  -9.721   8.227  -5.098
   75    HA   GLU  10           HA       GLU  10 -12.080   7.497  -6.613
   76   1HB   GLU  10          2HB       GLU  10 -11.575   8.854  -3.984
   77   2HB   GLU  10          1HB       GLU  10 -13.164   8.974  -4.742
   78   1HG   GLU  10          2HG       GLU  10 -13.376   6.557  -4.814
   79   2HG   GLU  10          1HG       GLU  10 -11.726   6.355  -4.226
   80    H    GLN  11           H        GLN  11  -9.947  10.234  -6.436
   81    HA   GLN  11           HA       GLN  11 -11.881  11.801  -8.039
   82   1HB   GLN  11          2HB       GLN  11 -11.132  13.841  -7.007
   83   2HB   GLN  11          1HB       GLN  11 -11.574  12.716  -5.725
   84   1HG   GLN  11          2HG       GLN  11  -9.057  12.046  -5.748
   85   2HG   GLN  11          1HG       GLN  11  -8.821  13.560  -6.619
   86   1HE2  GLN  11          1HE2      GLN  11  -7.908  12.910  -3.848
   87   2HE2  GLN  11          2HE2      GLN  11  -8.638  14.064  -2.841
   88    H    LEU  12           H        LEU  12  -9.607   9.984  -8.839
   89    HA   LEU  12           HA       LEU  12  -7.573  11.764  -9.885
   90   1HB   LEU  12          2HB       LEU  12  -6.917   9.635 -11.186
   91   2HB   LEU  12          1HB       LEU  12  -6.655   9.699  -9.462
   92    HG   LEU  12           HG       LEU  12  -8.483   8.223  -9.047
   93   1HD1  LEU  12          1HD1      LEU  12  -9.173   8.739 -11.942
   94   2HD1  LEU  12          2HD1      LEU  12 -10.194   8.948 -10.518
   95   3HD1  LEU  12          3HD1      LEU  12  -9.790   7.327 -11.082
   96   1HD2  LEU  12          1HD2      LEU  12  -6.792   6.778  -9.593
   97   2HD2  LEU  12          2HD2      LEU  12  -6.514   7.534 -11.162
   98   3HD2  LEU  12          3HD2      LEU  12  -7.854   6.405 -10.951
   99    H    THR  13           H        THR  13  -7.017  11.229 -12.367
  100    HA   THR  13           HA       THR  13  -9.424  12.059 -13.861
  101    HB   THR  13           HB       THR  13  -7.353  12.341 -15.625
  102    HG1  THR  13           HG1      THR  13  -5.609  12.195 -14.487
  103   1HG2  THR  13          1HG2      THR  13  -8.036  14.479 -15.560
  104   2HG2  THR  13          2HG2      THR  13  -7.610  14.654 -13.857
  105   3HG2  THR  13          3HG2      THR  13  -9.167  13.959 -14.311
  106    H    ASP  14           H        ASP  14  -9.473  11.329 -16.178
  107    HA   ASP  14           HA       ASP  14  -9.544   8.474 -16.288
  108   1HB   ASP  14          2HB       ASP  14 -10.020  10.684 -18.261
  109   2HB   ASP  14          1HB       ASP  14  -9.809   9.037 -18.854
  110    H    GLU  15           H        GLU  15  -7.288  10.966 -17.358
  111    HA   GLU  15           HA       GLU  15  -5.615   9.241 -18.915
  112   1HB   GLU  15          2HB       GLU  15  -5.174  11.951 -17.656
  113   2HB   GLU  15          1HB       GLU  15  -3.912  11.114 -18.560
  114   1HG   GLU  15          2HG       GLU  15  -6.661  11.533 -19.736
  115   2HG   GLU  15          1HG       GLU  15  -5.415  12.775 -19.862
  116    H    GLN  16           H        GLN  16  -5.780  10.135 -15.515
  117    HA   GLN  16           HA       GLN  16  -3.237   9.139 -14.723
  118   1HB   GLN  16          2HB       GLN  16  -4.880  10.661 -13.410
  119   2HB   GLN  16          1HB       GLN  16  -5.646   9.151 -12.918
  120   1HG   GLN  16          2HG       GLN  16  -3.242   8.393 -12.280
  121   2HG   GLN  16          1HG       GLN  16  -2.847  10.111 -12.352
  122   1HE2  GLN  16          1HE2      GLN  16  -4.546  11.539 -11.064
  123   2HE2  GLN  16          2HE2      GLN  16  -5.010  10.923  -9.552
  124    H    LYS  17           H        LYS  17  -6.510   7.693 -14.604
  125    HA   LYS  17           HA       LYS  17  -5.519   5.171 -13.657
  126   1HB   LYS  17          2HB       LYS  17  -7.830   4.330 -14.186
  127   2HB   LYS  17          1HB       LYS  17  -7.787   5.704 -13.089
  128   1HG   LYS  17          2HG       LYS  17  -9.469   6.342 -14.566
  129   2HG   LYS  17          1HG       LYS  17  -8.065   7.116 -15.293
  130   1HD   LYS  17          2HD       LYS  17  -8.161   5.810 -17.133
  131   2HD   LYS  17          1HD       LYS  17  -8.429   4.349 -16.186
  132   1HE   LYS  17          2HE       LYS  17 -10.697   4.479 -16.390
  133   2HE   LYS  17          1HE       LYS  17 -10.708   6.236 -16.236
  134   1HZ   LYS  17          1HZ       LYS  17  -9.986   6.442 -18.502
  135   2HZ   LYS  17          2HZ       LYS  17 -11.368   5.456 -18.457
  136   3HZ   LYS  17          3HZ       LYS  17  -9.833   4.760 -18.662
  137    H    ASN  18           H        ASN  18  -6.120   6.583 -16.817
  138    HA   ASN  18           HA       ASN  18  -6.076   4.167 -18.327
  139   1HB   ASN  18          2HB       ASN  18  -5.695   7.067 -18.964
  140   2HB   ASN  18          1HB       ASN  18  -5.185   5.871 -20.153
  141   1HD2  ASN  18          1HD2      ASN  18  -7.517   7.771 -20.299
  142   2HD2  ASN  18          2HD2      ASN  18  -8.882   6.786 -20.515
  143    H    GLU  19           H        GLU  19  -3.582   6.306 -17.067
  144    HA   GLU  19           HA       GLU  19  -1.363   5.431 -18.534
  145   1HB   GLU  19          2HB       GLU  19  -1.371   7.368 -16.951
  146   2HB   GLU  19          1HB       GLU  19  -1.394   6.224 -15.609
  147   1HG   GLU  19          2HG       GLU  19   0.732   5.257 -16.378
  148   2HG   GLU  19          1HG       GLU  19   0.754   6.368 -17.747
  149    H    PHE  20           H        PHE  20  -2.700   4.197 -15.463
  150    HA   PHE  20           HA       PHE  20  -0.818   1.990 -15.372
  151   1HB   PHE  20          2HB       PHE  20  -3.130   2.878 -13.673
  152   2HB   PHE  20          1HB       PHE  20  -2.440   1.269 -13.470
  153    HD1  PHE  20           HD1      PHE  20  -1.859   4.880 -13.104
  154    HD2  PHE  20           HD2      PHE  20  -0.123   0.970 -12.712
  155    HE1  PHE  20           HE1      PHE  20  -0.011   5.835 -11.758
  156    HE2  PHE  20           HE2      PHE  20   1.717   1.917 -11.357
  157    HZ   PHE  20           HZ       PHE  20   1.779   4.354 -10.882
  158    H    LYS  21           H        LYS  21  -4.303   2.402 -15.973
  159    HA   LYS  21           HA       LYS  21  -5.081  -0.247 -16.243
  160   1HB   LYS  21          2HB       LYS  21  -6.635   1.679 -16.262
  161   2HB   LYS  21          1HB       LYS  21  -6.086   2.087 -17.886
  162   1HG   LYS  21          2HG       LYS  21  -6.844  -0.725 -17.671
  163   2HG   LYS  21          1HG       LYS  21  -8.174   0.349 -17.240
  164   1HD   LYS  21          2HD       LYS  21  -6.586   1.051 -19.667
  165   2HD   LYS  21          1HD       LYS  21  -7.676  -0.331 -19.785
  166   1HE   LYS  21          2HE       LYS  21  -9.581   0.972 -19.338
  167   2HE   LYS  21          1HE       LYS  21  -8.638   2.270 -18.607
  168   1HZ   LYS  21          1HZ       LYS  21  -7.724   2.799 -20.765
  169   2HZ   LYS  21          2HZ       LYS  21  -9.421   2.849 -20.827
  170   3HZ   LYS  21          3HZ       LYS  21  -8.582   1.524 -21.482
  171    H    ALA  22           H        ALA  22  -3.363   1.791 -18.566
  172    HA   ALA  22           HA       ALA  22  -3.690   0.209 -20.875
  173   1HB   ALA  22          1HB       ALA  22  -1.597   1.268 -21.668
  174   2HB   ALA  22          2HB       ALA  22  -1.310   1.890 -20.042
  175   3HB   ALA  22          3HB       ALA  22  -2.702   2.453 -20.968
  176    H    ALA  23           H        ALA  23  -1.014   0.249 -18.517
  177    HA   ALA  23           HA       ALA  23   0.299  -2.063 -19.541
  178   1HB   ALA  23          1HB       ALA  23   1.576  -0.528 -18.193
  179   2HB   ALA  23          2HB       ALA  23   1.464  -2.044 -17.298
  180   3HB   ALA  23          3HB       ALA  23   0.441  -0.679 -16.849
  181    H    PHE  24           H        PHE  24  -2.129  -1.490 -17.055
  182    HA   PHE  24           HA       PHE  24  -2.172  -4.014 -15.824
  183   1HB   PHE  24          2HB       PHE  24  -3.407  -1.839 -15.162
  184   2HB   PHE  24          1HB       PHE  24  -4.655  -2.367 -16.288
  185    HD1  PHE  24           HD1      PHE  24  -5.624  -4.743 -15.977
  186    HD2  PHE  24           HD2      PHE  24  -3.317  -2.713 -12.982
  187    HE1  PHE  24           HE1      PHE  24  -6.525  -6.271 -14.247
  188    HE2  PHE  24           HE2      PHE  24  -4.216  -4.238 -11.255
  189    HZ   PHE  24           HZ       PHE  24  -5.823  -6.012 -11.891
  190    H    ASP  25           H        ASP  25  -3.949  -2.784 -18.654
  191    HA   ASP  25           HA       ASP  25  -5.560  -5.056 -19.096
  192   1HB   ASP  25          2HB       ASP  25  -5.567  -2.634 -20.177
  193   2HB   ASP  25          1HB       ASP  25  -4.618  -3.442 -21.423
  194    H    ILE  26           H        ILE  26  -2.404  -4.160 -20.519
  195    HA   ILE  26           HA       ILE  26  -2.241  -6.472 -22.176
  196    HB   ILE  26           HB       ILE  26   0.168  -5.884 -22.424
  197   1HG1  ILE  26          2HG1      ILE  26  -0.533  -3.626 -20.517
  198   2HG1  ILE  26          1HG1      ILE  26   0.497  -4.998 -20.114
  199   1HG2  ILE  26          1HG2      ILE  26  -1.620  -4.854 -23.813
  200   2HG2  ILE  26          2HG2      ILE  26  -0.257  -3.763 -23.565
  201   3HG2  ILE  26          3HG2      ILE  26  -1.743  -3.540 -22.643
  202   1HD1  ILE  26          1HD1      ILE  26   1.344  -3.730 -22.593
  203   2HD1  ILE  26          2HD1      ILE  26   2.275  -4.064 -21.132
  204   3HD1  ILE  26          3HD1      ILE  26   1.324  -2.584 -21.252
  205    H    PHE  27           H        PHE  27  -0.995  -5.778 -18.910
  206    HA   PHE  27           HA       PHE  27   0.446  -8.257 -18.713
  207   1HB   PHE  27          2HB       PHE  27  -0.429  -6.272 -16.606
  208   2HB   PHE  27          1HB       PHE  27   0.522  -7.713 -16.251
  209    HD1  PHE  27           HD1      PHE  27   2.399  -7.938 -18.445
  210    HD2  PHE  27           HD2      PHE  27   0.966  -4.401 -16.472
  211    HE1  PHE  27           HE1      PHE  27   4.446  -6.726 -19.131
  212    HE2  PHE  27           HE2      PHE  27   3.015  -3.191 -17.166
  213    HZ   PHE  27           HZ       PHE  27   4.754  -4.353 -18.492
  214    H    ILE  28           H        ILE  28  -2.830  -7.220 -17.937
  215    HA   ILE  28           HA       ILE  28  -3.410  -9.873 -16.791
  216    HB   ILE  28           HB       ILE  28  -4.012  -7.500 -15.741
  217   1HG1  ILE  28          2HG1      ILE  28  -4.426  -9.801 -14.829
  218   2HG1  ILE  28          1HG1      ILE  28  -5.643  -8.606 -14.380
  219   1HG2  ILE  28          1HG2      ILE  28  -5.467  -7.063 -17.880
  220   2HG2  ILE  28          2HG2      ILE  28  -6.063  -6.581 -16.292
  221   3HG2  ILE  28          3HG2      ILE  28  -6.652  -8.062 -17.040
  222   1HD1  ILE  28          1HD1      ILE  28  -7.057  -9.434 -16.286
  223   2HD1  ILE  28          2HD1      ILE  28  -6.776 -10.648 -15.038
  224   3HD1  ILE  28          3HD1      ILE  28  -5.870 -10.710 -16.549
  225    H    GLN  29           H        GLN  29  -2.922  -9.610 -19.557
  226    HA   GLN  29           HA       GLN  29  -5.406  -9.542 -21.023
  227   1HB   GLN  29          2HB       GLN  29  -3.186  -8.905 -22.009
  228   2HB   GLN  29          1HB       GLN  29  -2.718 -10.603 -21.926
  229   1HG   GLN  29          2HG       GLN  29  -4.525 -11.236 -23.410
  230   2HG   GLN  29          1HG       GLN  29  -5.174  -9.595 -23.388
  231   1HE2  GLN  29          1HE2      GLN  29  -3.386  -7.867 -24.083
  232   2HE2  GLN  29          2HE2      GLN  29  -2.454  -8.304 -25.433
  233    H    ASP  30           H        ASP  30  -3.036 -12.097 -20.233
  234    HA   ASP  30           HA       ASP  30  -4.939 -14.165 -21.027
  235   1HB   ASP  30          2HB       ASP  30  -2.052 -14.238 -20.146
  236   2HB   ASP  30          1HB       ASP  30  -3.006 -15.699 -20.397
  237    H    ALA  31           H        ALA  31  -4.514 -12.395 -18.239
  238    HA   ALA  31           HA       ALA  31  -4.895 -14.631 -16.389
  239   1HB   ALA  31          1HB       ALA  31  -5.161 -12.518 -14.783
  240   2HB   ALA  31          2HB       ALA  31  -4.279 -11.730 -16.092
  241   3HB   ALA  31          3HB       ALA  31  -3.577 -13.123 -15.270
  242    H    GLU  32           H        GLU  32  -6.691 -14.855 -15.076
  243    HA   GLU  32           HA       GLU  32  -9.127 -13.403 -15.928
  244   1HB   GLU  32          2HB       GLU  32  -8.768 -16.369 -15.456
  245   2HB   GLU  32          1HB       GLU  32 -10.351 -15.591 -15.448
  246   1HG   GLU  32          2HG       GLU  32 -10.344 -15.236 -17.708
  247   2HG   GLU  32          1HG       GLU  32  -8.606 -14.940 -17.760
  248    H    ASP  33           H        ASP  33  -7.611 -12.535 -13.842
  249    HA   ASP  33           HA       ASP  33  -9.218 -13.306 -11.475
  250   1HB   ASP  33          2HB       ASP  33  -6.989 -12.380 -10.288
  251   2HB   ASP  33          1HB       ASP  33  -7.212 -14.077 -10.702
  252    H    GLY  34           H        GLY  34  -7.291 -10.722 -12.995
  253   1HA   GLY  34          2HA       GLY  34  -8.239  -8.508 -13.273
  254   2HA   GLY  34          1HA       GLY  34  -9.089  -8.734 -11.747
  255    H    CYS  35           H        CYS  35  -5.704  -9.546 -12.392
  256    HA   CYS  35           HA       CYS  35  -4.661  -7.188 -11.090
  257   1HB   CYS  35          2HB       CYS  35  -3.494  -8.625  -9.311
  258   2HB   CYS  35          1HB       CYS  35  -5.195  -8.252  -9.056
  259    HG   CYS  35           HG       CYS  35  -5.808 -10.664  -9.829
  260    H    ILE  36           H        ILE  36  -2.431  -6.964 -11.347
  261    HA   ILE  36           HA       ILE  36  -1.279  -8.684 -13.415
  262    HB   ILE  36           HB       ILE  36   0.432  -7.014 -13.668
  263   1HG1  ILE  36          2HG1      ILE  36  -0.162  -4.938 -11.907
  264   2HG1  ILE  36          1HG1      ILE  36  -0.299  -6.380 -10.901
  265   1HG2  ILE  36          1HG2      ILE  36  -1.794  -6.481 -14.623
  266   2HG2  ILE  36          2HG2      ILE  36  -0.915  -5.025 -14.159
  267   3HG2  ILE  36          3HG2      ILE  36  -2.217  -5.633 -13.136
  268   1HD1  ILE  36          1HD1      ILE  36   2.061  -5.157 -11.365
  269   2HD1  ILE  36          2HD1      ILE  36   2.042  -6.266 -12.736
  270   3HD1  ILE  36          3HD1      ILE  36   1.931  -6.896 -11.090
  271    H    SER  37           H        SER  37   1.284  -8.905 -13.063
  272    HA   SER  37           HA       SER  37   1.537 -10.517 -10.633
  273   1HB   SER  37          2HB       SER  37   2.359 -10.985 -13.193
  274   2HB   SER  37          1HB       SER  37   3.836 -10.352 -12.476
  275    HG   SER  37           HG       SER  37   2.602 -12.739 -12.102
  276    H    THR  38           H        THR  38   2.193  -9.480  -8.855
  277    HA   THR  38           HA       THR  38   3.506  -7.012  -8.698
  278    HB   THR  38           HB       THR  38   4.123  -7.659  -6.380
  279    HG1  THR  38           HG1      THR  38   4.458  -9.705  -6.133
  280   1HG2  THR  38          1HG2      THR  38   1.975  -6.804  -6.408
  281   2HG2  THR  38          2HG2      THR  38   1.673  -8.415  -5.760
  282   3HG2  THR  38          3HG2      THR  38   1.371  -8.079  -7.464
  283    H    LYS  39           H        LYS  39   4.810 -10.300  -8.818
  284    HA   LYS  39           HA       LYS  39   7.529  -9.639  -8.381
  285   1HB   LYS  39          2HB       LYS  39   8.019 -11.825  -9.512
  286   2HB   LYS  39          1HB       LYS  39   6.855 -11.945  -8.195
  287   1HG   LYS  39          2HG       LYS  39   5.416 -11.380 -10.609
  288   2HG   LYS  39          1HG       LYS  39   6.511 -12.725 -10.921
  289   1HD   LYS  39          2HD       LYS  39   4.824 -12.672  -8.423
  290   2HD   LYS  39          1HD       LYS  39   4.153 -13.255  -9.947
  291   1HE   LYS  39          2HE       LYS  39   6.821 -14.319  -9.135
  292   2HE   LYS  39          1HE       LYS  39   5.415 -14.893  -8.241
  293   1HZ   LYS  39          1HZ       LYS  39   4.380 -15.511 -10.338
  294   2HZ   LYS  39          2HZ       LYS  39   5.873 -16.299 -10.145
  295   3HZ   LYS  39          3HZ       LYS  39   5.741 -14.968 -11.193
  296    H    GLU  40           H        GLU  40   5.485  -9.426 -11.211
  297    HA   GLU  40           HA       GLU  40   7.813  -8.723 -12.887
  298   1HB   GLU  40          2HB       GLU  40   4.972  -9.384 -13.709
  299   2HB   GLU  40          1HB       GLU  40   6.309  -9.035 -14.804
  300   1HG   GLU  40          2HG       GLU  40   7.543 -10.986 -13.925
  301   2HG   GLU  40          1HG       GLU  40   6.202 -11.340 -12.835
  302    H    LEU  41           H        LEU  41   6.417  -6.990 -10.814
  303    HA   LEU  41           HA       LEU  41   4.864  -5.008 -12.096
  304   1HB   LEU  41          2HB       LEU  41   5.675  -5.468  -9.514
  305   2HB   LEU  41          1HB       LEU  41   6.581  -4.034  -9.935
  306    HG   LEU  41           HG       LEU  41   3.640  -4.095 -10.493
  307   1HD1  LEU  41          1HD1      LEU  41   3.770  -4.905  -8.202
  308   2HD1  LEU  41          2HD1      LEU  41   3.275  -3.213  -8.177
  309   3HD1  LEU  41          3HD1      LEU  41   4.938  -3.651  -7.788
  310   1HD2  LEU  41          1HD2      LEU  41   5.428  -1.892  -9.436
  311   2HD2  LEU  41          2HD2      LEU  41   3.853  -1.727 -10.214
  312   3HD2  LEU  41          3HD2      LEU  41   5.255  -2.227 -11.159
  313    H    GLY  42           H        GLY  42   8.320  -5.560 -11.984
  314   1HA   GLY  42          2HA       GLY  42   9.318  -3.017 -12.584
  315   2HA   GLY  42          1HA       GLY  42  10.067  -4.532 -13.079
  316    H    LYS  43           H        LYS  43   7.796  -5.439 -14.652
  317    HA   LYS  43           HA       LYS  43   8.432  -4.266 -17.167
  318   1HB   LYS  43          2HB       LYS  43   6.045  -5.996 -16.459
  319   2HB   LYS  43          1HB       LYS  43   6.672  -5.691 -18.078
  320   1HG   LYS  43          2HG       LYS  43   8.895  -6.656 -17.239
  321   2HG   LYS  43          1HG       LYS  43   7.993  -7.226 -15.834
  322   1HD   LYS  43          2HD       LYS  43   6.526  -8.549 -17.225
  323   2HD   LYS  43          1HD       LYS  43   7.213  -7.854 -18.693
  324   1HE   LYS  43          2HE       LYS  43   8.946  -9.332 -16.714
  325   2HE   LYS  43          1HE       LYS  43   8.053 -10.194 -17.966
  326   1HZ   LYS  43          1HZ       LYS  43  10.228  -9.689 -18.776
  327   2HZ   LYS  43          2HZ       LYS  43  10.063  -8.047 -18.374
  328   3HZ   LYS  43          3HZ       LYS  43   9.118  -8.720 -19.615
  329    H    VAL  44           H        VAL  44   6.007  -3.570 -14.753
  330    HA   VAL  44           HA       VAL  44   4.477  -1.885 -16.594
  331    HB   VAL  44           HB       VAL  44   2.715  -2.043 -15.163
  332   1HG1  VAL  44          1HG1      VAL  44   4.028  -4.158 -13.548
  333   2HG1  VAL  44          2HG1      VAL  44   4.041  -4.395 -15.293
  334   3HG1  VAL  44          3HG1      VAL  44   2.509  -4.201 -14.442
  335   1HG2  VAL  44          1HG2      VAL  44   3.148  -2.263 -12.586
  336   2HG2  VAL  44          2HG2      VAL  44   3.358  -0.695 -13.362
  337   3HG2  VAL  44          3HG2      VAL  44   4.763  -1.690 -12.988
  338    H    MET  45           H        MET  45   6.596  -1.642 -13.775
  339    HA   MET  45           HA       MET  45   6.302   1.108 -13.247
  340   1HB   MET  45          2HB       MET  45   8.576  -0.823 -12.792
  341   2HB   MET  45          1HB       MET  45   8.693   0.875 -12.332
  342   1HG   MET  45          2HG       MET  45   6.178  -0.064 -11.394
  343   2HG   MET  45          1HG       MET  45   7.385  -1.264 -10.932
  344   1HE   MET  45          1HE       MET  45   6.580  -0.619  -8.472
  345   2HE   MET  45          2HE       MET  45   7.890   0.176  -7.606
  346   3HE   MET  45          3HE       MET  45   8.248  -1.165  -8.693
  347    H    ARG  46           H        ARG  46   8.494  -0.655 -15.423
  348    HA   ARG  46           HA       ARG  46  10.028   1.552 -16.279
  349   1HB   ARG  46          2HB       ARG  46  10.560   0.178 -18.281
  350   2HB   ARG  46          1HB       ARG  46  10.755  -0.710 -16.771
  351   1HG   ARG  46          2HG       ARG  46   9.099  -2.174 -17.281
  352   2HG   ARG  46          1HG       ARG  46   8.051  -0.912 -17.920
  353   1HD   ARG  46          2HD       ARG  46   9.192  -0.923 -20.035
  354   2HD   ARG  46          1HD       ARG  46  10.466  -1.963 -19.406
  355    HE   ARG  46           HE       ARG  46   7.930  -3.243 -19.163
  356   1HH1  ARG  46          2HH1      ARG  46  10.362  -2.339 -21.501
  357   2HH1  ARG  46          1HH1      ARG  46   9.980  -3.635 -22.582
  358   1HH2  ARG  46          1HH2      ARG  46   7.449  -4.932 -20.592
  359   2HH2  ARG  46          2HH2      ARG  46   8.336  -5.099 -22.071
  360    H    MET  47           H        MET  47   6.850   0.416 -17.243
  361    HA   MET  47           HA       MET  47   6.670   2.150 -19.557
  362   1HB   MET  47          2HB       MET  47   4.604   0.490 -18.097
  363   2HB   MET  47          1HB       MET  47   4.259   1.445 -19.537
  364   1HG   MET  47          2HG       MET  47   6.358   0.133 -20.501
  365   2HG   MET  47          1HG       MET  47   5.907  -1.038 -19.261
  366   1HE   MET  47          1HE       MET  47   3.744  -3.033 -20.101
  367   2HE   MET  47          2HE       MET  47   2.455  -1.899 -19.707
  368   3HE   MET  47          3HE       MET  47   3.960  -1.863 -18.791
  369    H    LEU  48           H        LEU  48   5.855   2.292 -16.149
  370    HA   LEU  48           HA       LEU  48   4.069   4.533 -16.314
  371   1HB   LEU  48          2HB       LEU  48   5.411   3.001 -14.163
  372   2HB   LEU  48          1HB       LEU  48   5.012   4.660 -13.784
  373    HG   LEU  48           HG       LEU  48   3.226   3.268 -13.002
  374   1HD1  LEU  48          1HD1      LEU  48   2.629   5.415 -14.152
  375   2HD1  LEU  48          2HD1      LEU  48   1.342   4.210 -14.200
  376   3HD1  LEU  48          3HD1      LEU  48   2.339   4.493 -15.627
  377   1HD2  LEU  48          1HD2      LEU  48   1.932   1.962 -14.888
  378   2HD2  LEU  48          2HD2      LEU  48   3.362   1.241 -14.152
  379   3HD2  LEU  48          3HD2      LEU  48   3.483   2.027 -15.727
  380    H    GLY  49           H        GLY  49   7.517   4.091 -16.082
  381   1HA   GLY  49          2HA       GLY  49   8.908   5.915 -16.980
  382   2HA   GLY  49          1HA       GLY  49   7.895   7.031 -16.073
  383    H    GLN  50           H        GLN  50   9.088   3.919 -14.867
  384    HA   GLN  50           HA       GLN  50  11.233   5.133 -13.333
  385   1HB   GLN  50          2HB       GLN  50  10.299   4.445 -11.124
  386   2HB   GLN  50          1HB       GLN  50   9.386   5.745 -11.888
  387   1HG   GLN  50          2HG       GLN  50   8.183   3.424 -12.866
  388   2HG   GLN  50          1HG       GLN  50   8.519   3.049 -11.177
  389   1HE2  GLN  50          1HE2      GLN  50   7.061   5.648 -13.210
  390   2HE2  GLN  50          2HE2      GLN  50   5.932   6.128 -12.038
  391    H    ASN  51           H        ASN  51  12.476   3.557 -12.108
  392    HA   ASN  51           HA       ASN  51  11.878   0.737 -12.508
  393   1HB   ASN  51          2HB       ASN  51  13.243   1.840 -14.543
  394   2HB   ASN  51          1HB       ASN  51  14.592   1.491 -13.462
  395   1HD2  ASN  51          1HD2      ASN  51  11.663  -0.119 -14.838
  396   2HD2  ASN  51          2HD2      ASN  51  12.377  -1.657 -14.922
  397    HA   PRO  52           HA       PRO  52  14.098   1.519  -8.587
  398   1HB   PRO  52          2HB       PRO  52  12.478  -0.091  -7.083
  399   2HB   PRO  52          1HB       PRO  52  12.104   1.595  -7.470
  400   1HG   PRO  52          2HG       PRO  52  10.928  -0.891  -8.553
  401   2HG   PRO  52          1HG       PRO  52  10.216   0.722  -8.408
  402   1HD   PRO  52          2HD       PRO  52  11.276  -0.448 -10.768
  403   2HD   PRO  52          1HD       PRO  52  10.804   1.254 -10.550
  404    H    THR  53           H        THR  53  14.262  -0.543  -6.731
  405    HA   THR  53           HA       THR  53  15.880  -2.552  -8.171
  406    HB   THR  53           HB       THR  53  17.210  -2.734  -6.252
  407    HG1  THR  53           HG1      THR  53  16.437  -2.595  -4.277
  408   1HG2  THR  53          1HG2      THR  53  17.217  -0.395  -7.258
  409   2HG2  THR  53          2HG2      THR  53  17.826  -0.527  -5.608
  410   3HG2  THR  53          3HG2      THR  53  16.198   0.086  -5.900
  411    HA   PRO  54           HA       PRO  54  13.206  -5.838  -6.900
  412   1HB   PRO  54          2HB       PRO  54  14.824  -7.724  -5.743
  413   2HB   PRO  54          1HB       PRO  54  14.764  -7.400  -7.482
  414   1HG   PRO  54          2HG       PRO  54  16.831  -6.638  -5.493
  415   2HG   PRO  54          1HG       PRO  54  16.997  -6.972  -7.224
  416   1HD   PRO  54          2HD       PRO  54  16.946  -4.427  -6.049
  417   2HD   PRO  54          1HD       PRO  54  16.708  -4.767  -7.778
  418    H    GLU  55           H        GLU  55  15.244  -4.572  -4.348
  419    HA   GLU  55           HA       GLU  55  13.715  -5.730  -2.174
  420   1HB   GLU  55          2HB       GLU  55  15.785  -3.513  -2.142
  421   2HB   GLU  55          1HB       GLU  55  15.130  -4.336  -0.727
  422   1HG   GLU  55          2HG       GLU  55  16.602  -6.023  -0.969
  423   2HG   GLU  55          1HG       GLU  55  16.070  -6.292  -2.630
  424    H    GLU  56           H        GLU  56  13.986  -2.591  -3.825
  425    HA   GLU  56           HA       GLU  56  12.103  -1.271  -2.091
  426   1HB   GLU  56          2HB       GLU  56  13.963  -0.421  -3.979
  427   2HB   GLU  56          1HB       GLU  56  12.406  -0.063  -4.728
  428   1HG   GLU  56          2HG       GLU  56  12.730   1.860  -3.461
  429   2HG   GLU  56          1HG       GLU  56  11.814   0.869  -2.326
  430    H    LEU  57           H        LEU  57  11.956  -2.964  -5.180
  431    HA   LEU  57           HA       LEU  57   9.379  -2.186  -5.996
  432   1HB   LEU  57          2HB       LEU  57  10.641  -3.257  -7.620
  433   2HB   LEU  57          1HB       LEU  57  11.194  -4.499  -6.527
  434    HG   LEU  57           HG       LEU  57   9.617  -5.186  -8.400
  435   1HD1  LEU  57          1HD1      LEU  57   8.282  -6.048  -5.921
  436   2HD1  LEU  57          2HD1      LEU  57  10.040  -6.193  -5.894
  437   3HD1  LEU  57          3HD1      LEU  57   9.105  -7.006  -7.151
  438   1HD2  LEU  57          1HD2      LEU  57   7.507  -4.381  -8.504
  439   2HD2  LEU  57          2HD2      LEU  57   8.059  -3.120  -7.404
  440   3HD2  LEU  57          3HD2      LEU  57   7.267  -4.561  -6.768
  441    H    GLN  58           H        GLN  58  10.508  -4.925  -4.016
  442    HA   GLN  58           HA       GLN  58   7.941  -6.062  -3.570
  443   1HB   GLN  58          2HB       GLN  58  10.188  -7.197  -3.198
  444   2HB   GLN  58          1HB       GLN  58  10.301  -6.279  -1.697
  445   1HG   GLN  58          2HG       GLN  58   9.353  -8.471  -1.213
  446   2HG   GLN  58          1HG       GLN  58   8.109  -7.245  -0.988
  447   1HE2  GLN  58          1HE2      GLN  58   6.192  -7.483  -2.207
  448   2HE2  GLN  58          2HE2      GLN  58   5.995  -8.614  -3.458
  449    H    GLU  59           H        GLU  59   9.809  -3.573  -1.894
  450    HA   GLU  59           HA       GLU  59   8.293  -3.390   0.474
  451   1HB   GLU  59          2HB       GLU  59  10.055  -1.491  -1.035
  452   2HB   GLU  59          1HB       GLU  59   9.069  -0.876   0.291
  453   1HG   GLU  59          2HG       GLU  59  10.614  -3.383   0.783
  454   2HG   GLU  59          1HG       GLU  59  11.520  -1.871   0.705
  455    H    MET  60           H        MET  60   7.792  -1.994  -2.745
  456    HA   MET  60           HA       MET  60   5.683  -0.221  -2.037
  457   1HB   MET  60          2HB       MET  60   6.138  -1.559  -4.715
  458   2HB   MET  60          1HB       MET  60   5.182  -0.108  -4.414
  459   1HG   MET  60          2HG       MET  60   8.043  -0.143  -3.533
  460   2HG   MET  60          1HG       MET  60   7.690   0.082  -5.244
  461   1HE   MET  60          1HE       MET  60   9.283   1.922  -4.014
  462   2HE   MET  60          2HE       MET  60   8.692   2.257  -2.390
  463   3HE   MET  60          3HE       MET  60   8.642   3.522  -3.615
  464    H    ILE  61           H        ILE  61   5.743  -3.537  -3.254
  465    HA   ILE  61           HA       ILE  61   2.921  -3.879  -3.403
  466    HB   ILE  61           HB       ILE  61   5.064  -5.990  -3.027
  467   1HG1  ILE  61          2HG1      ILE  61   3.772  -5.473  -5.660
  468   2HG1  ILE  61          1HG1      ILE  61   4.928  -4.260  -5.106
  469   1HG2  ILE  61          1HG2      ILE  61   2.194  -6.141  -4.001
  470   2HG2  ILE  61          2HG2      ILE  61   2.835  -6.846  -2.516
  471   3HG2  ILE  61          3HG2      ILE  61   3.350  -7.470  -4.083
  472   1HD1  ILE  61          1HD1      ILE  61   5.531  -7.227  -5.169
  473   2HD1  ILE  61          2HD1      ILE  61   6.667  -5.910  -4.883
  474   3HD1  ILE  61          3HD1      ILE  61   5.947  -6.122  -6.479
  475    H    ASP  62           H        ASP  62   5.318  -4.776  -0.920
  476    HA   ASP  62           HA       ASP  62   3.578  -5.991   0.908
  477   1HB   ASP  62          2HB       ASP  62   6.247  -4.677   1.110
  478   2HB   ASP  62          1HB       ASP  62   5.367  -4.990   2.605
  479    H    GLU  63           H        GLU  63   4.204  -2.575   0.295
  480    HA   GLU  63           HA       GLU  63   2.758  -1.725   2.676
  481   1HB   GLU  63          2HB       GLU  63   4.045  -0.215   0.396
  482   2HB   GLU  63          1HB       GLU  63   3.121   0.580   1.670
  483   1HG   GLU  63          2HG       GLU  63   5.262  -1.349   2.481
  484   2HG   GLU  63          1HG       GLU  63   5.752   0.243   1.899
  485    H    VAL  64           H        VAL  64   2.327  -1.376  -0.862
  486    HA   VAL  64           HA       VAL  64  -0.280  -0.240  -0.697
  487    HB   VAL  64           HB       VAL  64   1.058  -1.692  -2.995
  488   1HG1  VAL  64          1HG1      VAL  64  -1.479  -0.101  -2.734
  489   2HG1  VAL  64          2HG1      VAL  64  -1.193  -1.608  -3.602
  490   3HG1  VAL  64          3HG1      VAL  64  -0.585  -0.085  -4.255
  491   1HG2  VAL  64          1HG2      VAL  64   0.803   1.284  -2.510
  492   2HG2  VAL  64          2HG2      VAL  64   1.793   0.466  -3.719
  493   3HG2  VAL  64          3HG2      VAL  64   2.215   0.349  -2.008
  494    H    ASP  65           H        ASP  65   0.707  -3.462  -1.879
  495    HA   ASP  65           HA       ASP  65  -1.859  -4.584  -1.998
  496   1HB   ASP  65          2HB       ASP  65   0.769  -5.421  -2.523
  497   2HB   ASP  65          1HB       ASP  65   0.159  -6.546  -1.317
  498    H    GLU  66           H        GLU  66  -3.117  -4.275  -0.211
  499    HA   GLU  66           HA       GLU  66  -2.259  -4.586   2.476
  500   1HB   GLU  66          2HB       GLU  66  -4.716  -4.665   3.005
  501   2HB   GLU  66          1HB       GLU  66  -4.218  -3.267   2.058
  502   1HG   GLU  66          2HG       GLU  66  -5.789  -3.825   0.540
  503   2HG   GLU  66          1HG       GLU  66  -4.842  -5.262   0.166
  504    H    ASP  67           H        ASP  67  -3.726  -6.825   0.176
  505    HA   ASP  67           HA       ASP  67  -4.002  -8.925   2.161
  506   1HB   ASP  67          2HB       ASP  67  -4.596 -10.328   0.107
  507   2HB   ASP  67          1HB       ASP  67  -5.684  -8.999   0.495
  508    H    GLY  68           H        GLY  68  -1.819  -8.102  -0.498
  509   1HA   GLY  68          2HA       GLY  68   0.342  -8.797  -0.919
  510   2HA   GLY  68          1HA       GLY  68   0.319  -9.645   0.624
  511    H    SER  69           H        SER  69  -1.689  -9.957  -2.296
  512    HA   SER  69           HA       SER  69  -1.463 -12.853  -2.193
  513   1HB   SER  69          2HB       SER  69  -3.075 -12.791  -4.077
  514   2HB   SER  69          1HB       SER  69  -3.638 -11.868  -2.688
  515    HG   SER  69           HG       SER  69  -2.795 -11.016  -5.200
  516    H    GLY  70           H        GLY  70   0.558 -10.541  -3.420
  517   1HA   GLY  70          2HA       GLY  70   2.374 -10.737  -4.839
  518   2HA   GLY  70          1HA       GLY  70   1.862 -12.381  -5.213
  519    H    THR  71           H        THR  71  -0.496  -9.861  -5.490
  520    HA   THR  71           HA       THR  71  -0.055  -9.511  -8.361
  521    HB   THR  71           HB       THR  71  -2.302 -10.178  -8.965
  522    HG1  THR  71           HG1      THR  71  -3.635 -11.113  -7.303
  523   1HG2  THR  71          1HG2      THR  71  -2.195 -12.583  -8.468
  524   2HG2  THR  71          2HG2      THR  71  -1.038 -12.270  -7.172
  525   3HG2  THR  71          3HG2      THR  71  -0.591 -11.960  -8.851
  526    H    VAL  72           H        VAL  72  -0.412  -7.453  -8.922
  527    HA   VAL  72           HA       VAL  72  -1.638  -5.666  -6.955
  528    HB   VAL  72           HB       VAL  72  -0.459  -4.840  -9.605
  529   1HG1  VAL  72          1HG1      VAL  72  -1.809  -3.189  -8.341
  530   2HG1  VAL  72          2HG1      VAL  72  -0.110  -2.719  -8.413
  531   3HG1  VAL  72          3HG1      VAL  72  -0.767  -3.428  -6.938
  532   1HG2  VAL  72          1HG2      VAL  72   1.647  -4.415  -8.309
  533   2HG2  VAL  72          2HG2      VAL  72   1.272  -6.131  -8.479
  534   3HG2  VAL  72          3HG2      VAL  72   0.946  -5.301  -6.956
  535    H    ASP  73           H        ASP  73  -3.707  -5.195  -7.047
  536    HA   ASP  73           HA       ASP  73  -5.279  -5.699  -9.452
  537   1HB   ASP  73          2HB       ASP  73  -6.017  -4.657  -6.701
  538   2HB   ASP  73          1HB       ASP  73  -7.179  -4.866  -8.011
  539    H    PHE  74           H        PHE  74  -6.880  -3.847 -10.090
  540    HA   PHE  74           HA       PHE  74  -5.336  -1.663 -10.981
  541   1HB   PHE  74          2HB       PHE  74  -7.559  -2.497 -11.947
  542   2HB   PHE  74          1HB       PHE  74  -8.332  -1.517 -10.699
  543    HD1  PHE  74           HD1      PHE  74  -5.261  -1.010 -12.782
  544    HD2  PHE  74           HD2      PHE  74  -9.154   0.445 -11.691
  545    HE1  PHE  74           HE1      PHE  74  -4.902   1.008 -14.174
  546    HE2  PHE  74           HE2      PHE  74  -8.788   2.466 -13.082
  547    HZ   PHE  74           HZ       PHE  74  -6.666   2.743 -14.323
  548    H    ASP  75           H        ASP  75  -7.406  -2.048  -8.133
  549    HA   ASP  75           HA       ASP  75  -7.385   0.677  -7.310
  550   1HB   ASP  75          2HB       ASP  75  -7.908  -1.935  -5.920
  551   2HB   ASP  75          1HB       ASP  75  -7.727  -0.461  -4.968
  552    H    GLU  76           H        GLU  76  -5.284  -2.101  -6.613
  553    HA   GLU  76           HA       GLU  76  -3.544  -0.640  -4.839
  554   1HB   GLU  76          2HB       GLU  76  -3.002  -3.256  -6.269
  555   2HB   GLU  76          1HB       GLU  76  -2.148  -2.627  -4.862
  556   1HG   GLU  76          2HG       GLU  76  -4.138  -2.812  -3.490
  557   2HG   GLU  76          1HG       GLU  76  -5.119  -3.243  -4.889
  558    H    PHE  77           H        PHE  77  -3.750  -1.172  -8.273
  559    HA   PHE  77           HA       PHE  77  -1.062  -0.612  -8.993
  560   1HB   PHE  77          2HB       PHE  77  -3.176  -1.563 -10.358
  561   2HB   PHE  77          1HB       PHE  77  -3.287   0.123 -10.836
  562    HD1  PHE  77           HD1      PHE  77  -2.892  -0.783 -13.151
  563    HD2  PHE  77           HD2      PHE  77   0.093  -1.007 -10.060
  564    HE1  PHE  77           HE1      PHE  77  -1.141  -1.172 -14.855
  565    HE2  PHE  77           HE2      PHE  77   1.833  -1.385 -11.771
  566    HZ   PHE  77           HZ       PHE  77   1.219  -1.475 -14.173
  567    H    LEU  78           H        LEU  78  -4.006   1.399  -9.086
  568    HA   LEU  78           HA       LEU  78  -2.663   3.815  -9.774
  569   1HB   LEU  78          2HB       LEU  78  -5.389   3.120  -8.760
  570   2HB   LEU  78          1HB       LEU  78  -4.873   4.795  -8.725
  571    HG   LEU  78           HG       LEU  78  -4.879   4.977 -11.051
  572   1HD1  LEU  78          1HD1      LEU  78  -4.863   1.957 -11.299
  573   2HD1  LEU  78          2HD1      LEU  78  -3.419   2.963 -11.411
  574   3HD1  LEU  78          3HD1      LEU  78  -4.704   3.131 -12.606
  575   1HD2  LEU  78          1HD2      LEU  78  -7.161   4.521 -10.106
  576   2HD2  LEU  78          2HD2      LEU  78  -6.958   2.828 -10.557
  577   3HD2  LEU  78          3HD2      LEU  78  -7.000   4.074 -11.803
  578    H    VAL  79           H        VAL  79  -3.383   2.232  -6.721
  579    HA   VAL  79           HA       VAL  79  -2.992   4.432  -4.980
  580    HB   VAL  79           HB       VAL  79  -2.906   1.448  -4.687
  581   1HG1  VAL  79          1HG1      VAL  79  -1.950   3.436  -2.606
  582   2HG1  VAL  79          2HG1      VAL  79  -1.011   2.130  -3.334
  583   3HG1  VAL  79          3HG1      VAL  79  -2.361   1.754  -2.262
  584   1HG2  VAL  79          1HG2      VAL  79  -4.978   3.002  -4.584
  585   2HG2  VAL  79          2HG2      VAL  79  -4.355   3.496  -3.010
  586   3HG2  VAL  79          3HG2      VAL  79  -4.782   1.809  -3.299
  587    H    MET  80           H        MET  80  -0.760   1.861  -6.048
  588    HA   MET  80           HA       MET  80   1.567   2.524  -4.786
  589   1HB   MET  80          2HB       MET  80   0.900   0.840  -6.843
  590   2HB   MET  80          1HB       MET  80   1.973   1.985  -7.648
  591   1HG   MET  80          2HG       MET  80   2.909   1.115  -4.996
  592   2HG   MET  80          1HG       MET  80   2.817  -0.179  -6.188
  593   1HE   MET  80          1HE       MET  80   5.070   0.860  -9.042
  594   2HE   MET  80          2HE       MET  80   3.328   1.099  -8.926
  595   3HE   MET  80          3HE       MET  80   4.052  -0.373  -8.284
  596    H    MET  81           H        MET  81   0.116   4.229  -7.537
  597    HA   MET  81           HA       MET  81   2.381   5.834  -8.172
  598   1HB   MET  81          2HB       MET  81   0.349   5.441  -9.635
  599   2HB   MET  81          1HB       MET  81  -0.506   6.591  -8.612
  600   1HG   MET  81          2HG       MET  81   2.148   7.478  -9.596
  601   2HG   MET  81          1HG       MET  81   0.892   7.320 -10.824
  602   1HE   MET  81          1HE       MET  81  -1.709   9.213 -10.429
  603   2HE   MET  81          2HE       MET  81  -1.988   8.810  -8.737
  604   3HE   MET  81          3HE       MET  81  -1.446   7.561  -9.855
  605    H    VAL  82           H        VAL  82  -0.611   6.609  -6.353
  606    HA   VAL  82           HA       VAL  82   0.278   9.175  -5.510
  607    HB   VAL  82           HB       VAL  82  -1.535   9.016  -3.798
  608   1HG1  VAL  82          1HG1      VAL  82  -3.384   8.765  -5.522
  609   2HG1  VAL  82          2HG1      VAL  82  -2.135   8.300  -6.677
  610   3HG1  VAL  82          3HG1      VAL  82  -2.110   9.906  -5.947
  611   1HG2  VAL  82          1HG2      VAL  82  -1.311   6.510  -3.503
  612   2HG2  VAL  82          2HG2      VAL  82  -2.116   6.324  -5.062
  613   3HG2  VAL  82          3HG2      VAL  82  -2.966   7.080  -3.715
  614    H    ARG  83           H        ARG  83   0.841   5.963  -4.288
  615    HA   ARG  83           HA       ARG  83   1.646   6.637  -1.643
  616   1HB   ARG  83          2HB       ARG  83   2.339   4.284  -3.419
  617   2HB   ARG  83          1HB       ARG  83   2.859   4.420  -1.739
  618   1HG   ARG  83          2HG       ARG  83   0.104   4.997  -1.708
  619   2HG   ARG  83          1HG       ARG  83   0.279   3.618  -2.792
  620   1HD   ARG  83          2HD       ARG  83  -0.007   2.749  -0.563
  621   2HD   ARG  83          1HD       ARG  83   1.672   2.494  -1.022
  622    HE   ARG  83           HE       ARG  83   1.560   4.951   0.311
  623   1HH1  ARG  83          2HH1      ARG  83   0.928   1.581   0.982
  624   2HH1  ARG  83          1HH1      ARG  83   1.339   1.708   2.658
  625   1HH2  ARG  83          1HH2      ARG  83   2.095   5.093   2.511
  626   2HH2  ARG  83          2HH2      ARG  83   1.997   3.691   3.522
  627    H    CYS  84           H        CYS  84   3.260   6.732  -4.755
  628    HA   CYS  84           HA       CYS  84   5.896   7.146  -3.557
  629   1HB   CYS  84          2HB       CYS  84   4.899   6.863  -6.382
  630   2HB   CYS  84          1HB       CYS  84   6.518   7.475  -6.048
  631    HG   CYS  84           HG       CYS  84   7.232   5.152  -5.620
  632    H    MET  85           H        MET  85   3.399   8.978  -5.285
  633    HA   MET  85           HA       MET  85   4.963  11.382  -5.494
  634   1HB   MET  85          2HB       MET  85   2.755  10.518  -6.784
  635   2HB   MET  85          1HB       MET  85   2.003  11.564  -5.579
  636   1HG   MET  85          2HG       MET  85   2.443  13.080  -7.294
  637   2HG   MET  85          1HG       MET  85   3.884  13.257  -6.293
  638   1HE   MET  85          1HE       MET  85   3.415  11.492 -10.447
  639   2HE   MET  85          2HE       MET  85   2.273  12.397  -9.457
  640   3HE   MET  85          3HE       MET  85   2.567  10.694  -9.116
  641    H    LYS  86           H        LYS  86   2.405  10.215  -3.327
  642    HA   LYS  86           HA       LYS  86   2.908  12.525  -1.542
  643   1HB   LYS  86          2HB       LYS  86   0.541  12.068  -2.546
  644   2HB   LYS  86          1HB       LYS  86   0.478  10.768  -1.357
  645   1HG   LYS  86          2HG       LYS  86   1.461  13.244  -0.176
  646   2HG   LYS  86          1HG       LYS  86  -0.132  13.460  -0.901
  647   1HD   LYS  86          2HD       LYS  86  -0.865  11.363   0.323
  648   2HD   LYS  86          1HD       LYS  86   0.670  11.417   1.188
  649   1HE   LYS  86          2HE       LYS  86  -0.662  12.617   2.656
  650   2HE   LYS  86          1HE       LYS  86  -0.058  13.929   1.645
  651   1HZ   LYS  86          1HZ       LYS  86  -2.469  14.025   1.953
  652   2HZ   LYS  86          2HZ       LYS  86  -2.628  12.498   1.229
  653   3HZ   LYS  86          3HZ       LYS  86  -2.055  13.816   0.323
  654    H    ASP  87           H        ASP  87   2.925  12.105   0.743
  655    HA   ASP  87           HA       ASP  87   3.530  10.970   2.641
  656   1HB   ASP  87          2HB       ASP  87   1.590   9.445   1.796
  657   2HB   ASP  87          1HB       ASP  87   2.882   8.347   1.315
  658    H    ASP  88           H        ASP  88   5.603  11.741   1.276
  659    HA   ASP  88           HA       ASP  88   7.574   9.686   1.756
  660   1HB   ASP  88          2HB       ASP  88   8.583   9.825  -0.528
  661   2HB   ASP  88          1HB       ASP  88   7.013   9.028  -0.502
  662    H    SER  89           HN       SER  89   8.912  10.804   2.984
  663    HA   SER  89           HA       SER  89   9.602  13.578   2.222
  664   1HB   SER  89          2HB       SER  89   8.599  13.216   4.495
  665   2HB   SER  89          1HB       SER  89  10.006  12.240   4.906
  666    HG   SER  89           HG       SER  89   9.794  14.994   4.410
  Start of MODEL   25
    1   1H    MET   1          1H        MET   1  -6.602   6.198  11.615
    2   2H    MET   1          2H        MET   1  -5.454   6.178  10.362
    3   3H    MET   1          3H        MET   1  -6.973   5.449  10.141
    4    HA   MET   1           HA       MET   1  -8.080   7.424   9.900
    5   1HB   MET   1          2HB       MET   1  -7.078   9.602  10.664
    6   2HB   MET   1          1HB       MET   1  -7.374   8.462  11.973
    7   1HG   MET   1          2HG       MET   1  -4.871   7.729  11.453
    8   2HG   MET   1          1HG       MET   1  -4.771   9.361  10.794
    9   1HE   MET   1          1HE       MET   1  -4.614   7.901  14.964
   10   2HE   MET   1          2HE       MET   1  -4.728   7.042  13.431
   11   3HE   MET   1          3HE       MET   1  -6.198   7.539  14.266
   12    H    ASN   2           H        ASN   2  -6.957   6.143   7.939
   13    HA   ASN   2           HA       ASN   2  -5.315   8.109   6.448
   14   1HB   ASN   2          2HB       ASN   2  -5.421   5.093   6.170
   15   2HB   ASN   2          1HB       ASN   2  -4.526   6.168   5.097
   16   1HD2  ASN   2          1HD2      ASN   2  -2.856   7.631   6.262
   17   2HD2  ASN   2          2HD2      ASN   2  -2.043   6.964   7.595
   18    H    ASP   3           H        ASP   3  -7.061   9.249   5.606
   19    HA   ASP   3           HA       ASP   3  -8.902   7.747   3.847
   20   1HB   ASP   3          2HB       ASP   3  -9.159  10.382   5.281
   21   2HB   ASP   3          1HB       ASP   3 -10.214   9.962   3.930
   22    H    ILE   4           H        ILE   4  -6.218   9.875   3.761
   23    HA   ILE   4           HA       ILE   4  -6.823  11.378   1.436
   24    HB   ILE   4           HB       ILE   4  -4.377  11.766   1.274
   25   1HG1  ILE   4          2HG1      ILE   4  -3.283  10.745   3.561
   26   2HG1  ILE   4          1HG1      ILE   4  -4.368   9.432   3.107
   27   1HG2  ILE   4          1HG2      ILE   4  -5.654  11.986   4.013
   28   2HG2  ILE   4          2HG2      ILE   4  -5.656  13.201   2.734
   29   3HG2  ILE   4          3HG2      ILE   4  -4.153  12.796   3.564
   30   1HD1  ILE   4          1HD1      ILE   4  -2.551  10.701   1.065
   31   2HD1  ILE   4          2HD1      ILE   4  -3.309   9.108   1.029
   32   3HD1  ILE   4          3HD1      ILE   4  -1.964   9.419   2.126
   33    H    TYR   5           H        TYR   5  -5.484   8.158   1.871
   34    HA   TYR   5           HA       TYR   5  -4.505   7.769  -0.765
   35   1HB   TYR   5          2HB       TYR   5  -5.566   5.693   1.172
   36   2HB   TYR   5          1HB       TYR   5  -4.590   5.365  -0.259
   37    HD1  TYR   5           HD1      TYR   5  -4.586   6.553   3.190
   38    HD2  TYR   5           HD2      TYR   5  -2.218   6.153  -0.372
   39    HE1  TYR   5           HE1      TYR   5  -2.531   6.966   4.507
   40    HE2  TYR   5           HE2      TYR   5  -0.166   6.566   0.948
   41    HH   TYR   5           HH       TYR   5   0.127   7.964   3.499
   42    H    LYS   6           H        LYS   6  -7.661   7.294   0.734
   43    HA   LYS   6           HA       LYS   6  -8.828   6.175  -1.692
   44   1HB   LYS   6          2HB       LYS   6 -10.023   6.907   0.991
   45   2HB   LYS   6          1HB       LYS   6 -10.948   6.222  -0.345
   46   1HG   LYS   6          2HG       LYS   6 -10.383   4.223   0.583
   47   2HG   LYS   6          1HG       LYS   6  -8.838   4.485  -0.224
   48   1HD   LYS   6          2HD       LYS   6  -7.983   5.609   1.824
   49   2HD   LYS   6          1HD       LYS   6  -9.511   5.259   2.631
   50   1HE   LYS   6          2HE       LYS   6  -9.130   2.919   2.580
   51   2HE   LYS   6          1HE       LYS   6  -7.850   3.071   1.376
   52   1HZ   LYS   6          1HZ       LYS   6  -6.988   2.684   3.621
   53   2HZ   LYS   6          2HZ       LYS   6  -7.711   4.128   4.150
   54   3HZ   LYS   6          3HZ       LYS   6  -6.468   4.171   2.992
   55    H    ALA   7           H        ALA   7  -8.501   9.281  -0.153
   56    HA   ALA   7           HA       ALA   7 -10.711  10.596  -1.372
   57   1HB   ALA   7          1HB       ALA   7  -9.430  12.689  -0.815
   58   2HB   ALA   7          2HB       ALA   7  -8.118  11.660  -0.241
   59   3HB   ALA   7          3HB       ALA   7  -9.691  11.607   0.556
   60    H    ALA   8           H        ALA   8  -7.421   9.922  -2.431
   61    HA   ALA   8           HA       ALA   8  -7.547  11.748  -4.670
   62   1HB   ALA   8          1HB       ALA   8  -5.389  11.250  -3.646
   63   2HB   ALA   8          2HB       ALA   8  -5.400  10.716  -5.328
   64   3HB   ALA   8          3HB       ALA   8  -5.584   9.538  -4.027
   65    H    VAL   9           H        VAL   9  -7.742   8.210  -4.249
   66    HA   VAL   9           HA       VAL   9  -7.994   7.624  -7.017
   67    HB   VAL   9           HB       VAL   9  -7.374   5.973  -5.209
   68   1HG1  VAL   9          1HG1      VAL   9  -9.178   4.870  -3.990
   69   2HG1  VAL   9          2HG1      VAL   9 -10.374   5.907  -4.768
   70   3HG1  VAL   9          3HG1      VAL   9  -9.206   6.599  -3.642
   71   1HG2  VAL   9          1HG2      VAL   9  -8.147   5.412  -7.585
   72   2HG2  VAL   9          2HG2      VAL   9  -9.723   5.053  -6.881
   73   3HG2  VAL   9          3HG2      VAL   9  -8.307   4.122  -6.395
   74    H    GLU  10           H        GLU  10 -10.303   8.736  -4.641
   75    HA   GLU  10           HA       GLU  10 -12.608   7.960  -6.215
   76   1HB   GLU  10          2HB       GLU  10 -13.935   8.998  -4.510
   77   2HB   GLU  10          1HB       GLU  10 -12.642   8.109  -3.708
   78   1HG   GLU  10          2HG       GLU  10 -11.383  10.128  -3.333
   79   2HG   GLU  10          1HG       GLU  10 -12.483  11.068  -4.338
   80    H    GLN  11           H        GLN  11 -10.417  10.638  -6.173
   81    HA   GLN  11           HA       GLN  11 -12.244  12.099  -7.984
   82   1HB   GLN  11          2HB       GLN  11 -11.591  14.219  -7.050
   83   2HB   GLN  11          1HB       GLN  11 -12.131  13.188  -5.726
   84   1HG   GLN  11          2HG       GLN  11  -9.589  12.541  -5.555
   85   2HG   GLN  11          1HG       GLN  11  -9.337  14.043  -6.441
   86   1HE2  GLN  11          1HE2      GLN  11  -8.301  14.966  -4.476
   87   2HE2  GLN  11          2HE2      GLN  11  -9.261  15.491  -3.179
   88    H    LEU  12           H        LEU  12  -9.995  10.244  -8.532
   89    HA   LEU  12           HA       LEU  12  -7.770  11.839  -9.438
   90   1HB   LEU  12          2HB       LEU  12  -7.314   9.626 -10.778
   91   2HB   LEU  12          1HB       LEU  12  -7.019   9.724  -9.058
   92    HG   LEU  12           HG       LEU  12  -9.078   8.526  -8.599
   93   1HD1  LEU  12          1HD1      LEU  12 -10.552   9.306 -10.315
   94   2HD1  LEU  12          2HD1      LEU  12 -10.355   7.576 -10.590
   95   3HD1  LEU  12          3HD1      LEU  12  -9.477   8.731 -11.591
   96   1HD2  LEU  12          1HD2      LEU  12  -7.613   7.133 -10.852
   97   2HD2  LEU  12          2HD2      LEU  12  -8.450   6.378  -9.496
   98   3HD2  LEU  12          3HD2      LEU  12  -6.966   7.288  -9.218
   99    H    THR  13           H        THR  13  -7.061  11.330 -11.857
  100    HA   THR  13           HA       THR  13  -9.214  12.425 -13.539
  101    HB   THR  13           HB       THR  13  -6.974  12.459 -15.113
  102    HG1  THR  13           HG1      THR  13  -5.587  11.775 -13.538
  103   1HG2  THR  13          1HG2      THR  13  -8.590  14.307 -13.638
  104   2HG2  THR  13          2HG2      THR  13  -7.663  14.588 -15.112
  105   3HG2  THR  13          3HG2      THR  13  -6.906  14.818 -13.536
  106    H    ASP  14           H        ASP  14  -9.139  11.728 -15.879
  107    HA   ASP  14           HA       ASP  14  -9.551   8.890 -16.039
  108   1HB   ASP  14          2HB       ASP  14  -9.543  11.096 -18.104
  109   2HB   ASP  14          1HB       ASP  14  -9.805   9.404 -18.529
  110    H    GLU  15           H        GLU  15  -6.966  11.112 -16.845
  111    HA   GLU  15           HA       GLU  15  -5.413   9.528 -18.553
  112   1HB   GLU  15          2HB       GLU  15  -3.571  10.968 -17.997
  113   2HB   GLU  15          1HB       GLU  15  -5.029  11.961 -18.008
  114   1HG   GLU  15          2HG       GLU  15  -5.159  11.507 -15.479
  115   2HG   GLU  15          1HG       GLU  15  -3.501  10.923 -15.615
  116    H    GLN  16           H        GLN  16  -5.669   9.556 -15.019
  117    HA   GLN  16           HA       GLN  16  -3.481   7.763 -14.548
  118   1HB   GLN  16          2HB       GLN  16  -5.783   8.772 -12.898
  119   2HB   GLN  16          1HB       GLN  16  -4.780   7.447 -12.307
  120   1HG   GLN  16          2HG       GLN  16  -2.827   8.781 -12.281
  121   2HG   GLN  16          1HG       GLN  16  -3.545  10.004 -13.329
  122   1HE2  GLN  16          1HE2      GLN  16  -4.657   8.445 -10.257
  123   2HE2  GLN  16          2HE2      GLN  16  -4.957   9.912  -9.461
  124    H    LYS  17           H        LYS  17  -6.977   7.414 -14.978
  125    HA   LYS  17           HA       LYS  17  -7.169   4.655 -14.353
  126   1HB   LYS  17          2HB       LYS  17  -8.896   6.386 -16.141
  127   2HB   LYS  17          1HB       LYS  17  -9.304   4.743 -15.648
  128   1HG   LYS  17          2HG       LYS  17  -8.872   7.110 -13.796
  129   2HG   LYS  17          1HG       LYS  17 -10.416   6.346 -14.170
  130   1HD   LYS  17          2HD       LYS  17  -9.187   4.162 -13.336
  131   2HD   LYS  17          1HD       LYS  17  -8.152   5.319 -12.501
  132   1HE   LYS  17          2HE       LYS  17  -9.743   5.775 -10.968
  133   2HE   LYS  17          1HE       LYS  17 -10.977   5.985 -12.210
  134   1HZ   LYS  17          1HZ       LYS  17 -11.467   4.125 -10.728
  135   2HZ   LYS  17          2HZ       LYS  17 -10.012   3.371 -11.176
  136   3HZ   LYS  17          3HZ       LYS  17 -11.244   3.601 -12.325
  137    H    ASN  18           H        ASN  18  -5.872   6.291 -17.102
  138    HA   ASN  18           HA       ASN  18  -6.016   3.836 -18.734
  139   1HB   ASN  18          2HB       ASN  18  -5.789   6.747 -19.371
  140   2HB   ASN  18          1HB       ASN  18  -5.031   5.594 -20.473
  141   1HD2  ASN  18          1HD2      ASN  18  -8.071   6.936 -19.450
  142   2HD2  ASN  18          2HD2      ASN  18  -9.062   5.966 -20.430
  143    H    GLU  19           H        GLU  19  -3.812   6.046 -17.134
  144    HA   GLU  19           HA       GLU  19  -1.393   5.374 -18.376
  145   1HB   GLU  19          2HB       GLU  19  -1.822   7.208 -16.638
  146   2HB   GLU  19          1HB       GLU  19  -1.652   5.945 -15.420
  147   1HG   GLU  19          2HG       GLU  19   0.541   6.684 -15.561
  148   2HG   GLU  19          1HG       GLU  19   0.563   5.395 -16.764
  149    H    PHE  20           H        PHE  20  -2.792   4.033 -15.377
  150    HA   PHE  20           HA       PHE  20  -0.848   1.902 -15.255
  151   1HB   PHE  20          2HB       PHE  20  -3.301   2.609 -13.669
  152   2HB   PHE  20          1HB       PHE  20  -2.505   1.055 -13.452
  153    HD1  PHE  20           HD1      PHE  20  -2.298   4.657 -12.902
  154    HD2  PHE  20           HD2      PHE  20  -0.145   0.948 -12.650
  155    HE1  PHE  20           HE1      PHE  20  -0.632   5.724 -11.415
  156    HE2  PHE  20           HE2      PHE  20   1.517   2.013 -11.154
  157    HZ   PHE  20           HZ       PHE  20   1.276   4.404 -10.538
  158    H    LYS  21           H        LYS  21  -4.261   2.208 -16.213
  159    HA   LYS  21           HA       LYS  21  -4.900  -0.499 -16.458
  160   1HB   LYS  21          2HB       LYS  21  -6.568   1.289 -16.610
  161   2HB   LYS  21          1HB       LYS  21  -5.896   1.794 -18.157
  162   1HG   LYS  21          2HG       LYS  21  -6.538  -1.076 -18.038
  163   2HG   LYS  21          1HG       LYS  21  -7.944  -0.031 -17.834
  164   1HD   LYS  21          2HD       LYS  21  -6.041   0.718 -19.997
  165   2HD   LYS  21          1HD       LYS  21  -7.001  -0.738 -20.263
  166   1HE   LYS  21          2HE       LYS  21  -9.056   0.599 -19.676
  167   2HE   LYS  21          1HE       LYS  21  -8.041   2.041 -19.645
  168   1HZ   LYS  21          1HZ       LYS  21  -8.464   0.234 -21.963
  169   2HZ   LYS  21          2HZ       LYS  21  -7.395   1.555 -21.946
  170   3HZ   LYS  21          3HZ       LYS  21  -9.068   1.809 -21.791
  171    H    ALA  22           H        ALA  22  -3.069   1.575 -18.645
  172    HA   ALA  22           HA       ALA  22  -3.176  -0.020 -20.965
  173   1HB   ALA  22          1HB       ALA  22  -2.230   2.286 -20.893
  174   2HB   ALA  22          2HB       ALA  22  -1.139   1.131 -21.659
  175   3HB   ALA  22          3HB       ALA  22  -0.844   1.659 -20.003
  176    H    ALA  23           H        ALA  23  -0.672   0.081 -18.428
  177    HA   ALA  23           HA       ALA  23   0.724  -2.229 -19.353
  178   1HB   ALA  23          1HB       ALA  23   1.947  -2.105 -17.261
  179   2HB   ALA  23          2HB       ALA  23   0.721  -1.047 -16.560
  180   3HB   ALA  23          3HB       ALA  23   1.736  -0.467 -17.881
  181    H    PHE  24           H        PHE  24  -1.816  -1.615 -16.994
  182    HA   PHE  24           HA       PHE  24  -1.938  -4.091 -15.703
  183   1HB   PHE  24          2HB       PHE  24  -3.240  -1.934 -15.188
  184   2HB   PHE  24          1HB       PHE  24  -4.381  -2.467 -16.419
  185    HD1  PHE  24           HD1      PHE  24  -5.452  -4.780 -16.166
  186    HD2  PHE  24           HD2      PHE  24  -3.302  -2.833 -13.000
  187    HE1  PHE  24           HE1      PHE  24  -6.528  -6.278 -14.511
  188    HE2  PHE  24           HE2      PHE  24  -4.378  -4.328 -11.350
  189    HZ   PHE  24           HZ       PHE  24  -5.993  -6.046 -12.102
  190    H    ASP  25           H        ASP  25  -3.606  -2.987 -18.665
  191    HA   ASP  25           HA       ASP  25  -5.096  -5.341 -19.113
  192   1HB   ASP  25          2HB       ASP  25  -5.023  -2.906 -20.299
  193   2HB   ASP  25          1HB       ASP  25  -4.201  -3.877 -21.519
  194    H    ILE  26           H        ILE  26  -1.889  -4.396 -20.375
  195    HA   ILE  26           HA       ILE  26  -1.601  -6.721 -22.006
  196    HB   ILE  26           HB       ILE  26   0.822  -6.103 -22.098
  197   1HG1  ILE  26          2HG1      ILE  26  -0.043  -3.778 -20.347
  198   2HG1  ILE  26          1HG1      ILE  26   0.914  -5.144 -19.776
  199   1HG2  ILE  26          1HG2      ILE  26  -1.099  -3.793 -22.517
  200   2HG2  ILE  26          2HG2      ILE  26  -0.903  -5.148 -23.630
  201   3HG2  ILE  26          3HG2      ILE  26   0.439  -4.041 -23.343
  202   1HD1  ILE  26          1HD1      ILE  26   2.045  -4.012 -22.203
  203   2HD1  ILE  26          2HD1      ILE  26   2.804  -4.275 -20.633
  204   3HD1  ILE  26          3HD1      ILE  26   1.894  -2.793 -20.936
  205    H    PHE  27           H        PHE  27  -0.611  -5.970 -18.682
  206    HA   PHE  27           HA       PHE  27   0.888  -8.395 -18.353
  207   1HB   PHE  27          2HB       PHE  27  -0.166  -6.378 -16.369
  208   2HB   PHE  27          1HB       PHE  27   0.760  -7.803 -15.892
  209    HD1  PHE  27           HD1      PHE  27   2.803  -8.137 -17.865
  210    HD2  PHE  27           HD2      PHE  27   1.199  -4.475 -16.292
  211    HE1  PHE  27           HE1      PHE  27   4.898  -6.961 -18.467
  212    HE2  PHE  27           HE2      PHE  27   3.296  -3.303 -16.896
  213    HZ   PHE  27           HZ       PHE  27   5.145  -4.541 -17.983
  214    H    ILE  28           H        ILE  28  -2.485  -7.483 -17.812
  215    HA   ILE  28           HA       ILE  28  -3.012 -10.115 -16.592
  216    HB   ILE  28           HB       ILE  28  -5.232  -9.314 -16.076
  217   1HG1  ILE  28          2HG1      ILE  28  -5.419  -6.662 -16.704
  218   2HG1  ILE  28          1HG1      ILE  28  -4.546  -7.270 -18.109
  219   1HG2  ILE  28          1HG2      ILE  28  -4.654  -7.785 -14.422
  220   2HG2  ILE  28          2HG2      ILE  28  -3.516  -6.931 -15.461
  221   3HG2  ILE  28          3HG2      ILE  28  -3.089  -8.506 -14.794
  222   1HD1  ILE  28          1HD1      ILE  28  -6.287  -8.652 -18.771
  223   2HD1  ILE  28          2HD1      ILE  28  -7.192  -7.318 -18.052
  224   3HD1  ILE  28          3HD1      ILE  28  -6.928  -8.801 -17.134
  225    H    GLN  29           H        GLN  29  -2.509  -9.243 -19.606
  226    HA   GLN  29           HA       GLN  29  -4.696  -9.713 -21.207
  227   1HB   GLN  29          2HB       GLN  29  -2.533  -9.088 -22.124
  228   2HB   GLN  29          1HB       GLN  29  -1.843 -10.632 -21.627
  229   1HG   GLN  29          2HG       GLN  29  -3.298 -11.838 -23.147
  230   2HG   GLN  29          1HG       GLN  29  -4.162 -10.356 -23.559
  231   1HE2  GLN  29          1HE2      GLN  29  -2.614  -8.537 -24.454
  232   2HE2  GLN  29          2HE2      GLN  29  -1.400  -9.058 -25.520
  233    H    ASP  30           H        ASP  30  -2.640 -12.107 -19.594
  234    HA   ASP  30           HA       ASP  30  -4.497 -14.237 -20.475
  235   1HB   ASP  30          2HB       ASP  30  -1.572 -14.336 -19.723
  236   2HB   ASP  30          1HB       ASP  30  -2.570 -15.782 -19.879
  237    H    ALA  31           H        ALA  31  -4.768 -12.377 -18.125
  238    HA   ALA  31           HA       ALA  31  -4.558 -14.264 -15.876
  239   1HB   ALA  31          1HB       ALA  31  -3.680 -11.908 -15.633
  240   2HB   ALA  31          2HB       ALA  31  -4.880 -12.373 -14.428
  241   3HB   ALA  31          3HB       ALA  31  -5.344 -11.342 -15.782
  242    H    GLU  32           H        GLU  32  -6.401 -14.452 -14.414
  243    HA   GLU  32           HA       GLU  32  -9.010 -13.961 -15.714
  244   1HB   GLU  32          2HB       GLU  32  -9.789 -16.184 -14.941
  245   2HB   GLU  32          1HB       GLU  32  -8.477 -16.302 -16.112
  246   1HG   GLU  32          2HG       GLU  32  -6.903 -16.398 -14.061
  247   2HG   GLU  32          1HG       GLU  32  -8.361 -16.728 -13.123
  248    H    ASP  33           H        ASP  33  -7.584 -12.550 -13.525
  249    HA   ASP  33           HA       ASP  33  -9.755 -12.701 -11.551
  250   1HB   ASP  33          2HB       ASP  33  -7.494 -14.015 -10.951
  251   2HB   ASP  33          1HB       ASP  33  -7.026 -12.402 -10.414
  252    H    GLY  34           H        GLY  34  -8.455 -10.769 -13.680
  253   1HA   GLY  34          2HA       GLY  34  -8.132  -8.504 -13.927
  254   2HA   GLY  34          1HA       GLY  34  -9.280  -8.352 -12.603
  255    H    CYS  35           H        CYS  35  -5.891  -9.472 -12.910
  256    HA   CYS  35           HA       CYS  35  -4.905  -7.325 -11.240
  257   1HB   CYS  35          2HB       CYS  35  -3.998  -8.825  -9.475
  258   2HB   CYS  35          1HB       CYS  35  -5.759  -8.767  -9.478
  259    HG   CYS  35           HG       CYS  35  -4.065 -11.183 -10.490
  260    H    ILE  36           H        ILE  36  -2.680  -7.073 -11.386
  261    HA   ILE  36           HA       ILE  36  -1.393  -8.692 -13.465
  262    HB   ILE  36           HB       ILE  36   0.318  -7.004 -13.560
  263   1HG1  ILE  36          2HG1      ILE  36  -0.347  -4.974 -11.807
  264   2HG1  ILE  36          1HG1      ILE  36  -0.630  -6.419 -10.836
  265   1HG2  ILE  36          1HG2      ILE  36  -1.676  -6.360 -14.735
  266   2HG2  ILE  36          2HG2      ILE  36  -1.083  -4.927 -13.895
  267   3HG2  ILE  36          3HG2      ILE  36  -2.453  -5.827 -13.244
  268   1HD1  ILE  36          1HD1      ILE  36   1.908  -5.999 -12.432
  269   2HD1  ILE  36          2HD1      ILE  36   1.611  -7.196 -11.172
  270   3HD1  ILE  36          3HD1      ILE  36   1.745  -5.489 -10.752
  271    H    SER  37           H        SER  37   1.082  -9.035 -13.023
  272    HA   SER  37           HA       SER  37   1.233 -10.610 -10.557
  273   1HB   SER  37          2HB       SER  37   1.922 -11.563 -12.796
  274   2HB   SER  37          1HB       SER  37   3.278 -10.439 -12.780
  275    HG   SER  37           HG       SER  37   4.209 -11.581 -11.248
  276    H    THR  38           H        THR  38   1.958  -9.617  -8.787
  277    HA   THR  38           HA       THR  38   3.313  -7.172  -8.651
  278    HB   THR  38           HB       THR  38   3.940  -7.816  -6.346
  279    HG1  THR  38           HG1      THR  38   4.152  -9.838  -5.922
  280   1HG2  THR  38          1HG2      THR  38   1.517  -8.537  -5.666
  281   2HG2  THR  38          2HG2      THR  38   1.168  -8.306  -7.379
  282   3HG2  THR  38          3HG2      THR  38   1.773  -6.961  -6.413
  283    H    LYS  39           H        LYS  39   4.562 -10.475  -8.826
  284    HA   LYS  39           HA       LYS  39   7.293  -9.933  -8.378
  285   1HB   LYS  39          2HB       LYS  39   6.237 -12.054 -10.261
  286   2HB   LYS  39          1HB       LYS  39   7.758 -12.070  -9.374
  287   1HG   LYS  39          2HG       LYS  39   4.956 -12.396  -8.287
  288   2HG   LYS  39          1HG       LYS  39   6.317 -13.505  -8.142
  289   1HD   LYS  39          2HD       LYS  39   7.479 -11.980  -6.656
  290   2HD   LYS  39          1HD       LYS  39   6.253 -10.738  -6.909
  291   1HE   LYS  39          2HE       LYS  39   5.545 -11.666  -4.891
  292   2HE   LYS  39          1HE       LYS  39   4.599 -12.596  -6.052
  293   1HZ   LYS  39          1HZ       LYS  39   6.251 -14.342  -5.969
  294   2HZ   LYS  39          2HZ       LYS  39   5.676 -14.013  -4.405
  295   3HZ   LYS  39          3HZ       LYS  39   7.199 -13.441  -4.889
  296    H    GLU  40           H        GLU  40   5.261  -9.576 -11.202
  297    HA   GLU  40           HA       GLU  40   7.587  -8.745 -12.820
  298   1HB   GLU  40          2HB       GLU  40   4.759  -9.403 -13.686
  299   2HB   GLU  40          1HB       GLU  40   6.093  -8.978 -14.759
  300   1HG   GLU  40          2HG       GLU  40   7.357 -10.950 -13.969
  301   2HG   GLU  40          1HG       GLU  40   6.015 -11.382 -12.910
  302    H    LEU  41           H        LEU  41   6.150  -7.144 -10.664
  303    HA   LEU  41           HA       LEU  41   4.638  -5.104 -11.966
  304   1HB   LEU  41          2HB       LEU  41   4.632  -5.630  -9.487
  305   2HB   LEU  41          1HB       LEU  41   6.167  -4.793  -9.390
  306    HG   LEU  41           HG       LEU  41   3.894  -3.333 -10.651
  307   1HD1  LEU  41          1HD1      LEU  41   3.433  -4.621  -8.253
  308   2HD1  LEU  41          2HD1      LEU  41   2.606  -3.162  -8.799
  309   3HD1  LEU  41          3HD1      LEU  41   4.004  -3.036  -7.732
  310   1HD2  LEU  41          1HD2      LEU  41   5.009  -1.538  -9.126
  311   2HD2  LEU  41          2HD2      LEU  41   5.896  -2.100 -10.544
  312   3HD2  LEU  41          3HD2      LEU  41   6.304  -2.722  -8.944
  313    H    GLY  42           H        GLY  42   8.069  -5.626 -11.442
  314   1HA   GLY  42          2HA       GLY  42   9.077  -3.040 -11.787
  315   2HA   GLY  42          1HA       GLY  42   9.914  -4.515 -12.267
  316    H    LYS  43           H        LYS  43   7.789  -5.343 -14.113
  317    HA   LYS  43           HA       LYS  43   8.706  -4.094 -16.496
  318   1HB   LYS  43          2HB       LYS  43   6.219  -5.778 -16.087
  319   2HB   LYS  43          1HB       LYS  43   6.988  -5.417 -17.632
  320   1HG   LYS  43          2HG       LYS  43   8.661  -6.658 -15.479
  321   2HG   LYS  43          1HG       LYS  43   7.511  -7.681 -16.339
  322   1HD   LYS  43          2HD       LYS  43   8.589  -6.457 -18.461
  323   2HD   LYS  43          1HD       LYS  43   9.958  -6.308 -17.358
  324   1HE   LYS  43          2HE       LYS  43   9.082  -8.940 -17.009
  325   2HE   LYS  43          1HE       LYS  43   8.959  -8.668 -18.746
  326   1HZ   LYS  43          1HZ       LYS  43  11.255  -7.817 -18.692
  327   2HZ   LYS  43          2HZ       LYS  43  11.146  -9.445 -18.220
  328   3HZ   LYS  43          3HZ       LYS  43  11.356  -8.232 -17.049
  329    H    VAL  44           H        VAL  44   6.082  -3.383 -14.296
  330    HA   VAL  44           HA       VAL  44   4.734  -1.644 -16.214
  331    HB   VAL  44           HB       VAL  44   2.923  -1.629 -14.822
  332   1HG1  VAL  44          1HG1      VAL  44   3.903  -3.868 -13.185
  333   2HG1  VAL  44          2HG1      VAL  44   4.152  -4.085 -14.915
  334   3HG1  VAL  44          3HG1      VAL  44   2.530  -3.793 -14.287
  335   1HG2  VAL  44          1HG2      VAL  44   3.588  -0.390 -12.966
  336   2HG2  VAL  44          2HG2      VAL  44   4.942  -1.460 -12.605
  337   3HG2  VAL  44          3HG2      VAL  44   3.299  -1.966 -12.232
  338    H    MET  45           H        MET  45   6.794  -1.422 -13.354
  339    HA   MET  45           HA       MET  45   6.558   1.379 -12.957
  340   1HB   MET  45          2HB       MET  45   8.623  -0.667 -12.174
  341   2HB   MET  45          1HB       MET  45   8.897   1.048 -11.873
  342   1HG   MET  45          2HG       MET  45   6.325  -0.270 -11.022
  343   2HG   MET  45          1HG       MET  45   7.760  -0.351 -10.002
  344   1HE   MET  45          1HE       MET  45   4.723   1.417 -10.998
  345   2HE   MET  45          2HE       MET  45   4.696   2.692  -9.783
  346   3HE   MET  45          3HE       MET  45   4.873   1.013  -9.282
  347    H    ARG  46           H        ARG  46   8.757  -0.631 -14.876
  348    HA   ARG  46           HA       ARG  46  10.437   1.495 -15.769
  349   1HB   ARG  46          2HB       ARG  46   9.856  -1.139 -17.150
  350   2HB   ARG  46          1HB       ARG  46  11.216  -0.067 -17.479
  351   1HG   ARG  46          2HG       ARG  46  10.941  -0.800 -14.639
  352   2HG   ARG  46          1HG       ARG  46  11.274  -2.166 -15.701
  353   1HD   ARG  46          2HD       ARG  46  12.890   0.213 -16.302
  354   2HD   ARG  46          1HD       ARG  46  13.175  -0.444 -14.694
  355    HE   ARG  46           HE       ARG  46  13.879  -1.676 -17.218
  356   1HH1  ARG  46          2HH1      ARG  46  13.158  -2.214 -13.840
  357   2HH1  ARG  46          1HH1      ARG  46  14.023  -3.711 -13.767
  358   1HH2  ARG  46          1HH2      ARG  46  15.006  -3.640 -17.094
  359   2HH2  ARG  46          2HH2      ARG  46  15.065  -4.515 -15.601
  360    H    MET  47           H        MET  47   7.396   0.129 -16.909
  361    HA   MET  47           HA       MET  47   7.354   1.554 -19.410
  362   1HB   MET  47          2HB       MET  47   5.297   0.025 -17.824
  363   2HB   MET  47          1HB       MET  47   4.830   0.967 -19.240
  364   1HG   MET  47          2HG       MET  47   7.078  -1.051 -19.338
  365   2HG   MET  47          1HG       MET  47   5.402  -1.504 -19.646
  366   1HE   MET  47          1HE       MET  47   8.356  -1.190 -21.744
  367   2HE   MET  47          2HE       MET  47   8.509   0.103 -20.558
  368   3HE   MET  47          3HE       MET  47   8.408   0.497 -22.272
  369    H    LEU  48           H        LEU  48   6.288   2.172 -16.124
  370    HA   LEU  48           HA       LEU  48   4.644   4.450 -16.701
  371   1HB   LEU  48          2HB       LEU  48   5.781   3.166 -14.274
  372   2HB   LEU  48          1HB       LEU  48   5.334   4.851 -14.141
  373    HG   LEU  48           HG       LEU  48   3.061   4.399 -14.355
  374   1HD1  LEU  48          1HD1      LEU  48   2.263   3.033 -15.955
  375   2HD1  LEU  48          2HD1      LEU  48   2.932   1.628 -15.125
  376   3HD1  LEU  48          3HD1      LEU  48   3.910   2.506 -16.298
  377   1HD2  LEU  48          1HD2      LEU  48   3.223   3.420 -12.312
  378   2HD2  LEU  48          2HD2      LEU  48   4.595   2.426 -12.798
  379   3HD2  LEU  48          3HD2      LEU  48   2.952   1.906 -13.176
  380    H    GLY  49           H        GLY  49   8.054   3.913 -16.223
  381   1HA   GLY  49          2HA       GLY  49   9.553   5.607 -17.205
  382   2HA   GLY  49          1HA       GLY  49   8.547   6.829 -16.435
  383    H    GLN  50           H        GLN  50   9.422   3.831 -14.810
  384    HA   GLN  50           HA       GLN  50  11.413   5.265 -13.165
  385   1HB   GLN  50          2HB       GLN  50   9.388   3.392 -11.939
  386   2HB   GLN  50          1HB       GLN  50  10.476   4.508 -11.120
  387   1HG   GLN  50          2HG       GLN  50   8.301   5.444 -13.005
  388   2HG   GLN  50          1HG       GLN  50   8.038   5.245 -11.274
  389   1HE2  GLN  50          1HE2      GLN  50   8.227   7.747 -13.096
  390   2HE2  GLN  50          2HE2      GLN  50   9.342   8.742 -12.289
  391    H    ASN  51           H        ASN  51  13.174   4.085 -12.647
  392    HA   ASN  51           HA       ASN  51  13.146   1.201 -13.341
  393   1HB   ASN  51          2HB       ASN  51  14.551   2.891 -14.781
  394   2HB   ASN  51          1HB       ASN  51  15.667   2.834 -13.418
  395   1HD2  ASN  51          1HD2      ASN  51  15.273   1.456 -16.362
  396   2HD2  ASN  51          2HD2      ASN  51  15.890  -0.095 -16.057
  397    HA   PRO  52           HA       PRO  52  14.323   1.567  -8.897
  398   1HB   PRO  52          2HB       PRO  52  12.529  -0.275  -7.975
  399   2HB   PRO  52          1HB       PRO  52  12.135   1.431  -8.225
  400   1HG   PRO  52          2HG       PRO  52  11.358  -0.933  -9.816
  401   2HG   PRO  52          1HG       PRO  52  10.535   0.624  -9.636
  402   1HD   PRO  52          2HD       PRO  52  12.138  -0.201 -11.839
  403   2HD   PRO  52          1HD       PRO  52  11.504   1.434 -11.538
  404    H    THR  53           H        THR  53  14.254  -0.712  -7.341
  405    HA   THR  53           HA       THR  53  16.088  -2.561  -8.751
  406    HB   THR  53           HB       THR  53  17.287  -2.835  -6.758
  407    HG1  THR  53           HG1      THR  53  16.350  -2.891  -4.870
  408   1HG2  THR  53          1HG2      THR  53  16.171  -0.029  -6.547
  409   2HG2  THR  53          2HG2      THR  53  17.531  -0.521  -7.559
  410   3HG2  THR  53          3HG2      THR  53  17.663  -0.603  -5.802
  411    HA   PRO  54           HA       PRO  54  13.359  -5.922  -7.821
  412   1HB   PRO  54          2HB       PRO  54  14.936  -7.869  -6.712
  413   2HB   PRO  54          1HB       PRO  54  14.957  -7.436  -8.429
  414   1HG   PRO  54          2HG       PRO  54  16.927  -6.803  -6.304
  415   2HG   PRO  54          1HG       PRO  54  17.169  -7.006  -8.044
  416   1HD   PRO  54          2HD       PRO  54  17.032  -4.553  -6.675
  417   2HD   PRO  54          1HD       PRO  54  16.908  -4.764  -8.436
  418    H    GLU  55           H        GLU  55  15.297  -4.851  -5.102
  419    HA   GLU  55           HA       GLU  55  13.631  -6.106  -3.085
  420   1HB   GLU  55          2HB       GLU  55  15.871  -4.077  -2.945
  421   2HB   GLU  55          1HB       GLU  55  14.983  -4.628  -1.525
  422   1HG   GLU  55          2HG       GLU  55  15.817  -6.803  -1.678
  423   2HG   GLU  55          1HG       GLU  55  16.164  -6.656  -3.401
  424    H    GLU  56           H        GLU  56  13.991  -2.951  -4.633
  425    HA   GLU  56           HA       GLU  56  12.173  -1.568  -2.892
  426   1HB   GLU  56          2HB       GLU  56  14.049  -0.651  -4.531
  427   2HB   GLU  56          1HB       GLU  56  12.706  -0.608  -5.671
  428   1HG   GLU  56          2HG       GLU  56  12.374   0.550  -2.911
  429   2HG   GLU  56          1HG       GLU  56  13.165   1.491  -4.175
  430    H    LEU  57           H        LEU  57  11.924  -2.918  -6.201
  431    HA   LEU  57           HA       LEU  57   9.296  -2.146  -6.735
  432   1HB   LEU  57          2HB       LEU  57   9.317  -3.597  -8.524
  433   2HB   LEU  57          1HB       LEU  57  11.016  -3.280  -8.283
  434    HG   LEU  57           HG       LEU  57  10.942  -5.508  -6.884
  435   1HD1  LEU  57          1HD1      LEU  57   8.818  -6.339  -6.811
  436   2HD1  LEU  57          2HD1      LEU  57   9.173  -6.911  -8.442
  437   3HD1  LEU  57          3HD1      LEU  57   8.301  -5.395  -8.209
  438   1HD2  LEU  57          1HD2      LEU  57  10.662  -5.586  -9.902
  439   2HD2  LEU  57          2HD2      LEU  57  11.557  -6.719  -8.889
  440   3HD2  LEU  57          3HD2      LEU  57  12.123  -5.059  -9.068
  441    H    GLN  58           H        GLN  58  10.490  -5.022  -5.006
  442    HA   GLN  58           HA       GLN  58   7.834  -6.097  -4.640
  443   1HB   GLN  58          2HB       GLN  58   9.956  -7.482  -4.707
  444   2HB   GLN  58          1HB       GLN  58  10.318  -6.860  -3.098
  445   1HG   GLN  58          2HG       GLN  58   9.190  -8.971  -2.811
  446   2HG   GLN  58          1HG       GLN  58   8.055  -7.703  -2.356
  447   1HE2  GLN  58          1HE2      GLN  58   6.084  -7.587  -3.524
  448   2HE2  GLN  58          2HE2      GLN  58   5.729  -8.556  -4.870
  449    H    GLU  59           H        GLU  59  10.064  -4.098  -2.758
  450    HA   GLU  59           HA       GLU  59   8.764  -4.252  -0.260
  451   1HB   GLU  59          2HB       GLU  59  10.756  -2.485  -1.518
  452   2HB   GLU  59          1HB       GLU  59   9.776  -1.708  -0.275
  453   1HG   GLU  59          2HG       GLU  59  11.020  -4.411   0.204
  454   2HG   GLU  59          1HG       GLU  59  11.939  -2.930   0.475
  455    H    MET  60           H        MET  60   8.358  -1.922  -2.943
  456    HA   MET  60           HA       MET  60   6.342  -0.399  -1.633
  457   1HB   MET  60          2HB       MET  60   5.916   0.627  -3.794
  458   2HB   MET  60          1HB       MET  60   7.655   0.471  -3.556
  459   1HG   MET  60          2HG       MET  60   7.283  -1.842  -4.794
  460   2HG   MET  60          1HG       MET  60   5.852  -1.028  -5.423
  461   1HE   MET  60          1HE       MET  60   6.254   1.733  -5.797
  462   2HE   MET  60          2HE       MET  60   5.843   0.778  -7.219
  463   3HE   MET  60          3HE       MET  60   7.118   1.989  -7.319
  464    H    ILE  61           H        ILE  61   6.289  -3.358  -3.483
  465    HA   ILE  61           HA       ILE  61   3.482  -3.376  -4.049
  466    HB   ILE  61           HB       ILE  61   5.564  -5.570  -3.983
  467   1HG1  ILE  61          2HG1      ILE  61   4.040  -4.440  -6.329
  468   2HG1  ILE  61          1HG1      ILE  61   5.528  -3.693  -5.748
  469   1HG2  ILE  61          1HG2      ILE  61   2.821  -5.867  -5.194
  470   2HG2  ILE  61          2HG2      ILE  61   3.080  -6.246  -3.492
  471   3HG2  ILE  61          3HG2      ILE  61   3.971  -7.123  -4.733
  472   1HD1  ILE  61          1HD1      ILE  61   6.215  -5.204  -7.455
  473   2HD1  ILE  61          2HD1      ILE  61   5.155  -6.478  -6.856
  474   3HD1  ILE  61          3HD1      ILE  61   6.587  -6.019  -5.938
  475    H    ASP  62           H        ASP  62   5.509  -4.958  -1.574
  476    HA   ASP  62           HA       ASP  62   3.433  -6.283  -0.210
  477   1HB   ASP  62          2HB       ASP  62   6.183  -5.374   0.550
  478   2HB   ASP  62          1HB       ASP  62   5.088  -5.927   1.817
  479    H    GLU  63           H        GLU  63   4.600  -2.961  -0.014
  480    HA   GLU  63           HA       GLU  63   3.069  -2.291   2.336
  481   1HB   GLU  63          2HB       GLU  63   4.884  -0.883   0.475
  482   2HB   GLU  63          1HB       GLU  63   3.627   0.114   1.206
  483   1HG   GLU  63          2HG       GLU  63   4.942  -1.719   3.100
  484   2HG   GLU  63          1HG       GLU  63   6.021  -0.508   2.408
  485    H    VAL  64           H        VAL  64   2.650  -1.807  -1.178
  486    HA   VAL  64           HA       VAL  64   0.211  -0.300  -0.857
  487    HB   VAL  64           HB       VAL  64   1.697   0.017  -2.820
  488   1HG1  VAL  64          1HG1      VAL  64   1.924  -1.617  -4.520
  489   2HG1  VAL  64          2HG1      VAL  64   0.614  -2.601  -3.867
  490   3HG1  VAL  64          3HG1      VAL  64   2.155  -2.506  -3.017
  491   1HG2  VAL  64          1HG2      VAL  64  -1.028   0.122  -2.731
  492   2HG2  VAL  64          2HG2      VAL  64  -0.791  -0.984  -4.083
  493   3HG2  VAL  64          3HG2      VAL  64  -0.076   0.627  -4.128
  494    H    ASP  65           H        ASP  65   0.991  -3.691  -1.575
  495    HA   ASP  65           HA       ASP  65  -1.730  -4.433  -2.118
  496   1HB   ASP  65          2HB       ASP  65   0.770  -5.659  -2.431
  497   2HB   ASP  65          1HB       ASP  65  -0.059  -6.632  -1.220
  498    H    GLU  66           H        GLU  66  -3.131  -4.027  -0.512
  499    HA   GLU  66           HA       GLU  66  -2.641  -4.137   2.248
  500   1HB   GLU  66          2HB       GLU  66  -5.109  -4.223   2.499
  501   2HB   GLU  66          1HB       GLU  66  -4.586  -2.977   1.368
  502   1HG   GLU  66          2HG       GLU  66  -5.110  -4.429  -0.531
  503   2HG   GLU  66          1HG       GLU  66  -5.539  -5.744   0.562
  504    H    ASP  67           H        ASP  67  -3.705  -6.646   0.009
  505    HA   ASP  67           HA       ASP  67  -4.005  -8.568   2.199
  506   1HB   ASP  67          2HB       ASP  67  -4.692 -10.127   0.291
  507   2HB   ASP  67          1HB       ASP  67  -5.767  -8.774   0.638
  508    H    GLY  68           H        GLY  68  -1.931  -7.915  -0.584
  509   1HA   GLY  68          2HA       GLY  68   0.225  -8.622  -1.027
  510   2HA   GLY  68          1HA       GLY  68   0.246  -9.391   0.556
  511    H    SER  69           H        SER  69  -1.830  -9.861  -2.294
  512    HA   SER  69           HA       SER  69  -1.560 -12.748  -2.045
  513   1HB   SER  69          2HB       SER  69  -3.237 -12.807  -3.878
  514   2HB   SER  69          1HB       SER  69  -3.770 -11.863  -2.492
  515    HG   SER  69           HG       SER  69  -3.921 -10.230  -3.796
  516    H    GLY  70           H        GLY  70   0.430 -10.534  -3.429
  517   1HA   GLY  70          2HA       GLY  70   2.189 -10.834  -4.903
  518   2HA   GLY  70          1HA       GLY  70   1.601 -12.464  -5.222
  519    H    THR  71           H        THR  71  -0.740  -9.954  -5.487
  520    HA   THR  71           HA       THR  71  -0.333  -9.607  -8.363
  521    HB   THR  71           HB       THR  71  -2.547 -10.287  -8.973
  522    HG1  THR  71           HG1      THR  71  -2.975 -10.692  -6.194
  523   1HG2  THR  71          1HG2      THR  71  -2.574 -12.672  -8.293
  524   2HG2  THR  71          2HG2      THR  71  -1.370 -12.319  -7.052
  525   3HG2  THR  71          3HG2      THR  71  -0.957 -12.140  -8.758
  526    H    VAL  72           H        VAL  72  -0.789  -7.577  -8.987
  527    HA   VAL  72           HA       VAL  72  -1.956  -5.771  -6.980
  528    HB   VAL  72           HB       VAL  72  -0.718  -4.944  -9.601
  529   1HG1  VAL  72          1HG1      VAL  72  -0.336  -2.844  -8.367
  530   2HG1  VAL  72          2HG1      VAL  72  -1.066  -3.554  -6.928
  531   3HG1  VAL  72          3HG1      VAL  72  -2.047  -3.270  -8.366
  532   1HG2  VAL  72          1HG2      VAL  72   0.990  -6.255  -8.493
  533   2HG2  VAL  72          2HG2      VAL  72   0.629  -5.495  -6.941
  534   3HG2  VAL  72          3HG2      VAL  72   1.367  -4.550  -8.235
  535    H    ASP  73           H        ASP  73  -4.011  -5.240  -7.116
  536    HA   ASP  73           HA       ASP  73  -5.542  -5.713  -9.551
  537   1HB   ASP  73          2HB       ASP  73  -6.313  -4.650  -6.818
  538   2HB   ASP  73          1HB       ASP  73  -7.451  -4.821  -8.155
  539    H    PHE  74           H        PHE  74  -7.005  -3.867 -10.337
  540    HA   PHE  74           HA       PHE  74  -5.398  -1.707 -11.136
  541   1HB   PHE  74          2HB       PHE  74  -7.591  -2.521 -12.200
  542   2HB   PHE  74          1HB       PHE  74  -8.398  -1.483 -11.021
  543    HD1  PHE  74           HD1      PHE  74  -5.189  -1.095 -12.909
  544    HD2  PHE  74           HD2      PHE  74  -9.129   0.442 -12.151
  545    HE1  PHE  74           HE1      PHE  74  -4.709   0.860 -14.353
  546    HE2  PHE  74           HE2      PHE  74  -8.638   2.406 -13.588
  547    HZ   PHE  74           HZ       PHE  74  -6.428   2.611 -14.688
  548    H    ASP  75           H        ASP  75  -7.520  -2.064  -8.340
  549    HA   ASP  75           HA       ASP  75  -7.518   0.693  -7.580
  550   1HB   ASP  75          2HB       ASP  75  -9.089  -1.163  -6.723
  551   2HB   ASP  75          1HB       ASP  75  -7.768  -1.610  -5.643
  552    H    GLU  76           H        GLU  76  -5.540  -2.126  -6.680
  553    HA   GLU  76           HA       GLU  76  -3.840  -0.717  -4.858
  554   1HB   GLU  76          2HB       GLU  76  -3.251  -3.273  -6.379
  555   2HB   GLU  76          1HB       GLU  76  -2.416  -2.694  -4.939
  556   1HG   GLU  76          2HG       GLU  76  -4.505  -2.873  -3.641
  557   2HG   GLU  76          1HG       GLU  76  -5.359  -3.427  -5.081
  558    H    PHE  77           H        PHE  77  -3.861  -1.257  -8.316
  559    HA   PHE  77           HA       PHE  77  -1.174  -0.593  -8.900
  560   1HB   PHE  77          2HB       PHE  77  -3.229  -1.579 -10.355
  561   2HB   PHE  77          1HB       PHE  77  -3.296   0.100 -10.863
  562    HD1  PHE  77           HD1      PHE  77  -2.802  -0.904 -13.126
  563    HD2  PHE  77           HD2      PHE  77   0.037  -0.992  -9.897
  564    HE1  PHE  77           HE1      PHE  77  -0.971  -1.317 -14.735
  565    HE2  PHE  77           HE2      PHE  77   1.859  -1.389 -11.516
  566    HZ   PHE  77           HZ       PHE  77   1.359  -1.560 -13.937
  567    H    LEU  78           H        LEU  78  -4.160   1.350  -9.126
  568    HA   LEU  78           HA       LEU  78  -2.812   3.792  -9.743
  569   1HB   LEU  78          2HB       LEU  78  -5.593   3.046  -8.951
  570   2HB   LEU  78          1HB       LEU  78  -5.116   4.733  -8.895
  571    HG   LEU  78           HG       LEU  78  -4.702   4.764 -11.265
  572   1HD1  LEU  78          1HD1      LEU  78  -4.814   2.813 -12.668
  573   2HD1  LEU  78          2HD1      LEU  78  -5.370   1.812 -11.327
  574   3HD1  LEU  78          3HD1      LEU  78  -3.721   2.436 -11.338
  575   1HD2  LEU  78          1HD2      LEU  78  -6.999   5.096 -10.866
  576   2HD2  LEU  78          2HD2      LEU  78  -7.253   3.417 -10.394
  577   3HD2  LEU  78          3HD2      LEU  78  -6.978   3.826 -12.088
  578    H    VAL  79           H        VAL  79  -3.847   2.252  -6.749
  579    HA   VAL  79           HA       VAL  79  -3.632   4.453  -5.003
  580    HB   VAL  79           HB       VAL  79  -3.633   1.491  -4.720
  581   1HG1  VAL  79          1HG1      VAL  79  -2.588   3.337  -2.554
  582   2HG1  VAL  79          2HG1      VAL  79  -1.703   2.026  -3.335
  583   3HG1  VAL  79          3HG1      VAL  79  -3.081   1.663  -2.295
  584   1HG2  VAL  79          1HG2      VAL  79  -5.636   3.057  -4.598
  585   2HG2  VAL  79          2HG2      VAL  79  -4.972   3.652  -3.077
  586   3HG2  VAL  79          3HG2      VAL  79  -5.450   1.961  -3.228
  587    H    MET  80           H        MET  80  -1.245   2.026  -6.017
  588    HA   MET  80           HA       MET  80   0.966   2.666  -4.532
  589   1HB   MET  80          2HB       MET  80   0.480   1.176  -6.841
  590   2HB   MET  80          1HB       MET  80   1.708   2.343  -7.326
  591   1HG   MET  80          2HG       MET  80   3.097   1.694  -5.392
  592   2HG   MET  80          1HG       MET  80   1.868   0.529  -4.900
  593   1HE   MET  80          1HE       MET  80   1.850  -2.266  -6.603
  594   2HE   MET  80          2HE       MET  80   1.277  -1.365  -8.005
  595   3HE   MET  80          3HE       MET  80   0.782  -0.872  -6.387
  596    H    MET  81           H        MET  81  -0.445   4.574  -7.142
  597    HA   MET  81           HA       MET  81   1.774   6.254  -7.681
  598   1HB   MET  81          2HB       MET  81  -0.287   6.090  -9.106
  599   2HB   MET  81          1HB       MET  81  -1.154   7.003  -7.872
  600   1HG   MET  81          2HG       MET  81  -0.217   8.966  -8.509
  601   2HG   MET  81          1HG       MET  81   1.387   8.250  -8.656
  602   1HE   MET  81          1HE       MET  81   2.503   7.741 -11.093
  603   2HE   MET  81          2HE       MET  81   1.512   6.624 -12.028
  604   3HE   MET  81          3HE       MET  81   1.743   6.353 -10.301
  605    H    VAL  82           H        VAL  82  -1.101   6.827  -5.630
  606    HA   VAL  82           HA       VAL  82  -0.105   9.252  -4.507
  607    HB   VAL  82           HB       VAL  82  -1.921   8.995  -2.844
  608   1HG1  VAL  82          1HG1      VAL  82  -2.587   8.445  -5.746
  609   2HG1  VAL  82          2HG1      VAL  82  -2.501  10.014  -4.945
  610   3HG1  VAL  82          3HG1      VAL  82  -3.798   8.888  -4.542
  611   1HG2  VAL  82          1HG2      VAL  82  -3.327   7.067  -2.793
  612   2HG2  VAL  82          2HG2      VAL  82  -1.678   6.441  -2.783
  613   3HG2  VAL  82          3HG2      VAL  82  -2.620   6.422  -4.275
  614    H    ARG  83           H        ARG  83   0.200   5.865  -3.623
  615    HA   ARG  83           HA       ARG  83   1.077   6.133  -0.959
  616   1HB   ARG  83          2HB       ARG  83   1.842   4.064  -3.039
  617   2HB   ARG  83          1HB       ARG  83   2.205   3.940  -1.319
  618   1HG   ARG  83          2HG       ARG  83  -0.358   4.296  -0.990
  619   2HG   ARG  83          1HG       ARG  83  -0.474   3.840  -2.690
  620   1HD   ARG  83          2HD       ARG  83  -0.675   1.770  -1.668
  621   2HD   ARG  83          1HD       ARG  83   1.054   1.831  -1.966
  622    HE   ARG  83           HE       ARG  83  -0.282   2.142   0.637
  623   1HH1  ARG  83          2HH1      ARG  83   2.671   2.018  -1.239
  624   2HH1  ARG  83          1HH1      ARG  83   3.679   1.784   0.144
  625   1HH2  ARG  83          1HH2      ARG  83   1.063   1.816   2.420
  626   2HH2  ARG  83          2HH2      ARG  83   2.775   1.673   2.206
  627    H    CYS  84           H        CYS  84   2.833   6.227  -4.039
  628    HA   CYS  84           HA       CYS  84   5.451   6.411  -2.943
  629   1HB   CYS  84          2HB       CYS  84   4.254   7.075  -5.619
  630   2HB   CYS  84          1HB       CYS  84   5.922   7.518  -5.254
  631    HG   CYS  84           HG       CYS  84   6.597   5.107  -5.277
  632    H    MET  85           H        MET  85   3.026   8.833  -3.842
  633    HA   MET  85           HA       MET  85   4.710  11.108  -3.441
  634   1HB   MET  85          2HB       MET  85   1.781  10.663  -3.819
  635   2HB   MET  85          1HB       MET  85   2.309  12.206  -3.147
  636   1HG   MET  85          2HG       MET  85   3.661  12.687  -5.056
  637   2HG   MET  85          1HG       MET  85   3.517  11.037  -5.661
  638   1HE   MET  85          1HE       MET  85   2.148  14.231  -4.786
  639   2HE   MET  85          2HE       MET  85   0.467  13.784  -4.504
  640   3HE   MET  85          3HE       MET  85   0.910  14.619  -5.989
  641    H    LYS  86           H        LYS  86   2.088   9.688  -1.446
  642    HA   LYS  86           HA       LYS  86   3.452  10.762   0.942
  643   1HB   LYS  86          2HB       LYS  86   1.433  12.178   0.122
  644   2HB   LYS  86          1HB       LYS  86   0.454  10.847   0.736
  645   1HG   LYS  86          2HG       LYS  86   2.595  11.838   2.545
  646   2HG   LYS  86          1HG       LYS  86   1.232  12.925   2.282
  647   1HD   LYS  86          2HD       LYS  86  -0.243  10.834   2.747
  648   2HD   LYS  86          1HD       LYS  86   1.222  10.146   3.448
  649   1HE   LYS  86          2HE       LYS  86   0.351  12.903   4.266
  650   2HE   LYS  86          1HE       LYS  86  -0.439  11.496   4.977
  651   1HZ   LYS  86          1HZ       LYS  86   1.446  12.207   6.304
  652   2HZ   LYS  86          2HZ       LYS  86   2.486  12.027   4.973
  653   3HZ   LYS  86          3HZ       LYS  86   1.729  10.666   5.655
  654    H    ASP  87           H        ASP  87   3.961   9.089   2.160
  655    HA   ASP  87           HA       ASP  87   2.053   7.341   3.278
  656   1HB   ASP  87          2HB       ASP  87   2.233   6.352   0.927
  657   2HB   ASP  87          1HB       ASP  87   3.881   5.889   1.358
  658    H    ASP  88           H        ASP  88   3.248   8.317   5.013
  659    HA   ASP  88           HA       ASP  88   6.027   7.788   5.436
  660   1HB   ASP  88          2HB       ASP  88   3.786   8.757   7.202
  661   2HB   ASP  88          1HB       ASP  88   5.370   8.375   7.879
  662    H    SER  89           HN       SER  89   3.023   6.314   6.644
  663    HA   SER  89           HA       SER  89   4.605   4.031   7.654
  664   1HB   SER  89          2HB       SER  89   2.487   3.527   8.978
  665   2HB   SER  89          1HB       SER  89   3.387   4.956   9.473
  666    HG   SER  89           HG       SER  89   1.184   5.433   9.284
  Start of MODEL   26
    1   1H    MET   1          1H        MET   1  -8.604   4.885   9.795
    2   2H    MET   1          2H        MET   1  -8.925   4.441   8.186
    3   3H    MET   1          3H        MET   1  -8.368   6.007   8.545
    4    HA   MET   1           HA       MET   1  -6.267   5.053   9.365
    5   1HB   MET   1          2HB       MET   1  -7.642   2.533   8.414
    6   2HB   MET   1          1HB       MET   1  -5.886   2.639   8.535
    7   1HG   MET   1          2HG       MET   1  -6.293   3.469  10.950
    8   2HG   MET   1          1HG       MET   1  -7.932   2.850  10.745
    9   1HE   MET   1          1HE       MET   1  -7.121   1.675  12.944
   10   2HE   MET   1          2HE       MET   1  -6.878  -0.063  12.797
   11   3HE   MET   1          3HE       MET   1  -8.293   0.686  12.063
   12    H    ASN   2           H        ASN   2  -5.419   6.455   7.899
   13    HA   ASN   2           HA       ASN   2  -4.578   7.278   5.929
   14   1HB   ASN   2          2HB       ASN   2  -4.507   4.307   5.387
   15   2HB   ASN   2          1HB       ASN   2  -3.892   5.487   4.232
   16   1HD2  ASN   2          1HD2      ASN   2  -2.371   7.239   5.448
   17   2HD2  ASN   2          2HD2      ASN   2  -1.232   6.552   6.501
   18    H    ASP   3           H        ASP   3  -6.867   8.140   5.790
   19    HA   ASP   3           HA       ASP   3  -8.513   6.947   3.691
   20   1HB   ASP   3          2HB       ASP   3 -10.153   8.652   4.249
   21   2HB   ASP   3          1HB       ASP   3  -9.580   7.887   5.728
   22    H    ILE   4           H        ILE   4  -6.061   9.350   3.950
   23    HA   ILE   4           HA       ILE   4  -6.813  11.201   2.002
   24    HB   ILE   4           HB       ILE   4  -4.496  11.809   1.774
   25   1HG1  ILE   4          2HG1      ILE   4  -3.680   9.382   1.595
   26   2HG1  ILE   4          1HG1      ILE   4  -2.651  10.488   2.496
   27   1HG2  ILE   4          1HG2      ILE   4  -4.985  10.922   4.630
   28   2HG2  ILE   4          2HG2      ILE   4  -5.680  12.368   3.896
   29   3HG2  ILE   4          3HG2      ILE   4  -3.933  12.232   4.093
   30   1HD1  ILE   4          1HD1      ILE   4  -4.394   8.267   3.521
   31   2HD1  ILE   4          2HD1      ILE   4  -4.032   9.636   4.572
   32   3HD1  ILE   4          3HD1      ILE   4  -2.722   8.650   3.927
   33    H    TYR   5           H        TYR   5  -5.461   7.982   1.621
   34    HA   TYR   5           HA       TYR   5  -4.811   8.202  -1.150
   35   1HB   TYR   5          2HB       TYR   5  -5.477   5.735   0.479
   36   2HB   TYR   5          1HB       TYR   5  -4.742   5.736  -1.123
   37    HD1  TYR   5           HD1      TYR   5  -2.522   7.048  -1.413
   38    HD2  TYR   5           HD2      TYR   5  -4.134   5.913   2.403
   39    HE1  TYR   5           HE1      TYR   5  -0.292   7.351  -0.382
   40    HE2  TYR   5           HE2      TYR   5  -1.897   6.206   3.432
   41    HH   TYR   5           HH       TYR   5   0.778   6.135   2.065
   42    H    LYS   6           H        LYS   6  -7.695   7.149   0.624
   43    HA   LYS   6           HA       LYS   6  -9.169   6.307  -1.680
   44   1HB   LYS   6          2HB       LYS   6  -9.891   6.919   1.172
   45   2HB   LYS   6          1HB       LYS   6 -11.155   6.658  -0.029
   46   1HG   LYS   6          2HG       LYS   6 -10.887   4.460   0.497
   47   2HG   LYS   6          1HG       LYS   6  -9.485   4.559  -0.566
   48   1HD   LYS   6          2HD       LYS   6  -8.964   5.478   2.185
   49   2HD   LYS   6          1HD       LYS   6  -9.396   3.774   2.069
   50   1HE   LYS   6          2HE       LYS   6  -7.459   4.744   0.042
   51   2HE   LYS   6          1HE       LYS   6  -6.869   4.698   1.702
   52   1HZ   LYS   6          1HZ       LYS   6  -8.140   2.432   0.261
   53   2HZ   LYS   6          2HZ       LYS   6  -7.551   2.392   1.855
   54   3HZ   LYS   6          3HZ       LYS   6  -6.478   2.606   0.556
   55    H    ALA   7           H        ALA   7  -8.683   9.374  -0.052
   56    HA   ALA   7           HA       ALA   7 -10.900  10.761  -1.198
   57   1HB   ALA   7          1HB       ALA   7 -10.012  12.692  -0.234
   58   2HB   ALA   7          2HB       ALA   7  -8.348  12.129  -0.398
   59   3HB   ALA   7          3HB       ALA   7  -9.401  11.424   0.828
   60    H    ALA   8           H        ALA   8  -7.648  10.028  -2.307
   61    HA   ALA   8           HA       ALA   8  -7.732  11.940  -4.490
   62   1HB   ALA   8          1HB       ALA   8  -5.585  11.359  -3.452
   63   2HB   ALA   8          2HB       ALA   8  -5.595  10.917  -5.160
   64   3HB   ALA   8          3HB       ALA   8  -5.807   9.674  -3.926
   65    H    VAL   9           H        VAL   9  -8.022   8.415  -4.105
   66    HA   VAL   9           HA       VAL   9  -8.251   7.818  -6.869
   67    HB   VAL   9           HB       VAL   9  -7.734   6.146  -5.064
   68   1HG1  VAL   9          1HG1      VAL   9 -10.726   6.319  -4.589
   69   2HG1  VAL   9          2HG1      VAL   9  -9.473   6.827  -3.459
   70   3HG1  VAL   9          3HG1      VAL   9  -9.641   5.124  -3.878
   71   1HG2  VAL   9          1HG2      VAL   9  -8.686   4.356  -6.268
   72   2HG2  VAL   9          2HG2      VAL   9  -8.634   5.660  -7.454
   73   3HG2  VAL   9          3HG2      VAL   9 -10.150   5.266  -6.642
   74    H    GLU  10           H        GLU  10 -10.547   9.074  -4.563
   75    HA   GLU  10           HA       GLU  10 -12.868   8.360  -6.133
   76   1HB   GLU  10          2HB       GLU  10 -14.146   9.583  -4.482
   77   2HB   GLU  10          1HB       GLU  10 -12.956   8.579  -3.654
   78   1HG   GLU  10          2HG       GLU  10 -11.764  10.373  -2.895
   79   2HG   GLU  10          1HG       GLU  10 -12.059  11.321  -4.349
   80    H    GLN  11           H        GLN  11 -10.565  10.948  -6.131
   81    HA   GLN  11           HA       GLN  11 -12.259  12.378  -8.084
   82   1HB   GLN  11          2HB       GLN  11 -11.609  14.530  -7.198
   83   2HB   GLN  11          1HB       GLN  11 -12.301  13.573  -5.890
   84   1HG   GLN  11          2HG       GLN  11  -9.920  12.889  -5.291
   85   2HG   GLN  11          1HG       GLN  11  -9.371  14.125  -6.422
   86   1HE2  GLN  11          1HE2      GLN  11  -9.370  13.899  -3.296
   87   2HE2  GLN  11          2HE2      GLN  11  -9.987  15.402  -2.808
   88    H    LEU  12           H        LEU  12 -10.016  10.468  -8.392
   89    HA   LEU  12           HA       LEU  12  -7.688  11.957  -9.185
   90   1HB   LEU  12          2HB       LEU  12  -7.202   9.724 -10.452
   91   2HB   LEU  12          1HB       LEU  12  -7.077   9.806  -8.712
   92    HG   LEU  12           HG       LEU  12  -9.178   8.654  -8.447
   93   1HD1  LEU  12          1HD1      LEU  12 -10.584   9.462 -10.152
   94   2HD1  LEU  12          2HD1      LEU  12 -10.284   7.793 -10.637
   95   3HD1  LEU  12          3HD1      LEU  12  -9.406   9.108 -11.416
   96   1HD2  LEU  12          1HD2      LEU  12  -7.468   7.371 -10.599
   97   2HD2  LEU  12          2HD2      LEU  12  -8.638   6.516  -9.594
   98   3HD2  LEU  12          3HD2      LEU  12  -7.212   7.247  -8.859
   99    H    THR  13           H        THR  13  -6.820  11.504 -11.528
  100    HA   THR  13           HA       THR  13  -8.823  12.639 -13.346
  101    HB   THR  13           HB       THR  13  -6.556  12.543 -14.832
  102    HG1  THR  13           HG1      THR  13  -5.095  11.855 -13.457
  103   1HG2  THR  13          1HG2      THR  13  -7.540  14.618 -14.689
  104   2HG2  THR  13          2HG2      THR  13  -6.137  14.889 -13.656
  105   3HG2  THR  13          3HG2      THR  13  -7.710  14.539 -12.936
  106    H    ASP  14           H        ASP  14  -8.794  11.885 -15.623
  107    HA   ASP  14           HA       ASP  14  -9.285   9.058 -15.749
  108   1HB   ASP  14          2HB       ASP  14 -10.446  10.910 -17.113
  109   2HB   ASP  14          1HB       ASP  14  -9.006  10.890 -18.131
  110    H    GLU  15           H        GLU  15  -6.650  11.208 -16.554
  111    HA   GLU  15           HA       GLU  15  -5.160   9.416 -18.200
  112   1HB   GLU  15          2HB       GLU  15  -3.353  10.981 -17.974
  113   2HB   GLU  15          1HB       GLU  15  -4.845  11.910 -18.095
  114   1HG   GLU  15          2HG       GLU  15  -4.889  12.271 -15.700
  115   2HG   GLU  15          1HG       GLU  15  -3.519  11.187 -15.467
  116    H    GLN  16           H        GLN  16  -5.403   9.931 -14.741
  117    HA   GLN  16           HA       GLN  16  -3.067   8.509 -13.952
  118   1HB   GLN  16          2HB       GLN  16  -4.983  10.002 -12.638
  119   2HB   GLN  16          1HB       GLN  16  -5.327   8.363 -12.085
  120   1HG   GLN  16          2HG       GLN  16  -2.617   8.367 -11.902
  121   2HG   GLN  16          1HG       GLN  16  -2.954  10.069 -11.584
  122   1HE2  GLN  16          1HE2      GLN  16  -4.948  10.338  -9.959
  123   2HE2  GLN  16          2HE2      GLN  16  -4.911   9.307  -8.610
  124    H    LYS  17           H        LYS  17  -6.476   7.585 -14.325
  125    HA   LYS  17           HA       LYS  17  -6.141   4.871 -13.510
  126   1HB   LYS  17          2HB       LYS  17  -8.284   6.066 -15.289
  127   2HB   LYS  17          1HB       LYS  17  -8.360   4.503 -14.477
  128   1HG   LYS  17          2HG       LYS  17  -8.857   5.431 -12.459
  129   2HG   LYS  17          1HG       LYS  17  -7.752   6.784 -12.698
  130   1HD   LYS  17          2HD       LYS  17  -9.901   7.779 -12.732
  131   2HD   LYS  17          1HD       LYS  17  -9.463   7.637 -14.433
  132   1HE   LYS  17          2HE       LYS  17 -10.832   5.270 -13.309
  133   2HE   LYS  17          1HE       LYS  17 -11.817   6.730 -13.380
  134   1HZ   LYS  17          1HZ       LYS  17 -10.416   5.378 -15.612
  135   2HZ   LYS  17          2HZ       LYS  17 -11.049   6.948 -15.744
  136   3HZ   LYS  17          3HZ       LYS  17 -12.082   5.636 -15.434
  137    H    ASN  18           H        ASN  18  -6.209   6.497 -16.678
  138    HA   ASN  18           HA       ASN  18  -5.996   4.140 -18.251
  139   1HB   ASN  18          2HB       ASN  18  -5.515   7.054 -18.753
  140   2HB   ASN  18          1HB       ASN  18  -4.952   5.875 -19.939
  141   1HD2  ASN  18          1HD2      ASN  18  -7.372   7.887 -19.793
  142   2HD2  ASN  18          2HD2      ASN  18  -8.678   6.930 -20.302
  143    H    GLU  19           H        GLU  19  -3.580   6.250 -16.770
  144    HA   GLU  19           HA       GLU  19  -1.267   5.398 -18.064
  145   1HB   GLU  19          2HB       GLU  19  -1.398   7.248 -16.381
  146   2HB   GLU  19          1HB       GLU  19  -1.499   6.029 -15.111
  147   1HG   GLU  19          2HG       GLU  19   0.777   6.252 -15.101
  148   2HG   GLU  19          1HG       GLU  19   0.678   5.125 -16.453
  149    H    PHE  20           H        PHE  20  -2.839   4.007 -15.182
  150    HA   PHE  20           HA       PHE  20  -0.969   1.779 -15.113
  151   1HB   PHE  20          2HB       PHE  20  -3.313   2.616 -13.429
  152   2HB   PHE  20          1HB       PHE  20  -2.600   1.015 -13.261
  153    HD1  PHE  20           HD1      PHE  20  -2.210   4.568 -12.603
  154    HD2  PHE  20           HD2      PHE  20  -0.170   0.786 -12.633
  155    HE1  PHE  20           HE1      PHE  20  -0.419   5.518 -11.184
  156    HE2  PHE  20           HE2      PHE  20   1.609   1.732 -11.202
  157    HZ   PHE  20           HZ       PHE  20   1.492   4.103 -10.478
  158    H    LYS  21           H        LYS  21  -4.432   2.279 -15.802
  159    HA   LYS  21           HA       LYS  21  -5.223  -0.368 -16.141
  160   1HB   LYS  21          2HB       LYS  21  -6.766   1.576 -16.125
  161   2HB   LYS  21          1HB       LYS  21  -6.215   1.997 -17.744
  162   1HG   LYS  21          2HG       LYS  21  -7.050  -0.819 -17.431
  163   2HG   LYS  21          1HG       LYS  21  -8.347   0.356 -17.215
  164   1HD   LYS  21          2HD       LYS  21  -6.521   0.795 -19.527
  165   2HD   LYS  21          1HD       LYS  21  -7.630  -0.571 -19.642
  166   1HE   LYS  21          2HE       LYS  21  -9.526   0.785 -19.552
  167   2HE   LYS  21          1HE       LYS  21  -8.672   2.097 -18.740
  168   1HZ   LYS  21          1HZ       LYS  21  -9.159   2.567 -21.091
  169   2HZ   LYS  21          2HZ       LYS  21  -8.186   1.250 -21.545
  170   3HZ   LYS  21          3HZ       LYS  21  -7.497   2.588 -20.755
  171    H    ALA  22           H        ALA  22  -3.563   1.761 -18.440
  172    HA   ALA  22           HA       ALA  22  -3.857   0.185 -20.758
  173   1HB   ALA  22          1HB       ALA  22  -1.546   1.967 -19.945
  174   2HB   ALA  22          2HB       ALA  22  -2.970   2.469 -20.858
  175   3HB   ALA  22          3HB       ALA  22  -1.820   1.338 -21.570
  176    H    ALA  23           H        ALA  23  -1.161   0.313 -18.430
  177    HA   ALA  23           HA       ALA  23   0.243  -1.914 -19.518
  178   1HB   ALA  23          1HB       ALA  23   1.790  -1.519 -17.878
  179   2HB   ALA  23          2HB       ALA  23   0.566  -1.279 -16.632
  180   3HB   ALA  23          3HB       ALA  23   0.934   0.018 -17.768
  181    H    PHE  24           H        PHE  24  -2.173  -1.506 -16.996
  182    HA   PHE  24           HA       PHE  24  -2.059  -4.062 -15.817
  183   1HB   PHE  24          2HB       PHE  24  -3.350  -1.967 -15.043
  184   2HB   PHE  24          1HB       PHE  24  -4.609  -2.487 -16.160
  185    HD1  PHE  24           HD1      PHE  24  -5.561  -4.854 -15.900
  186    HD2  PHE  24           HD2      PHE  24  -3.130  -2.961 -12.912
  187    HE1  PHE  24           HE1      PHE  24  -6.397  -6.453 -14.202
  188    HE2  PHE  24           HE2      PHE  24  -3.968  -4.554 -11.216
  189    HZ   PHE  24           HZ       PHE  24  -5.606  -6.295 -11.858
  190    H    ASP  25           H        ASP  25  -4.010  -2.829 -18.535
  191    HA   ASP  25           HA       ASP  25  -5.482  -5.213 -18.972
  192   1HB   ASP  25          2HB       ASP  25  -5.872  -2.792 -19.875
  193   2HB   ASP  25          1HB       ASP  25  -4.847  -3.320 -21.209
  194    H    ILE  26           H        ILE  26  -2.395  -4.083 -20.308
  195    HA   ILE  26           HA       ILE  26  -2.218  -6.219 -22.230
  196    HB   ILE  26           HB       ILE  26   0.119  -5.435 -22.570
  197   1HG1  ILE  26          2HG1      ILE  26  -0.578  -3.363 -20.465
  198   2HG1  ILE  26          1HG1      ILE  26   0.479  -4.740 -20.172
  199   1HG2  ILE  26          1HG2      ILE  26  -1.974  -3.240 -22.457
  200   2HG2  ILE  26          2HG2      ILE  26  -1.783  -4.402 -23.768
  201   3HG2  ILE  26          3HG2      ILE  26  -0.515  -3.220 -23.446
  202   1HD1  ILE  26          1HD1      ILE  26   2.034  -3.964 -21.879
  203   2HD1  ILE  26          2HD1      ILE  26   1.737  -2.659 -20.729
  204   3HD1  ILE  26          3HD1      ILE  26   0.949  -2.641 -22.307
  205    H    PHE  27           H        PHE  27  -0.970  -5.688 -18.961
  206    HA   PHE  27           HA       PHE  27   0.728  -8.009 -18.978
  207   1HB   PHE  27          2HB       PHE  27  -0.338  -6.413 -16.635
  208   2HB   PHE  27          1HB       PHE  27   0.933  -7.631 -16.549
  209    HD1  PHE  27           HD1      PHE  27   1.111  -4.609 -15.832
  210    HD2  PHE  27           HD2      PHE  27   2.116  -6.837 -19.368
  211    HE1  PHE  27           HE1      PHE  27   2.779  -2.883 -16.457
  212    HE2  PHE  27           HE2      PHE  27   3.785  -5.109 -19.982
  213    HZ   PHE  27           HZ       PHE  27   4.114  -3.135 -18.525
  214    H    ILE  28           H        ILE  28  -2.593  -7.346 -17.899
  215    HA   ILE  28           HA       ILE  28  -2.852 -10.112 -16.941
  216    HB   ILE  28           HB       ILE  28  -4.972  -9.497 -16.021
  217   1HG1  ILE  28          2HG1      ILE  28  -5.499  -6.862 -16.467
  218   2HG1  ILE  28          1HG1      ILE  28  -4.796  -7.315 -18.020
  219   1HG2  ILE  28          1HG2      ILE  28  -2.971  -8.697 -14.797
  220   2HG2  ILE  28          2HG2      ILE  28  -4.361  -7.638 -14.555
  221   3HG2  ILE  28          3HG2      ILE  28  -3.072  -7.164 -15.660
  222   1HD1  ILE  28          1HD1      ILE  28  -7.385  -7.638 -17.577
  223   2HD1  ILE  28          2HD1      ILE  28  -6.844  -9.122 -16.791
  224   3HD1  ILE  28          3HD1      ILE  28  -6.475  -8.841 -18.494
  225    H    GLN  29           H        GLN  29  -2.937  -8.752 -19.900
  226    HA   GLN  29           HA       GLN  29  -5.320  -9.422 -21.144
  227   1HB   GLN  29          2HB       GLN  29  -3.550  -8.228 -22.314
  228   2HB   GLN  29          1HB       GLN  29  -2.496  -9.639 -22.224
  229   1HG   GLN  29          2HG       GLN  29  -3.976 -10.915 -23.649
  230   2HG   GLN  29          1HG       GLN  29  -5.186  -9.632 -23.619
  231   1HE2  GLN  29          1HE2      GLN  29  -4.266  -7.397 -24.455
  232   2HE2  GLN  29          2HE2      GLN  29  -3.242  -7.481 -25.806
  233    H    ASP  30           H        ASP  30  -2.571 -11.499 -20.346
  234    HA   ASP  30           HA       ASP  30  -4.029 -13.854 -21.363
  235   1HB   ASP  30          2HB       ASP  30  -1.859 -15.032 -21.174
  236   2HB   ASP  30          1HB       ASP  30  -1.755 -13.619 -22.222
  237    H    ALA  31           H        ALA  31  -4.322 -12.324 -18.662
  238    HA   ALA  31           HA       ALA  31  -3.742 -14.526 -16.803
  239   1HB   ALA  31          1HB       ALA  31  -3.059 -12.184 -16.206
  240   2HB   ALA  31          2HB       ALA  31  -4.132 -12.941 -15.028
  241   3HB   ALA  31          3HB       ALA  31  -4.770 -11.752 -16.163
  242    H    GLU  32           H        GLU  32  -5.356 -15.262 -15.341
  243    HA   GLU  32           HA       GLU  32  -8.130 -14.926 -16.326
  244   1HB   GLU  32          2HB       GLU  32  -8.545 -17.272 -15.632
  245   2HB   GLU  32          1HB       GLU  32  -7.327 -17.158 -16.901
  246   1HG   GLU  32          2HG       GLU  32  -5.553 -17.252 -15.119
  247   2HG   GLU  32          1HG       GLU  32  -6.825 -17.544 -13.934
  248    H    ASP  33           H        ASP  33  -6.954 -13.299 -14.325
  249    HA   ASP  33           HA       ASP  33  -8.647 -14.032 -12.028
  250   1HB   ASP  33          2HB       ASP  33  -6.043 -14.512 -11.791
  251   2HB   ASP  33          1HB       ASP  33  -6.001 -12.783 -11.445
  252    H    GLY  34           H        GLY  34  -6.591 -11.494 -13.463
  253   1HA   GLY  34          2HA       GLY  34  -7.528  -9.348 -14.079
  254   2HA   GLY  34          1HA       GLY  34  -8.650  -9.501 -12.728
  255    H    CYS  35           H        CYS  35  -5.150 -10.076 -12.834
  256    HA   CYS  35           HA       CYS  35  -4.500  -7.652 -11.400
  257   1HB   CYS  35          2HB       CYS  35  -3.517  -8.894  -9.443
  258   2HB   CYS  35          1HB       CYS  35  -5.278  -8.899  -9.495
  259    HG   CYS  35           HG       CYS  35  -4.316 -11.355 -10.907
  260    H    ILE  36           H        ILE  36  -2.226  -7.308 -11.236
  261    HA   ILE  36           HA       ILE  36  -0.705  -8.894 -13.187
  262    HB   ILE  36           HB       ILE  36   0.886  -7.110 -13.242
  263   1HG1  ILE  36          2HG1      ILE  36   0.036  -5.106 -11.521
  264   2HG1  ILE  36          1HG1      ILE  36  -0.178  -6.567 -10.556
  265   1HG2  ILE  36          1HG2      ILE  36  -1.288  -6.688 -14.386
  266   2HG2  ILE  36          2HG2      ILE  36  -0.502  -5.201 -13.856
  267   3HG2  ILE  36          3HG2      ILE  36  -1.859  -5.856 -12.940
  268   1HD1  ILE  36          1HD1      ILE  36   2.135  -7.220 -10.930
  269   2HD1  ILE  36          2HD1      ILE  36   2.112  -5.562 -10.338
  270   3HD1  ILE  36          3HD1      ILE  36   2.370  -5.879 -12.053
  271    H    SER  37           H        SER  37   1.709  -9.177 -12.586
  272    HA   SER  37           HA       SER  37   1.767 -10.590 -10.020
  273   1HB   SER  37          2HB       SER  37   2.743 -11.314 -12.446
  274   2HB   SER  37          1HB       SER  37   4.180 -10.584 -11.736
  275    HG   SER  37           HG       SER  37   4.100 -12.737 -11.140
  276    H    THR  38           H        THR  38   2.355  -9.467  -8.290
  277    HA   THR  38           HA       THR  38   3.573  -6.970  -8.186
  278    HB   THR  38           HB       THR  38   4.159  -7.506  -5.835
  279    HG1  THR  38           HG1      THR  38   4.169  -9.511  -5.150
  280   1HG2  THR  38          1HG2      THR  38   1.465  -8.127  -6.979
  281   2HG2  THR  38          2HG2      THR  38   1.960  -6.791  -5.940
  282   3HG2  THR  38          3HG2      THR  38   1.738  -8.402  -5.260
  283    H    LYS  39           H        LYS  39   5.077 -10.182  -8.087
  284    HA   LYS  39           HA       LYS  39   7.742  -9.284  -7.680
  285   1HB   LYS  39          2HB       LYS  39   8.409 -11.545  -8.463
  286   2HB   LYS  39          1HB       LYS  39   7.157 -11.599  -7.224
  287   1HG   LYS  39          2HG       LYS  39   5.893 -11.419  -9.800
  288   2HG   LYS  39          1HG       LYS  39   7.075 -12.726  -9.840
  289   1HD   LYS  39          2HD       LYS  39   5.157 -12.444  -7.529
  290   2HD   LYS  39          1HD       LYS  39   4.678 -13.276  -9.007
  291   1HE   LYS  39          2HE       LYS  39   7.271 -14.003  -7.674
  292   2HE   LYS  39          1HE       LYS  39   5.758 -14.651  -7.046
  293   1HZ   LYS  39          1HZ       LYS  39   6.766 -14.917  -9.828
  294   2HZ   LYS  39          2HZ       LYS  39   5.254 -15.473  -9.286
  295   3HZ   LYS  39          3HZ       LYS  39   6.684 -16.149  -8.665
  296    H    GLU  40           H        GLU  40   5.747  -9.562 -10.547
  297    HA   GLU  40           HA       GLU  40   8.081  -8.926 -12.245
  298   1HB   GLU  40          2HB       GLU  40   5.339  -9.978 -12.985
  299   2HB   GLU  40          1HB       GLU  40   6.596  -9.553 -14.145
  300   1HG   GLU  40          2HG       GLU  40   8.047 -11.277 -13.364
  301   2HG   GLU  40          1HG       GLU  40   7.070 -11.544 -11.919
  302    H    LEU  41           H        LEU  41   6.663  -7.010 -10.476
  303    HA   LEU  41           HA       LEU  41   4.987  -5.350 -12.088
  304   1HB   LEU  41          2HB       LEU  41   5.204  -5.460  -9.506
  305   2HB   LEU  41          1HB       LEU  41   6.527  -4.335  -9.731
  306    HG   LEU  41           HG       LEU  41   4.077  -3.549 -11.141
  307   1HD1  LEU  41          1HD1      LEU  41   3.344  -2.721  -8.656
  308   2HD1  LEU  41          2HD1      LEU  41   4.003  -4.311  -8.281
  309   3HD1  LEU  41          3HD1      LEU  41   2.685  -4.153  -9.441
  310   1HD2  LEU  41          1HD2      LEU  41   6.017  -2.271  -9.196
  311   2HD2  LEU  41          2HD2      LEU  41   4.633  -1.414  -9.878
  312   3HD2  LEU  41          3HD2      LEU  41   5.910  -2.012 -10.938
  313    H    GLY  42           H        GLY  42   8.394  -5.789 -11.983
  314   1HA   GLY  42          2HA       GLY  42   9.377  -3.230 -12.569
  315   2HA   GLY  42          1HA       GLY  42  10.113  -4.739 -13.106
  316    H    LYS  43           H        LYS  43   7.662  -5.561 -14.558
  317    HA   LYS  43           HA       LYS  43   8.258  -4.453 -17.110
  318   1HB   LYS  43          2HB       LYS  43   5.879  -6.085 -16.189
  319   2HB   LYS  43          1HB       LYS  43   6.252  -5.709 -17.870
  320   1HG   LYS  43          2HG       LYS  43   8.296  -6.952 -17.796
  321   2HG   LYS  43          1HG       LYS  43   8.220  -7.098 -16.039
  322   1HD   LYS  43          2HD       LYS  43   6.052  -8.384 -16.344
  323   2HD   LYS  43          1HD       LYS  43   6.401  -8.412 -18.073
  324   1HE   LYS  43          2HE       LYS  43   8.487  -9.334 -16.110
  325   2HE   LYS  43          1HE       LYS  43   7.184 -10.422 -16.584
  326   1HZ   LYS  43          1HZ       LYS  43   9.047  -9.041 -18.442
  327   2HZ   LYS  43          2HZ       LYS  43   7.788 -10.086 -18.899
  328   3HZ   LYS  43          3HZ       LYS  43   9.112 -10.681 -18.016
  329    H    VAL  44           H        VAL  44   6.010  -3.567 -14.584
  330    HA   VAL  44           HA       VAL  44   4.505  -1.801 -16.364
  331    HB   VAL  44           HB       VAL  44   2.838  -1.785 -14.831
  332   1HG1  VAL  44          1HG1      VAL  44   2.562  -3.829 -13.766
  333   2HG1  VAL  44          2HG1      VAL  44   4.246  -3.906 -13.248
  334   3HG1  VAL  44          3HG1      VAL  44   3.827  -4.221 -14.930
  335   1HG2  VAL  44          1HG2      VAL  44   4.985  -1.582 -12.704
  336   2HG2  VAL  44          2HG2      VAL  44   3.267  -1.697 -12.328
  337   3HG2  VAL  44          3HG2      VAL  44   3.875  -0.319 -13.241
  338    H    MET  45           H        MET  45   6.902  -1.697 -13.786
  339    HA   MET  45           HA       MET  45   6.903   1.074 -13.284
  340   1HB   MET  45          2HB       MET  45   9.023  -1.058 -13.052
  341   2HB   MET  45          1HB       MET  45   9.387   0.632 -12.702
  342   1HG   MET  45          2HG       MET  45   7.000  -0.706 -11.445
  343   2HG   MET  45          1HG       MET  45   8.606  -0.894 -10.742
  344   1HE   MET  45          1HE       MET  45   5.886   0.472  -9.496
  345   2HE   MET  45          2HE       MET  45   5.505   1.101 -11.096
  346   3HE   MET  45          3HE       MET  45   5.743   2.216  -9.754
  347    H    ARG  46           H        ARG  46   8.629  -0.898 -15.694
  348    HA   ARG  46           HA       ARG  46  10.187   1.206 -16.793
  349   1HB   ARG  46          2HB       ARG  46  10.444  -0.253 -18.771
  350   2HB   ARG  46          1HB       ARG  46  10.728  -1.125 -17.267
  351   1HG   ARG  46          2HG       ARG  46   8.702  -2.293 -17.410
  352   2HG   ARG  46          1HG       ARG  46   7.983  -1.113 -18.501
  353   1HD   ARG  46          2HD       ARG  46   8.556  -2.482 -20.190
  354   2HD   ARG  46          1HD       ARG  46  10.225  -2.022 -19.885
  355    HE   ARG  46           HE       ARG  46   8.923  -4.517 -19.084
  356   1HH1  ARG  46          2HH1      ARG  46  11.708  -2.412 -18.846
  357   2HH1  ARG  46          1HH1      ARG  46  12.754  -3.661 -18.270
  358   1HH2  ARG  46          1HH2      ARG  46  10.319  -6.131 -18.324
  359   2HH2  ARG  46          2HH2      ARG  46  11.974  -5.757 -17.975
  360    H    MET  47           H        MET  47   6.879   0.163 -17.354
  361    HA   MET  47           HA       MET  47   6.477   1.796 -19.702
  362   1HB   MET  47          2HB       MET  47   4.927  -0.127 -18.135
  363   2HB   MET  47          1HB       MET  47   3.967   1.259 -18.648
  364   1HG   MET  47          2HG       MET  47   3.942  -0.575 -20.329
  365   2HG   MET  47          1HG       MET  47   4.642   0.910 -20.974
  366   1HE   MET  47          1HE       MET  47   4.608  -2.429 -20.261
  367   2HE   MET  47          2HE       MET  47   6.221  -3.110 -20.074
  368   3HE   MET  47          3HE       MET  47   5.577  -2.820 -21.688
  369    H    LEU  48           H        LEU  48   6.022   2.120 -16.232
  370    HA   LEU  48           HA       LEU  48   4.448   4.528 -16.343
  371   1HB   LEU  48          2HB       LEU  48   5.796   2.924 -14.233
  372   2HB   LEU  48          1HB       LEU  48   5.458   4.600 -13.871
  373    HG   LEU  48           HG       LEU  48   3.097   4.254 -14.081
  374   1HD1  LEU  48          1HD1      LEU  48   2.081   2.480 -15.146
  375   2HD1  LEU  48          2HD1      LEU  48   3.357   1.346 -14.704
  376   3HD1  LEU  48          3HD1      LEU  48   3.605   2.480 -16.031
  377   1HD2  LEU  48          1HD2      LEU  48   3.316   3.474 -11.968
  378   2HD2  LEU  48          2HD2      LEU  48   4.749   2.537 -12.385
  379   3HD2  LEU  48          3HD2      LEU  48   3.145   1.859 -12.658
  380    H    GLY  49           H        GLY  49   7.860   3.746 -16.229
  381   1HA   GLY  49          2HA       GLY  49   9.372   5.437 -17.221
  382   2HA   GLY  49          1HA       GLY  49   8.515   6.639 -16.264
  383    H    GLN  50           H        GLN  50   9.322   3.476 -14.966
  384    HA   GLN  50           HA       GLN  50  11.508   4.657 -13.360
  385   1HB   GLN  50          2HB       GLN  50   9.494   2.691 -12.250
  386   2HB   GLN  50          1HB       GLN  50  10.715   3.601 -11.366
  387   1HG   GLN  50          2HG       GLN  50   8.426   4.901 -12.871
  388   2HG   GLN  50          1HG       GLN  50   8.368   4.518 -11.152
  389   1HE2  GLN  50          1HE2      GLN  50   8.627   7.172 -12.868
  390   2HE2  GLN  50          2HE2      GLN  50   9.845   8.016 -12.041
  391    H    ASN  51           H        ASN  51  12.935   2.969 -12.391
  392    HA   ASN  51           HA       ASN  51  12.834   0.332 -13.631
  393   1HB   ASN  51          2HB       ASN  51  14.087   2.051 -15.167
  394   2HB   ASN  51          1HB       ASN  51  15.396   1.850 -14.003
  395   1HD2  ASN  51          1HD2      ASN  51  13.410   0.122 -16.401
  396   2HD2  ASN  51          2HD2      ASN  51  14.426  -1.234 -16.509
  397    HA   PRO  52           HA       PRO  52  14.863   0.428  -9.446
  398   1HB   PRO  52          2HB       PRO  52  12.856  -0.763  -8.026
  399   2HB   PRO  52          1HB       PRO  52  12.955   0.984  -8.292
  400   1HG   PRO  52          2HG       PRO  52  11.124  -0.996  -9.487
  401   2HG   PRO  52          1HG       PRO  52  10.910   0.747  -9.271
  402   1HD   PRO  52          2HD       PRO  52  11.642  -0.614 -11.682
  403   2HD   PRO  52          1HD       PRO  52  11.574   1.144 -11.418
  404    H    THR  53           H        THR  53  14.433  -1.771  -7.778
  405    HA   THR  53           HA       THR  53  15.220  -4.047  -9.500
  406    HB   THR  53           HB       THR  53  16.648  -4.802  -7.802
  407    HG1  THR  53           HG1      THR  53  16.182  -4.610  -5.757
  408   1HG2  THR  53          1HG2      THR  53  17.509  -2.704  -8.720
  409   2HG2  THR  53          2HG2      THR  53  17.937  -2.845  -7.015
  410   3HG2  THR  53          3HG2      THR  53  16.611  -1.790  -7.507
  411    HA   PRO  54           HA       PRO  54  11.767  -6.343  -8.004
  412   1HB   PRO  54          2HB       PRO  54  12.803  -8.810  -7.405
  413   2HB   PRO  54          1HB       PRO  54  12.536  -8.219  -9.053
  414   1HG   PRO  54          2HG       PRO  54  15.076  -8.469  -7.527
  415   2HG   PRO  54          1HG       PRO  54  14.788  -8.600  -9.269
  416   1HD   PRO  54          2HD       PRO  54  15.860  -6.362  -7.978
  417   2HD   PRO  54          1HD       PRO  54  15.143  -6.355  -9.606
  418    H    GLU  55           H        GLU  55  14.562  -6.237  -5.902
  419    HA   GLU  55           HA       GLU  55  13.143  -7.115  -3.531
  420   1HB   GLU  55          2HB       GLU  55  15.871  -5.833  -3.834
  421   2HB   GLU  55          1HB       GLU  55  15.228  -6.533  -2.349
  422   1HG   GLU  55          2HG       GLU  55  15.441  -8.132  -4.908
  423   2HG   GLU  55          1HG       GLU  55  16.771  -8.035  -3.753
  424    H    GLU  56           H        GLU  56  14.122  -4.065  -5.043
  425    HA   GLU  56           HA       GLU  56  13.396  -2.427  -2.786
  426   1HB   GLU  56          2HB       GLU  56  14.296  -1.940  -5.588
  427   2HB   GLU  56          1HB       GLU  56  13.436  -0.639  -4.763
  428   1HG   GLU  56          2HG       GLU  56  15.081  -0.384  -3.146
  429   2HG   GLU  56          1HG       GLU  56  15.635  -2.052  -3.300
  430    H    LEU  57           H        LEU  57  11.907  -3.079  -5.980
  431    HA   LEU  57           HA       LEU  57   9.636  -1.467  -5.618
  432   1HB   LEU  57          2HB       LEU  57   8.690  -2.564  -7.473
  433   2HB   LEU  57          1HB       LEU  57  10.408  -2.488  -7.772
  434    HG   LEU  57           HG       LEU  57  10.373  -4.937  -6.774
  435   1HD1  LEU  57          1HD1      LEU  57   7.922  -5.577  -8.040
  436   2HD1  LEU  57          2HD1      LEU  57   7.571  -4.246  -6.939
  437   3HD1  LEU  57          3HD1      LEU  57   8.308  -5.725  -6.327
  438   1HD2  LEU  57          1HD2      LEU  57  11.026  -4.313  -9.073
  439   2HD2  LEU  57          2HD2      LEU  57   9.327  -4.232  -9.538
  440   3HD2  LEU  57          3HD2      LEU  57  10.043  -5.777  -9.079
  441    H    GLN  58           H        GLN  58  10.274  -4.812  -4.644
  442    HA   GLN  58           HA       GLN  58   7.683  -5.616  -3.976
  443   1HB   GLN  58          2HB       GLN  58   9.901  -6.964  -3.941
  444   2HB   GLN  58          1HB       GLN  58  10.046  -6.387  -2.283
  445   1HG   GLN  58          2HG       GLN  58   8.923  -8.549  -2.269
  446   2HG   GLN  58          1HG       GLN  58   7.765  -7.301  -1.814
  447   1HE2  GLN  58          1HE2      GLN  58   5.823  -7.346  -2.958
  448   2HE2  GLN  58          2HE2      GLN  58   5.608  -8.076  -4.474
  449    H    GLU  59           H        GLU  59   9.928  -3.545  -2.206
  450    HA   GLU  59           HA       GLU  59   8.656  -3.603   0.318
  451   1HB   GLU  59          2HB       GLU  59  10.237  -1.365  -0.977
  452   2HB   GLU  59          1HB       GLU  59   9.796  -1.441   0.729
  453   1HG   GLU  59          2HG       GLU  59  11.008  -3.632   0.888
  454   2HG   GLU  59          1HG       GLU  59  11.549  -3.406  -0.775
  455    H    MET  60           H        MET  60   8.322  -1.208  -2.333
  456    HA   MET  60           HA       MET  60   6.221   0.220  -1.053
  457   1HB   MET  60          2HB       MET  60   5.833   1.284  -3.244
  458   2HB   MET  60          1HB       MET  60   7.541   1.282  -2.816
  459   1HG   MET  60          2HG       MET  60   7.995  -0.551  -4.304
  460   2HG   MET  60          1HG       MET  60   6.276  -0.834  -4.577
  461   1HE   MET  60          1HE       MET  60   7.447   0.381  -8.017
  462   2HE   MET  60          2HE       MET  60   7.078  -0.980  -6.961
  463   3HE   MET  60          3HE       MET  60   8.677  -0.241  -6.909
  464    H    ILE  61           H        ILE  61   6.280  -2.579  -3.162
  465    HA   ILE  61           HA       ILE  61   3.498  -2.598  -3.804
  466    HB   ILE  61           HB       ILE  61   5.559  -4.820  -3.777
  467   1HG1  ILE  61          2HG1      ILE  61   6.073  -3.181  -5.461
  468   2HG1  ILE  61          1HG1      ILE  61   5.298  -4.527  -6.291
  469   1HG2  ILE  61          1HG2      ILE  61   3.465  -5.501  -5.510
  470   2HG2  ILE  61          2HG2      ILE  61   2.663  -4.919  -4.051
  471   3HG2  ILE  61          3HG2      ILE  61   3.822  -6.245  -3.952
  472   1HD1  ILE  61          1HD1      ILE  61   3.978  -1.926  -5.455
  473   2HD1  ILE  61          2HD1      ILE  61   3.128  -3.293  -6.178
  474   3HD1  ILE  61          3HD1      ILE  61   4.357  -2.427  -7.101
  475    H    ASP  62           H        ASP  62   5.439  -4.302  -1.343
  476    HA   ASP  62           HA       ASP  62   3.375  -5.764  -0.136
  477   1HB   ASP  62          2HB       ASP  62   5.954  -4.642   0.959
  478   2HB   ASP  62          1HB       ASP  62   4.845  -5.567   1.969
  479    H    GLU  63           H        GLU  63   4.419  -2.411   0.356
  480    HA   GLU  63           HA       GLU  63   2.768  -1.897   2.631
  481   1HB   GLU  63          2HB       GLU  63   4.691  -0.468   1.129
  482   2HB   GLU  63          1HB       GLU  63   3.206   0.479   1.060
  483   1HG   GLU  63          2HG       GLU  63   3.323  -0.364   3.713
  484   2HG   GLU  63          1HG       GLU  63   5.000   0.010   3.318
  485    H    VAL  64           H        VAL  64   2.384  -1.254  -0.849
  486    HA   VAL  64           HA       VAL  64  -0.179  -0.039  -0.666
  487    HB   VAL  64           HB       VAL  64   1.157  -1.444  -2.992
  488   1HG1  VAL  64          1HG1      VAL  64  -1.372   0.134  -2.704
  489   2HG1  VAL  64          2HG1      VAL  64  -1.039  -1.278  -3.706
  490   3HG1  VAL  64          3HG1      VAL  64  -0.432   0.308  -4.187
  491   1HG2  VAL  64          1HG2      VAL  64   2.310   0.544  -1.859
  492   2HG2  VAL  64          2HG2      VAL  64   0.957   1.520  -2.437
  493   3HG2  VAL  64          3HG2      VAL  64   2.007   0.696  -3.591
  494    H    ASP  65           H        ASP  65   0.715  -3.248  -1.951
  495    HA   ASP  65           HA       ASP  65  -1.835  -4.307  -2.227
  496   1HB   ASP  65          2HB       ASP  65   0.673  -5.270  -2.672
  497   2HB   ASP  65          1HB       ASP  65   0.197  -6.229  -1.271
  498    H    GLU  66           H        GLU  66  -3.328  -4.136  -0.682
  499    HA   GLU  66           HA       GLU  66  -2.777  -4.422   2.131
  500   1HB   GLU  66          2HB       GLU  66  -5.508  -4.536   0.844
  501   2HB   GLU  66          1HB       GLU  66  -5.100  -4.037   2.485
  502   1HG   GLU  66          2HG       GLU  66  -4.012  -2.570   0.084
  503   2HG   GLU  66          1HG       GLU  66  -5.591  -2.176   0.761
  504    H    ASP  67           H        ASP  67  -3.862  -6.526  -0.436
  505    HA   ASP  67           HA       ASP  67  -4.826  -8.615   1.315
  506   1HB   ASP  67          2HB       ASP  67  -4.048  -9.026  -1.568
  507   2HB   ASP  67          1HB       ASP  67  -5.280  -9.867  -0.631
  508    H    GLY  68           H        GLY  68  -1.907  -8.102  -0.661
  509   1HA   GLY  68          2HA       GLY  68   0.241  -8.929  -0.386
  510   2HA   GLY  68          1HA       GLY  68  -0.284  -9.682   1.120
  511    H    SER  69           H        SER  69  -1.712 -10.071  -2.085
  512    HA   SER  69           HA       SER  69  -1.425 -12.972  -1.872
  513   1HB   SER  69          2HB       SER  69  -2.883 -12.851  -4.001
  514   2HB   SER  69          1HB       SER  69  -3.616 -12.374  -2.473
  515    HG   SER  69           HG       SER  69  -2.730 -10.788  -4.626
  516    H    GLY  70           H        GLY  70   0.527 -10.598  -3.040
  517   1HA   GLY  70          2HA       GLY  70   2.404 -10.718  -4.385
  518   2HA   GLY  70          1HA       GLY  70   1.982 -12.388  -4.760
  519    H    THR  71           H        THR  71  -0.488 -10.005  -5.177
  520    HA   THR  71           HA       THR  71   0.077  -9.665  -8.029
  521    HB   THR  71           HB       THR  71  -2.119 -10.429  -8.716
  522    HG1  THR  71           HG1      THR  71  -3.663 -10.783  -7.319
  523   1HG2  THR  71          1HG2      THR  71  -0.820 -12.444  -6.858
  524   2HG2  THR  71          2HG2      THR  71  -0.351 -12.141  -8.532
  525   3HG2  THR  71          3HG2      THR  71  -1.935 -12.827  -8.172
  526    H    VAL  72           H        VAL  72  -0.337  -7.628  -8.631
  527    HA   VAL  72           HA       VAL  72  -1.715  -5.867  -6.747
  528    HB   VAL  72           HB       VAL  72  -0.435  -5.092  -9.371
  529   1HG1  VAL  72          1HG1      VAL  72  -1.175  -3.581  -6.848
  530   2HG1  VAL  72          2HG1      VAL  72  -1.908  -3.400  -8.442
  531   3HG1  VAL  72          3HG1      VAL  72  -0.240  -2.892  -8.175
  532   1HG2  VAL  72          1HG2      VAL  72   1.316  -6.140  -8.118
  533   2HG2  VAL  72          2HG2      VAL  72   0.761  -5.414  -6.608
  534   3HG2  VAL  72          3HG2      VAL  72   1.500  -4.405  -7.851
  535    H    ASP  73           H        ASP  73  -3.760  -5.318  -6.940
  536    HA   ASP  73           HA       ASP  73  -5.238  -5.984  -9.381
  537   1HB   ASP  73          2HB       ASP  73  -6.126  -4.970  -6.664
  538   2HB   ASP  73          1HB       ASP  73  -7.226  -5.232  -8.017
  539    H    PHE  74           H        PHE  74  -6.850  -4.237 -10.144
  540    HA   PHE  74           HA       PHE  74  -5.398  -1.986 -10.979
  541   1HB   PHE  74          2HB       PHE  74  -7.514  -2.921 -12.044
  542   2HB   PHE  74          1HB       PHE  74  -8.408  -2.018 -10.820
  543    HD1  PHE  74           HD1      PHE  74  -5.281  -1.252 -12.723
  544    HD2  PHE  74           HD2      PHE  74  -9.326  -0.117 -11.841
  545    HE1  PHE  74           HE1      PHE  74  -4.989   0.817 -14.049
  546    HE2  PHE  74           HE2      PHE  74  -9.033   1.956 -13.169
  547    HZ   PHE  74           HZ       PHE  74  -6.868   2.423 -14.276
  548    H    ASP  75           H        ASP  75  -7.469  -2.450  -8.163
  549    HA   ASP  75           HA       ASP  75  -7.658   0.303  -7.423
  550   1HB   ASP  75          2HB       ASP  75  -7.969  -2.260  -5.847
  551   2HB   ASP  75          1HB       ASP  75  -8.182  -0.664  -5.126
  552    H    GLU  76           H        GLU  76  -5.446  -2.336  -6.568
  553    HA   GLU  76           HA       GLU  76  -3.873  -0.748  -4.752
  554   1HB   GLU  76          2HB       GLU  76  -3.137  -3.355  -6.105
  555   2HB   GLU  76          1HB       GLU  76  -2.373  -2.658  -4.676
  556   1HG   GLU  76          2HG       GLU  76  -4.399  -2.921  -3.380
  557   2HG   GLU  76          1HG       GLU  76  -5.310  -3.405  -4.807
  558    H    PHE  77           H        PHE  77  -3.901  -1.358  -8.175
  559    HA   PHE  77           HA       PHE  77  -1.228  -0.661  -8.818
  560   1HB   PHE  77          2HB       PHE  77  -3.279  -1.715 -10.221
  561   2HB   PHE  77          1HB       PHE  77  -3.410  -0.044 -10.744
  562    HD1  PHE  77           HD1      PHE  77  -2.918  -0.928 -13.025
  563    HD2  PHE  77           HD2      PHE  77  -0.045  -1.149  -9.830
  564    HE1  PHE  77           HE1      PHE  77  -1.107  -1.318 -14.666
  565    HE2  PHE  77           HE2      PHE  77   1.756  -1.530 -11.477
  566    HZ   PHE  77           HZ       PHE  77   1.229  -1.622 -13.898
  567    H    LEU  78           H        LEU  78  -4.264   1.212  -8.921
  568    HA   LEU  78           HA       LEU  78  -3.007   3.666  -9.671
  569   1HB   LEU  78          2HB       LEU  78  -5.723   2.853  -8.763
  570   2HB   LEU  78          1HB       LEU  78  -5.298   4.554  -8.685
  571    HG   LEU  78           HG       LEU  78  -5.032   4.690 -11.051
  572   1HD1  LEU  78          1HD1      LEU  78  -3.820   2.489 -11.254
  573   2HD1  LEU  78          2HD1      LEU  78  -5.001   2.783 -12.528
  574   3HD1  LEU  78          3HD1      LEU  78  -5.389   1.686 -11.200
  575   1HD2  LEU  78          1HD2      LEU  78  -7.224   3.791 -11.874
  576   2HD2  LEU  78          2HD2      LEU  78  -7.362   4.681 -10.358
  577   3HD2  LEU  78          3HD2      LEU  78  -7.390   2.918 -10.350
  578    H    VAL  79           H        VAL  79  -3.678   2.133  -6.586
  579    HA   VAL  79           HA       VAL  79  -3.478   4.415  -4.918
  580    HB   VAL  79           HB       VAL  79  -3.271   1.465  -4.534
  581   1HG1  VAL  79          1HG1      VAL  79  -2.558   1.771  -2.173
  582   2HG1  VAL  79          2HG1      VAL  79  -2.252   3.478  -2.504
  583   3HG1  VAL  79          3HG1      VAL  79  -1.293   2.235  -3.315
  584   1HG2  VAL  79          1HG2      VAL  79  -5.018   1.878  -2.943
  585   2HG2  VAL  79          2HG2      VAL  79  -5.370   2.890  -4.344
  586   3HG2  VAL  79          3HG2      VAL  79  -4.655   3.604  -2.898
  587    H    MET  80           H        MET  80  -1.063   2.058  -6.036
  588    HA   MET  80           HA       MET  80   1.222   2.853  -4.753
  589   1HB   MET  80          2HB       MET  80   0.642   1.269  -6.972
  590   2HB   MET  80          1HB       MET  80   1.752   2.489  -7.592
  591   1HG   MET  80          2HG       MET  80   3.095   1.945  -5.382
  592   2HG   MET  80          1HG       MET  80   2.201   0.427  -5.465
  593   1HE   MET  80          1HE       MET  80   2.161  -1.146  -7.568
  594   2HE   MET  80          2HE       MET  80   3.014  -0.807  -9.071
  595   3HE   MET  80          3HE       MET  80   1.705   0.250  -8.554
  596    H    MET  81           H        MET  81  -0.419   4.541  -7.398
  597    HA   MET  81           HA       MET  81   1.678   6.370  -8.005
  598   1HB   MET  81          2HB       MET  81  -0.209   5.989  -9.540
  599   2HB   MET  81          1HB       MET  81  -1.311   6.707  -8.369
  600   1HG   MET  81          2HG       MET  81  -0.559   8.288 -10.193
  601   2HG   MET  81          1HG       MET  81  -0.230   8.856  -8.557
  602   1HE   MET  81          1HE       MET  81   1.775   6.070 -10.728
  603   2HE   MET  81          2HE       MET  81   2.682   7.237 -11.686
  604   3HE   MET  81          3HE       MET  81   0.921   7.265 -11.713
  605    H    VAL  82           H        VAL  82  -1.349   6.873  -6.150
  606    HA   VAL  82           HA       VAL  82  -0.648   9.428  -5.175
  607    HB   VAL  82           HB       VAL  82  -2.391   9.028  -3.425
  608   1HG1  VAL  82          1HG1      VAL  82  -4.255   8.869  -5.027
  609   2HG1  VAL  82          2HG1      VAL  82  -3.154   8.245  -6.255
  610   3HG1  VAL  82          3HG1      VAL  82  -2.971   9.897  -5.663
  611   1HG2  VAL  82          1HG2      VAL  82  -3.620   6.964  -3.377
  612   2HG2  VAL  82          2HG2      VAL  82  -1.913   6.532  -3.281
  613   3HG2  VAL  82          3HG2      VAL  82  -2.781   6.360  -4.807
  614    H    ARG  83           H        ARG  83   0.141   6.201  -4.043
  615    HA   ARG  83           HA       ARG  83   0.941   6.730  -1.413
  616   1HB   ARG  83          2HB       ARG  83   2.024   4.755  -3.431
  617   2HB   ARG  83          1HB       ARG  83   2.519   4.786  -1.739
  618   1HG   ARG  83          2HG       ARG  83  -0.408   4.809  -2.212
  619   2HG   ARG  83          1HG       ARG  83   0.423   3.320  -2.658
  620   1HD   ARG  83          2HD       ARG  83   1.049   2.852  -0.491
  621   2HD   ARG  83          1HD       ARG  83   1.116   4.550  -0.029
  622    HE   ARG  83           HE       ARG  83  -1.553   4.078  -0.484
  623   1HH1  ARG  83          2HH1      ARG  83   0.920   2.631   1.514
  624   2HH1  ARG  83          1HH1      ARG  83  -0.190   2.133   2.744
  625   1HH2  ARG  83          1HH2      ARG  83  -2.989   3.418   1.141
  626   2HH2  ARG  83          2HH2      ARG  83  -2.397   2.578   2.535
  627    H    CYS  84           H        CYS  84   2.574   7.337  -4.469
  628    HA   CYS  84           HA       CYS  84   4.993   8.264  -3.074
  629   1HB   CYS  84          2HB       CYS  84   4.353   7.536  -5.910
  630   2HB   CYS  84          1HB       CYS  84   5.695   8.633  -5.584
  631    HG   CYS  84           HG       CYS  84   5.749   6.049  -3.914
  632    H    MET  85           H        MET  85   2.297   9.410  -5.044
  633    HA   MET  85           HA       MET  85   3.205  12.011  -5.612
  634   1HB   MET  85          2HB       MET  85   1.005  10.642  -6.317
  635   2HB   MET  85          1HB       MET  85   0.309  11.635  -5.038
  636   1HG   MET  85          2HG       MET  85   2.081  12.988  -7.026
  637   2HG   MET  85          1HG       MET  85   0.469  12.512  -7.557
  638   1HE   MET  85          1HE       MET  85   1.758  16.031  -5.205
  639   2HE   MET  85          2HE       MET  85   1.828  15.738  -6.941
  640   3HE   MET  85          3HE       MET  85   2.716  14.686  -5.841
  641    H    LYS  86           H        LYS  86   0.910  11.022  -3.037
  642    HA   LYS  86           HA       LYS  86   2.103  13.032  -1.267
  643   1HB   LYS  86          2HB       LYS  86   0.177  14.258  -0.870
  644   2HB   LYS  86          1HB       LYS  86   0.022  13.929  -2.592
  645   1HG   LYS  86          2HG       LYS  86  -1.268  12.250  -0.416
  646   2HG   LYS  86          1HG       LYS  86  -2.093  13.529  -1.302
  647   1HD   LYS  86          2HD       LYS  86  -1.233  12.201  -3.419
  648   2HD   LYS  86          1HD       LYS  86  -1.152  10.857  -2.281
  649   1HE   LYS  86          2HE       LYS  86  -3.629  12.563  -2.463
  650   2HE   LYS  86          1HE       LYS  86  -3.372  11.228  -3.587
  651   1HZ   LYS  86          1HZ       LYS  86  -3.200   9.709  -1.760
  652   2HZ   LYS  86          2HZ       LYS  86  -4.638  10.596  -1.587
  653   3HZ   LYS  86          3HZ       LYS  86  -3.287  10.971  -0.628
  654    H    ASP  87           H        ASP  87   2.150  12.458   0.819
  655    HA   ASP  87           HA       ASP  87   0.383  10.667   2.112
  656   1HB   ASP  87          2HB       ASP  87   1.903   8.712   2.374
  657   2HB   ASP  87          1HB       ASP  87   1.378   8.937   0.708
  658    H    ASP  88           H        ASP  88   1.410  13.125   2.786
  659    HA   ASP  88           HA       ASP  88   3.303  12.509   4.978
  660   1HB   ASP  88          2HB       ASP  88   3.730  15.052   4.907
  661   2HB   ASP  88          1HB       ASP  88   4.428  14.067   3.626
  662    H    SER  89           HN       SER  89   0.994  11.803   5.771
  663    HA   SER  89           HA       SER  89  -0.583  14.002   6.854
  664   1HB   SER  89          2HB       SER  89  -0.866  10.998   7.062
  665   2HB   SER  89          1HB       SER  89  -1.944  12.135   7.864
  666    HG   SER  89           HG       SER  89  -2.885  11.752   5.935
  Start of MODEL   27
    1   1H    MET   1          1H        MET   1  -8.489   3.350   7.590
    2   2H    MET   1          2H        MET   1  -7.996   2.758   9.103
    3   3H    MET   1          3H        MET   1  -6.895   2.814   7.809
    4    HA   MET   1           HA       MET   1  -8.181   5.277   8.809
    5   1HB   MET   1          2HB       MET   1  -6.093   5.595  10.204
    6   2HB   MET   1          1HB       MET   1  -7.177   4.335  10.792
    7   1HG   MET   1          2HG       MET   1  -5.786   2.597   9.922
    8   2HG   MET   1          1HG       MET   1  -4.841   3.735   8.963
    9   1HE   MET   1          1HE       MET   1  -5.571   1.973  12.018
   10   2HE   MET   1          2HE       MET   1  -5.953   3.444  12.907
   11   3HE   MET   1          3HE       MET   1  -4.488   2.545  13.293
   12    H    ASN   2           H        ASN   2  -7.786   4.811   6.176
   13    HA   ASN   2           HA       ASN   2  -5.459   6.515   5.564
   14   1HB   ASN   2          2HB       ASN   2  -6.150   3.878   4.274
   15   2HB   ASN   2          1HB       ASN   2  -5.201   5.102   3.430
   16   1HD2  ASN   2          1HD2      ASN   2  -3.269   5.986   4.865
   17   2HD2  ASN   2          2HD2      ASN   2  -2.416   4.811   5.743
   18    H    ASP   3           H        ASP   3  -6.829   8.269   5.283
   19    HA   ASP   3           HA       ASP   3  -8.914   8.063   3.218
   20   1HB   ASP   3          2HB       ASP   3  -8.355  10.047   5.405
   21   2HB   ASP   3          1HB       ASP   3  -9.391  10.475   4.043
   22    H    ILE   4           H        ILE   4  -5.862   9.648   3.927
   23    HA   ILE   4           HA       ILE   4  -5.855  11.626   1.956
   24    HB   ILE   4           HB       ILE   4  -3.448  11.666   2.090
   25   1HG1  ILE   4          2HG1      ILE   4  -3.212   9.118   1.971
   26   2HG1  ILE   4          1HG1      ILE   4  -2.102   9.951   3.050
   27   1HG2  ILE   4          1HG2      ILE   4  -4.055  12.725   4.001
   28   2HG2  ILE   4          2HG2      ILE   4  -3.349  11.310   4.778
   29   3HG2  ILE   4          3HG2      ILE   4  -5.092  11.403   4.533
   30   1HD1  ILE   4          1HD1      ILE   4  -4.440   8.197   3.723
   31   2HD1  ILE   4          2HD1      ILE   4  -3.981   9.470   4.853
   32   3HD1  ILE   4          3HD1      ILE   4  -2.821   8.217   4.418
   33    H    TYR   5           H        TYR   5  -5.227   8.179   1.674
   34    HA   TYR   5           HA       TYR   5  -4.237   8.323  -1.035
   35   1HB   TYR   5          2HB       TYR   5  -5.256   5.977   0.592
   36   2HB   TYR   5          1HB       TYR   5  -4.524   5.843  -1.006
   37    HD1  TYR   5           HD1      TYR   5  -2.134   6.482  -1.353
   38    HD2  TYR   5           HD2      TYR   5  -3.924   6.396   2.549
   39    HE1  TYR   5           HE1      TYR   5   0.120   6.521  -0.318
   40    HE2  TYR   5           HE2      TYR   5  -1.674   6.431   3.582
   41    HH   TYR   5           HH       TYR   5   0.933   5.590   2.346
   42    H    LYS   6           H        LYS   6  -7.335   7.570   0.525
   43    HA   LYS   6           HA       LYS   6  -8.717   6.900  -1.889
   44   1HB   LYS   6          2HB       LYS   6  -9.297   6.485   0.693
   45   2HB   LYS   6          1HB       LYS   6 -10.239   7.953   0.441
   46   1HG   LYS   6          2HG       LYS   6 -11.802   6.391  -0.233
   47   2HG   LYS   6          1HG       LYS   6 -10.985   6.658  -1.772
   48   1HD   LYS   6          2HD       LYS   6 -11.035   4.306  -1.570
   49   2HD   LYS   6          1HD       LYS   6  -9.409   4.736  -1.041
   50   1HE   LYS   6          2HE       LYS   6  -9.838   4.223   1.160
   51   2HE   LYS   6          1HE       LYS   6 -11.536   4.684   1.047
   52   1HZ   LYS   6          1HZ       LYS   6 -10.368   2.250  -0.192
   53   2HZ   LYS   6          2HZ       LYS   6 -12.013   2.676  -0.142
   54   3HZ   LYS   6          3HZ       LYS   6 -11.193   2.272   1.290
   55    H    ALA   7           H        ALA   7  -7.882   9.908  -0.374
   56    HA   ALA   7           HA       ALA   7  -9.969  11.534  -1.415
   57   1HB   ALA   7          1HB       ALA   7  -8.679  13.391  -0.718
   58   2HB   ALA   7          2HB       ALA   7  -7.166  12.493  -0.849
   59   3HB   ALA   7          3HB       ALA   7  -8.304  12.118   0.445
   60    H    ALA   8           H        ALA   8  -6.916  10.389  -2.744
   61    HA   ALA   8           HA       ALA   8  -6.985  12.187  -5.014
   62   1HB   ALA   8          1HB       ALA   8  -4.844  11.345  -4.097
   63   2HB   ALA   8          2HB       ALA   8  -5.041  10.943  -5.804
   64   3HB   ALA   8          3HB       ALA   8  -5.305   9.710  -4.569
   65    H    VAL   9           H        VAL   9  -7.640   8.729  -4.451
   66    HA   VAL   9           HA       VAL   9  -8.207   8.084  -7.153
   67    HB   VAL   9           HB       VAL   9  -7.722   6.414  -5.336
   68   1HG1  VAL   9          1HG1      VAL   9  -9.598   5.678  -3.924
   69   2HG1  VAL   9          2HG1      VAL   9 -10.619   6.945  -4.603
   70   3HG1  VAL   9          3HG1      VAL   9  -9.220   7.371  -3.619
   71   1HG2  VAL   9          1HG2      VAL   9  -8.813   5.903  -7.591
   72   2HG2  VAL   9          2HG2      VAL   9 -10.352   5.868  -6.731
   73   3HG2  VAL   9          3HG2      VAL   9  -9.086   4.712  -6.318
   74    H    GLU  10           H        GLU  10 -10.122   9.641  -4.681
   75    HA   GLU  10           HA       GLU  10 -12.640   9.188  -6.030
   76   1HB   GLU  10          2HB       GLU  10 -13.619  10.554  -4.295
   77   2HB   GLU  10          1HB       GLU  10 -12.477   9.434  -3.557
   78   1HG   GLU  10          2HG       GLU  10 -10.925  11.102  -3.093
   79   2HG   GLU  10          1HG       GLU  10 -11.515  12.156  -4.374
   80    H    GLN  11           H        GLN  11 -10.056  11.462  -6.324
   81    HA   GLN  11           HA       GLN  11 -11.775  13.114  -8.071
   82   1HB   GLN  11          2HB       GLN  11 -10.727  15.145  -7.315
   83   2HB   GLN  11          1HB       GLN  11 -11.320  14.280  -5.899
   84   1HG   GLN  11          2HG       GLN  11  -8.951  13.264  -5.751
   85   2HG   GLN  11          1HG       GLN  11  -8.473  14.527  -6.882
   86   1HE2  GLN  11          1HE2      GLN  11  -7.587  14.307  -4.069
   87   2HE2  GLN  11          2HE2      GLN  11  -8.126  15.714  -3.287
   88    H    LEU  12           H        LEU  12  -9.885  10.900  -8.669
   89    HA   LEU  12           HA       LEU  12  -7.555  12.141  -9.868
   90   1HB   LEU  12          2HB       LEU  12  -7.406   9.793 -10.990
   91   2HB   LEU  12          1HB       LEU  12  -7.022   9.990  -9.298
   92    HG   LEU  12           HG       LEU  12  -9.140   9.027  -8.650
   93   1HD1  LEU  12          1HD1      LEU  12 -10.654   9.871 -10.299
   94   2HD1  LEU  12          2HD1      LEU  12 -10.653   8.118 -10.490
   95   3HD1  LEU  12          3HD1      LEU  12  -9.741   9.127 -11.614
   96   1HD2  LEU  12          1HD2      LEU  12  -8.000   7.373 -10.918
   97   2HD2  LEU  12          2HD2      LEU  12  -8.821   6.779  -9.474
   98   3HD2  LEU  12          3HD2      LEU  12  -7.231   7.527  -9.338
   99    H    THR  13           H        THR  13  -7.081  11.555 -12.253
  100    HA   THR  13           HA       THR  13  -9.376  12.511 -13.840
  101    HB   THR  13           HB       THR  13  -7.252  12.536 -15.564
  102    HG1  THR  13           HG1      THR  13  -5.694  12.039 -14.133
  103   1HG2  THR  13          1HG2      THR  13  -8.555  14.515 -13.768
  104   2HG2  THR  13          2HG2      THR  13  -8.434  14.491 -15.528
  105   3HG2  THR  13          3HG2      THR  13  -7.058  15.011 -14.557
  106    H    ASP  14           H        ASP  14  -9.481  11.684 -16.113
  107    HA   ASP  14           HA       ASP  14  -9.787   8.841 -16.112
  108   1HB   ASP  14          2HB       ASP  14  -9.972  10.944 -18.270
  109   2HB   ASP  14          1HB       ASP  14 -10.142   9.226 -18.631
  110    H    GLU  15           H        GLU  15  -7.313  11.079 -17.228
  111    HA   GLU  15           HA       GLU  15  -5.810   9.288 -18.832
  112   1HB   GLU  15          2HB       GLU  15  -5.264  11.886 -17.464
  113   2HB   GLU  15          1HB       GLU  15  -3.884  10.931 -18.005
  114   1HG   GLU  15          2HG       GLU  15  -4.862  10.820 -20.279
  115   2HG   GLU  15          1HG       GLU  15  -6.215  11.812 -19.735
  116    H    GLN  16           H        GLN  16  -5.937   9.873 -15.364
  117    HA   GLN  16           HA       GLN  16  -3.563   8.426 -14.683
  118   1HB   GLN  16          2HB       GLN  16  -5.765   9.736 -13.250
  119   2HB   GLN  16          1HB       GLN  16  -5.177   8.277 -12.452
  120   1HG   GLN  16          2HG       GLN  16  -3.065   9.147 -12.103
  121   2HG   GLN  16          1HG       GLN  16  -3.158  10.211 -13.508
  122   1HE2  GLN  16          1HE2      GLN  16  -5.065   9.795 -10.456
  123   2HE2  GLN  16          2HE2      GLN  16  -5.121  11.455 -10.107
  124    H    LYS  17           H        LYS  17  -7.027   7.647 -14.762
  125    HA   LYS  17           HA       LYS  17  -6.839   4.992 -13.808
  126   1HB   LYS  17          2HB       LYS  17  -8.865   6.251 -15.678
  127   2HB   LYS  17          1HB       LYS  17  -9.042   4.661 -14.935
  128   1HG   LYS  17          2HG       LYS  17  -9.456   5.529 -12.847
  129   2HG   LYS  17          1HG       LYS  17  -8.418   6.931 -13.109
  130   1HD   LYS  17          2HD       LYS  17 -10.112   8.183 -13.973
  131   2HD   LYS  17          1HD       LYS  17 -10.796   6.820 -14.861
  132   1HE   LYS  17          2HE       LYS  17 -10.999   6.777 -11.879
  133   2HE   LYS  17          1HE       LYS  17 -12.055   7.883 -12.758
  134   1HZ   LYS  17          1HZ       LYS  17 -12.800   6.010 -14.114
  135   2HZ   LYS  17          2HZ       LYS  17 -13.116   5.749 -12.466
  136   3HZ   LYS  17          3HZ       LYS  17 -11.815   4.957 -13.219
  137    H    ASN  18           H        ASN  18  -6.786   6.351 -17.096
  138    HA   ASN  18           HA       ASN  18  -6.520   3.820 -18.415
  139   1HB   ASN  18          2HB       ASN  18  -6.096   6.674 -19.299
  140   2HB   ASN  18          1HB       ASN  18  -5.747   5.309 -20.361
  141   1HD2  ASN  18          1HD2      ASN  18  -8.121   7.494 -19.861
  142   2HD2  ASN  18          2HD2      ASN  18  -9.487   6.552 -20.214
  143    H    GLU  19           H        GLU  19  -4.259   6.129 -17.041
  144    HA   GLU  19           HA       GLU  19  -1.888   5.393 -18.328
  145   1HB   GLU  19          2HB       GLU  19  -2.089   7.315 -16.762
  146   2HB   GLU  19          1HB       GLU  19  -2.207   6.180 -15.419
  147   1HG   GLU  19          2HG       GLU  19   0.025   5.235 -16.126
  148   2HG   GLU  19          1HG       GLU  19   0.147   6.553 -17.292
  149    H    PHE  20           H        PHE  20  -3.405   4.023 -15.403
  150    HA   PHE  20           HA       PHE  20  -1.383   1.929 -15.240
  151   1HB   PHE  20          2HB       PHE  20  -3.744   2.725 -13.567
  152   2HB   PHE  20          1HB       PHE  20  -3.003   1.137 -13.365
  153    HD1  PHE  20           HD1      PHE  20  -2.515   4.773 -13.021
  154    HD2  PHE  20           HD2      PHE  20  -0.721   0.905 -12.535
  155    HE1  PHE  20           HE1      PHE  20  -0.710   5.781 -11.654
  156    HE2  PHE  20           HE2      PHE  20   1.078   1.902 -11.161
  157    HZ   PHE  20           HZ       PHE  20   1.089   4.346 -10.722
  158    H    LYS  21           H        LYS  21  -4.890   2.177 -15.868
  159    HA   LYS  21           HA       LYS  21  -5.476  -0.527 -16.152
  160   1HB   LYS  21          2HB       LYS  21  -7.108   1.423 -16.170
  161   2HB   LYS  21          1HB       LYS  21  -6.714   1.617 -17.873
  162   1HG   LYS  21          2HG       LYS  21  -8.697   0.224 -17.698
  163   2HG   LYS  21          1HG       LYS  21  -7.355  -0.785 -18.237
  164   1HD   LYS  21          2HD       LYS  21  -7.193  -1.895 -16.203
  165   2HD   LYS  21          1HD       LYS  21  -7.882  -0.550 -15.296
  166   1HE   LYS  21          2HE       LYS  21  -9.673  -2.032 -15.286
  167   2HE   LYS  21          1HE       LYS  21 -10.036  -1.089 -16.732
  168   1HZ   LYS  21          1HZ       LYS  21  -8.975  -2.775 -18.076
  169   2HZ   LYS  21          2HZ       LYS  21 -10.199  -3.476 -17.130
  170   3HZ   LYS  21          3HZ       LYS  21  -8.568  -3.672 -16.695
  171    H    ALA  22           H        ALA  22  -4.041   1.694 -18.519
  172    HA   ALA  22           HA       ALA  22  -4.239   0.071 -20.813
  173   1HB   ALA  22          1HB       ALA  22  -3.526   2.380 -21.018
  174   2HB   ALA  22          2HB       ALA  22  -2.240   1.338 -21.627
  175   3HB   ALA  22          3HB       ALA  22  -2.101   2.066 -20.026
  176    H    ALA  23           H        ALA  23  -1.677   0.316 -18.368
  177    HA   ALA  23           HA       ALA  23  -0.079  -1.797 -19.483
  178   1HB   ALA  23          1HB       ALA  23   0.782   0.084 -18.011
  179   2HB   ALA  23          2HB       ALA  23   1.306  -1.534 -17.546
  180   3HB   ALA  23          3HB       ALA  23   0.010  -0.735 -16.654
  181    H    PHE  24           H        PHE  24  -2.665  -1.510 -17.164
  182    HA   PHE  24           HA       PHE  24  -2.366  -3.985 -15.832
  183   1HB   PHE  24          2HB       PHE  24  -3.840  -1.965 -15.194
  184   2HB   PHE  24          1HB       PHE  24  -5.020  -2.642 -16.315
  185    HD1  PHE  24           HD1      PHE  24  -5.852  -5.005 -15.957
  186    HD2  PHE  24           HD2      PHE  24  -3.501  -2.913 -13.038
  187    HE1  PHE  24           HE1      PHE  24  -6.575  -6.615 -14.216
  188    HE2  PHE  24           HE2      PHE  24  -4.227  -4.517 -11.299
  189    HZ   PHE  24           HZ       PHE  24  -5.768  -6.363 -11.886
  190    H    ASP  25           H        ASP  25  -4.256  -3.051 -18.732
  191    HA   ASP  25           HA       ASP  25  -5.450  -5.640 -18.997
  192   1HB   ASP  25          2HB       ASP  25  -6.268  -4.899 -21.158
  193   2HB   ASP  25          1HB       ASP  25  -6.520  -3.648 -19.952
  194    H    ILE  26           H        ILE  26  -2.415  -4.307 -20.128
  195    HA   ILE  26           HA       ILE  26  -2.006  -6.417 -22.079
  196    HB   ILE  26           HB       ILE  26   0.309  -5.494 -22.258
  197   1HG1  ILE  26          2HG1      ILE  26  -0.705  -3.408 -20.298
  198   2HG1  ILE  26          1HG1      ILE  26   0.430  -4.687 -19.876
  199   1HG2  ILE  26          1HG2      ILE  26  -1.836  -4.621 -23.449
  200   2HG2  ILE  26          2HG2      ILE  26  -0.378  -3.630 -23.510
  201   3HG2  ILE  26          3HG2      ILE  26  -1.671  -3.229 -22.379
  202   1HD1  ILE  26          1HD1      ILE  26   1.485  -2.454 -20.460
  203   2HD1  ILE  26          2HD1      ILE  26   0.935  -2.717 -22.115
  204   3HD1  ILE  26          3HD1      ILE  26   2.087  -3.834 -21.381
  205    H    PHE  27           H        PHE  27  -1.002  -5.728 -18.761
  206    HA   PHE  27           HA       PHE  27   0.823  -7.946 -18.604
  207   1HB   PHE  27          2HB       PHE  27  -0.439  -6.234 -16.452
  208   2HB   PHE  27          1HB       PHE  27   0.770  -7.477 -16.141
  209    HD1  PHE  27           HD1      PHE  27   0.836  -4.299 -15.807
  210    HD2  PHE  27           HD2      PHE  27   2.417  -7.054 -18.703
  211    HE1  PHE  27           HE1      PHE  27   2.625  -2.679 -16.382
  212    HE2  PHE  27           HE2      PHE  27   4.200  -5.434 -19.270
  213    HZ   PHE  27           HZ       PHE  27   4.306  -3.247 -18.110
  214    H    ILE  28           H        ILE  28  -2.584  -7.422 -17.721
  215    HA   ILE  28           HA       ILE  28  -2.770 -10.177 -16.712
  216    HB   ILE  28           HB       ILE  28  -4.965  -9.646 -15.922
  217   1HG1  ILE  28          2HG1      ILE  28  -5.564  -7.030 -16.461
  218   2HG1  ILE  28          1HG1      ILE  28  -4.792  -7.515 -17.969
  219   1HG2  ILE  28          1HG2      ILE  28  -3.256  -7.184 -15.497
  220   2HG2  ILE  28          2HG2      ILE  28  -3.030  -8.710 -14.643
  221   3HG2  ILE  28          3HG2      ILE  28  -4.521  -7.792 -14.430
  222   1HD1  ILE  28          1HD1      ILE  28  -6.424  -9.069 -18.471
  223   2HD1  ILE  28          2HD1      ILE  28  -7.397  -7.910 -17.563
  224   3HD1  ILE  28          3HD1      ILE  28  -6.805  -9.373 -16.775
  225    H    GLN  29           H        GLN  29  -2.650  -9.014 -19.704
  226    HA   GLN  29           HA       GLN  29  -4.920  -9.646 -21.122
  227   1HB   GLN  29          2HB       GLN  29  -2.927  -8.708 -22.182
  228   2HB   GLN  29          1HB       GLN  29  -2.050 -10.213 -21.908
  229   1HG   GLN  29          2HG       GLN  29  -3.474 -11.421 -23.404
  230   2HG   GLN  29          1HG       GLN  29  -4.617 -10.081 -23.504
  231   1HE2  GLN  29          1HE2      GLN  29  -3.531  -7.932 -24.362
  232   2HE2  GLN  29          2HE2      GLN  29  -2.434  -8.121 -25.643
  233    H    ASP  30           H        ASP  30  -2.430 -11.875 -19.937
  234    HA   ASP  30           HA       ASP  30  -4.068 -14.166 -20.838
  235   1HB   ASP  30          2HB       ASP  30  -1.449 -13.778 -21.309
  236   2HB   ASP  30          1HB       ASP  30  -1.331 -14.597 -19.752
  237    H    ALA  31           H        ALA  31  -4.641 -12.535 -18.438
  238    HA   ALA  31           HA       ALA  31  -4.058 -14.406 -16.243
  239   1HB   ALA  31          1HB       ALA  31  -3.653 -11.931 -15.943
  240   2HB   ALA  31          2HB       ALA  31  -4.722 -12.657 -14.743
  241   3HB   ALA  31          3HB       ALA  31  -5.397 -11.703 -16.062
  242    H    GLU  32           H        GLU  32  -5.760 -15.056 -14.821
  243    HA   GLU  32           HA       GLU  32  -8.461 -15.044 -16.030
  244   1HB   GLU  32          2HB       GLU  32  -8.724 -17.398 -15.181
  245   2HB   GLU  32          1HB       GLU  32  -7.558 -17.234 -16.492
  246   1HG   GLU  32          2HG       GLU  32  -5.795 -17.803 -15.165
  247   2HG   GLU  32          1HG       GLU  32  -6.417 -16.899 -13.784
  248    H    ASP  33           H        ASP  33  -7.515 -13.265 -14.046
  249    HA   ASP  33           HA       ASP  33  -9.341 -13.947 -11.856
  250   1HB   ASP  33          2HB       ASP  33  -6.419 -13.283 -11.476
  251   2HB   ASP  33          1HB       ASP  33  -7.612 -13.148 -10.185
  252    H    GLY  34           H        GLY  34  -7.044 -11.507 -13.072
  253   1HA   GLY  34          2HA       GLY  34  -7.977  -9.349 -13.825
  254   2HA   GLY  34          1HA       GLY  34  -9.039  -9.410 -12.421
  255    H    CYS  35           H        CYS  35  -5.584 -10.179 -12.634
  256    HA   CYS  35           HA       CYS  35  -4.787  -7.737 -11.284
  257   1HB   CYS  35          2HB       CYS  35  -3.694  -9.016  -9.400
  258   2HB   CYS  35          1HB       CYS  35  -5.452  -8.944  -9.325
  259    HG   CYS  35           HG       CYS  35  -5.582 -11.404 -10.106
  260    H    ILE  36           H        ILE  36  -2.562  -7.357 -11.390
  261    HA   ILE  36           HA       ILE  36  -1.153  -9.007 -13.364
  262    HB   ILE  36           HB       ILE  36   0.468  -7.211 -13.490
  263   1HG1  ILE  36          2HG1      ILE  36  -0.400  -5.137 -11.904
  264   2HG1  ILE  36          1HG1      ILE  36  -0.684  -6.529 -10.859
  265   1HG2  ILE  36          1HG2      ILE  36  -1.500  -6.782 -14.792
  266   2HG2  ILE  36          2HG2      ILE  36  -1.077  -5.265 -13.998
  267   3HG2  ILE  36          3HG2      ILE  36  -2.400  -6.249 -13.371
  268   1HD1  ILE  36          1HD1      ILE  36   1.894  -6.667 -12.245
  269   2HD1  ILE  36          2HD1      ILE  36   1.530  -6.866 -10.529
  270   3HD1  ILE  36          3HD1      ILE  36   1.752  -5.250 -11.204
  271    H    SER  37           H        SER  37   1.350  -9.161 -12.859
  272    HA   SER  37           HA       SER  37   1.523 -10.572 -10.296
  273   1HB   SER  37          2HB       SER  37   2.365 -11.513 -12.553
  274   2HB   SER  37          1HB       SER  37   3.723 -10.412 -12.346
  275    HG   SER  37           HG       SER  37   2.990 -12.676 -10.885
  276    H    THR  38           H        THR  38   2.293  -9.581  -8.559
  277    HA   THR  38           HA       THR  38   3.363  -6.997  -8.463
  278    HB   THR  38           HB       THR  38   4.145  -7.571  -6.186
  279    HG1  THR  38           HG1      THR  38   4.493  -9.569  -5.679
  280   1HG2  THR  38          1HG2      THR  38   1.875  -8.485  -5.381
  281   2HG2  THR  38          2HG2      THR  38   1.419  -8.483  -7.084
  282   3HG2  THR  38          3HG2      THR  38   1.860  -6.974  -6.289
  283    H    LYS  39           H        LYS  39   4.908 -10.115  -8.901
  284    HA   LYS  39           HA       LYS  39   7.611  -9.263  -8.567
  285   1HB   LYS  39          2HB       LYS  39   6.602 -11.576 -10.243
  286   2HB   LYS  39          1HB       LYS  39   8.226 -11.372  -9.584
  287   1HG   LYS  39          2HG       LYS  39   7.561 -11.863  -7.418
  288   2HG   LYS  39          1HG       LYS  39   5.906 -11.321  -7.694
  289   1HD   LYS  39          2HD       LYS  39   5.631 -13.309  -9.253
  290   2HD   LYS  39          1HD       LYS  39   7.183 -13.892  -8.650
  291   1HE   LYS  39          2HE       LYS  39   5.061 -13.114  -6.678
  292   2HE   LYS  39          1HE       LYS  39   4.939 -14.672  -7.496
  293   1HZ   LYS  39          1HZ       LYS  39   7.264 -13.698  -5.925
  294   2HZ   LYS  39          2HZ       LYS  39   7.196 -15.178  -6.755
  295   3HZ   LYS  39          3HZ       LYS  39   6.160 -14.889  -5.440
  296    H    GLU  40           H        GLU  40   5.373  -9.335 -11.289
  297    HA   GLU  40           HA       GLU  40   7.404  -8.657 -13.237
  298   1HB   GLU  40          2HB       GLU  40   5.755  -8.866 -14.865
  299   2HB   GLU  40          1HB       GLU  40   5.187  -9.981 -13.625
  300   1HG   GLU  40          2HG       GLU  40   3.269  -8.825 -13.425
  301   2HG   GLU  40          1HG       GLU  40   4.161  -7.355 -13.045
  302    H    LEU  41           H        LEU  41   6.238  -6.808 -10.825
  303    HA   LEU  41           HA       LEU  41   5.237  -4.464 -11.938
  304   1HB   LEU  41          2HB       LEU  41   6.324  -5.248  -9.420
  305   2HB   LEU  41          1HB       LEU  41   7.037  -3.720  -9.871
  306    HG   LEU  41           HG       LEU  41   5.007  -3.482  -8.458
  307   1HD1  LEU  41          1HD1      LEU  41   5.295  -2.322 -11.179
  308   2HD1  LEU  41          2HD1      LEU  41   5.234  -1.518  -9.612
  309   3HD1  LEU  41          3HD1      LEU  41   3.742  -2.064 -10.381
  310   1HD2  LEU  41          1HD2      LEU  41   3.636  -4.708 -10.874
  311   2HD2  LEU  41          2HD2      LEU  41   2.796  -3.941  -9.525
  312   3HD2  LEU  41          3HD2      LEU  41   3.734  -5.411  -9.259
  313    H    GLY  42           H        GLY  42   8.470  -5.752 -12.158
  314   1HA   GLY  42          2HA       GLY  42   9.978  -3.427 -12.590
  315   2HA   GLY  42          1HA       GLY  42  10.336  -5.005 -13.289
  316    H    LYS  43           H        LYS  43   7.923  -5.309 -14.785
  317    HA   LYS  43           HA       LYS  43   8.582  -3.840 -17.163
  318   1HB   LYS  43          2HB       LYS  43   6.147  -5.540 -16.552
  319   2HB   LYS  43          1HB       LYS  43   6.624  -4.963 -18.149
  320   1HG   LYS  43          2HG       LYS  43   8.776  -6.188 -17.924
  321   2HG   LYS  43          1HG       LYS  43   8.238  -6.812 -16.365
  322   1HD   LYS  43          2HD       LYS  43   6.143  -7.633 -17.701
  323   2HD   LYS  43          1HD       LYS  43   7.182  -7.437 -19.114
  324   1HE   LYS  43          2HE       LYS  43   8.003  -9.030 -16.672
  325   2HE   LYS  43          1HE       LYS  43   7.214  -9.754 -18.072
  326   1HZ   LYS  43          1HZ       LYS  43   9.841  -8.388 -17.971
  327   2HZ   LYS  43          2HZ       LYS  43   9.041  -8.724 -19.432
  328   3HZ   LYS  43          3HZ       LYS  43   9.516  -9.994 -18.409
  329    H    VAL  44           H        VAL  44   6.475  -3.293 -14.481
  330    HA   VAL  44           HA       VAL  44   4.765  -1.388 -15.866
  331    HB   VAL  44           HB       VAL  44   4.912  -1.810 -12.882
  332   1HG1  VAL  44          1HG1      VAL  44   2.695  -0.944 -12.901
  333   2HG1  VAL  44          2HG1      VAL  44   2.558  -1.130 -14.649
  334   3HG1  VAL  44          3HG1      VAL  44   3.623   0.102 -13.973
  335   1HG2  VAL  44          1HG2      VAL  44   3.626  -3.728 -12.986
  336   2HG2  VAL  44          2HG2      VAL  44   4.558  -3.938 -14.467
  337   3HG2  VAL  44          3HG2      VAL  44   2.917  -3.296 -14.540
  338    H    MET  45           H        MET  45   7.226  -1.390 -13.302
  339    HA   MET  45           HA       MET  45   7.298   1.315 -12.691
  340   1HB   MET  45          2HB       MET  45   9.008  -0.969 -12.264
  341   2HB   MET  45          1HB       MET  45   9.985   0.444 -12.661
  342   1HG   MET  45          2HG       MET  45   9.756   0.839 -10.412
  343   2HG   MET  45          1HG       MET  45   8.256   1.595 -10.948
  344   1HE   MET  45          1HE       MET  45   7.009   0.262  -7.811
  345   2HE   MET  45          2HE       MET  45   6.033   0.840  -9.158
  346   3HE   MET  45          3HE       MET  45   7.591   1.591  -8.822
  347    H    ARG  46           H        ARG  46   9.013  -0.433 -15.278
  348    HA   ARG  46           HA       ARG  46  10.476   1.798 -16.249
  349   1HB   ARG  46          2HB       ARG  46  10.743   0.493 -18.333
  350   2HB   ARG  46          1HB       ARG  46  11.086  -0.473 -16.899
  351   1HG   ARG  46          2HG       ARG  46   8.945  -1.564 -17.023
  352   2HG   ARG  46          1HG       ARG  46   8.386  -0.453 -18.272
  353   1HD   ARG  46          2HD       ARG  46   9.014  -2.510 -19.357
  354   2HD   ARG  46          1HD       ARG  46  10.230  -1.300 -19.754
  355    HE   ARG  46           HE       ARG  46  11.051  -2.728 -17.447
  356   1HH1  ARG  46          2HH1      ARG  46  10.579  -3.146 -20.881
  357   2HH1  ARG  46          1HH1      ARG  46  11.809  -4.355 -21.030
  358   1HH2  ARG  46          1HH2      ARG  46  12.658  -4.313 -17.664
  359   2HH2  ARG  46          2HH2      ARG  46  12.983  -5.015 -19.213
  360    H    MET  47           H        MET  47   7.200   0.668 -16.842
  361    HA   MET  47           HA       MET  47   6.700   2.452 -19.058
  362   1HB   MET  47          2HB       MET  47   4.930   0.705 -17.345
  363   2HB   MET  47          1HB       MET  47   4.270   1.792 -18.567
  364   1HG   MET  47          2HG       MET  47   6.515   0.010 -19.398
  365   2HG   MET  47          1HG       MET  47   4.940  -0.740 -19.139
  366   1HE   MET  47          1HE       MET  47   6.375   2.666 -21.265
  367   2HE   MET  47          2HE       MET  47   6.601   1.449 -22.519
  368   3HE   MET  47          3HE       MET  47   7.257   1.175 -20.907
  369    H    LEU  48           H        LEU  48   6.273   2.517 -15.565
  370    HA   LEU  48           HA       LEU  48   4.601   4.865 -15.529
  371   1HB   LEU  48          2HB       LEU  48   5.967   3.164 -13.510
  372   2HB   LEU  48          1HB       LEU  48   5.573   4.802 -13.041
  373    HG   LEU  48           HG       LEU  48   3.246   4.409 -13.224
  374   1HD1  LEU  48          1HD1      LEU  48   2.802   3.314 -15.210
  375   2HD1  LEU  48          2HD1      LEU  48   2.602   1.966 -14.091
  376   3HD1  LEU  48          3HD1      LEU  48   4.110   2.153 -14.987
  377   1HD2  LEU  48          1HD2      LEU  48   3.584   1.704 -12.277
  378   2HD2  LEU  48          2HD2      LEU  48   3.222   3.160 -11.349
  379   3HD2  LEU  48          3HD2      LEU  48   4.898   2.710 -11.663
  380    H    GLY  49           H        GLY  49   8.035   4.194 -15.444
  381   1HA   GLY  49          2HA       GLY  49   9.494   5.995 -16.304
  382   2HA   GLY  49          1HA       GLY  49   8.581   7.107 -15.293
  383    H    GLN  50           H        GLN  50   9.547   3.899 -14.212
  384    HA   GLN  50           HA       GLN  50  11.649   5.081 -12.498
  385   1HB   GLN  50          2HB       GLN  50   9.710   2.970 -11.533
  386   2HB   GLN  50          1HB       GLN  50  10.891   3.863 -10.579
  387   1HG   GLN  50          2HG       GLN  50   8.558   5.166 -12.016
  388   2HG   GLN  50          1HG       GLN  50   8.518   4.685 -10.321
  389   1HE2  GLN  50          1HE2      GLN  50   8.603   7.446 -11.805
  390   2HE2  GLN  50          2HE2      GLN  50   9.815   8.289 -10.970
  391    H    ASN  51           H        ASN  51  13.207   3.485 -11.693
  392    HA   ASN  51           HA       ASN  51  13.236   0.885 -13.031
  393   1HB   ASN  51          2HB       ASN  51  15.639   1.318 -13.791
  394   2HB   ASN  51          1HB       ASN  51  14.368   2.100 -14.725
  395   1HD2  ASN  51          1HD2      ASN  51  17.174   2.672 -12.748
  396   2HD2  ASN  51          2HD2      ASN  51  17.092   4.367 -12.763
  397    HA   PRO  52           HA       PRO  52  15.213   0.966  -8.814
  398   1HB   PRO  52          2HB       PRO  52  13.235  -0.324  -7.439
  399   2HB   PRO  52          1HB       PRO  52  13.280   1.430  -7.672
  400   1HG   PRO  52          2HG       PRO  52  11.524  -0.582  -8.921
  401   2HG   PRO  52          1HG       PRO  52  11.257   1.150  -8.679
  402   1HD   PRO  52          2HD       PRO  52  12.056  -0.153 -11.099
  403   2HD   PRO  52          1HD       PRO  52  11.924   1.598 -10.812
  404    H    THR  53           H        THR  53  14.835  -1.262  -7.184
  405    HA   THR  53           HA       THR  53  15.870  -3.453  -8.874
  406    HB   THR  53           HB       THR  53  17.130  -4.181  -7.041
  407    HG1  THR  53           HG1      THR  53  16.374  -4.156  -5.082
  408   1HG2  THR  53          1HG2      THR  53  17.807  -1.880  -7.789
  409   2HG2  THR  53          2HG2      THR  53  18.269  -2.270  -6.132
  410   3HG2  THR  53          3HG2      THR  53  16.878  -1.231  -6.437
  411    HA   PRO  54           HA       PRO  54  12.423  -6.037  -7.896
  412   1HB   PRO  54          2HB       PRO  54  13.531  -8.419  -7.107
  413   2HB   PRO  54          1HB       PRO  54  13.481  -7.854  -8.784
  414   1HG   PRO  54          2HG       PRO  54  15.760  -7.896  -6.873
  415   2HG   PRO  54          1HG       PRO  54  15.760  -8.076  -8.634
  416   1HD   PRO  54          2HD       PRO  54  16.460  -5.753  -7.268
  417   2HD   PRO  54          1HD       PRO  54  15.975  -5.813  -8.977
  418    H    GLU  55           H        GLU  55  14.848  -5.794  -5.365
  419    HA   GLU  55           HA       GLU  55  13.085  -6.726  -3.253
  420   1HB   GLU  55          2HB       GLU  55  15.838  -5.475  -3.262
  421   2HB   GLU  55          1HB       GLU  55  14.963  -5.831  -1.773
  422   1HG   GLU  55          2HG       GLU  55  14.716  -8.217  -2.625
  423   2HG   GLU  55          1HG       GLU  55  15.860  -7.792  -3.899
  424    H    GLU  56           H        GLU  56  14.179  -3.673  -4.642
  425    HA   GLU  56           HA       GLU  56  13.094  -1.976  -2.607
  426   1HB   GLU  56          2HB       GLU  56  14.895  -1.496  -4.479
  427   2HB   GLU  56          1HB       GLU  56  13.478  -1.028  -5.420
  428   1HG   GLU  56          2HG       GLU  56  12.937   0.731  -3.980
  429   2HG   GLU  56          1HG       GLU  56  13.812   0.021  -2.623
  430    H    LEU  57           H        LEU  57  11.931  -3.100  -5.787
  431    HA   LEU  57           HA       LEU  57   9.536  -1.539  -5.719
  432   1HB   LEU  57          2HB       LEU  57   8.857  -2.771  -7.648
  433   2HB   LEU  57          1HB       LEU  57  10.549  -2.371  -7.806
  434    HG   LEU  57           HG       LEU  57  10.889  -4.816  -6.851
  435   1HD1  LEU  57          1HD1      LEU  57   8.795  -5.688  -6.424
  436   2HD1  LEU  57          2HD1      LEU  57   8.919  -6.124  -8.127
  437   3HD1  LEU  57          3HD1      LEU  57   8.018  -4.687  -7.650
  438   1HD2  LEU  57          1HD2      LEU  57  11.741  -4.297  -8.993
  439   2HD2  LEU  57          2HD2      LEU  57  10.140  -3.944  -9.641
  440   3HD2  LEU  57          3HD2      LEU  57  10.610  -5.611  -9.311
  441    H    GLN  58           H        GLN  58  10.411  -4.743  -4.556
  442    HA   GLN  58           HA       GLN  58   7.806  -5.793  -4.250
  443   1HB   GLN  58          2HB       GLN  58  10.491  -6.534  -3.415
  444   2HB   GLN  58          1HB       GLN  58   9.296  -6.894  -2.170
  445   1HG   GLN  58          2HG       GLN  58   9.021  -7.700  -5.081
  446   2HG   GLN  58          1HG       GLN  58   9.601  -8.769  -3.805
  447   1HE2  GLN  58          1HE2      GLN  58   6.757  -7.566  -5.350
  448   2HE2  GLN  58          2HE2      GLN  58   5.627  -8.203  -4.255
  449    H    GLU  59           H        GLU  59   9.837  -3.887  -2.009
  450    HA   GLU  59           HA       GLU  59   8.053  -4.042   0.192
  451   1HB   GLU  59          2HB       GLU  59   9.301  -2.186   1.150
  452   2HB   GLU  59          1HB       GLU  59  10.413  -3.343   0.424
  453   1HG   GLU  59          2HG       GLU  59  11.188  -1.817  -1.045
  454   2HG   GLU  59          1HG       GLU  59   9.560  -1.317  -1.494
  455    H    MET  60           H        MET  60   8.100  -2.014  -2.664
  456    HA   MET  60           HA       MET  60   6.222  -0.066  -1.660
  457   1HB   MET  60          2HB       MET  60   6.830  -0.654  -4.563
  458   2HB   MET  60          1HB       MET  60   6.192   0.839  -3.877
  459   1HG   MET  60          2HG       MET  60   8.392   0.864  -2.482
  460   2HG   MET  60          1HG       MET  60   8.974  -0.282  -3.688
  461   1HE   MET  60          1HE       MET  60  10.539   1.880  -6.055
  462   2HE   MET  60          2HE       MET  60  10.307   0.320  -5.269
  463   3HE   MET  60          3HE       MET  60  10.973   1.670  -4.353
  464    H    ILE  61           H        ILE  61   6.083  -3.123  -3.325
  465    HA   ILE  61           HA       ILE  61   3.287  -2.909  -4.050
  466    HB   ILE  61           HB       ILE  61   5.191  -5.265  -4.021
  467   1HG1  ILE  61          2HG1      ILE  61   4.024  -4.001  -6.477
  468   2HG1  ILE  61          1HG1      ILE  61   5.368  -3.192  -5.669
  469   1HG2  ILE  61          1HG2      ILE  61   2.324  -5.183  -4.194
  470   2HG2  ILE  61          2HG2      ILE  61   3.393  -6.581  -4.305
  471   3HG2  ILE  61          3HG2      ILE  61   2.978  -5.670  -5.758
  472   1HD1  ILE  61          1HD1      ILE  61   5.373  -6.088  -6.564
  473   2HD1  ILE  61          2HD1      ILE  61   6.720  -5.226  -5.822
  474   3HD1  ILE  61          3HD1      ILE  61   6.153  -4.763  -7.425
  475    H    ASP  62           H        ASP  62   5.216  -4.606  -1.604
  476    HA   ASP  62           HA       ASP  62   3.163  -6.029  -0.341
  477   1HB   ASP  62          2HB       ASP  62   5.672  -6.237   0.055
  478   2HB   ASP  62          1HB       ASP  62   5.525  -4.836   1.114
  479    H    GLU  63           H        GLU  63   4.350  -2.715   0.281
  480    HA   GLU  63           HA       GLU  63   2.712  -2.212   2.532
  481   1HB   GLU  63          2HB       GLU  63   3.221   0.150   2.164
  482   2HB   GLU  63          1HB       GLU  63   4.669  -0.836   1.980
  483   1HG   GLU  63          2HG       GLU  63   4.426  -0.776  -0.458
  484   2HG   GLU  63          1HG       GLU  63   2.949   0.173  -0.303
  485    H    VAL  64           H        VAL  64   2.137  -1.743  -0.944
  486    HA   VAL  64           HA       VAL  64  -0.415  -0.440  -0.504
  487    HB   VAL  64           HB       VAL  64   0.910   0.129  -2.497
  488   1HG1  VAL  64          1HG1      VAL  64   1.977  -1.997  -2.960
  489   2HG1  VAL  64          2HG1      VAL  64   1.011  -1.547  -4.363
  490   3HG1  VAL  64          3HG1      VAL  64   0.417  -2.769  -3.241
  491   1HG2  VAL  64          1HG2      VAL  64  -1.713   0.021  -2.405
  492   2HG2  VAL  64          2HG2      VAL  64  -1.515  -1.324  -3.526
  493   3HG2  VAL  64          3HG2      VAL  64  -0.913   0.277  -3.956
  494    H    ASP  65           H        ASP  65   0.706  -3.716  -1.211
  495    HA   ASP  65           HA       ASP  65  -1.884  -4.756  -1.840
  496   1HB   ASP  65          2HB       ASP  65   0.732  -5.727  -1.991
  497   2HB   ASP  65          1HB       ASP  65  -0.044  -6.739  -0.778
  498    H    GLU  66           H        GLU  66  -3.474  -4.891  -0.459
  499    HA   GLU  66           HA       GLU  66  -3.249  -4.600   2.341
  500   1HB   GLU  66          2HB       GLU  66  -5.553  -5.883   0.857
  501   2HB   GLU  66          1HB       GLU  66  -5.604  -5.120   2.445
  502   1HG   GLU  66          2HG       GLU  66  -4.868  -2.970   1.338
  503   2HG   GLU  66          1HG       GLU  66  -5.086  -3.773  -0.217
  504    H    ASP  67           H        ASP  67  -3.857  -7.499   0.354
  505    HA   ASP  67           HA       ASP  67  -3.494  -9.183   2.727
  506   1HB   ASP  67          2HB       ASP  67  -4.483 -10.956   1.518
  507   2HB   ASP  67          1HB       ASP  67  -5.419  -9.525   1.100
  508    H    GLY  68           H        GLY  68  -1.856  -8.364  -0.266
  509   1HA   GLY  68          2HA       GLY  68   0.348  -8.738  -0.871
  510   2HA   GLY  68          1HA       GLY  68   0.592  -9.552   0.671
  511    H    SER  69           H        SER  69  -1.649 -10.225  -2.013
  512    HA   SER  69           HA       SER  69  -1.110 -13.055  -1.898
  513   1HB   SER  69          2HB       SER  69  -2.507 -12.879  -4.162
  514   2HB   SER  69          1HB       SER  69  -3.279 -12.764  -2.585
  515    HG   SER  69           HG       SER  69  -2.370 -10.588  -4.183
  516    H    GLY  70           H        GLY  70   0.596 -10.531  -3.363
  517   1HA   GLY  70          2HA       GLY  70   2.532 -10.743  -4.661
  518   2HA   GLY  70          1HA       GLY  70   2.088 -12.411  -5.014
  519    H    THR  71           H        THR  71  -0.419 -10.077  -5.362
  520    HA   THR  71           HA       THR  71   0.065  -9.700  -8.227
  521    HB   THR  71           HB       THR  71  -2.149 -10.458  -8.856
  522    HG1  THR  71           HG1      THR  71  -2.502 -11.256  -6.158
  523   1HG2  THR  71          1HG2      THR  71  -0.362 -12.157  -8.764
  524   2HG2  THR  71          2HG2      THR  71  -1.929 -12.865  -8.373
  525   3HG2  THR  71          3HG2      THR  71  -0.776 -12.502  -7.085
  526    H    VAL  72           H        VAL  72  -0.616  -7.749  -8.950
  527    HA   VAL  72           HA       VAL  72  -1.879  -5.975  -6.967
  528    HB   VAL  72           HB       VAL  72  -0.688  -5.132  -9.606
  529   1HG1  VAL  72          1HG1      VAL  72  -0.430  -2.983  -8.370
  530   2HG1  VAL  72          2HG1      VAL  72  -1.228  -3.716  -6.978
  531   3HG1  VAL  72          3HG1      VAL  72  -2.114  -3.494  -8.487
  532   1HG2  VAL  72          1HG2      VAL  72   0.670  -5.501  -6.918
  533   2HG2  VAL  72          2HG2      VAL  72   1.358  -4.563  -8.245
  534   3HG2  VAL  72          3HG2      VAL  72   1.088  -6.296  -8.436
  535    H    ASP  73           H        ASP  73  -3.956  -5.543  -7.116
  536    HA   ASP  73           HA       ASP  73  -5.442  -6.156  -9.561
  537   1HB   ASP  73          2HB       ASP  73  -6.309  -5.214  -6.812
  538   2HB   ASP  73          1HB       ASP  73  -7.424  -5.451  -8.157
  539    H    PHE  74           H        PHE  74  -7.094  -4.408 -10.271
  540    HA   PHE  74           HA       PHE  74  -5.683  -2.124 -11.086
  541   1HB   PHE  74          2HB       PHE  74  -7.822  -3.061 -12.118
  542   2HB   PHE  74          1HB       PHE  74  -8.691  -2.184 -10.857
  543    HD1  PHE  74           HD1      PHE  74  -5.600  -1.322 -12.783
  544    HD2  PHE  74           HD2      PHE  74  -9.679  -0.319 -11.887
  545    HE1  PHE  74           HE1      PHE  74  -5.381   0.767 -14.101
  546    HE2  PHE  74           HE2      PHE  74  -9.454   1.771 -13.200
  547    HZ   PHE  74           HZ       PHE  74  -7.308   2.313 -14.308
  548    H    ASP  75           H        ASP  75  -7.700  -2.680  -8.245
  549    HA   ASP  75           HA       ASP  75  -7.904   0.039  -7.412
  550   1HB   ASP  75          2HB       ASP  75  -9.247  -2.005  -6.564
  551   2HB   ASP  75          1HB       ASP  75  -7.862  -2.303  -5.513
  552    H    GLU  76           H        GLU  76  -5.642  -2.595  -6.636
  553    HA   GLU  76           HA       GLU  76  -4.029  -1.032  -4.844
  554   1HB   GLU  76          2HB       GLU  76  -3.256  -3.567  -6.313
  555   2HB   GLU  76          1HB       GLU  76  -2.489  -2.904  -4.870
  556   1HG   GLU  76          2HG       GLU  76  -4.575  -3.222  -3.597
  557   2HG   GLU  76          1HG       GLU  76  -5.368  -3.855  -5.038
  558    H    PHE  77           H        PHE  77  -4.100  -1.596  -8.287
  559    HA   PHE  77           HA       PHE  77  -1.470  -0.806  -8.967
  560   1HB   PHE  77          2HB       PHE  77  -3.499  -1.887 -10.357
  561   2HB   PHE  77          1HB       PHE  77  -3.727  -0.208 -10.817
  562    HD1  PHE  77           HD1      PHE  77  -3.252  -0.928 -13.134
  563    HD2  PHE  77           HD2      PHE  77  -0.279  -1.233 -10.032
  564    HE1  PHE  77           HE1      PHE  77  -1.479  -1.160 -14.837
  565    HE2  PHE  77           HE2      PHE  77   1.480  -1.455 -11.749
  566    HZ   PHE  77           HZ       PHE  77   0.883  -1.426 -14.155
  567    H    LEU  78           H        LEU  78  -4.547   1.006  -9.128
  568    HA   LEU  78           HA       LEU  78  -3.367   3.508  -9.775
  569   1HB   LEU  78          2HB       LEU  78  -6.039   2.601  -8.824
  570   2HB   LEU  78          1HB       LEU  78  -5.652   4.305  -8.672
  571    HG   LEU  78           HG       LEU  78  -5.497   4.582 -11.023
  572   1HD1  LEU  78          1HD1      LEU  78  -5.408   2.761 -12.614
  573   2HD1  LEU  78          2HD1      LEU  78  -5.654   1.574 -11.332
  574   3HD1  LEU  78          3HD1      LEU  78  -4.153   2.495 -11.405
  575   1HD2  LEU  78          1HD2      LEU  78  -7.650   3.609 -11.849
  576   2HD2  LEU  78          2HD2      LEU  78  -7.804   4.378 -10.270
  577   3HD2  LEU  78          3HD2      LEU  78  -7.721   2.620 -10.392
  578    H    VAL  79           H        VAL  79  -4.119   1.921  -6.712
  579    HA   VAL  79           HA       VAL  79  -3.773   4.151  -4.998
  580    HB   VAL  79           HB       VAL  79  -3.702   1.176  -4.662
  581   1HG1  VAL  79          1HG1      VAL  79  -2.785   3.163  -2.559
  582   2HG1  VAL  79          2HG1      VAL  79  -1.795   1.915  -3.322
  583   3HG1  VAL  79          3HG1      VAL  79  -3.132   1.457  -2.263
  584   1HG2  VAL  79          1HG2      VAL  79  -5.774   2.689  -4.597
  585   2HG2  VAL  79          2HG2      VAL  79  -5.151   3.294  -3.062
  586   3HG2  VAL  79          3HG2      VAL  79  -5.562   1.587  -3.235
  587    H    MET  80           H        MET  80  -1.513   1.607  -6.040
  588    HA   MET  80           HA       MET  80   0.794   2.296  -4.723
  589   1HB   MET  80          2HB       MET  80   0.157   0.602  -6.824
  590   2HB   MET  80          1HB       MET  80   1.330   1.710  -7.533
  591   1HG   MET  80          2HG       MET  80   2.575   1.250  -5.202
  592   2HG   MET  80          1HG       MET  80   1.676  -0.261  -5.328
  593   1HE   MET  80          1HE       MET  80   1.397  -1.517  -7.211
  594   2HE   MET  80          2HE       MET  80   2.791  -2.181  -8.060
  595   3HE   MET  80          3HE       MET  80   1.844  -0.897  -8.807
  596    H    MET  81           H        MET  81  -0.709   4.017  -7.407
  597    HA   MET  81           HA       MET  81   1.499   5.577  -8.232
  598   1HB   MET  81          2HB       MET  81  -0.640   5.399  -9.496
  599   2HB   MET  81          1HB       MET  81  -1.427   6.360  -8.247
  600   1HG   MET  81          2HG       MET  81   0.123   8.226  -8.690
  601   2HG   MET  81          1HG       MET  81   0.930   7.266  -9.928
  602   1HE   MET  81          1HE       MET  81  -3.263   7.183  -9.667
  603   2HE   MET  81          2HE       MET  81  -3.258   8.942  -9.774
  604   3HE   MET  81          3HE       MET  81  -2.320   8.141  -8.517
  605    H    VAL  82           H        VAL  82  -1.193   6.414  -6.034
  606    HA   VAL  82           HA       VAL  82  -0.027   8.865  -5.153
  607    HB   VAL  82           HB       VAL  82  -1.726   8.742  -3.317
  608   1HG1  VAL  82          1HG1      VAL  82  -2.561   8.282  -6.187
  609   2HG1  VAL  82          2HG1      VAL  82  -2.381   9.823  -5.346
  610   3HG1  VAL  82          3HG1      VAL  82  -3.705   8.736  -4.923
  611   1HG2  VAL  82          1HG2      VAL  82  -3.268   6.916  -3.202
  612   2HG2  VAL  82          2HG2      VAL  82  -1.662   6.189  -3.251
  613   3HG2  VAL  82          3HG2      VAL  82  -2.661   6.220  -4.705
  614    H    ARG  83           H        ARG  83   0.294   5.540  -4.136
  615    HA   ARG  83           HA       ARG  83   1.350   5.977  -1.534
  616   1HB   ARG  83          2HB       ARG  83   1.711   3.693  -3.489
  617   2HB   ARG  83          1HB       ARG  83   2.354   3.679  -1.847
  618   1HG   ARG  83          2HG       ARG  83  -0.454   4.466  -1.894
  619   2HG   ARG  83          1HG       ARG  83  -0.207   2.877  -2.621
  620   1HD   ARG  83          2HD       ARG  83   0.570   1.942  -0.660
  621   2HD   ARG  83          1HD       ARG  83   1.225   3.465  -0.069
  622    HE   ARG  83           HE       ARG  83  -1.632   3.550  -0.179
  623   1HH1  ARG  83          2HH1      ARG  83   1.060   2.281   1.650
  624   2HH1  ARG  83          1HH1      ARG  83   0.187   2.236   3.143
  625   1HH2  ARG  83          1HH2      ARG  83  -2.757   3.484   1.788
  626   2HH2  ARG  83          2HH2      ARG  83  -1.969   2.915   3.222
  627    H    CYS  84           H        CYS  84   2.787   5.804  -4.756
  628    HA   CYS  84           HA       CYS  84   5.504   6.081  -3.749
  629   1HB   CYS  84          2HB       CYS  84   4.708   4.832  -5.912
  630   2HB   CYS  84          1HB       CYS  84   4.749   6.440  -6.633
  631    HG   CYS  84           HG       CYS  84   7.201   4.797  -5.796
  632    H    MET  85           H        MET  85   3.129   8.066  -5.510
  633    HA   MET  85           HA       MET  85   4.788  10.358  -5.815
  634   1HB   MET  85          2HB       MET  85   2.407   9.680  -6.858
  635   2HB   MET  85          1HB       MET  85   1.846  10.725  -5.553
  636   1HG   MET  85          2HG       MET  85   2.244  12.425  -7.003
  637   2HG   MET  85          1HG       MET  85   3.940  12.182  -6.589
  638   1HE   MET  85          1HE       MET  85   5.604  12.112  -9.097
  639   2HE   MET  85          2HE       MET  85   5.607  10.350  -9.086
  640   3HE   MET  85          3HE       MET  85   5.505  11.233  -7.565
  641    H    LYS  86           H        LYS  86   2.699   9.204  -3.245
  642    HA   LYS  86           HA       LYS  86   2.507   9.810  -1.048
  643   1HB   LYS  86          2HB       LYS  86   5.060  10.597  -1.600
  644   2HB   LYS  86          1HB       LYS  86   4.324  12.133  -1.143
  645   1HG   LYS  86          2HG       LYS  86   5.188  11.092   0.866
  646   2HG   LYS  86          1HG       LYS  86   3.428  11.011   0.924
  647   1HD   LYS  86          2HD       LYS  86   3.769   8.802   1.363
  648   2HD   LYS  86          1HD       LYS  86   4.019   8.674  -0.378
  649   1HE   LYS  86          2HE       LYS  86   6.320   9.406   1.419
  650   2HE   LYS  86          1HE       LYS  86   5.842   7.718   1.243
  651   1HZ   LYS  86          1HZ       LYS  86   5.972   8.126  -1.230
  652   2HZ   LYS  86          2HZ       LYS  86   7.453   8.103  -0.397
  653   3HZ   LYS  86          3HZ       LYS  86   6.761   9.583  -0.865
  654    H    ASP  87           H        ASP  87   0.608  10.661  -0.626
  655    HA   ASP  87           HA       ASP  87  -0.145  13.260  -1.777
  656   1HB   ASP  87          2HB       ASP  87  -1.589  11.036  -1.746
  657   2HB   ASP  87          1HB       ASP  87  -2.021  11.602  -0.134
  658    H    ASP  88           H        ASP  88   1.795  13.459   0.195
  659    HA   ASP  88           HA       ASP  88   0.350  14.975   2.242
  660   1HB   ASP  88          2HB       ASP  88   2.300  12.744   2.867
  661   2HB   ASP  88          1HB       ASP  88   1.817  13.972   4.036
  662    H    SER  89           HN       SER  89   1.661  16.103   0.163
  663    HA   SER  89           HA       SER  89   4.406  16.731   0.926
  664   1HB   SER  89          2HB       SER  89   2.658  17.600  -1.379
  665   2HB   SER  89          1HB       SER  89   4.259  18.278  -1.093
  666    HG   SER  89           HG       SER  89   4.554  16.554  -2.428
  Start of MODEL   28
    1   1H    MET   1          1H        MET   1  -8.363   7.812  10.558
    2   2H    MET   1          2H        MET   1  -9.213   6.426  10.064
    3   3H    MET   1          3H        MET   1 -10.044   7.729  10.766
    4    HA   MET   1           HA       MET   1 -10.316   7.609   8.329
    5   1HB   MET   1          2HB       MET   1 -10.160   9.779   9.878
    6   2HB   MET   1          1HB       MET   1  -8.732  10.087   8.890
    7   1HG   MET   1          2HG       MET   1 -10.014  10.055   6.866
    8   2HG   MET   1          1HG       MET   1 -11.430   9.412   7.698
    9   1HE   MET   1          1HE       MET   1 -13.288  12.131   9.116
   10   2HE   MET   1          2HE       MET   1 -12.910  10.413   9.036
   11   3HE   MET   1          3HE       MET   1 -13.409  11.265   7.577
   12    H    ASN   2           H        ASN   2  -9.053   6.117   7.215
   13    HA   ASN   2           HA       ASN   2  -6.392   7.093   6.346
   14   1HB   ASN   2          2HB       ASN   2  -7.240   4.203   6.691
   15   2HB   ASN   2          1HB       ASN   2  -5.658   4.768   6.154
   16   1HD2  ASN   2          1HD2      ASN   2  -7.910   5.030   8.952
   17   2HD2  ASN   2          2HD2      ASN   2  -6.682   5.200  10.113
   18    H    ASP   3           H        ASP   3  -9.077   7.508   5.167
   19    HA   ASP   3           HA       ASP   3  -9.014   5.886   2.731
   20   1HB   ASP   3          2HB       ASP   3 -11.149   6.944   2.196
   21   2HB   ASP   3          1HB       ASP   3 -11.181   6.309   3.840
   22    H    ILE   4           H        ILE   4  -7.017   8.141   3.474
   23    HA   ILE   4           HA       ILE   4  -7.433  10.253   1.605
   24    HB   ILE   4           HB       ILE   4  -5.056  10.809   1.994
   25   1HG1  ILE   4          2HG1      ILE   4  -4.149   9.202   3.995
   26   2HG1  ILE   4          1HG1      ILE   4  -5.055   8.026   3.043
   27   1HG2  ILE   4          1HG2      ILE   4  -6.600  10.052   4.493
   28   2HG2  ILE   4          2HG2      ILE   4  -6.755  11.563   3.597
   29   3HG2  ILE   4          3HG2      ILE   4  -5.249  11.185   4.433
   30   1HD1  ILE   4          1HD1      ILE   4  -3.775   8.489   1.077
   31   2HD1  ILE   4          2HD1      ILE   4  -2.608   8.326   2.388
   32   3HD1  ILE   4          3HD1      ILE   4  -3.056   9.927   1.802
   33    H    TYR   5           H        TYR   5  -5.986   7.075   1.390
   34    HA   TYR   5           HA       TYR   5  -4.577   7.458  -1.064
   35   1HB   TYR   5          2HB       TYR   5  -5.662   4.905   0.162
   36   2HB   TYR   5          1HB       TYR   5  -4.510   4.992  -1.172
   37    HD1  TYR   5           HD1      TYR   5  -2.212   5.839  -0.805
   38    HD2  TYR   5           HD2      TYR   5  -4.994   5.413   2.441
   39    HE1  TYR   5           HE1      TYR   5  -0.354   6.066   0.817
   40    HE2  TYR   5           HE2      TYR   5  -3.136   5.639   4.062
   41    HH   TYR   5           HH       TYR   5  -0.280   5.120   3.674
   42    H    LYS   6           H        LYS   6  -7.857   6.477  -0.213
   43    HA   LYS   6           HA       LYS   6  -8.589   5.913  -2.974
   44   1HB   LYS   6          2HB       LYS   6  -9.939   5.715  -0.323
   45   2HB   LYS   6          1HB       LYS   6 -10.958   5.905  -1.751
   46   1HG   LYS   6          2HG       LYS   6 -10.115   3.923  -2.754
   47   2HG   LYS   6          1HG       LYS   6  -8.748   3.848  -1.642
   48   1HD   LYS   6          2HD       LYS   6 -11.388   3.836  -0.322
   49   2HD   LYS   6          1HD       LYS   6 -11.070   2.424  -1.330
   50   1HE   LYS   6          2HE       LYS   6 -10.113   1.729   0.669
   51   2HE   LYS   6          1HE       LYS   6  -8.719   2.483  -0.104
   52   1HZ   LYS   6          1HZ       LYS   6  -9.128   3.170   2.245
   53   2HZ   LYS   6          2HZ       LYS   6 -10.551   3.936   1.722
   54   3HZ   LYS   6          3HZ       LYS   6  -9.040   4.453   1.140
   55    H    ALA   7           H        ALA   7  -8.507   8.655  -0.883
   56    HA   ALA   7           HA       ALA   7 -10.650  10.152  -2.039
   57   1HB   ALA   7          1HB       ALA   7  -9.482  12.110  -0.962
   58   2HB   ALA   7          2HB       ALA   7  -8.221  10.991  -0.444
   59   3HB   ALA   7          3HB       ALA   7  -9.873  10.792   0.142
   60    H    ALA   8           H        ALA   8  -7.308   9.594  -2.915
   61    HA   ALA   8           HA       ALA   8  -7.192  11.824  -4.774
   62   1HB   ALA   8          1HB       ALA   8  -5.230   9.599  -4.931
   63   2HB   ALA   8          2HB       ALA   8  -5.243  10.557  -3.451
   64   3HB   ALA   8          3HB       ALA   8  -4.966  11.341  -5.005
   65    H    VAL   9           H        VAL   9  -7.394   8.270  -4.965
   66    HA   VAL   9           HA       VAL   9  -7.378   8.082  -7.783
   67    HB   VAL   9           HB       VAL   9  -7.023   6.159  -6.222
   68   1HG1  VAL   9          1HG1      VAL   9  -8.895   6.665  -4.680
   69   2HG1  VAL   9          2HG1      VAL   9  -8.987   5.019  -5.299
   70   3HG1  VAL   9          3HG1      VAL   9 -10.043   6.268  -5.957
   71   1HG2  VAL   9          1HG2      VAL   9  -7.940   4.559  -7.715
   72   2HG2  VAL   9          2HG2      VAL   9  -7.709   6.000  -8.703
   73   3HG2  VAL   9          3HG2      VAL   9  -9.317   5.589  -8.105
   74    H    GLU  10           H        GLU  10  -9.916   8.953  -5.545
   75    HA   GLU  10           HA       GLU  10 -12.052   8.530  -7.452
   76   1HB   GLU  10          2HB       GLU  10 -13.511   9.433  -5.754
   77   2HB   GLU  10          1HB       GLU  10 -12.386   8.311  -4.991
   78   1HG   GLU  10          2HG       GLU  10 -11.205   9.997  -3.926
   79   2HG   GLU  10          1HG       GLU  10 -11.639  11.210  -5.129
   80    H    GLN  11           H        GLN  11  -9.771  11.042  -6.821
   81    HA   GLN  11           HA       GLN  11 -11.438  12.933  -8.379
   82   1HB   GLN  11          2HB       GLN  11 -10.406  14.772  -7.210
   83   2HB   GLN  11          1HB       GLN  11 -11.040  13.636  -6.019
   84   1HG   GLN  11          2HG       GLN  11  -8.794  12.666  -5.729
   85   2HG   GLN  11          1HG       GLN  11  -8.150  13.773  -6.941
   86   1HE2  GLN  11          1HE2      GLN  11  -8.311  13.402  -3.656
   87   2HE2  GLN  11          2HE2      GLN  11  -8.282  15.033  -3.183
   88    H    LEU  12           H        LEU  12  -9.172  10.884  -9.118
   89    HA   LEU  12           HA       LEU  12  -7.133  12.643 -10.214
   90   1HB   LEU  12          2HB       LEU  12  -6.405  10.447 -11.366
   91   2HB   LEU  12          1HB       LEU  12  -6.173  10.631  -9.645
   92    HG   LEU  12           HG       LEU  12  -8.070   9.197  -9.191
   93   1HD1  LEU  12          1HD1      LEU  12  -8.447   9.290 -12.191
   94   2HD1  LEU  12          2HD1      LEU  12  -9.606   9.745 -10.942
   95   3HD1  LEU  12          3HD1      LEU  12  -9.185   8.049 -11.177
   96   1HD2  LEU  12          1HD2      LEU  12  -7.255   7.112 -10.440
   97   2HD2  LEU  12          2HD2      LEU  12  -6.044   7.982  -9.499
   98   3HD2  LEU  12          3HD2      LEU  12  -6.108   8.177 -11.250
   99    H    THR  13           H        THR  13  -6.518  12.009 -12.645
  100    HA   THR  13           HA       THR  13  -8.829  12.849 -14.227
  101    HB   THR  13           HB       THR  13  -6.808  12.611 -16.039
  102    HG1  THR  13           HG1      THR  13  -5.170  12.104 -14.757
  103   1HG2  THR  13          1HG2      THR  13  -7.779  14.671 -16.066
  104   2HG2  THR  13          2HG2      THR  13  -6.341  15.110 -15.146
  105   3HG2  THR  13          3HG2      THR  13  -7.857  14.778 -14.307
  106    H    ASP  14           H        ASP  14  -9.131  11.870 -16.396
  107    HA   ASP  14           HA       ASP  14  -9.614   9.063 -16.183
  108   1HB   ASP  14          2HB       ASP  14  -9.746  10.988 -18.509
  109   2HB   ASP  14          1HB       ASP  14 -10.145   9.277 -18.662
  110    H    GLU  15           H        GLU  15  -7.053  11.042 -17.543
  111    HA   GLU  15           HA       GLU  15  -5.779   8.997 -19.081
  112   1HB   GLU  15          2HB       GLU  15  -4.805  11.623 -17.945
  113   2HB   GLU  15          1HB       GLU  15  -3.758  10.548 -18.871
  114   1HG   GLU  15          2HG       GLU  15  -4.558  11.745 -20.647
  115   2HG   GLU  15          1HG       GLU  15  -5.915  10.625 -20.516
  116    H    GLN  16           H        GLN  16  -5.657   9.969 -15.708
  117    HA   GLN  16           HA       GLN  16  -3.277   8.555 -14.998
  118   1HB   GLN  16          2HB       GLN  16  -5.026  10.298 -13.693
  119   2HB   GLN  16          1HB       GLN  16  -5.224   8.766 -12.842
  120   1HG   GLN  16          2HG       GLN  16  -2.614   8.684 -12.888
  121   2HG   GLN  16          1HG       GLN  16  -2.733  10.416 -13.202
  122   1HE2  GLN  16          1HE2      GLN  16  -3.994  11.716 -11.547
  123   2HE2  GLN  16          2HE2      GLN  16  -4.021  11.171  -9.940
  124    H    LYS  17           H        LYS  17  -6.745   7.783 -14.891
  125    HA   LYS  17           HA       LYS  17  -6.484   5.212 -13.701
  126   1HB   LYS  17          2HB       LYS  17  -8.651   6.295 -15.524
  127   2HB   LYS  17          1HB       LYS  17  -8.764   4.803 -14.593
  128   1HG   LYS  17          2HG       LYS  17  -8.938   5.913 -12.567
  129   2HG   LYS  17          1HG       LYS  17  -8.050   7.324 -13.144
  130   1HD   LYS  17          2HD       LYS  17 -10.293   8.073 -12.995
  131   2HD   LYS  17          1HD       LYS  17 -10.064   7.727 -14.707
  132   1HE   LYS  17          2HE       LYS  17 -12.116   6.680 -14.217
  133   2HE   LYS  17          1HE       LYS  17 -10.957   5.356 -14.126
  134   1HZ   LYS  17          1HZ       LYS  17 -11.851   6.943 -11.781
  135   2HZ   LYS  17          2HZ       LYS  17 -10.899   5.536 -11.764
  136   3HZ   LYS  17          3HZ       LYS  17 -12.528   5.455 -12.233
  137    H    ASN  18           H        ASN  18  -6.659   6.334 -17.067
  138    HA   ASN  18           HA       ASN  18  -6.538   3.736 -18.247
  139   1HB   ASN  18          2HB       ASN  18  -6.048   6.516 -19.307
  140   2HB   ASN  18          1HB       ASN  18  -5.803   5.085 -20.309
  141   1HD2  ASN  18          1HD2      ASN  18  -7.997   7.347 -20.176
  142   2HD2  ASN  18          2HD2      ASN  18  -9.443   6.462 -20.263
  143    H    GLU  19           H        GLU  19  -4.120   5.949 -17.032
  144    HA   GLU  19           HA       GLU  19  -1.847   5.098 -18.421
  145   1HB   GLU  19          2HB       GLU  19  -2.005   7.029 -16.779
  146   2HB   GLU  19          1HB       GLU  19  -1.879   5.834 -15.488
  147   1HG   GLU  19          2HG       GLU  19   0.359   6.344 -15.761
  148   2HG   GLU  19          1HG       GLU  19   0.212   5.025 -16.921
  149    H    PHE  20           H        PHE  20  -3.147   3.899 -15.313
  150    HA   PHE  20           HA       PHE  20  -1.274   1.695 -15.232
  151   1HB   PHE  20          2HB       PHE  20  -3.571   2.584 -13.515
  152   2HB   PHE  20          1HB       PHE  20  -2.886   0.972 -13.318
  153    HD1  PHE  20           HD1      PHE  20  -2.255   4.590 -13.003
  154    HD2  PHE  20           HD2      PHE  20  -0.604   0.658 -12.516
  155    HE1  PHE  20           HE1      PHE  20  -0.397   5.533 -11.666
  156    HE2  PHE  20           HE2      PHE  20   1.253   1.596 -11.176
  157    HZ   PHE  20           HZ       PHE  20   1.360   4.040 -10.749
  158    H    LYS  21           H        LYS  21  -4.778   2.068 -15.799
  159    HA   LYS  21           HA       LYS  21  -5.490  -0.609 -16.048
  160   1HB   LYS  21          2HB       LYS  21  -7.069   1.330 -16.030
  161   2HB   LYS  21          1HB       LYS  21  -6.625   1.651 -17.704
  162   1HG   LYS  21          2HG       LYS  21  -7.366  -1.155 -17.155
  163   2HG   LYS  21          1HG       LYS  21  -8.679   0.002 -16.935
  164   1HD   LYS  21          2HD       LYS  21  -6.971   0.201 -19.395
  165   2HD   LYS  21          1HD       LYS  21  -8.215  -1.046 -19.318
  166   1HE   LYS  21          2HE       LYS  21  -9.825   0.831 -18.612
  167   2HE   LYS  21          1HE       LYS  21  -8.567   1.950 -19.140
  168   1HZ   LYS  21          1HZ       LYS  21  -8.594   0.815 -21.315
  169   2HZ   LYS  21          2HZ       LYS  21 -10.074   1.559 -20.938
  170   3HZ   LYS  21          3HZ       LYS  21  -9.905  -0.125 -20.790
  171    H    ALA  22           H        ALA  22  -4.067   1.542 -18.491
  172    HA   ALA  22           HA       ALA  22  -4.333  -0.154 -20.732
  173   1HB   ALA  22          1HB       ALA  22  -3.655   2.193 -20.954
  174   2HB   ALA  22          2HB       ALA  22  -2.456   1.132 -21.695
  175   3HB   ALA  22          3HB       ALA  22  -2.145   1.845 -20.110
  176    H    ALA  23           H        ALA  23  -1.621   0.262 -18.460
  177    HA   ALA  23           HA       ALA  23   0.012  -1.805 -19.529
  178   1HB   ALA  23          1HB       ALA  23   0.530   0.140 -17.782
  179   2HB   ALA  23          2HB       ALA  23   1.453  -1.363 -17.782
  180   3HB   ALA  23          3HB       ALA  23   0.145  -1.132 -16.620
  181    H    PHE  24           H        PHE  24  -2.547  -1.690 -17.132
  182    HA   PHE  24           HA       PHE  24  -2.223  -4.230 -15.950
  183   1HB   PHE  24          2HB       PHE  24  -3.872  -2.186 -15.452
  184   2HB   PHE  24          1HB       PHE  24  -4.971  -3.160 -16.421
  185    HD1  PHE  24           HD1      PHE  24  -4.476  -5.888 -15.755
  186    HD2  PHE  24           HD2      PHE  24  -4.292  -2.453 -13.193
  187    HE1  PHE  24           HE1      PHE  24  -4.915  -7.337 -13.790
  188    HE2  PHE  24           HE2      PHE  24  -4.729  -3.894 -11.232
  189    HZ   PHE  24           HZ       PHE  24  -5.049  -6.326 -11.532
  190    H    ASP  25           H        ASP  25  -4.144  -3.160 -18.744
  191    HA   ASP  25           HA       ASP  25  -5.339  -5.636 -19.360
  192   1HB   ASP  25          2HB       ASP  25  -5.706  -3.173 -20.305
  193   2HB   ASP  25          1HB       ASP  25  -4.652  -3.776 -21.584
  194    H    ILE  26           H        ILE  26  -2.283  -4.206 -20.515
  195    HA   ILE  26           HA       ILE  26  -1.746  -6.351 -22.346
  196    HB   ILE  26           HB       ILE  26   0.529  -5.363 -22.517
  197   1HG1  ILE  26          2HG1      ILE  26  -0.520  -3.356 -20.494
  198   2HG1  ILE  26          1HG1      ILE  26   0.666  -4.607 -20.129
  199   1HG2  ILE  26          1HG2      ILE  26  -0.202  -3.285 -23.545
  200   2HG2  ILE  26          2HG2      ILE  26  -1.690  -3.298 -22.599
  201   3HG2  ILE  26          3HG2      ILE  26  -1.424  -4.522 -23.841
  202   1HD1  ILE  26          1HD1      ILE  26   1.730  -3.412 -22.381
  203   2HD1  ILE  26          2HD1      ILE  26   2.215  -3.068 -20.720
  204   3HD1  ILE  26          3HD1      ILE  26   1.018  -2.048 -21.518
  205    H    PHE  27           H        PHE  27  -0.755  -5.645 -19.013
  206    HA   PHE  27           HA       PHE  27   1.107  -7.836 -18.874
  207   1HB   PHE  27          2HB       PHE  27  -0.187  -6.207 -16.672
  208   2HB   PHE  27          1HB       PHE  27   1.091  -7.395 -16.422
  209    HD1  PHE  27           HD1      PHE  27   0.993  -4.236 -15.985
  210    HD2  PHE  27           HD2      PHE  27   2.664  -6.806 -18.997
  211    HE1  PHE  27           HE1      PHE  27   2.683  -2.506 -16.529
  212    HE2  PHE  27           HE2      PHE  27   4.354  -5.076 -19.534
  213    HZ   PHE  27           HZ       PHE  27   4.363  -2.925 -18.302
  214    H    ILE  28           H        ILE  28  -2.303  -7.375 -18.007
  215    HA   ILE  28           HA       ILE  28  -2.415 -10.228 -17.245
  216    HB   ILE  28           HB       ILE  28  -3.132  -8.258 -15.632
  217   1HG1  ILE  28          2HG1      ILE  28  -4.566  -9.771 -14.458
  218   2HG1  ILE  28          1HG1      ILE  28  -4.950 -10.647 -15.939
  219   1HG2  ILE  28          1HG2      ILE  28  -5.833  -8.784 -16.813
  220   2HG2  ILE  28          2HG2      ILE  28  -4.832  -7.501 -17.491
  221   3HG2  ILE  28          3HG2      ILE  28  -5.298  -7.452 -15.792
  222   1HD1  ILE  28          1HD1      ILE  28  -3.165 -11.646 -14.316
  223   2HD1  ILE  28          2HD1      ILE  28  -2.095 -10.435 -15.024
  224   3HD1  ILE  28          3HD1      ILE  28  -2.845 -11.659 -16.051
  225    H    GLN  29           H        GLN  29  -2.316  -9.541 -19.933
  226    HA   GLN  29           HA       GLN  29  -4.673  -9.174 -21.339
  227   1HB   GLN  29          2HB       GLN  29  -2.378  -9.366 -22.339
  228   2HB   GLN  29          1HB       GLN  29  -2.484 -11.113 -22.125
  229   1HG   GLN  29          2HG       GLN  29  -4.125 -11.354 -23.744
  230   2HG   GLN  29          1HG       GLN  29  -4.721  -9.707 -23.538
  231   1HE2  GLN  29          1HE2      GLN  29  -3.322  -7.930 -24.447
  232   2HE2  GLN  29          2HE2      GLN  29  -2.291  -8.280 -25.749
  233    H    ASP  30           H        ASP  30  -3.274 -12.300 -20.303
  234    HA   ASP  30           HA       ASP  30  -5.837 -13.624 -20.876
  235   1HB   ASP  30          2HB       ASP  30  -3.340 -14.475 -21.419
  236   2HB   ASP  30          1HB       ASP  30  -3.531 -15.172 -19.812
  237    H    ALA  31           H        ALA  31  -5.969 -11.843 -18.758
  238    HA   ALA  31           HA       ALA  31  -5.409 -12.706 -16.201
  239   1HB   ALA  31          1HB       ALA  31  -8.015 -11.364 -16.892
  240   2HB   ALA  31          2HB       ALA  31  -6.480 -10.500 -16.932
  241   3HB   ALA  31          3HB       ALA  31  -7.054 -11.207 -15.422
  242    H    GLU  32           H        GLU  32  -6.463 -13.814 -14.646
  243    HA   GLU  32           HA       GLU  32  -8.779 -15.477 -15.413
  244   1HB   GLU  32          2HB       GLU  32  -7.771 -17.401 -14.214
  245   2HB   GLU  32          1HB       GLU  32  -6.816 -16.916 -15.614
  246   1HG   GLU  32          2HG       GLU  32  -5.370 -15.550 -14.066
  247   2HG   GLU  32          1HG       GLU  32  -6.250 -16.254 -12.710
  248    H    ASP  33           H        ASP  33  -7.925 -13.052 -13.558
  249    HA   ASP  33           HA       ASP  33  -9.807 -13.671 -11.446
  250   1HB   ASP  33          2HB       ASP  33  -6.857 -13.435 -10.924
  251   2HB   ASP  33          1HB       ASP  33  -8.008 -12.850  -9.722
  252    H    GLY  34           H        GLY  34  -7.292 -11.430 -12.633
  253   1HA   GLY  34          2HA       GLY  34  -8.060  -9.215 -13.404
  254   2HA   GLY  34          1HA       GLY  34  -9.089  -9.163 -11.977
  255    H    CYS  35           H        CYS  35  -5.741 -10.316 -12.100
  256    HA   CYS  35           HA       CYS  35  -4.767  -7.899 -10.756
  257   1HB   CYS  35          2HB       CYS  35  -3.946 -10.501  -9.549
  258   2HB   CYS  35          1HB       CYS  35  -4.065  -8.908  -8.807
  259    HG   CYS  35           HG       CYS  35  -6.226 -10.984  -8.742
  260    H    ILE  36           H        ILE  36  -2.626  -7.467 -11.174
  261    HA   ILE  36           HA       ILE  36  -1.367  -9.106 -13.237
  262    HB   ILE  36           HB       ILE  36   0.245  -7.348 -13.489
  263   1HG1  ILE  36          2HG1      ILE  36  -0.411  -5.321 -11.702
  264   2HG1  ILE  36          1HG1      ILE  36  -0.485  -6.776 -10.708
  265   1HG2  ILE  36          1HG2      ILE  36  -2.277  -6.997 -14.139
  266   2HG2  ILE  36          2HG2      ILE  36  -1.146  -5.649 -14.254
  267   3HG2  ILE  36          3HG2      ILE  36  -2.231  -5.772 -12.870
  268   1HD1  ILE  36          1HD1      ILE  36   1.831  -5.397 -11.404
  269   2HD1  ILE  36          2HD1      ILE  36   1.828  -6.782 -12.497
  270   3HD1  ILE  36          3HD1      ILE  36   1.761  -7.036 -10.751
  271    H    SER  37           H        SER  37   1.157  -9.284 -12.952
  272    HA   SER  37           HA       SER  37   1.551 -10.799 -10.476
  273   1HB   SER  37          2HB       SER  37   2.196 -11.911 -12.544
  274   2HB   SER  37          1HB       SER  37   3.247 -10.566 -12.974
  275    HG   SER  37           HG       SER  37   3.573 -12.579 -11.067
  276    H    THR  38           H        THR  38   2.341  -9.769  -8.771
  277    HA   THR  38           HA       THR  38   3.548  -7.236  -8.732
  278    HB   THR  38           HB       THR  38   4.306  -7.812  -6.450
  279    HG1  THR  38           HG1      THR  38   4.686  -9.817  -6.042
  280   1HG2  THR  38          1HG2      THR  38   1.531  -8.566  -7.329
  281   2HG2  THR  38          2HG2      THR  38   2.067  -7.100  -6.511
  282   3HG2  THR  38          3HG2      THR  38   1.991  -8.623  -5.628
  283    H    LYS  39           H        LYS  39   4.904 -10.444  -9.160
  284    HA   LYS  39           HA       LYS  39   7.653  -9.755  -8.825
  285   1HB   LYS  39          2HB       LYS  39   6.614 -11.973 -10.600
  286   2HB   LYS  39          1HB       LYS  39   8.165 -11.890  -9.768
  287   1HG   LYS  39          2HG       LYS  39   5.425 -12.326  -8.566
  288   2HG   LYS  39          1HG       LYS  39   6.837 -13.376  -8.464
  289   1HD   LYS  39          2HD       LYS  39   8.006 -11.524  -7.194
  290   2HD   LYS  39          1HD       LYS  39   6.457 -10.679  -7.140
  291   1HE   LYS  39          2HE       LYS  39   5.471 -12.772  -6.094
  292   2HE   LYS  39          1HE       LYS  39   7.118 -13.382  -5.943
  293   1HZ   LYS  39          1HZ       LYS  39   7.636 -11.277  -4.723
  294   2HZ   LYS  39          2HZ       LYS  39   6.575 -12.330  -3.914
  295   3HZ   LYS  39          3HZ       LYS  39   5.971 -10.948  -4.696
  296    H    GLU  40           H        GLU  40   5.383  -9.563 -11.477
  297    HA   GLU  40           HA       GLU  40   7.436  -8.930 -13.449
  298   1HB   GLU  40          2HB       GLU  40   4.426  -9.116 -13.605
  299   2HB   GLU  40          1HB       GLU  40   5.435  -8.613 -14.960
  300   1HG   GLU  40          2HG       GLU  40   6.750 -10.784 -14.590
  301   2HG   GLU  40          1HG       GLU  40   5.421 -11.284 -13.544
  302    H    LEU  41           H        LEU  41   6.301  -7.144 -10.994
  303    HA   LEU  41           HA       LEU  41   5.280  -4.776 -12.094
  304   1HB   LEU  41          2HB       LEU  41   5.758  -5.590  -9.585
  305   2HB   LEU  41          1HB       LEU  41   7.145  -4.552  -9.797
  306    HG   LEU  41           HG       LEU  41   5.132  -3.496  -8.695
  307   1HD1  LEU  41          1HD1      LEU  41   7.021  -2.361 -10.172
  308   2HD1  LEU  41          2HD1      LEU  41   5.651  -1.423  -9.578
  309   3HD1  LEU  41          3HD1      LEU  41   5.662  -2.013 -11.239
  310   1HD2  LEU  41          1HD2      LEU  41   3.520  -4.649 -10.340
  311   2HD2  LEU  41          2HD2      LEU  41   3.979  -3.394 -11.489
  312   3HD2  LEU  41          3HD2      LEU  41   3.196  -2.955  -9.970
  313    H    GLY  42           H        GLY  42   8.488  -6.095 -12.250
  314   1HA   GLY  42          2HA       GLY  42  10.062  -3.788 -12.520
  315   2HA   GLY  42          1HA       GLY  42  10.421  -5.347 -13.254
  316    H    LYS  43           H        LYS  43   7.893  -5.376 -14.792
  317    HA   LYS  43           HA       LYS  43   8.796  -3.808 -17.071
  318   1HB   LYS  43          2HB       LYS  43   6.330  -5.552 -16.842
  319   2HB   LYS  43          1HB       LYS  43   7.076  -4.960 -18.326
  320   1HG   LYS  43          2HG       LYS  43   8.543  -6.721 -16.346
  321   2HG   LYS  43          1HG       LYS  43   7.629  -7.369 -17.708
  322   1HD   LYS  43          2HD       LYS  43   9.007  -6.002 -19.259
  323   2HD   LYS  43          1HD       LYS  43   9.952  -5.429 -17.885
  324   1HE   LYS  43          2HE       LYS  43  10.119  -8.087 -17.449
  325   2HE   LYS  43          1HE       LYS  43   9.958  -8.092 -19.206
  326   1HZ   LYS  43          1HZ       LYS  43  11.962  -6.544 -17.652
  327   2HZ   LYS  43          2HZ       LYS  43  11.802  -6.535 -19.343
  328   3HZ   LYS  43          3HZ       LYS  43  12.271  -7.955 -18.540
  329    H    VAL  44           H        VAL  44   6.635  -3.385 -14.461
  330    HA   VAL  44           HA       VAL  44   4.904  -1.496 -15.873
  331    HB   VAL  44           HB       VAL  44   4.741  -1.988 -12.922
  332   1HG1  VAL  44          1HG1      VAL  44   3.326  -0.422 -14.599
  333   2HG1  VAL  44          2HG1      VAL  44   2.619  -1.172 -13.170
  334   3HG1  VAL  44          3HG1      VAL  44   2.403  -1.916 -14.754
  335   1HG2  VAL  44          1HG2      VAL  44   4.928  -4.243 -13.824
  336   2HG2  VAL  44          2HG2      VAL  44   3.769  -3.869 -15.097
  337   3HG2  VAL  44          3HG2      VAL  44   3.239  -3.939 -13.416
  338    H    MET  45           H        MET  45   7.240  -1.589 -13.194
  339    HA   MET  45           HA       MET  45   7.103   1.003 -12.268
  340   1HB   MET  45          2HB       MET  45   9.539   0.786 -11.707
  341   2HB   MET  45          1HB       MET  45   8.561  -0.581 -11.174
  342   1HG   MET  45          2HG       MET  45   9.239  -1.836 -13.204
  343   2HG   MET  45          1HG       MET  45  10.253  -0.480 -13.692
  344   1HE   MET  45          1HE       MET  45  12.130  -1.118 -13.945
  345   2HE   MET  45          2HE       MET  45  12.614  -2.719 -13.391
  346   3HE   MET  45          3HE       MET  45  13.373  -1.289 -12.697
  347    H    ARG  46           H        ARG  46   8.770  -0.180 -15.168
  348    HA   ARG  46           HA       ARG  46  10.057   2.294 -15.787
  349   1HB   ARG  46          2HB       ARG  46  10.455   1.346 -18.002
  350   2HB   ARG  46          1HB       ARG  46  10.800   0.149 -16.756
  351   1HG   ARG  46          2HG       ARG  46   8.164  -0.368 -17.218
  352   2HG   ARG  46          1HG       ARG  46   8.674   0.169 -18.819
  353   1HD   ARG  46          2HD       ARG  46  10.067  -1.972 -17.190
  354   2HD   ARG  46          1HD       ARG  46   8.939  -2.290 -18.502
  355    HE   ARG  46           HE       ARG  46  10.836  -0.668 -19.640
  356   1HH1  ARG  46          2HH1      ARG  46  10.899  -3.669 -17.854
  357   2HH1  ARG  46          1HH1      ARG  46  12.324  -4.253 -18.641
  358   1HH2  ARG  46          1HH2      ARG  46  12.707  -1.454 -20.657
  359   2HH2  ARG  46          2HH2      ARG  46  13.346  -3.003 -20.223
  360    H    MET  47           H        MET  47   6.871   0.987 -16.474
  361    HA   MET  47           HA       MET  47   6.151   2.994 -18.415
  362   1HB   MET  47          2HB       MET  47   4.383   1.152 -16.783
  363   2HB   MET  47          1HB       MET  47   3.871   2.105 -18.174
  364   1HG   MET  47          2HG       MET  47   6.092   0.050 -18.310
  365   2HG   MET  47          1HG       MET  47   4.410  -0.324 -18.680
  366   1HE   MET  47          1HE       MET  47   5.970  -1.008 -21.275
  367   2HE   MET  47          2HE       MET  47   7.182  -0.449 -20.125
  368   3HE   MET  47          3HE       MET  47   7.119   0.255 -21.738
  369    H    LEU  48           H        LEU  48   5.916   2.616 -14.925
  370    HA   LEU  48           HA       LEU  48   4.073   4.754 -14.452
  371   1HB   LEU  48          2HB       LEU  48   5.947   3.135 -12.788
  372   2HB   LEU  48          1HB       LEU  48   5.333   4.632 -12.128
  373    HG   LEU  48           HG       LEU  48   3.022   3.792 -12.410
  374   1HD1  LEU  48          1HD1      LEU  48   2.607   1.510 -13.085
  375   2HD1  LEU  48          2HD1      LEU  48   4.336   1.166 -13.155
  376   3HD1  LEU  48          3HD1      LEU  48   3.607   2.255 -14.334
  377   1HD2  LEU  48          1HD2      LEU  48   3.090   2.363 -10.518
  378   2HD2  LEU  48          2HD2      LEU  48   4.536   3.361 -10.358
  379   3HD2  LEU  48          3HD2      LEU  48   4.665   1.711 -10.966
  380    H    GLY  49           H        GLY  49   7.544   4.512 -14.843
  381   1HA   GLY  49          2HA       GLY  49   8.652   6.551 -15.716
  382   2HA   GLY  49          1HA       GLY  49   7.778   7.447 -14.480
  383    H    GLN  50           H        GLN  50   9.078   4.317 -13.660
  384    HA   GLN  50           HA       GLN  50  11.394   5.566 -12.318
  385   1HB   GLN  50          2HB       GLN  50   9.542   3.527 -11.052
  386   2HB   GLN  50          1HB       GLN  50  10.966   4.255 -10.307
  387   1HG   GLN  50          2HG       GLN  50   9.712   5.988  -9.608
  388   2HG   GLN  50          1HG       GLN  50   9.329   6.371 -11.285
  389   1HE2  GLN  50          1HE2      GLN  50   7.090   6.730 -11.240
  390   2HE2  GLN  50          2HE2      GLN  50   5.961   5.625 -10.623
  391    H    ASN  51           H        ASN  51  13.038   3.956 -11.639
  392    HA   ASN  51           HA       ASN  51  12.937   1.407 -13.094
  393   1HB   ASN  51          2HB       ASN  51  14.101   3.392 -14.405
  394   2HB   ASN  51          1HB       ASN  51  15.453   3.007 -13.340
  395   1HD2  ASN  51          1HD2      ASN  51  13.176   1.453 -15.660
  396   2HD2  ASN  51          2HD2      ASN  51  14.256   0.229 -16.125
  397    HA   PRO  52           HA       PRO  52  15.085   1.264  -8.916
  398   1HB   PRO  52          2HB       PRO  52  13.141  -0.063  -7.525
  399   2HB   PRO  52          1HB       PRO  52  13.234   1.702  -7.639
  400   1HG   PRO  52          2HG       PRO  52  11.388  -0.181  -8.990
  401   2HG   PRO  52          1HG       PRO  52  11.130   1.504  -8.514
  402   1HD   PRO  52          2HD       PRO  52  11.709   0.596 -11.122
  403   2HD   PRO  52          1HD       PRO  52  11.796   2.278 -10.556
  404    H    THR  53           H        THR  53  14.743  -1.053  -7.412
  405    HA   THR  53           HA       THR  53  15.610  -3.159  -9.299
  406    HB   THR  53           HB       THR  53  16.980  -4.024  -7.609
  407    HG1  THR  53           HG1      THR  53  16.404  -4.064  -5.581
  408   1HG2  THR  53          1HG2      THR  53  18.217  -2.182  -6.646
  409   2HG2  THR  53          2HG2      THR  53  16.842  -1.098  -6.859
  410   3HG2  THR  53          3HG2      THR  53  17.698  -1.725  -8.268
  411    HA   PRO  54           HA       PRO  54  12.180  -5.722  -8.219
  412   1HB   PRO  54          2HB       PRO  54  13.269  -8.173  -7.648
  413   2HB   PRO  54          1HB       PRO  54  13.122  -7.508  -9.283
  414   1HG   PRO  54          2HG       PRO  54  15.524  -7.722  -7.541
  415   2HG   PRO  54          1HG       PRO  54  15.398  -7.795  -9.306
  416   1HD   PRO  54          2HD       PRO  54  16.257  -5.575  -7.855
  417   2HD   PRO  54          1HD       PRO  54  15.660  -5.522  -9.529
  418    H    GLU  55           H        GLU  55  14.771  -5.640  -5.857
  419    HA   GLU  55           HA       GLU  55  13.159  -6.678  -3.676
  420   1HB   GLU  55          2HB       GLU  55  15.850  -5.278  -3.653
  421   2HB   GLU  55          1HB       GLU  55  15.093  -6.062  -2.266
  422   1HG   GLU  55          2HG       GLU  55  15.381  -8.206  -3.149
  423   2HG   GLU  55          1HG       GLU  55  15.494  -7.618  -4.807
  424    H    GLU  56           H        GLU  56  14.181  -3.562  -4.973
  425    HA   GLU  56           HA       GLU  56  13.236  -1.952  -2.808
  426   1HB   GLU  56          2HB       GLU  56  14.908  -1.351  -4.716
  427   2HB   GLU  56          1HB       GLU  56  13.457  -0.965  -5.640
  428   1HG   GLU  56          2HG       GLU  56  12.803   0.733  -4.124
  429   2HG   GLU  56          1HG       GLU  56  13.892   0.145  -2.866
  430    H    LEU  57           H        LEU  57  11.854  -2.902  -5.964
  431    HA   LEU  57           HA       LEU  57   9.439  -1.411  -5.611
  432   1HB   LEU  57          2HB       LEU  57   8.639  -2.539  -7.561
  433   2HB   LEU  57          1HB       LEU  57  10.300  -2.071  -7.821
  434    HG   LEU  57           HG       LEU  57  10.794  -4.554  -7.064
  435   1HD1  LEU  57          1HD1      LEU  57   8.817  -5.584  -6.543
  436   2HD1  LEU  57          2HD1      LEU  57   8.716  -5.806  -8.290
  437   3HD1  LEU  57          3HD1      LEU  57   7.863  -4.468  -7.520
  438   1HD2  LEU  57          1HD2      LEU  57   9.608  -3.826  -9.764
  439   2HD2  LEU  57          2HD2      LEU  57  10.640  -5.220  -9.444
  440   3HD2  LEU  57          3HD2      LEU  57  11.288  -3.587  -9.282
  441    H    GLN  58           H        GLN  58  10.501  -4.602  -4.634
  442    HA   GLN  58           HA       GLN  58   8.002  -5.848  -4.264
  443   1HB   GLN  58          2HB       GLN  58  10.241  -6.992  -4.145
  444   2HB   GLN  58          1HB       GLN  58  10.454  -6.278  -2.546
  445   1HG   GLN  58          2HG       GLN  58   9.555  -8.477  -2.196
  446   2HG   GLN  58          1HG       GLN  58   8.240  -7.343  -1.894
  447   1HE2  GLN  58          1HE2      GLN  58   6.377  -7.483  -3.249
  448   2HE2  GLN  58          2HE2      GLN  58   6.241  -8.584  -4.533
  449    H    GLU  59           H        GLU  59   9.930  -3.803  -2.056
  450    HA   GLU  59           HA       GLU  59   8.228  -4.072   0.191
  451   1HB   GLU  59          2HB       GLU  59   9.362  -2.190   1.140
  452   2HB   GLU  59          1HB       GLU  59  10.562  -3.109   0.237
  453   1HG   GLU  59          2HG       GLU  59  11.072  -1.192  -0.835
  454   2HG   GLU  59          1HG       GLU  59   9.509  -1.316  -1.637
  455    H    MET  60           H        MET  60   8.055  -2.050  -2.672
  456    HA   MET  60           HA       MET  60   6.069  -0.230  -1.712
  457   1HB   MET  60          2HB       MET  60   6.608  -1.056  -4.577
  458   2HB   MET  60          1HB       MET  60   5.753   0.391  -4.043
  459   1HG   MET  60          2HG       MET  60   7.911   0.988  -2.773
  460   2HG   MET  60          1HG       MET  60   8.685  -0.262  -3.746
  461   1HE   MET  60          1HE       MET  60   6.212   3.184  -5.245
  462   2HE   MET  60          2HE       MET  60   7.442   3.717  -4.102
  463   3HE   MET  60          3HE       MET  60   6.302   2.457  -3.636
  464    H    ILE  61           H        ILE  61   6.025  -3.281  -3.470
  465    HA   ILE  61           HA       ILE  61   3.226  -3.426  -3.930
  466    HB   ILE  61           HB       ILE  61   5.276  -5.646  -3.664
  467   1HG1  ILE  61          2HG1      ILE  61   4.035  -4.733  -6.239
  468   2HG1  ILE  61          1HG1      ILE  61   5.336  -3.768  -5.541
  469   1HG2  ILE  61          1HG2      ILE  61   3.647  -7.095  -4.695
  470   2HG2  ILE  61          2HG2      ILE  61   2.527  -5.756  -4.938
  471   3HG2  ILE  61          3HG2      ILE  61   2.866  -6.339  -3.309
  472   1HD1  ILE  61          1HD1      ILE  61   6.904  -5.473  -5.759
  473   2HD1  ILE  61          2HD1      ILE  61   5.910  -5.741  -7.191
  474   3HD1  ILE  61          3HD1      ILE  61   5.679  -6.741  -5.756
  475    H    ASP  62           H        ASP  62   5.309  -4.808  -1.380
  476    HA   ASP  62           HA       ASP  62   3.313  -6.113   0.095
  477   1HB   ASP  62          2HB       ASP  62   5.912  -6.114   0.380
  478   2HB   ASP  62          1HB       ASP  62   5.613  -4.761   1.472
  479    H    GLU  63           H        GLU  63   4.297  -2.725   0.058
  480    HA   GLU  63           HA       GLU  63   2.792  -1.967   2.384
  481   1HB   GLU  63          2HB       GLU  63   4.136  -0.431   0.171
  482   2HB   GLU  63          1HB       GLU  63   3.132   0.384   1.370
  483   1HG   GLU  63          2HG       GLU  63   5.184  -1.537   2.375
  484   2HG   GLU  63          1HG       GLU  63   5.756   0.010   1.752
  485    H    VAL  64           H        VAL  64   2.290  -1.484  -1.129
  486    HA   VAL  64           HA       VAL  64  -0.285  -0.299  -0.827
  487    HB   VAL  64           HB       VAL  64   1.092   0.066  -2.838
  488   1HG1  VAL  64          1HG1      VAL  64   1.890  -2.371  -2.906
  489   2HG1  VAL  64          2HG1      VAL  64   1.490  -1.632  -4.455
  490   3HG1  VAL  64          3HG1      VAL  64   0.353  -2.740  -3.688
  491   1HG2  VAL  64          1HG2      VAL  64  -1.282  -1.339  -3.943
  492   2HG2  VAL  64          2HG2      VAL  64  -0.750   0.327  -4.174
  493   3HG2  VAL  64          3HG2      VAL  64  -1.603  -0.131  -2.699
  494    H    ASP  65           H        ASP  65   0.795  -3.630  -1.405
  495    HA   ASP  65           HA       ASP  65  -1.885  -4.646  -1.758
  496   1HB   ASP  65          2HB       ASP  65   0.687  -5.625  -2.280
  497   2HB   ASP  65          1HB       ASP  65   0.079  -6.647  -0.982
  498    H    GLU  66           H        GLU  66  -3.172  -4.355  -0.032
  499    HA   GLU  66           HA       GLU  66  -2.396  -4.390   2.678
  500   1HB   GLU  66          2HB       GLU  66  -5.130  -5.154   1.628
  501   2HB   GLU  66          1HB       GLU  66  -4.739  -4.498   3.216
  502   1HG   GLU  66          2HG       GLU  66  -3.837  -2.443   1.997
  503   2HG   GLU  66          1HG       GLU  66  -4.602  -3.090   0.546
  504    H    ASP  67           H        ASP  67  -3.624  -6.926   0.548
  505    HA   ASP  67           HA       ASP  67  -3.546  -8.931   2.653
  506   1HB   ASP  67          2HB       ASP  67  -4.239 -10.491   0.806
  507   2HB   ASP  67          1HB       ASP  67  -5.346  -9.147   1.082
  508    H    GLY  68           H        GLY  68  -1.654  -8.070  -0.229
  509   1HA   GLY  68          2HA       GLY  68   0.534  -8.580  -0.774
  510   2HA   GLY  68          1HA       GLY  68   0.701  -9.332   0.810
  511    H    SER  69           H        SER  69  -1.457 -10.004  -1.933
  512    HA   SER  69           HA       SER  69  -0.970 -12.857  -1.684
  513   1HB   SER  69          2HB       SER  69  -2.669 -13.032  -3.498
  514   2HB   SER  69          1HB       SER  69  -3.238 -12.128  -2.098
  515    HG   SER  69           HG       SER  69  -3.739 -10.915  -3.876
  516    H    GLY  70           H        GLY  70   0.839 -10.526  -3.158
  517   1HA   GLY  70          2HA       GLY  70   2.579 -10.735  -4.675
  518   2HA   GLY  70          1HA       GLY  70   2.103 -12.409  -4.941
  519    H    THR  71           H        THR  71  -0.387 -10.034  -5.189
  520    HA   THR  71           HA       THR  71  -0.116  -9.796  -8.100
  521    HB   THR  71           HB       THR  71  -2.366 -10.520  -8.541
  522    HG1  THR  71           HG1      THR  71  -3.790 -10.456  -7.021
  523   1HG2  THR  71          1HG2      THR  71  -0.715 -12.328  -8.398
  524   2HG2  THR  71          2HG2      THR  71  -2.281 -12.886  -7.807
  525   3HG2  THR  71          3HG2      THR  71  -1.004 -12.473  -6.663
  526    H    VAL  72           H        VAL  72  -0.701  -7.825  -8.818
  527    HA   VAL  72           HA       VAL  72  -1.766  -5.942  -6.823
  528    HB   VAL  72           HB       VAL  72  -0.692  -5.197  -9.536
  529   1HG1  VAL  72          1HG1      VAL  72  -0.355  -3.049  -8.512
  530   2HG1  VAL  72          2HG1      VAL  72  -0.676  -3.700  -6.905
  531   3HG1  VAL  72          3HG1      VAL  72  -1.986  -3.565  -8.079
  532   1HG2  VAL  72          1HG2      VAL  72   1.496  -4.826  -8.393
  533   2HG2  VAL  72          2HG2      VAL  72   1.052  -6.532  -8.446
  534   3HG2  VAL  72          3HG2      VAL  72   0.850  -5.612  -6.953
  535    H    ASP  73           H        ASP  73  -3.826  -5.462  -6.849
  536    HA   ASP  73           HA       ASP  73  -5.496  -6.011  -9.183
  537   1HB   ASP  73          2HB       ASP  73  -6.065  -5.061  -6.369
  538   2HB   ASP  73          1HB       ASP  73  -7.309  -5.066  -7.619
  539    H    PHE  74           H        PHE  74  -7.085  -4.211  -9.840
  540    HA   PHE  74           HA       PHE  74  -5.631  -1.993 -10.768
  541   1HB   PHE  74          2HB       PHE  74  -7.879  -2.875 -11.646
  542   2HB   PHE  74          1HB       PHE  74  -8.616  -1.893 -10.379
  543    HD1  PHE  74           HD1      PHE  74  -5.627  -1.343 -12.568
  544    HD2  PHE  74           HD2      PHE  74  -9.519   0.026 -11.373
  545    HE1  PHE  74           HE1      PHE  74  -5.363   0.672 -13.992
  546    HE2  PHE  74           HE2      PHE  74  -9.249   2.038 -12.793
  547    HZ   PHE  74           HZ       PHE  74  -7.174   2.361 -14.104
  548    H    ASP  75           H        ASP  75  -7.538  -2.421  -7.828
  549    HA   ASP  75           HA       ASP  75  -7.563   0.323  -7.039
  550   1HB   ASP  75          2HB       ASP  75  -7.882  -2.250  -5.483
  551   2HB   ASP  75          1HB       ASP  75  -7.984  -0.659  -4.726
  552    H    GLU  76           H        GLU  76  -5.399  -2.412  -6.390
  553    HA   GLU  76           HA       GLU  76  -3.635  -0.896  -4.676
  554   1HB   GLU  76          2HB       GLU  76  -3.117  -3.550  -6.048
  555   2HB   GLU  76          1HB       GLU  76  -2.245  -2.885  -4.667
  556   1HG   GLU  76          2HG       GLU  76  -4.191  -3.058  -3.253
  557   2HG   GLU  76          1HG       GLU  76  -5.221  -3.464  -4.621
  558    H    PHE  77           H        PHE  77  -4.022  -1.344  -8.073
  559    HA   PHE  77           HA       PHE  77  -1.328  -0.827  -8.900
  560   1HB   PHE  77          2HB       PHE  77  -3.498  -1.832 -10.162
  561   2HB   PHE  77          1HB       PHE  77  -3.604  -0.163 -10.695
  562    HD1  PHE  77           HD1      PHE  77  -3.274  -1.023 -12.986
  563    HD2  PHE  77           HD2      PHE  77  -0.226  -1.434  -9.974
  564    HE1  PHE  77           HE1      PHE  77  -1.592  -1.478 -14.738
  565    HE2  PHE  77           HE2      PHE  77   1.448  -1.882 -11.740
  566    HZ   PHE  77           HZ       PHE  77   0.764  -1.909 -14.123
  567    H    LEU  78           H        LEU  78  -4.318   1.126  -8.913
  568    HA   LEU  78           HA       LEU  78  -3.020   3.548  -9.697
  569   1HB   LEU  78          2HB       LEU  78  -5.731   2.812  -8.697
  570   2HB   LEU  78          1HB       LEU  78  -5.256   4.499  -8.646
  571    HG   LEU  78           HG       LEU  78  -5.107   4.630 -11.013
  572   1HD1  LEU  78          1HD1      LEU  78  -5.434   1.622 -11.139
  573   2HD1  LEU  78          2HD1      LEU  78  -3.887   2.454 -11.287
  574   3HD1  LEU  78          3HD1      LEU  78  -5.145   2.714 -12.493
  575   1HD2  LEU  78          1HD2      LEU  78  -7.431   2.845 -10.234
  576   2HD2  LEU  78          2HD2      LEU  78  -7.322   3.719 -11.762
  577   3HD2  LEU  78          3HD2      LEU  78  -7.412   4.609 -10.242
  578    H    VAL  79           H        VAL  79  -3.666   2.025  -6.606
  579    HA   VAL  79           HA       VAL  79  -3.369   4.281  -4.926
  580    HB   VAL  79           HB       VAL  79  -3.234   1.324  -4.580
  581   1HG1  VAL  79          1HG1      VAL  79  -2.469   1.571  -2.235
  582   2HG1  VAL  79          2HG1      VAL  79  -2.128   3.275  -2.538
  583   3HG1  VAL  79          3HG1      VAL  79  -1.214   2.026  -3.389
  584   1HG2  VAL  79          1HG2      VAL  79  -5.261   2.914  -4.325
  585   2HG2  VAL  79          2HG2      VAL  79  -4.512   3.404  -2.806
  586   3HG2  VAL  79          3HG2      VAL  79  -4.990   1.724  -3.052
  587    H    MET  80           H        MET  80  -1.019   1.893  -6.119
  588    HA   MET  80           HA       MET  80   1.287   2.658  -4.831
  589   1HB   MET  80          2HB       MET  80   0.685   1.021  -7.000
  590   2HB   MET  80          1HB       MET  80   1.810   2.208  -7.659
  591   1HG   MET  80          2HG       MET  80   3.122   1.714  -5.402
  592   2HG   MET  80          1HG       MET  80   2.235   0.191  -5.490
  593   1HE   MET  80          1HE       MET  80   2.254  -1.371  -6.840
  594   2HE   MET  80          2HE       MET  80   3.714  -1.956  -7.634
  595   3HE   MET  80          3HE       MET  80   2.474  -1.138  -8.580
  596    H    MET  81           H        MET  81  -0.403   4.421  -7.371
  597    HA   MET  81           HA       MET  81   1.712   6.122  -8.193
  598   1HB   MET  81          2HB       MET  81  -0.424   5.928  -9.435
  599   2HB   MET  81          1HB       MET  81  -1.257   6.733  -8.106
  600   1HG   MET  81          2HG       MET  81  -0.641   8.757  -8.875
  601   2HG   MET  81          1HG       MET  81   1.055   8.279  -8.895
  602   1HE   MET  81          1HE       MET  81   1.571   6.558 -12.225
  603   2HE   MET  81          2HE       MET  81   1.697   6.312 -10.485
  604   3HE   MET  81          3HE       MET  81   2.400   7.753 -11.218
  605    H    VAL  82           H        VAL  82  -0.942   6.712  -5.867
  606    HA   VAL  82           HA       VAL  82   0.157   9.167  -4.896
  607    HB   VAL  82           HB       VAL  82  -1.473   8.882  -3.012
  608   1HG1  VAL  82          1HG1      VAL  82  -2.623   8.397  -5.774
  609   2HG1  VAL  82          2HG1      VAL  82  -2.063   9.962  -5.183
  610   3HG1  VAL  82          3HG1      VAL  82  -3.442   9.171  -4.417
  611   1HG2  VAL  82          1HG2      VAL  82  -3.008   7.014  -3.025
  612   2HG2  VAL  82          2HG2      VAL  82  -1.372   6.357  -3.029
  613   3HG2  VAL  82          3HG2      VAL  82  -2.314   6.389  -4.520
  614    H    ARG  83           H        ARG  83   0.627   5.807  -4.078
  615    HA   ARG  83           HA       ARG  83   1.678   6.039  -1.482
  616   1HB   ARG  83          2HB       ARG  83   2.162   4.048  -3.694
  617   2HB   ARG  83          1HB       ARG  83   2.960   3.912  -2.128
  618   1HG   ARG  83          2HG       ARG  83   0.014   4.361  -2.096
  619   2HG   ARG  83          1HG       ARG  83   0.571   2.773  -2.626
  620   1HD   ARG  83          2HD       ARG  83   1.844   2.486  -0.571
  621   2HD   ARG  83          1HD       ARG  83   1.443   4.119  -0.053
  622    HE   ARG  83           HE       ARG  83  -0.996   2.905  -0.411
  623   1HH1  ARG  83          2HH1      ARG  83   1.889   2.202   1.431
  624   2HH1  ARG  83          1HH1      ARG  83   1.036   1.362   2.681
  625   1HH2  ARG  83          1HH2      ARG  83  -2.091   1.801   1.240
  626   2HH2  ARG  83          2HH2      ARG  83  -1.211   1.135   2.573
  627    H    CYS  84           H        CYS  84   3.047   6.907  -4.566
  628    HA   CYS  84           HA       CYS  84   5.804   6.839  -3.806
  629   1HB   CYS  84          2HB       CYS  84   4.342   8.337  -5.992
  630   2HB   CYS  84          1HB       CYS  84   6.092   8.392  -5.779
  631    HG   CYS  84           HG       CYS  84   4.488   5.969  -6.812
  632    H    MET  85           H        MET  85   3.238   9.271  -3.693
  633    HA   MET  85           HA       MET  85   5.022  11.342  -2.683
  634   1HB   MET  85          2HB       MET  85   2.066  11.216  -3.270
  635   2HB   MET  85          1HB       MET  85   2.775  12.580  -2.406
  636   1HG   MET  85          2HG       MET  85   2.948  13.345  -4.589
  637   2HG   MET  85          1HG       MET  85   4.504  12.533  -4.417
  638   1HE   MET  85          1HE       MET  85   1.002  11.602  -7.077
  639   2HE   MET  85          2HE       MET  85   2.018  13.041  -7.081
  640   3HE   MET  85          3HE       MET  85   1.050  12.660  -5.659
  641    H    LYS  86           H        LYS  86   1.979   9.910  -1.439
  642    HA   LYS  86           HA       LYS  86   2.794  10.534   1.294
  643   1HB   LYS  86          2HB       LYS  86   0.349  10.607   0.143
  644   2HB   LYS  86          1HB       LYS  86   0.317   8.973   0.804
  645   1HG   LYS  86          2HG       LYS  86   1.440  10.900   2.692
  646   2HG   LYS  86          1HG       LYS  86  -0.209  11.314   2.218
  647   1HD   LYS  86          2HD       LYS  86  -0.813   8.878   2.687
  648   2HD   LYS  86          1HD       LYS  86   0.773   8.729   3.445
  649   1HE   LYS  86          2HE       LYS  86   0.172  10.683   4.915
  650   2HE   LYS  86          1HE       LYS  86  -1.459  10.615   4.248
  651   1HZ   LYS  86          1HZ       LYS  86  -0.078   8.401   5.669
  652   2HZ   LYS  86          2HZ       LYS  86  -1.652   8.340   5.030
  653   3HZ   LYS  86          3HZ       LYS  86  -1.296   9.385   6.321
  654    H    ASP  87           H        ASP  87   2.939   8.946   2.941
  655    HA   ASP  87           HA       ASP  87   3.555   6.927   3.862
  656   1HB   ASP  87          2HB       ASP  87   1.517   6.164   2.338
  657   2HB   ASP  87          1HB       ASP  87   2.797   5.410   1.389
  658    H    ASP  88           H        ASP  88   5.516   8.415   2.851
  659    HA   ASP  88           HA       ASP  88   7.476   6.441   2.009
  660   1HB   ASP  88          2HB       ASP  88   6.306   7.502  -0.087
  661   2HB   ASP  88          1HB       ASP  88   7.313   8.899   0.293
  662    H    SER  89           HN       SER  89   7.030   9.992   2.138
  663    HA   SER  89           HA       SER  89   9.043  10.198   4.242
  664   1HB   SER  89          2HB       SER  89  10.282  10.280   2.027
  665   2HB   SER  89          1HB       SER  89   9.411  11.772   1.685
  666    HG   SER  89           HG       SER  89  11.372  11.219   3.610
  Start of MODEL   29
    1   1H    MET   1          1H        MET   1 -12.474   8.986   8.976
    2   2H    MET   1          2H        MET   1 -12.827   8.020   7.624
    3   3H    MET   1          3H        MET   1 -11.478   9.052   7.605
    4    HA   MET   1           HA       MET   1 -10.432   7.768   9.364
    5   1HB   MET   1          2HB       MET   1 -12.726   7.011  10.257
    6   2HB   MET   1          1HB       MET   1 -12.684   5.782   8.994
    7   1HG   MET   1          2HG       MET   1 -11.744   4.685  10.861
    8   2HG   MET   1          1HG       MET   1 -10.335   5.195   9.930
    9   1HE   MET   1          1HE       MET   1  -9.682   4.290  12.109
   10   2HE   MET   1          2HE       MET   1  -9.928   5.022  13.693
   11   3HE   MET   1          3HE       MET   1  -8.554   5.514  12.706
   12    H    ASN   2           H        ASN   2  -8.944   7.685   7.705
   13    HA   ASN   2           HA       ASN   2  -7.695   6.785   6.010
   14   1HB   ASN   2          2HB       ASN   2  -9.121   4.437   7.154
   15   2HB   ASN   2          1HB       ASN   2  -8.348   4.217   5.585
   16   1HD2  ASN   2          1HD2      ASN   2  -7.399   6.100   8.522
   17   2HD2  ASN   2          2HD2      ASN   2  -5.856   5.401   8.640
   18    H    ASP   3           H        ASP   3  -9.970   8.242   5.275
   19    HA   ASP   3           HA       ASP   3 -10.960   6.805   2.883
   20   1HB   ASP   3          2HB       ASP   3 -12.115   9.036   4.542
   21   2HB   ASP   3          1HB       ASP   3 -12.650   8.776   2.882
   22    H    ILE   4           H        ILE   4  -8.323   8.130   3.143
   23    HA   ILE   4           HA       ILE   4  -8.561  10.486   1.421
   24    HB   ILE   4           HB       ILE   4  -6.139  10.734   1.748
   25   1HG1  ILE   4          2HG1      ILE   4  -5.353   9.033   3.716
   26   2HG1  ILE   4          1HG1      ILE   4  -6.448   7.977   2.828
   27   1HG2  ILE   4          1HG2      ILE   4  -7.455  10.128   4.404
   28   2HG2  ILE   4          2HG2      ILE   4  -7.853  11.552   3.442
   29   3HG2  ILE   4          3HG2      ILE   4  -6.216  11.336   4.063
   30   1HD1  ILE   4          1HD1      ILE   4  -4.413   9.606   1.331
   31   2HD1  ILE   4          2HD1      ILE   4  -5.178   8.086   0.867
   32   3HD1  ILE   4          3HD1      ILE   4  -3.929   8.100   2.111
   33    H    TYR   5           H        TYR   5  -7.556   7.136   1.291
   34    HA   TYR   5           HA       TYR   5  -6.161   7.222  -1.185
   35   1HB   TYR   5          2HB       TYR   5  -7.664   4.872   0.005
   36   2HB   TYR   5          1HB       TYR   5  -6.389   4.802  -1.213
   37    HD1  TYR   5           HD1      TYR   5  -7.142   4.990   2.319
   38    HD2  TYR   5           HD2      TYR   5  -4.054   5.628  -0.598
   39    HE1  TYR   5           HE1      TYR   5  -5.438   4.966   4.118
   40    HE2  TYR   5           HE2      TYR   5  -2.350   5.604   1.201
   41    HH   TYR   5           HH       TYR   5  -2.700   6.176   4.071
   42    H    LYS   6           H        LYS   6  -9.550   6.754  -0.305
   43    HA   LYS   6           HA       LYS   6 -10.394   6.243  -3.033
   44   1HB   LYS   6          2HB       LYS   6 -11.734   6.426  -0.375
   45   2HB   LYS   6          1HB       LYS   6 -12.716   6.726  -1.810
   46   1HG   LYS   6          2HG       LYS   6 -12.295   4.576  -2.696
   47   2HG   LYS   6          1HG       LYS   6 -10.908   4.317  -1.637
   48   1HD   LYS   6          2HD       LYS   6 -13.470   4.829  -0.243
   49   2HD   LYS   6          1HD       LYS   6 -13.397   3.314  -1.145
   50   1HE   LYS   6          2HE       LYS   6 -10.960   3.281   0.074
   51   2HE   LYS   6          1HE       LYS   6 -11.913   4.140   1.283
   52   1HZ   LYS   6          1HZ       LYS   6 -11.991   1.754   1.633
   53   2HZ   LYS   6          2HZ       LYS   6 -12.607   1.519   0.068
   54   3HZ   LYS   6          3HZ       LYS   6 -13.529   2.345   1.233
   55    H    ALA   7           H        ALA   7 -10.068   8.997  -0.898
   56    HA   ALA   7           HA       ALA   7 -11.768  10.786  -2.353
   57   1HB   ALA   7          1HB       ALA   7  -9.556  11.239  -0.346
   58   2HB   ALA   7          2HB       ALA   7 -11.295  11.352  -0.082
   59   3HB   ALA   7          3HB       ALA   7 -10.474  12.557  -1.074
   60    H    ALA   8           H        ALA   8  -8.459   9.718  -2.702
   61    HA   ALA   8           HA       ALA   8  -7.705  11.896  -4.474
   62   1HB   ALA   8          1HB       ALA   8  -6.031  10.843  -2.986
   63   2HB   ALA   8          2HB       ALA   8  -5.578  10.716  -4.686
   64   3HB   ALA   8          3HB       ALA   8  -6.250   9.319  -3.845
   65    H    VAL   9           H        VAL   9  -8.445   8.423  -4.747
   66    HA   VAL   9           HA       VAL   9  -7.973   8.219  -7.537
   67    HB   VAL   9           HB       VAL   9  -8.155   6.282  -5.937
   68   1HG1  VAL   9          1HG1      VAL   9 -10.219   7.046  -4.793
   69   2HG1  VAL   9          2HG1      VAL   9 -10.387   5.412  -5.431
   70   3HG1  VAL   9          3HG1      VAL   9 -11.129   6.769  -6.276
   71   1HG2  VAL   9          1HG2      VAL   9  -8.285   5.143  -7.873
   72   2HG2  VAL   9          2HG2      VAL   9  -9.045   6.526  -8.658
   73   3HG2  VAL   9          3HG2      VAL   9 -10.039   5.319  -7.845
   74    H    GLU  10           H        GLU  10 -10.684   9.445  -5.706
   75    HA   GLU  10           HA       GLU  10 -12.540   9.321  -7.928
   76   1HB   GLU  10          2HB       GLU  10 -14.107  10.409  -6.456
   77   2HB   GLU  10          1HB       GLU  10 -13.269   9.157  -5.543
   78   1HG   GLU  10          2HG       GLU  10 -11.955  10.713  -4.369
   79   2HG   GLU  10          1HG       GLU  10 -12.245  11.992  -5.546
   80    H    GLN  11           H        GLN  11 -10.083  11.514  -6.874
   81    HA   GLN  11           HA       GLN  11 -11.281  13.695  -8.470
   82   1HB   GLN  11          2HB       GLN  11  -9.849  15.230  -7.252
   83   2HB   GLN  11          1HB       GLN  11 -10.760  14.242  -6.112
   84   1HG   GLN  11          2HG       GLN  11  -8.839  12.807  -5.733
   85   2HG   GLN  11          1HG       GLN  11  -7.924  13.628  -6.996
   86   1HE2  GLN  11          1HE2      GLN  11  -8.859  13.764  -3.644
   87   2HE2  GLN  11          2HE2      GLN  11  -8.091  15.233  -3.283
   88    H    LEU  12           H        LEU  12  -8.974  11.282  -8.802
   89    HA   LEU  12           HA       LEU  12  -6.882  12.743 -10.100
   90   1HB   LEU  12          2HB       LEU  12  -6.316  10.446 -11.077
   91   2HB   LEU  12          1HB       LEU  12  -6.189  10.659  -9.347
   92    HG   LEU  12           HG       LEU  12  -8.289   9.466  -9.020
   93   1HD1  LEU  12          1HD1      LEU  12  -9.242   8.298 -11.117
   94   2HD1  LEU  12          2HD1      LEU  12  -8.350   9.510 -12.037
   95   3HD1  LEU  12          3HD1      LEU  12  -9.609  10.010 -10.907
   96   1HD2  LEU  12          1HD2      LEU  12  -7.541   7.266  -9.687
   97   2HD2  LEU  12          2HD2      LEU  12  -6.116   8.221  -9.275
   98   3HD2  LEU  12          3HD2      LEU  12  -6.535   7.945 -10.966
   99    H    THR  13           H        THR  13  -6.289  11.973 -12.460
  100    HA   THR  13           HA       THR  13  -8.568  12.772 -14.139
  101    HB   THR  13           HB       THR  13  -6.440  12.619 -15.849
  102    HG1  THR  13           HG1      THR  13  -4.891  12.204 -14.375
  103   1HG2  THR  13          1HG2      THR  13  -7.691  14.763 -14.208
  104   2HG2  THR  13          2HG2      THR  13  -7.589  14.596 -15.961
  105   3HG2  THR  13          3HG2      THR  13  -6.191  15.159 -15.046
  106    H    ASP  14           H        ASP  14  -8.591  11.747 -16.382
  107    HA   ASP  14           HA       ASP  14  -8.960   8.911 -16.094
  108   1HB   ASP  14          2HB       ASP  14 -10.023  10.759 -17.790
  109   2HB   ASP  14          1HB       ASP  14  -8.799  10.030 -18.831
  110    H    GLU  15           H        GLU  15  -6.496  11.042 -17.367
  111    HA   GLU  15           HA       GLU  15  -4.966   9.135 -18.797
  112   1HB   GLU  15          2HB       GLU  15  -3.183  10.781 -18.732
  113   2HB   GLU  15          1HB       GLU  15  -4.718  11.592 -19.030
  114   1HG   GLU  15          2HG       GLU  15  -4.019  12.971 -17.353
  115   2HG   GLU  15          1HG       GLU  15  -4.656  11.696 -16.320
  116    H    GLN  16           H        GLN  16  -5.122  10.012 -15.399
  117    HA   GLN  16           HA       GLN  16  -2.720   8.708 -14.573
  118   1HB   GLN  16          2HB       GLN  16  -4.262  10.450 -13.315
  119   2HB   GLN  16          1HB       GLN  16  -5.071   8.995 -12.737
  120   1HG   GLN  16          2HG       GLN  16  -2.229   8.607 -12.547
  121   2HG   GLN  16          1HG       GLN  16  -2.649  10.139 -11.779
  122   1HE2  GLN  16          1HE2      GLN  16  -4.021   6.790 -11.926
  123   2HE2  GLN  16          2HE2      GLN  16  -4.387   6.722 -10.271
  124    H    LYS  17           H        LYS  17  -6.141   7.769 -14.702
  125    HA   LYS  17           HA       LYS  17  -5.824   5.181 -13.565
  126   1HB   LYS  17          2HB       LYS  17  -7.930   6.205 -15.492
  127   2HB   LYS  17          1HB       LYS  17  -8.026   4.692 -14.591
  128   1HG   LYS  17          2HG       LYS  17  -8.352   5.764 -12.555
  129   2HG   LYS  17          1HG       LYS  17  -7.531   7.234 -13.080
  130   1HD   LYS  17          2HD       LYS  17  -9.809   7.853 -13.051
  131   2HD   LYS  17          1HD       LYS  17  -9.499   7.494 -14.748
  132   1HE   LYS  17          2HE       LYS  17 -11.442   6.269 -14.415
  133   2HE   LYS  17          1HE       LYS  17 -10.230   5.049 -14.027
  134   1HZ   LYS  17          1HZ       LYS  17 -11.670   6.776 -12.085
  135   2HZ   LYS  17          2HZ       LYS  17 -10.443   5.672 -11.680
  136   3HZ   LYS  17          3HZ       LYS  17 -11.913   5.115 -12.324
  137    H    ASN  18           H        ASN  18  -5.851   6.394 -16.903
  138    HA   ASN  18           HA       ASN  18  -5.582   3.877 -18.192
  139   1HB   ASN  18          2HB       ASN  18  -5.012   6.711 -19.036
  140   2HB   ASN  18          1HB       ASN  18  -4.618   5.352 -20.087
  141   1HD2  ASN  18          1HD2      ASN  18  -6.833   7.544 -20.175
  142   2HD2  ASN  18          2HD2      ASN  18  -8.253   6.650 -20.437
  143    H    GLU  19           H        GLU  19  -3.256   6.069 -16.733
  144    HA   GLU  19           HA       GLU  19  -0.875   5.256 -17.922
  145   1HB   GLU  19          2HB       GLU  19  -1.206   7.091 -16.180
  146   2HB   GLU  19          1HB       GLU  19  -1.154   5.814 -14.964
  147   1HG   GLU  19          2HG       GLU  19   1.088   6.385 -15.040
  148   2HG   GLU  19          1HG       GLU  19   1.050   5.124 -16.270
  149    H    PHE  20           H        PHE  20  -2.428   3.918 -15.003
  150    HA   PHE  20           HA       PHE  20  -0.596   1.671 -14.902
  151   1HB   PHE  20          2HB       PHE  20  -2.987   2.522 -13.286
  152   2HB   PHE  20          1HB       PHE  20  -2.285   0.918 -13.093
  153    HD1  PHE  20           HD1      PHE  20  -1.865   4.491 -12.479
  154    HD2  PHE  20           HD2      PHE  20   0.080   0.663 -12.329
  155    HE1  PHE  20           HE1      PHE  20  -0.122   5.433 -10.993
  156    HE2  PHE  20           HE2      PHE  20   1.815   1.600 -10.835
  157    HZ   PHE  20           HZ       PHE  20   1.721   3.989 -10.170
  158    H    LYS  21           H        LYS  21  -4.042   2.194 -15.634
  159    HA   LYS  21           HA       LYS  21  -4.877  -0.426 -16.000
  160   1HB   LYS  21          2HB       LYS  21  -6.347   1.592 -16.028
  161   2HB   LYS  21          1HB       LYS  21  -5.783   1.929 -17.663
  162   1HG   LYS  21          2HG       LYS  21  -6.548  -0.810 -17.600
  163   2HG   LYS  21          1HG       LYS  21  -7.837   0.105 -16.817
  164   1HD   LYS  21          2HD       LYS  21  -7.446   1.734 -18.893
  165   2HD   LYS  21          1HD       LYS  21  -6.855   0.249 -19.636
  166   1HE   LYS  21          2HE       LYS  21  -8.930  -0.684 -19.720
  167   2HE   LYS  21          1HE       LYS  21  -9.384  -0.049 -18.139
  168   1HZ   LYS  21          1HZ       LYS  21 -10.679   0.958 -19.919
  169   2HZ   LYS  21          2HZ       LYS  21  -9.258   1.523 -20.657
  170   3HZ   LYS  21          3HZ       LYS  21  -9.722   2.119 -19.135
  171    H    ALA  22           H        ALA  22  -3.093   1.638 -18.267
  172    HA   ALA  22           HA       ALA  22  -3.396   0.074 -20.592
  173   1HB   ALA  22          1HB       ALA  22  -2.404   2.304 -20.694
  174   2HB   ALA  22          2HB       ALA  22  -1.264   1.121 -21.337
  175   3HB   ALA  22          3HB       ALA  22  -1.042   1.765 -19.710
  176    H    ALA  23           H        ALA  23  -0.775   0.082 -18.184
  177    HA   ALA  23           HA       ALA  23   0.575  -2.207 -19.209
  178   1HB   ALA  23          1HB       ALA  23   1.513  -2.223 -16.772
  179   2HB   ALA  23          2HB       ALA  23   0.651  -0.695 -16.604
  180   3HB   ALA  23          3HB       ALA  23   1.917  -0.868 -17.823
  181    H    PHE  24           H        PHE  24  -1.890  -1.674 -16.755
  182    HA   PHE  24           HA       PHE  24  -1.972  -4.227 -15.594
  183   1HB   PHE  24          2HB       PHE  24  -3.175  -2.054 -14.883
  184   2HB   PHE  24          1HB       PHE  24  -4.426  -2.533 -16.029
  185    HD1  PHE  24           HD1      PHE  24  -5.558  -4.777 -15.758
  186    HD2  PHE  24           HD2      PHE  24  -2.974  -3.113 -12.763
  187    HE1  PHE  24           HE1      PHE  24  -6.494  -6.340 -14.080
  188    HE2  PHE  24           HE2      PHE  24  -3.913  -4.670 -11.085
  189    HZ   PHE  24           HZ       PHE  24  -5.677  -6.278 -11.743
  190    H    ASP  25           H        ASP  25  -3.784  -2.905 -18.368
  191    HA   ASP  25           HA       ASP  25  -5.380  -5.179 -18.858
  192   1HB   ASP  25          2HB       ASP  25  -5.209  -2.659 -19.934
  193   2HB   ASP  25          1HB       ASP  25  -4.622  -3.667 -21.256
  194    H    ILE  26           H        ILE  26  -2.190  -4.274 -20.157
  195    HA   ILE  26           HA       ILE  26  -2.070  -6.517 -21.954
  196    HB   ILE  26           HB       ILE  26   0.315  -5.878 -22.251
  197   1HG1  ILE  26          2HG1      ILE  26  -0.324  -3.661 -20.279
  198   2HG1  ILE  26          1HG1      ILE  26   0.629  -5.085 -19.873
  199   1HG2  ILE  26          1HG2      ILE  26  -0.158  -3.693 -23.266
  200   2HG2  ILE  26          2HG2      ILE  26  -1.638  -3.558 -22.316
  201   3HG2  ILE  26          3HG2      ILE  26  -1.496  -4.804 -23.556
  202   1HD1  ILE  26          1HD1      ILE  26   1.534  -3.740 -22.321
  203   2HD1  ILE  26          2HD1      ILE  26   2.466  -4.294 -20.931
  204   3HD1  ILE  26          3HD1      ILE  26   1.649  -2.731 -20.879
  205    H    PHE  27           H        PHE  27  -0.884  -5.895 -18.674
  206    HA   PHE  27           HA       PHE  27   0.681  -8.304 -18.564
  207   1HB   PHE  27          2HB       PHE  27  -0.249  -6.432 -16.378
  208   2HB   PHE  27          1HB       PHE  27   0.820  -7.810 -16.112
  209    HD1  PHE  27           HD1      PHE  27   2.427  -7.715 -18.653
  210    HD2  PHE  27           HD2      PHE  27   1.205  -4.576 -15.984
  211    HE1  PHE  27           HE1      PHE  27   4.354  -6.342 -19.385
  212    HE2  PHE  27           HE2      PHE  27   3.136  -3.205 -16.723
  213    HZ   PHE  27           HZ       PHE  27   4.707  -4.087 -18.421
  214    H    ILE  28           H        ILE  28  -2.646  -7.458 -17.692
  215    HA   ILE  28           HA       ILE  28  -3.031 -10.153 -16.561
  216    HB   ILE  28           HB       ILE  28  -5.174  -9.428 -15.765
  217   1HG1  ILE  28          2HG1      ILE  28  -5.519  -6.763 -16.332
  218   2HG1  ILE  28          1HG1      ILE  28  -4.843  -7.360 -17.849
  219   1HG2  ILE  28          1HG2      ILE  28  -3.342  -7.060 -15.357
  220   2HG2  ILE  28          2HG2      ILE  28  -3.064  -8.622 -14.588
  221   3HG2  ILE  28          3HG2      ILE  28  -4.538  -7.716 -14.238
  222   1HD1  ILE  28          1HD1      ILE  28  -7.459  -7.479 -17.374
  223   2HD1  ILE  28          2HD1      ILE  28  -7.002  -8.965 -16.541
  224   3HD1  ILE  28          3HD1      ILE  28  -6.634  -8.767 -18.255
  225    H    GLN  29           H        GLN  29  -2.769  -9.188 -19.548
  226    HA   GLN  29           HA       GLN  29  -5.066  -9.563 -21.008
  227   1HB   GLN  29          2HB       GLN  29  -2.940  -8.962 -22.036
  228   2HB   GLN  29          1HB       GLN  29  -2.278 -10.550 -21.654
  229   1HG   GLN  29          2HG       GLN  29  -3.845 -11.636 -23.129
  230   2HG   GLN  29          1HG       GLN  29  -4.726 -10.130 -23.386
  231   1HE2  GLN  29          1HE2      GLN  29  -3.050  -8.249 -24.154
  232   2HE2  GLN  29          2HE2      GLN  29  -2.016  -8.728 -25.411
  233    H    ASP  30           H        ASP  30  -2.979 -12.064 -19.612
  234    HA   ASP  30           HA       ASP  30  -4.862 -14.143 -20.535
  235   1HB   ASP  30          2HB       ASP  30  -2.030 -14.415 -19.496
  236   2HB   ASP  30          1HB       ASP  30  -3.050 -15.744 -20.049
  237    H    ALA  31           H        ALA  31  -5.111 -12.293 -18.106
  238    HA   ALA  31           HA       ALA  31  -5.123 -14.283 -15.938
  239   1HB   ALA  31          1HB       ALA  31  -4.105 -11.936 -15.657
  240   2HB   ALA  31          2HB       ALA  31  -5.222 -12.490 -14.410
  241   3HB   ALA  31          3HB       ALA  31  -5.770 -11.354 -15.643
  242    H    GLU  32           H        GLU  32  -6.984 -14.584 -14.650
  243    HA   GLU  32           HA       GLU  32  -9.538 -13.716 -15.865
  244   1HB   GLU  32          2HB       GLU  32 -10.474 -15.972 -15.278
  245   2HB   GLU  32          1HB       GLU  32  -9.259 -16.013 -16.554
  246   1HG   GLU  32          2HG       GLU  32  -7.778 -17.190 -15.283
  247   2HG   GLU  32          1HG       GLU  32  -8.171 -16.289 -13.819
  248    H    ASP  33           H        ASP  33  -8.255 -12.438 -13.728
  249    HA   ASP  33           HA       ASP  33 -10.192 -12.945 -11.569
  250   1HB   ASP  33          2HB       ASP  33  -7.198 -12.812 -11.265
  251   2HB   ASP  33          1HB       ASP  33  -8.289 -12.468  -9.923
  252    H    GLY  34           H        GLY  34  -7.625 -10.775 -12.744
  253   1HA   GLY  34          2HA       GLY  34  -8.259  -8.460 -13.296
  254   2HA   GLY  34          1HA       GLY  34  -9.270  -8.473 -11.853
  255    H    CYS  35           H        CYS  35  -5.961  -9.671 -12.319
  256    HA   CYS  35           HA       CYS  35  -4.799  -7.493 -10.783
  257   1HB   CYS  35          2HB       CYS  35  -3.813  -9.029  -9.076
  258   2HB   CYS  35          1HB       CYS  35  -5.563  -8.866  -8.945
  259    HG   CYS  35           HG       CYS  35  -5.817 -11.207 -10.103
  260    H    ILE  36           H        ILE  36  -2.557  -7.375 -10.956
  261    HA   ILE  36           HA       ILE  36  -1.417  -9.024 -13.110
  262    HB   ILE  36           HB       ILE  36   0.308  -7.356 -13.321
  263   1HG1  ILE  36          2HG1      ILE  36  -0.252  -5.279 -11.586
  264   2HG1  ILE  36          1HG1      ILE  36  -0.521  -6.697 -10.572
  265   1HG2  ILE  36          1HG2      ILE  36  -1.198  -5.211 -13.433
  266   2HG2  ILE  36          2HG2      ILE  36  -2.502  -6.332 -13.039
  267   3HG2  ILE  36          3HG2      ILE  36  -1.544  -6.571 -14.500
  268   1HD1  ILE  36          1HD1      ILE  36   1.705  -7.568 -11.180
  269   2HD1  ILE  36          2HD1      ILE  36   1.838  -5.963 -10.461
  270   3HD1  ILE  36          3HD1      ILE  36   1.978  -6.162 -12.208
  271    H    SER  37           H        SER  37   1.022  -9.492 -12.791
  272    HA   SER  37           HA       SER  37   1.271 -10.886 -10.226
  273   1HB   SER  37          2HB       SER  37   1.881 -11.699 -12.753
  274   2HB   SER  37          1HB       SER  37   3.453 -11.131 -12.200
  275    HG   SER  37           HG       SER  37   1.906 -13.265 -11.346
  276    H    THR  38           H        THR  38   2.213  -9.849  -8.594
  277    HA   THR  38           HA       THR  38   3.656  -7.458  -8.711
  278    HB   THR  38           HB       THR  38   4.461  -7.989  -6.443
  279    HG1  THR  38           HG1      THR  38   4.712  -9.988  -5.930
  280   1HG2  THR  38          1HG2      THR  38   2.293  -7.132  -6.371
  281   2HG2  THR  38          2HG2      THR  38   2.112  -8.660  -5.509
  282   3HG2  THR  38          3HG2      THR  38   1.607  -8.532  -7.194
  283    H    LYS  39           H        LYS  39   4.760 -10.805  -8.914
  284    HA   LYS  39           HA       LYS  39   7.547 -10.339  -8.774
  285   1HB   LYS  39          2HB       LYS  39   7.785 -12.538  -9.881
  286   2HB   LYS  39          1HB       LYS  39   6.614 -12.599  -8.565
  287   1HG   LYS  39          2HG       LYS  39   4.767 -12.376 -10.185
  288   2HG   LYS  39          1HG       LYS  39   5.930 -12.293 -11.507
  289   1HD   LYS  39          2HD       LYS  39   6.796 -14.568 -10.497
  290   2HD   LYS  39          1HD       LYS  39   5.181 -14.636  -9.791
  291   1HE   LYS  39          2HE       LYS  39   4.327 -14.112 -12.176
  292   2HE   LYS  39          1HE       LYS  39   5.947 -14.559 -12.709
  293   1HZ   LYS  39          1HZ       LYS  39   4.092 -16.261 -11.134
  294   2HZ   LYS  39          2HZ       LYS  39   5.674 -16.692 -11.580
  295   3HZ   LYS  39          3HZ       LYS  39   4.486 -16.460 -12.771
  296    H    GLU  40           H        GLU  40   5.221 -10.070 -11.395
  297    HA   GLU  40           HA       GLU  40   7.371  -9.450 -13.314
  298   1HB   GLU  40          2HB       GLU  40   4.443 -10.117 -13.677
  299   2HB   GLU  40          1HB       GLU  40   5.460  -9.523 -14.989
  300   1HG   GLU  40          2HG       GLU  40   6.349 -11.879 -13.336
  301   2HG   GLU  40          1HG       GLU  40   5.209 -12.105 -14.663
  302    H    LEU  41           H        LEU  41   6.256  -7.670 -11.073
  303    HA   LEU  41           HA       LEU  41   4.847  -5.537 -12.381
  304   1HB   LEU  41          2HB       LEU  41   4.814  -6.069  -9.902
  305   2HB   LEU  41          1HB       LEU  41   6.410  -5.355  -9.814
  306    HG   LEU  41           HG       LEU  41   4.390  -3.638 -11.101
  307   1HD1  LEU  41          1HD1      LEU  41   3.869  -3.208  -8.396
  308   2HD1  LEU  41          2HD1      LEU  41   3.814  -4.962  -8.564
  309   3HD1  LEU  41          3HD1      LEU  41   2.770  -3.948  -9.561
  310   1HD2  LEU  41          1HD2      LEU  41   5.466  -2.208  -9.085
  311   2HD2  LEU  41          2HD2      LEU  41   6.303  -2.455 -10.618
  312   3HD2  LEU  41          3HD2      LEU  41   6.699  -3.462  -9.225
  313    H    GLY  42           H        GLY  42   8.140  -6.491 -12.306
  314   1HA   GLY  42          2HA       GLY  42   9.508  -4.044 -12.398
  315   2HA   GLY  42          1HA       GLY  42  10.056  -5.539 -13.143
  316    H    LYS  43           H        LYS  43   7.370  -5.484 -14.704
  317    HA   LYS  43           HA       LYS  43   8.429  -4.065 -16.999
  318   1HB   LYS  43          2HB       LYS  43   5.883  -5.661 -16.642
  319   2HB   LYS  43          1HB       LYS  43   6.460  -5.003 -18.173
  320   1HG   LYS  43          2HG       LYS  43   8.291  -6.735 -16.540
  321   2HG   LYS  43          1HG       LYS  43   7.033  -7.489 -17.521
  322   1HD   LYS  43          2HD       LYS  43   7.959  -5.863 -19.391
  323   2HD   LYS  43          1HD       LYS  43   9.415  -5.893 -18.395
  324   1HE   LYS  43          2HE       LYS  43   8.083  -8.497 -19.028
  325   2HE   LYS  43          1HE       LYS  43   9.019  -7.712 -20.298
  326   1HZ   LYS  43          1HZ       LYS  43  10.375  -9.225 -18.979
  327   2HZ   LYS  43          2HZ       LYS  43  10.013  -8.348 -17.570
  328   3HZ   LYS  43          3HZ       LYS  43  10.915  -7.625 -18.815
  329    H    VAL  44           H        VAL  44   6.103  -3.447 -14.478
  330    HA   VAL  44           HA       VAL  44   4.780  -1.349 -16.026
  331    HB   VAL  44           HB       VAL  44   3.083  -1.345 -14.501
  332   1HG1  VAL  44          1HG1      VAL  44   3.737  -3.863 -13.227
  333   2HG1  VAL  44          2HG1      VAL  44   4.132  -3.910 -14.944
  334   3HG1  VAL  44          3HG1      VAL  44   2.496  -3.506 -14.428
  335   1HG2  VAL  44          1HG2      VAL  44   4.152  -0.460 -12.583
  336   2HG2  VAL  44          2HG2      VAL  44   5.199  -1.869 -12.409
  337   3HG2  VAL  44          3HG2      VAL  44   3.481  -1.995 -12.038
  338    H    MET  45           H        MET  45   7.035  -1.704 -13.328
  339    HA   MET  45           HA       MET  45   7.090   0.967 -12.465
  340   1HB   MET  45          2HB       MET  45   9.474   0.438 -11.726
  341   2HB   MET  45          1HB       MET  45   8.208  -0.601 -11.078
  342   1HG   MET  45          2HG       MET  45   9.463  -2.327 -11.823
  343   2HG   MET  45          1HG       MET  45   8.906  -1.883 -13.434
  344   1HE   MET  45          1HE       MET  45  11.484  -3.348 -12.238
  345   2HE   MET  45          2HE       MET  45  11.935  -2.155 -11.023
  346   3HE   MET  45          3HE       MET  45  13.009  -2.463 -12.385
  347    H    ARG  46           H        ARG  46   8.639  -0.596 -15.210
  348    HA   ARG  46           HA       ARG  46  10.321   1.673 -15.834
  349   1HB   ARG  46          2HB       ARG  46   9.560  -0.614 -17.660
  350   2HB   ARG  46          1HB       ARG  46  10.927   0.484 -17.837
  351   1HG   ARG  46          2HG       ARG  46  11.991  -0.396 -15.861
  352   2HG   ARG  46          1HG       ARG  46  10.564  -1.349 -15.456
  353   1HD   ARG  46          2HD       ARG  46  11.499  -3.043 -16.607
  354   2HD   ARG  46          1HD       ARG  46  11.155  -2.120 -18.066
  355    HE   ARG  46           HE       ARG  46  13.637  -1.344 -16.818
  356   1HH1  ARG  46          2HH1      ARG  46  12.102  -3.664 -18.934
  357   2HH1  ARG  46          1HH1      ARG  46  13.565  -4.052 -19.772
  358   1HH2  ARG  46          1HH2      ARG  46  15.541  -1.874 -17.930
  359   2HH2  ARG  46          2HH2      ARG  46  15.506  -3.045 -19.206
  360    H    MET  47           H        MET  47   7.117   0.547 -16.678
  361    HA   MET  47           HA       MET  47   6.770   2.365 -18.900
  362   1HB   MET  47          2HB       MET  47   5.003   0.445 -17.422
  363   2HB   MET  47          1HB       MET  47   4.273   1.676 -18.455
  364   1HG   MET  47          2HG       MET  47   6.507  -0.110 -19.433
  365   2HG   MET  47          1HG       MET  47   4.812  -0.576 -19.565
  366   1HE   MET  47          1HE       MET  47   7.421   0.456 -21.825
  367   2HE   MET  47          2HE       MET  47   7.653   1.592 -20.498
  368   3HE   MET  47          3HE       MET  47   7.247   2.194 -22.102
  369    H    LEU  48           H        LEU  48   6.178   2.417 -15.446
  370    HA   LEU  48           HA       LEU  48   4.353   4.599 -15.362
  371   1HB   LEU  48          2HB       LEU  48   6.096   3.175 -13.433
  372   2HB   LEU  48          1HB       LEU  48   5.627   4.802 -12.998
  373    HG   LEU  48           HG       LEU  48   3.298   4.206 -12.987
  374   1HD1  LEU  48          1HD1      LEU  48   3.733   1.332 -13.565
  375   2HD1  LEU  48          2HD1      LEU  48   3.904   2.411 -14.949
  376   3HD1  LEU  48          3HD1      LEU  48   2.398   2.384 -14.033
  377   1HD2  LEU  48          1HD2      LEU  48   3.701   1.884 -11.549
  378   2HD2  LEU  48          2HD2      LEU  48   3.875   3.515 -10.901
  379   3HD2  LEU  48          3HD2      LEU  48   5.291   2.644 -11.489
  380    H    GLY  49           H        GLY  49   7.823   4.346 -15.613
  381   1HA   GLY  49          2HA       GLY  49   8.914   6.286 -16.731
  382   2HA   GLY  49          1HA       GLY  49   8.052   7.303 -15.583
  383    H    GLN  50           H        GLN  50   9.387   4.243 -14.528
  384    HA   GLN  50           HA       GLN  50  11.644   5.651 -13.230
  385   1HB   GLN  50          2HB       GLN  50  10.076   3.421 -11.917
  386   2HB   GLN  50          1HB       GLN  50  11.286   4.471 -11.182
  387   1HG   GLN  50          2HG       GLN  50   8.654   5.479 -12.303
  388   2HG   GLN  50          1HG       GLN  50   8.900   5.072 -10.606
  389   1HE2  GLN  50          1HE2      GLN  50   8.506   7.765 -12.166
  390   2HE2  GLN  50          2HE2      GLN  50   9.737   8.749 -11.536
  391    H    ASN  51           H        ASN  51  13.230   3.918 -12.304
  392    HA   ASN  51           HA       ASN  51  13.336   1.472 -13.901
  393   1HB   ASN  51          2HB       ASN  51  15.768   2.023 -14.532
  394   2HB   ASN  51          1HB       ASN  51  14.497   2.829 -15.446
  395   1HD2  ASN  51          1HD2      ASN  51  15.606   4.792 -15.932
  396   2HD2  ASN  51          2HD2      ASN  51  16.153   5.869 -14.738
  397    HA   PRO  52           HA       PRO  52  15.263   1.342  -9.588
  398   1HB   PRO  52          2HB       PRO  52  13.272  -0.028  -8.301
  399   2HB   PRO  52          1HB       PRO  52  13.358   1.738  -8.389
  400   1HG   PRO  52          2HG       PRO  52  11.604  -0.144  -9.867
  401   2HG   PRO  52          1HG       PRO  52  11.291   1.520  -9.349
  402   1HD   PRO  52          2HD       PRO  52  11.979   0.734 -11.954
  403   2HD   PRO  52          1HD       PRO  52  12.076   2.388 -11.314
  404    H    THR  53           H        THR  53  14.872  -0.980  -8.106
  405    HA   THR  53           HA       THR  53  15.890  -3.070  -9.936
  406    HB   THR  53           HB       THR  53  17.238  -3.849  -8.191
  407    HG1  THR  53           HG1      THR  53  16.620  -3.859  -6.160
  408   1HG2  THR  53          1HG2      THR  53  17.799  -1.474  -8.848
  409   2HG2  THR  53          2HG2      THR  53  18.382  -1.965  -7.258
  410   3HG2  THR  53          3HG2      THR  53  16.945  -0.950  -7.395
  411    HA   PRO  54           HA       PRO  54  12.543  -5.777  -8.914
  412   1HB   PRO  54          2HB       PRO  54  13.719  -8.161  -8.245
  413   2HB   PRO  54          1HB       PRO  54  13.616  -7.535  -9.898
  414   1HG   PRO  54          2HG       PRO  54  15.945  -7.619  -8.054
  415   2HG   PRO  54          1HG       PRO  54  15.900  -7.706  -9.822
  416   1HD   PRO  54          2HD       PRO  54  16.580  -5.440  -8.331
  417   2HD   PRO  54          1HD       PRO  54  16.100  -5.429 -10.043
  418    H    GLU  55           H        GLU  55  15.019  -5.510  -6.445
  419    HA   GLU  55           HA       GLU  55  13.372  -6.597  -4.318
  420   1HB   GLU  55          2HB       GLU  55  16.104  -5.386  -4.504
  421   2HB   GLU  55          1HB       GLU  55  15.292  -5.385  -2.939
  422   1HG   GLU  55          2HG       GLU  55  15.490  -7.891  -4.614
  423   2HG   GLU  55          1HG       GLU  55  16.767  -7.426  -3.491
  424    H    GLU  56           H        GLU  56  14.283  -3.447  -5.625
  425    HA   GLU  56           HA       GLU  56  13.183  -1.834  -3.559
  426   1HB   GLU  56          2HB       GLU  56  14.749  -1.260  -5.643
  427   2HB   GLU  56          1HB       GLU  56  13.197  -0.853  -6.376
  428   1HG   GLU  56          2HG       GLU  56  12.714   0.542  -4.305
  429   2HG   GLU  56          1HG       GLU  56  14.400   0.300  -3.849
  430    H    LEU  57           H        LEU  57  11.895  -2.833  -6.752
  431    HA   LEU  57           HA       LEU  57   9.372  -1.603  -6.470
  432   1HB   LEU  57          2HB       LEU  57   8.661  -2.893  -8.322
  433   2HB   LEU  57          1HB       LEU  57  10.330  -2.465  -8.605
  434    HG   LEU  57           HG       LEU  57  10.771  -4.870  -7.573
  435   1HD1  LEU  57          1HD1      LEU  57   8.677  -6.154  -8.819
  436   2HD1  LEU  57          2HD1      LEU  57   7.865  -4.778  -8.072
  437   3HD1  LEU  57          3HD1      LEU  57   8.798  -5.898  -7.078
  438   1HD2  LEU  57          1HD2      LEU  57   9.729  -4.343 -10.375
  439   2HD2  LEU  57          2HD2      LEU  57  10.664  -5.761  -9.898
  440   3HD2  LEU  57          3HD2      LEU  57  11.398  -4.159  -9.834
  441    H    GLN  58           H        GLN  58  10.584  -4.764  -5.436
  442    HA   GLN  58           HA       GLN  58   8.094  -5.928  -4.759
  443   1HB   GLN  58          2HB       GLN  58  10.906  -6.543  -4.313
  444   2HB   GLN  58          1HB       GLN  58   9.918  -6.941  -2.907
  445   1HG   GLN  58          2HG       GLN  58   9.268  -7.796  -5.744
  446   2HG   GLN  58          1HG       GLN  58  10.081  -8.819  -4.560
  447   1HE2  GLN  58          1HE2      GLN  58   6.987  -7.760  -5.672
  448   2HE2  GLN  58          2HE2      GLN  58   6.060  -8.444  -4.428
  449    H    GLU  59           H        GLU  59  10.356  -3.898  -2.917
  450    HA   GLU  59           HA       GLU  59   9.061  -4.025  -0.414
  451   1HB   GLU  59          2HB       GLU  59  10.817  -1.934  -1.696
  452   2HB   GLU  59          1HB       GLU  59  10.132  -1.704  -0.088
  453   1HG   GLU  59          2HG       GLU  59  11.716  -4.169  -0.854
  454   2HG   GLU  59          1HG       GLU  59  12.460  -2.736  -0.145
  455    H    MET  60           H        MET  60   8.510  -1.984  -3.254
  456    HA   MET  60           HA       MET  60   6.630  -0.216  -2.045
  457   1HB   MET  60          2HB       MET  60   6.811  -0.994  -4.967
  458   2HB   MET  60          1HB       MET  60   6.041   0.447  -4.305
  459   1HG   MET  60          2HG       MET  60   8.403   0.908  -3.265
  460   2HG   MET  60          1HG       MET  60   8.965  -0.207  -4.510
  461   1HE   MET  60          1HE       MET  60   8.458   3.558  -3.869
  462   2HE   MET  60          2HE       MET  60   6.927   2.735  -3.582
  463   3HE   MET  60          3HE       MET  60   7.060   3.899  -4.898
  464    H    ILE  61           H        ILE  61   6.366  -3.244  -3.820
  465    HA   ILE  61           HA       ILE  61   3.526  -3.353  -3.937
  466    HB   ILE  61           HB       ILE  61   5.587  -5.572  -4.044
  467   1HG1  ILE  61          2HG1      ILE  61   3.994  -4.535  -6.369
  468   2HG1  ILE  61          1HG1      ILE  61   5.391  -3.610  -5.814
  469   1HG2  ILE  61          1HG2      ILE  61   3.839  -6.994  -4.886
  470   2HG2  ILE  61          2HG2      ILE  61   2.694  -5.655  -4.945
  471   3HG2  ILE  61          3HG2      ILE  61   3.237  -6.285  -3.389
  472   1HD1  ILE  61          1HD1      ILE  61   6.863  -5.482  -6.156
  473   2HD1  ILE  61          2HD1      ILE  61   5.900  -5.304  -7.624
  474   3HD1  ILE  61          3HD1      ILE  61   5.506  -6.566  -6.458
  475    H    ASP  62           H        ASP  62   5.892  -4.855  -1.728
  476    HA   ASP  62           HA       ASP  62   4.105  -6.228  -0.071
  477   1HB   ASP  62          2HB       ASP  62   6.827  -5.037   0.401
  478   2HB   ASP  62          1HB       ASP  62   5.938  -5.793   1.723
  479    H    GLU  63           H        GLU  63   4.935  -2.807  -0.149
  480    HA   GLU  63           HA       GLU  63   3.646  -2.242   2.392
  481   1HB   GLU  63          2HB       GLU  63   4.925  -0.510   0.280
  482   2HB   GLU  63          1HB       GLU  63   4.075   0.170   1.668
  483   1HG   GLU  63          2HG       GLU  63   6.137  -1.948   2.161
  484   2HG   GLU  63          1HG       GLU  63   6.684  -0.316   1.780
  485    H    VAL  64           H        VAL  64   2.956  -1.614  -1.062
  486    HA   VAL  64           HA       VAL  64   0.493  -0.243  -0.522
  487    HB   VAL  64           HB       VAL  64   1.799   0.159  -2.583
  488   1HG1  VAL  64          1HG1      VAL  64   0.744  -2.464  -3.633
  489   2HG1  VAL  64          2HG1      VAL  64   2.311  -2.374  -2.831
  490   3HG1  VAL  64          3HG1      VAL  64   2.019  -1.442  -4.297
  491   1HG2  VAL  64          1HG2      VAL  64  -0.084   0.594  -3.859
  492   2HG2  VAL  64          2HG2      VAL  64  -0.845   0.287  -2.298
  493   3HG2  VAL  64          3HG2      VAL  64  -0.805  -0.981  -3.524
  494    H    ASP  65           H        ASP  65   1.290  -3.580  -1.483
  495    HA   ASP  65           HA       ASP  65  -1.395  -4.434  -1.848
  496   1HB   ASP  65          2HB       ASP  65   1.133  -5.574  -2.193
  497   2HB   ASP  65          1HB       ASP  65   0.382  -6.547  -0.933
  498    H    GLU  66           H        GLU  66  -2.871  -4.361  -0.310
  499    HA   GLU  66           HA       GLU  66  -2.355  -4.250   2.476
  500   1HB   GLU  66          2HB       GLU  66  -4.945  -5.105   1.159
  501   2HB   GLU  66          1HB       GLU  66  -4.746  -4.437   2.778
  502   1HG   GLU  66          2HG       GLU  66  -3.677  -2.800   0.536
  503   2HG   GLU  66          1HG       GLU  66  -5.431  -2.924   0.647
  504    H    ASP  67           H        ASP  67  -3.459  -6.875   0.369
  505    HA   ASP  67           HA       ASP  67  -3.394  -8.807   2.547
  506   1HB   ASP  67          2HB       ASP  67  -3.944 -10.440   0.632
  507   2HB   ASP  67          1HB       ASP  67  -5.164  -9.242   1.061
  508    H    GLY  68           H        GLY  68  -1.500  -8.050  -0.354
  509   1HA   GLY  68          2HA       GLY  68   0.691  -8.582  -0.876
  510   2HA   GLY  68          1HA       GLY  68   0.857  -9.274   0.738
  511    H    SER  69           H        SER  69  -1.289 -10.019  -1.998
  512    HA   SER  69           HA       SER  69  -0.811 -12.872  -1.640
  513   1HB   SER  69          2HB       SER  69  -2.584 -13.116  -3.369
  514   2HB   SER  69          1HB       SER  69  -3.100 -12.156  -1.985
  515    HG   SER  69           HG       SER  69  -3.393 -10.552  -3.305
  516    H    GLY  70           H        GLY  70   1.066 -10.697  -3.117
  517   1HA   GLY  70          2HA       GLY  70   2.733 -10.943  -4.694
  518   2HA   GLY  70          1HA       GLY  70   2.184 -12.596  -4.956
  519    H    THR  71           H        THR  71  -0.206 -10.109  -5.151
  520    HA   THR  71           HA       THR  71   0.032  -9.845  -8.055
  521    HB   THR  71           HB       THR  71  -2.224 -10.558  -8.504
  522    HG1  THR  71           HG1      THR  71  -3.655 -10.622  -6.980
  523   1HG2  THR  71          1HG2      THR  71  -0.869 -12.550  -6.660
  524   2HG2  THR  71          2HG2      THR  71  -0.550 -12.361  -8.386
  525   3HG2  THR  71          3HG2      THR  71  -2.125 -12.936  -7.838
  526    H    VAL  72           H        VAL  72  -0.539  -7.853  -8.727
  527    HA   VAL  72           HA       VAL  72  -1.677  -6.028  -6.710
  528    HB   VAL  72           HB       VAL  72  -0.490  -5.189  -9.347
  529   1HG1  VAL  72          1HG1      VAL  72  -0.657  -3.784  -6.668
  530   2HG1  VAL  72          2HG1      VAL  72  -1.859  -3.600  -7.946
  531   3HG1  VAL  72          3HG1      VAL  72  -0.196  -3.074  -8.215
  532   1HG2  VAL  72          1HG2      VAL  72   1.624  -4.779  -8.021
  533   2HG2  VAL  72          2HG2      VAL  72   1.260  -6.485  -8.289
  534   3HG2  VAL  72          3HG2      VAL  72   0.925  -5.745  -6.722
  535    H    ASP  73           H        ASP  73  -3.764  -5.627  -6.838
  536    HA   ASP  73           HA       ASP  73  -5.290  -6.161  -9.256
  537   1HB   ASP  73          2HB       ASP  73  -6.098  -4.994  -6.572
  538   2HB   ASP  73          1HB       ASP  73  -7.220  -5.340  -7.887
  539    H    PHE  74           H        PHE  74  -6.769  -4.391 -10.125
  540    HA   PHE  74           HA       PHE  74  -5.250  -2.172 -10.932
  541   1HB   PHE  74          2HB       PHE  74  -7.366  -3.052 -12.050
  542   2HB   PHE  74          1HB       PHE  74  -8.268  -2.147 -10.833
  543    HD1  PHE  74           HD1      PHE  74  -5.085  -1.380 -12.646
  544    HD2  PHE  74           HD2      PHE  74  -9.156  -0.250 -11.891
  545    HE1  PHE  74           HE1      PHE  74  -4.751   0.691 -13.953
  546    HE2  PHE  74           HE2      PHE  74  -8.821   1.827 -13.202
  547    HZ   PHE  74           HZ       PHE  74  -6.620   2.298 -14.236
  548    H    ASP  75           H        ASP  75  -7.400  -2.625  -8.183
  549    HA   ASP  75           HA       ASP  75  -7.564   0.109  -7.398
  550   1HB   ASP  75          2HB       ASP  75  -8.945  -1.973  -6.581
  551   2HB   ASP  75          1HB       ASP  75  -7.643  -2.134  -5.403
  552    H    GLU  76           H        GLU  76  -5.412  -2.580  -6.499
  553    HA   GLU  76           HA       GLU  76  -3.828  -1.066  -4.651
  554   1HB   GLU  76          2HB       GLU  76  -3.042  -3.583  -6.147
  555   2HB   GLU  76          1HB       GLU  76  -2.301  -2.955  -4.676
  556   1HG   GLU  76          2HG       GLU  76  -4.441  -3.257  -3.469
  557   2HG   GLU  76          1HG       GLU  76  -5.174  -3.896  -4.939
  558    H    PHE  77           H        PHE  77  -3.761  -1.635  -8.099
  559    HA   PHE  77           HA       PHE  77  -1.119  -0.820  -8.679
  560   1HB   PHE  77          2HB       PHE  77  -3.132  -1.899 -10.131
  561   2HB   PHE  77          1HB       PHE  77  -3.266  -0.227 -10.647
  562    HD1  PHE  77           HD1      PHE  77  -2.704  -1.083 -12.922
  563    HD2  PHE  77           HD2      PHE  77   0.085  -1.318  -9.653
  564    HE1  PHE  77           HE1      PHE  77  -0.843  -1.438 -14.519
  565    HE2  PHE  77           HE2      PHE  77   1.932  -1.664 -11.256
  566    HZ   PHE  77           HZ       PHE  77   1.471  -1.729 -13.691
  567    H    LEU  78           H        LEU  78  -4.202   0.971  -8.861
  568    HA   LEU  78           HA       LEU  78  -2.943   3.491  -9.429
  569   1HB   LEU  78          2HB       LEU  78  -5.711   2.570  -8.823
  570   2HB   LEU  78          1HB       LEU  78  -5.346   4.273  -8.611
  571    HG   LEU  78           HG       LEU  78  -4.839   4.534 -10.938
  572   1HD1  LEU  78          1HD1      LEU  78  -3.594   2.413 -11.222
  573   2HD1  LEU  78          2HD1      LEU  78  -4.789   2.640 -12.497
  574   3HD1  LEU  78          3HD1      LEU  78  -5.116   1.524 -11.171
  575   1HD2  LEU  78          1HD2      LEU  78  -7.223   4.513 -10.463
  576   2HD2  LEU  78          2HD2      LEU  78  -7.259   2.751 -10.533
  577   3HD2  LEU  78          3HD2      LEU  78  -6.954   3.685 -11.998
  578    H    VAL  79           H        VAL  79  -3.871   1.776  -6.526
  579    HA   VAL  79           HA       VAL  79  -3.917   3.928  -4.700
  580    HB   VAL  79           HB       VAL  79  -3.694   0.972  -4.531
  581   1HG1  VAL  79          1HG1      VAL  79  -1.794   1.681  -3.121
  582   2HG1  VAL  79          2HG1      VAL  79  -3.102   1.003  -2.151
  583   3HG1  VAL  79          3HG1      VAL  79  -2.867   2.750  -2.219
  584   1HG2  VAL  79          1HG2      VAL  79  -5.791   2.441  -4.342
  585   2HG2  VAL  79          2HG2      VAL  79  -5.181   2.916  -2.757
  586   3HG2  VAL  79          3HG2      VAL  79  -5.563   1.226  -3.083
  587    H    MET  80           H        MET  80  -1.306   1.791  -5.799
  588    HA   MET  80           HA       MET  80   0.811   2.538  -4.221
  589   1HB   MET  80          2HB       MET  80   0.507   1.130  -6.604
  590   2HB   MET  80          1HB       MET  80   1.607   2.444  -7.024
  591   1HG   MET  80          2HG       MET  80   3.156   1.820  -5.318
  592   2HG   MET  80          1HG       MET  80   1.989   0.739  -4.559
  593   1HE   MET  80          1HE       MET  80   4.293   1.540  -7.406
  594   2HE   MET  80          2HE       MET  80   2.896   1.234  -8.434
  595   3HE   MET  80          3HE       MET  80   4.275   0.141  -8.487
  596    H    MET  81           H        MET  81  -0.665   4.393  -6.844
  597    HA   MET  81           HA       MET  81   1.396   6.342  -7.110
  598   1HB   MET  81          2HB       MET  81  -0.461   5.939  -8.769
  599   2HB   MET  81          1HB       MET  81  -1.553   6.756  -7.651
  600   1HG   MET  81          2HG       MET  81  -0.781   8.798  -8.236
  601   2HG   MET  81          1HG       MET  81   0.900   8.282  -8.110
  602   1HE   MET  81          1HE       MET  81   1.758   6.675 -11.392
  603   2HE   MET  81          2HE       MET  81   1.739   6.417  -9.650
  604   3HE   MET  81          3HE       MET  81   2.442   7.894 -10.307
  605    H    VAL  82           H        VAL  82  -1.758   6.498  -5.418
  606    HA   VAL  82           HA       VAL  82  -1.218   9.001  -4.158
  607    HB   VAL  82           HB       VAL  82  -3.166   8.443  -2.702
  608   1HG1  VAL  82          1HG1      VAL  82  -3.640   9.556  -4.766
  609   2HG1  VAL  82          2HG1      VAL  82  -4.803   8.235  -4.645
  610   3HG1  VAL  82          3HG1      VAL  82  -3.397   8.077  -5.696
  611   1HG2  VAL  82          1HG2      VAL  82  -4.396   6.385  -3.053
  612   2HG2  VAL  82          2HG2      VAL  82  -2.727   5.961  -2.671
  613   3HG2  VAL  82          3HG2      VAL  82  -3.294   5.893  -4.339
  614    H    ARG  83           H        ARG  83  -0.506   5.688  -3.319
  615    HA   ARG  83           HA       ARG  83  -0.087   5.889  -0.558
  616   1HB   ARG  83          2HB       ARG  83   1.182   4.157  -2.674
  617   2HB   ARG  83          1HB       ARG  83   1.642   4.031  -0.976
  618   1HG   ARG  83          2HG       ARG  83  -1.275   4.030  -1.579
  619   2HG   ARG  83          1HG       ARG  83  -0.369   2.586  -2.030
  620   1HD   ARG  83          2HD       ARG  83   0.339   2.199   0.198
  621   2HD   ARG  83          1HD       ARG  83  -0.102   3.825   0.709
  622    HE   ARG  83           HE       ARG  83  -2.479   2.721  -0.091
  623   1HH1  ARG  83          2HH1      ARG  83   0.047   1.787   2.133
  624   2HH1  ARG  83          1HH1      ARG  83  -1.024   0.924   3.182
  625   1HH2  ARG  83          1HH2      ARG  83  -3.864   1.586   1.298
  626   2HH2  ARG  83          2HH2      ARG  83  -3.233   0.810   2.712
  627    H    CYS  84           H        CYS  84   1.861   7.035  -3.235
  628    HA   CYS  84           HA       CYS  84   4.274   7.409  -1.710
  629   1HB   CYS  84          2HB       CYS  84   3.988   7.213  -4.300
  630   2HB   CYS  84          1HB       CYS  84   3.645   8.941  -4.218
  631    HG   CYS  84           HG       CYS  84   6.037   9.121  -2.916
  632    H    MET  85           H        MET  85   1.517   9.428  -2.657
  633    HA   MET  85           HA       MET  85   2.584  11.886  -1.659
  634   1HB   MET  85          2HB       MET  85  -0.100  10.943  -2.583
  635   2HB   MET  85          1HB       MET  85  -0.021  12.421  -1.623
  636   1HG   MET  85          2HG       MET  85   0.178  13.126  -3.893
  637   2HG   MET  85          1HG       MET  85   1.810  13.200  -3.233
  638   1HE   MET  85          1HE       MET  85  -0.814  11.145  -4.935
  639   2HE   MET  85          2HE       MET  85   0.006  10.312  -6.252
  640   3HE   MET  85          3HE       MET  85  -0.161  12.065  -6.298
  641    H    LYS  86           H        LYS  86  -0.175   9.965  -0.406
  642    HA   LYS  86           HA       LYS  86   0.328  11.060   2.275
  643   1HB   LYS  86          2HB       LYS  86  -2.019  10.590   0.911
  644   2HB   LYS  86          1HB       LYS  86  -1.911   9.177   1.961
  645   1HG   LYS  86          2HG       LYS  86  -1.176  11.211   3.668
  646   2HG   LYS  86          1HG       LYS  86  -2.388  12.000   2.658
  647   1HD   LYS  86          2HD       LYS  86  -4.093  10.662   3.417
  648   2HD   LYS  86          1HD       LYS  86  -3.041   9.262   3.630
  649   1HE   LYS  86          2HE       LYS  86  -2.078  10.255   5.650
  650   2HE   LYS  86          1HE       LYS  86  -3.042  11.713   5.420
  651   1HZ   LYS  86          1HZ       LYS  86  -4.026  10.166   7.031
  652   2HZ   LYS  86          2HZ       LYS  86  -4.159   8.988   5.813
  653   3HZ   LYS  86          3HZ       LYS  86  -5.043  10.435   5.701
  654    H    ASP  87           H        ASP  87  -0.699   8.977   3.845
  655    HA   ASP  87           HA       ASP  87  -0.060   7.066   4.940
  656   1HB   ASP  87          2HB       ASP  87  -0.684   6.016   2.741
  657   2HB   ASP  87          1HB       ASP  87   1.006   6.147   2.257
  658    H    ASP  88           H        ASP  88   1.469   8.178   6.195
  659    HA   ASP  88           HA       ASP  88   4.238   8.309   5.270
  660   1HB   ASP  88          2HB       ASP  88   2.901   9.205   7.835
  661   2HB   ASP  88          1HB       ASP  88   4.630   9.363   7.525
  662    H    SER  89           HN       SER  89   4.348   5.933   5.077
  663    HA   SER  89           HA       SER  89   4.382   4.370   7.522
  664   1HB   SER  89          2HB       SER  89   5.192   2.537   5.983
  665   2HB   SER  89          1HB       SER  89   3.627   3.220   5.556
  666    HG   SER  89           HG       SER  89   4.470   4.022   3.787
  Start of MODEL   30
    1   1H    MET   1          1H        MET   1  -6.539  10.878  10.487
    2   2H    MET   1          2H        MET   1  -7.899  11.857  10.772
    3   3H    MET   1          3H        MET   1  -6.568  12.475   9.915
    4    HA   MET   1           HA       MET   1  -8.361  10.286   9.009
    5   1HB   MET   1          2HB       MET   1  -8.314  13.223   8.615
    6   2HB   MET   1          1HB       MET   1  -8.523  12.272   7.144
    7   1HG   MET   1          2HG       MET   1 -10.480  11.206   7.985
    8   2HG   MET   1          1HG       MET   1 -10.165  11.758   9.630
    9   1HE   MET   1          1HE       MET   1 -12.568  11.682   7.953
   10   2HE   MET   1          2HE       MET   1 -13.277  13.205   7.420
   11   3HE   MET   1          3HE       MET   1 -13.182  12.841   9.141
   12    H    ASN   2           H        ASN   2  -7.239   8.871   7.849
   13    HA   ASN   2           HA       ASN   2  -4.911   9.818   6.274
   14   1HB   ASN   2          2HB       ASN   2  -5.427   7.027   7.341
   15   2HB   ASN   2          1HB       ASN   2  -3.998   7.559   6.458
   16   1HD2  ASN   2          1HD2      ASN   2  -5.845   8.287   9.465
   17   2HD2  ASN   2          2HD2      ASN   2  -4.483   8.772  10.357
   18    H    ASP   3           H        ASP   3  -7.746   9.834   5.488
   19    HA   ASP   3           HA       ASP   3  -8.060   7.673   3.575
   20   1HB   ASP   3          2HB       ASP   3 -10.192   8.721   3.030
   21   2HB   ASP   3          1HB       ASP   3 -10.014   8.603   4.780
   22    H    ILE   4           H        ILE   4  -6.259  10.478   3.517
   23    HA   ILE   4           HA       ILE   4  -6.808  11.684   1.071
   24    HB   ILE   4           HB       ILE   4  -4.589  12.587   1.079
   25   1HG1  ILE   4          2HG1      ILE   4  -3.435  10.374   1.552
   26   2HG1  ILE   4          1HG1      ILE   4  -2.771  11.757   2.413
   27   1HG2  ILE   4          1HG2      ILE   4  -4.601  12.728   3.906
   28   2HG2  ILE   4          2HG2      ILE   4  -6.284  12.581   3.401
   29   3HG2  ILE   4          3HG2      ILE   4  -5.283  13.884   2.763
   30   1HD1  ILE   4          1HD1      ILE   4  -4.389  11.049   4.331
   31   2HD1  ILE   4          2HD1      ILE   4  -2.918  10.111   4.084
   32   3HD1  ILE   4          3HD1      ILE   4  -4.461   9.504   3.485
   33    H    TYR   5           H        TYR   5  -5.147   8.658   1.690
   34    HA   TYR   5           HA       TYR   5  -3.921   8.377  -0.868
   35   1HB   TYR   5          2HB       TYR   5  -4.752   6.309   1.183
   36   2HB   TYR   5          1HB       TYR   5  -3.861   5.924  -0.289
   37    HD1  TYR   5           HD1      TYR   5  -1.532   6.594  -0.575
   38    HD2  TYR   5           HD2      TYR   5  -3.719   7.639   2.973
   39    HE1  TYR   5           HE1      TYR   5   0.587   7.228   0.548
   40    HE2  TYR   5           HE2      TYR   5  -1.602   8.272   4.093
   41    HH   TYR   5           HH       TYR   5   0.927   9.090   2.915
   42    H    LYS   6           H        LYS   6  -6.936   7.039   0.494
   43    HA   LYS   6           HA       LYS   6  -7.780   5.979  -2.065
   44   1HB   LYS   6          2HB       LYS   6  -9.099   6.148   0.645
   45   2HB   LYS   6          1HB       LYS   6  -9.932   5.517  -0.776
   46   1HG   LYS   6          2HG       LYS   6  -8.691   3.599  -0.819
   47   2HG   LYS   6          1HG       LYS   6  -7.217   4.422  -0.310
   48   1HD   LYS   6          2HD       LYS   6  -8.604   4.667   1.969
   49   2HD   LYS   6          1HD       LYS   6  -9.384   3.213   1.349
   50   1HE   LYS   6          2HE       LYS   6  -6.834   2.519   0.888
   51   2HE   LYS   6          1HE       LYS   6  -6.568   3.620   2.239
   52   1HZ   LYS   6          1HZ       LYS   6  -6.913   1.384   3.034
   53   2HZ   LYS   6          2HZ       LYS   6  -8.400   1.282   2.220
   54   3HZ   LYS   6          3HZ       LYS   6  -8.209   2.365   3.517
   55    H    ALA   7           H        ALA   7  -7.946   9.045  -0.579
   56    HA   ALA   7           HA       ALA   7 -10.466   9.910  -1.652
   57   1HB   ALA   7          1HB       ALA   7  -8.101  11.416  -0.525
   58   2HB   ALA   7          2HB       ALA   7  -9.641  11.083   0.267
   59   3HB   ALA   7          3HB       ALA   7  -9.573  12.208  -1.090
   60    H    ALA   8           H        ALA   8  -7.131   9.879  -2.781
   61    HA   ALA   8           HA       ALA   8  -7.608  11.692  -4.979
   62   1HB   ALA   8          1HB       ALA   8  -5.365  11.488  -4.013
   63   2HB   ALA   8          2HB       ALA   8  -5.350  11.033  -5.716
   64   3HB   ALA   8          3HB       ALA   8  -5.312   9.786  -4.471
   65    H    VAL   9           H        VAL   9  -7.252   8.169  -4.615
   66    HA   VAL   9           HA       VAL   9  -7.496   7.553  -7.373
   67    HB   VAL   9           HB       VAL   9  -6.597   5.998  -5.618
   68   1HG1  VAL   9          1HG1      VAL   9  -8.418   6.407  -3.956
   69   2HG1  VAL   9          2HG1      VAL   9  -8.158   4.695  -4.282
   70   3HG1  VAL   9          3HG1      VAL   9  -9.530   5.531  -5.008
   71   1HG2  VAL   9          1HG2      VAL   9  -8.899   4.734  -7.113
   72   2HG2  VAL   9          2HG2      VAL   9  -7.313   4.045  -6.762
   73   3HG2  VAL   9          3HG2      VAL   9  -7.470   5.337  -7.952
   74    H    GLU  10           H        GLU  10  -9.878   8.296  -4.922
   75    HA   GLU  10           HA       GLU  10 -12.088   7.215  -6.446
   76   1HB   GLU  10          2HB       GLU  10 -13.503   8.051  -4.689
   77   2HB   GLU  10          1HB       GLU  10 -12.088   7.309  -3.947
   78   1HG   GLU  10          2HG       GLU  10 -11.129   9.393  -3.404
   79   2HG   GLU  10          1HG       GLU  10 -12.158  10.267  -4.535
   80    H    GLN  11           H        GLN  11 -10.328  10.204  -6.396
   81    HA   GLN  11           HA       GLN  11 -12.398  11.373  -8.155
   82   1HB   GLN  11          2HB       GLN  11 -12.051  13.569  -7.216
   83   2HB   GLN  11          1HB       GLN  11 -12.443  12.455  -5.908
   84   1HG   GLN  11          2HG       GLN  11  -9.801  12.192  -5.787
   85   2HG   GLN  11          1HG       GLN  11  -9.832  13.777  -6.556
   86   1HE2  GLN  11          1HE2      GLN  11  -9.045  14.853  -4.601
   87   2HE2  GLN  11          2HE2      GLN  11 -10.042  15.042  -3.241
   88    H    LEU  12           H        LEU  12  -9.892   9.906  -8.768
   89    HA   LEU  12           HA       LEU  12  -8.000  11.869  -9.729
   90   1HB   LEU  12          2HB       LEU  12  -7.183   9.763 -11.068
   91   2HB   LEU  12          1HB       LEU  12  -6.868   9.926  -9.358
   92    HG   LEU  12           HG       LEU  12  -8.639   8.364  -8.834
   93   1HD1  LEU  12          1HD1      LEU  12 -10.229   9.001 -10.600
   94   2HD1  LEU  12          2HD1      LEU  12  -9.934   7.263 -10.631
   95   3HD1  LEU  12          3HD1      LEU  12  -9.160   8.309 -11.821
   96   1HD2  LEU  12          1HD2      LEU  12  -7.658   6.374  -9.738
   97   2HD2  LEU  12          2HD2      LEU  12  -6.352   7.550  -9.607
   98   3HD2  LEU  12          3HD2      LEU  12  -7.094   7.227 -11.174
   99    H    THR  13           H        THR  13  -7.294  11.470 -12.185
  100    HA   THR  13           HA       THR  13  -9.627  12.282 -13.748
  101    HB   THR  13           HB       THR  13  -7.580  12.351 -15.528
  102    HG1  THR  13           HG1      THR  13  -5.968  11.744 -14.203
  103   1HG2  THR  13          1HG2      THR  13  -7.903  14.590 -15.402
  104   2HG2  THR  13          2HG2      THR  13  -7.603  14.639 -13.664
  105   3HG2  THR  13          3HG2      THR  13  -9.184  14.152 -14.274
  106    H    ASP  14           H        ASP  14  -9.876  11.467 -15.969
  107    HA   ASP  14           HA       ASP  14 -10.116   8.620 -16.016
  108   1HB   ASP  14          2HB       ASP  14 -11.505  10.387 -17.322
  109   2HB   ASP  14          1HB       ASP  14 -10.181  10.344 -18.485
  110    H    GLU  15           H        GLU  15  -7.732  10.931 -17.146
  111    HA   GLU  15           HA       GLU  15  -6.297   9.234 -18.910
  112   1HB   GLU  15          2HB       GLU  15  -5.689  11.779 -17.460
  113   2HB   GLU  15          1HB       GLU  15  -4.356  10.877 -18.180
  114   1HG   GLU  15          2HG       GLU  15  -6.862  11.561 -19.728
  115   2HG   GLU  15          1HG       GLU  15  -5.464  12.635 -19.679
  116    H    GLN  16           H        GLN  16  -6.224   9.677 -15.414
  117    HA   GLN  16           HA       GLN  16  -3.793   8.216 -14.978
  118   1HB   GLN  16          2HB       GLN  16  -5.946   9.361 -13.278
  119   2HB   GLN  16          1HB       GLN  16  -5.048   8.000 -12.601
  120   1HG   GLN  16          2HG       GLN  16  -2.986   9.138 -12.723
  121   2HG   GLN  16          1HG       GLN  16  -3.606  10.314 -13.883
  122   1HE2  GLN  16          1HE2      GLN  16  -4.817   9.202 -10.661
  123   2HE2  GLN  16          2HE2      GLN  16  -4.944  10.768 -10.017
  124    H    LYS  17           H        LYS  17  -7.261   7.450 -14.898
  125    HA   LYS  17           HA       LYS  17  -7.081   4.785 -14.007
  126   1HB   LYS  17          2HB       LYS  17  -9.085   6.069 -15.888
  127   2HB   LYS  17          1HB       LYS  17  -9.265   4.461 -15.192
  128   1HG   LYS  17          2HG       LYS  17  -9.047   7.055 -13.634
  129   2HG   LYS  17          1HG       LYS  17 -10.516   6.108 -13.870
  130   1HD   LYS  17          2HD       LYS  17  -8.799   4.211 -12.891
  131   2HD   LYS  17          1HD       LYS  17  -8.262   5.651 -12.028
  132   1HE   LYS  17          2HE       LYS  17  -9.958   5.009 -10.605
  133   2HE   LYS  17          1HE       LYS  17 -10.908   5.977 -11.731
  134   1HZ   LYS  17          1HZ       LYS  17 -11.233   3.846 -13.012
  135   2HZ   LYS  17          2HZ       LYS  17 -12.032   3.946 -11.516
  136   3HZ   LYS  17          3HZ       LYS  17 -10.608   3.032 -11.661
  137    H    ASN  18           H        ASN  18  -7.002   6.191 -17.276
  138    HA   ASN  18           HA       ASN  18  -6.671   3.664 -18.605
  139   1HB   ASN  18          2HB       ASN  18  -6.621   6.528 -19.408
  140   2HB   ASN  18          1HB       ASN  18  -5.767   5.389 -20.449
  141   1HD2  ASN  18          1HD2      ASN  18  -8.927   6.475 -19.427
  142   2HD2  ASN  18          2HD2      ASN  18  -9.822   5.406 -20.394
  143    H    GLU  19           H        GLU  19  -4.500   6.046 -17.219
  144    HA   GLU  19           HA       GLU  19  -2.097   5.401 -18.488
  145   1HB   GLU  19          2HB       GLU  19  -2.410   7.299 -16.896
  146   2HB   GLU  19          1HB       GLU  19  -2.439   6.138 -15.569
  147   1HG   GLU  19          2HG       GLU  19  -0.174   5.349 -16.261
  148   2HG   GLU  19          1HG       GLU  19  -0.145   6.608 -17.496
  149    H    PHE  20           H        PHE  20  -3.560   3.967 -15.562
  150    HA   PHE  20           HA       PHE  20  -1.480   1.919 -15.460
  151   1HB   PHE  20          2HB       PHE  20  -3.772   2.690 -13.684
  152   2HB   PHE  20          1HB       PHE  20  -2.998   1.117 -13.505
  153    HD1  PHE  20           HD1      PHE  20  -2.489   4.775 -13.325
  154    HD2  PHE  20           HD2      PHE  20  -0.737   0.911 -12.676
  155    HE1  PHE  20           HE1      PHE  20  -0.640   5.829 -12.058
  156    HE2  PHE  20           HE2      PHE  20   1.109   1.953 -11.399
  157    HZ   PHE  20           HZ       PHE  20   1.163   4.419 -11.092
  158    H    LYS  21           H        LYS  21  -4.998   2.130 -16.012
  159    HA   LYS  21           HA       LYS  21  -5.565  -0.595 -16.223
  160   1HB   LYS  21          2HB       LYS  21  -7.293   1.167 -16.155
  161   2HB   LYS  21          1HB       LYS  21  -6.851   1.649 -17.791
  162   1HG   LYS  21          2HG       LYS  21  -7.376  -1.235 -17.512
  163   2HG   LYS  21          1HG       LYS  21  -8.776  -0.224 -17.158
  164   1HD   LYS  21          2HD       LYS  21  -7.092   0.174 -19.639
  165   2HD   LYS  21          1HD       LYS  21  -8.476  -0.919 -19.606
  166   1HE   LYS  21          2HE       LYS  21  -9.719   1.177 -18.580
  167   2HE   LYS  21          1HE       LYS  21  -8.420   2.071 -19.369
  168   1HZ   LYS  21          1HZ       LYS  21 -10.270   0.151 -20.677
  169   2HZ   LYS  21          2HZ       LYS  21  -8.981   0.944 -21.449
  170   3HZ   LYS  21          3HZ       LYS  21 -10.294   1.838 -20.847
  171    H    ALA  22           H        ALA  22  -4.180   1.606 -18.628
  172    HA   ALA  22           HA       ALA  22  -4.433  -0.054 -20.906
  173   1HB   ALA  22          1HB       ALA  22  -2.311   1.991 -20.209
  174   2HB   ALA  22          2HB       ALA  22  -3.772   2.271 -21.158
  175   3HB   ALA  22          3HB       ALA  22  -2.490   1.242 -21.795
  176    H    ALA  23           H        ALA  23  -1.726   0.383 -18.635
  177    HA   ALA  23           HA       ALA  23  -0.090  -1.692 -19.688
  178   1HB   ALA  23          1HB       ALA  23  -0.009  -0.838 -16.801
  179   2HB   ALA  23          2HB       ALA  23   0.534   0.260 -18.070
  180   3HB   ALA  23          3HB       ALA  23   1.325  -1.301 -17.860
  181    H    PHE  24           H        PHE  24  -2.584  -1.530 -17.217
  182    HA   PHE  24           HA       PHE  24  -2.235  -4.069 -16.036
  183   1HB   PHE  24          2HB       PHE  24  -3.833  -2.003 -15.468
  184   2HB   PHE  24          1HB       PHE  24  -4.992  -2.967 -16.378
  185    HD1  PHE  24           HD1      PHE  24  -4.398  -5.706 -15.717
  186    HD2  PHE  24           HD2      PHE  24  -4.247  -2.246 -13.194
  187    HE1  PHE  24           HE1      PHE  24  -4.771  -7.142 -13.736
  188    HE2  PHE  24           HE2      PHE  24  -4.614  -3.677 -11.210
  189    HZ   PHE  24           HZ       PHE  24  -4.885  -6.121 -11.484
  190    H    ASP  25           H        ASP  25  -4.302  -2.995 -18.729
  191    HA   ASP  25           HA       ASP  25  -5.576  -5.428 -19.285
  192   1HB   ASP  25          2HB       ASP  25  -6.028  -3.072 -20.248
  193   2HB   ASP  25          1HB       ASP  25  -4.812  -3.489 -21.455
  194    H    ILE  26           H        ILE  26  -2.529  -4.131 -20.609
  195    HA   ILE  26           HA       ILE  26  -2.102  -6.359 -22.363
  196    HB   ILE  26           HB       ILE  26   0.193  -5.430 -22.636
  197   1HG1  ILE  26          2HG1      ILE  26  -0.753  -3.310 -20.680
  198   2HG1  ILE  26          1HG1      ILE  26   0.392  -4.585 -20.274
  199   1HG2  ILE  26          1HG2      ILE  26  -2.034  -3.371 -22.744
  200   2HG2  ILE  26          2HG2      ILE  26  -1.723  -4.597 -23.973
  201   3HG2  ILE  26          3HG2      ILE  26  -0.536  -3.328 -23.676
  202   1HD1  ILE  26          1HD1      ILE  26   1.060  -3.073 -22.718
  203   2HD1  ILE  26          2HD1      ILE  26   2.097  -3.577 -21.384
  204   3HD1  ILE  26          3HD1      ILE  26   1.106  -2.126 -21.231
  205    H    PHE  27           H        PHE  27  -1.031  -5.564 -19.085
  206    HA   PHE  27           HA       PHE  27   0.814  -7.769 -18.911
  207   1HB   PHE  27          2HB       PHE  27  -0.406  -6.058 -16.730
  208   2HB   PHE  27          1HB       PHE  27   0.893  -7.225 -16.493
  209    HD1  PHE  27           HD1      PHE  27   2.147  -6.572 -19.345
  210    HD2  PHE  27           HD2      PHE  27   0.993  -4.184 -15.961
  211    HE1  PHE  27           HE1      PHE  27   3.790  -4.844 -20.006
  212    HE2  PHE  27           HE2      PHE  27   2.643  -2.454 -16.630
  213    HZ   PHE  27           HZ       PHE  27   4.039  -2.785 -18.649
  214    H    ILE  28           H        ILE  28  -2.578  -7.253 -18.029
  215    HA   ILE  28           HA       ILE  28  -2.682 -10.059 -17.104
  216    HB   ILE  28           HB       ILE  28  -3.363  -8.079 -15.548
  217   1HG1  ILE  28          2HG1      ILE  28  -5.069  -9.508 -14.492
  218   2HG1  ILE  28          1HG1      ILE  28  -5.169 -10.473 -15.965
  219   1HG2  ILE  28          1HG2      ILE  28  -5.446  -7.105 -15.782
  220   2HG2  ILE  28          2HG2      ILE  28  -6.080  -8.434 -16.750
  221   3HG2  ILE  28          3HG2      ILE  28  -4.983  -7.259 -17.478
  222   1HD1  ILE  28          1HD1      ILE  28  -2.584 -10.049 -14.450
  223   2HD1  ILE  28          2HD1      ILE  28  -2.896 -11.209 -15.740
  224   3HD1  ILE  28          3HD1      ILE  28  -3.652 -11.423 -14.160
  225    H    GLN  29           H        GLN  29  -2.600  -9.611 -19.798
  226    HA   GLN  29           HA       GLN  29  -5.249  -9.550 -20.947
  227   1HB   GLN  29          2HB       GLN  29  -3.280  -8.702 -22.178
  228   2HB   GLN  29          1HB       GLN  29  -2.607 -10.332 -22.202
  229   1HG   GLN  29          2HG       GLN  29  -4.443 -11.150 -23.534
  230   2HG   GLN  29          1HG       GLN  29  -5.322  -9.630 -23.353
  231   1HE2  GLN  29          1HE2      GLN  29  -4.191  -7.645 -24.328
  232   2HE2  GLN  29          2HE2      GLN  29  -3.246  -7.880 -25.717
  233    H    ASP  30           H        ASP  30  -2.747 -12.056 -20.470
  234    HA   ASP  30           HA       ASP  30  -4.494 -14.140 -21.473
  235   1HB   ASP  30          2HB       ASP  30  -1.731 -14.211 -20.255
  236   2HB   ASP  30          1HB       ASP  30  -2.592 -15.649 -20.803
  237    H    ALA  31           H        ALA  31  -4.448 -12.580 -18.521
  238    HA   ALA  31           HA       ALA  31  -5.023 -15.023 -16.982
  239   1HB   ALA  31          1HB       ALA  31  -5.120 -12.363 -15.664
  240   2HB   ALA  31          2HB       ALA  31  -3.540 -12.917 -16.223
  241   3HB   ALA  31          3HB       ALA  31  -4.465 -13.892 -15.081
  242    H    GLU  32           H        GLU  32  -6.908 -15.158 -15.679
  243    HA   GLU  32           HA       GLU  32  -9.189 -13.559 -16.694
  244   1HB   GLU  32          2HB       GLU  32  -9.034 -16.491 -15.975
  245   2HB   GLU  32          1HB       GLU  32 -10.567 -15.629 -16.111
  246   1HG   GLU  32          2HG       GLU  32  -8.517 -15.578 -18.332
  247   2HG   GLU  32          1HG       GLU  32  -9.728 -16.854 -18.218
  248    H    ASP  33           H        ASP  33  -7.588 -12.791 -14.476
  249    HA   ASP  33           HA       ASP  33  -9.524 -13.128 -12.261
  250   1HB   ASP  33          2HB       ASP  33  -7.136 -14.224 -12.063
  251   2HB   ASP  33          1HB       ASP  33  -6.635 -12.572 -11.702
  252    H    GLY  34           H        GLY  34  -6.887 -11.048 -13.489
  253   1HA   GLY  34          2HA       GLY  34  -7.279  -8.721 -14.006
  254   2HA   GLY  34          1HA       GLY  34  -8.499  -8.686 -12.739
  255    H    CYS  35           H        CYS  35  -5.208 -10.039 -12.598
  256    HA   CYS  35           HA       CYS  35  -4.313  -7.838 -10.874
  257   1HB   CYS  35          2HB       CYS  35  -3.930 -10.659  -9.898
  258   2HB   CYS  35          1HB       CYS  35  -3.756  -9.151  -9.006
  259    HG   CYS  35           HG       CYS  35  -6.137  -9.322  -8.381
  260    H    ILE  36           H        ILE  36  -2.287  -7.297 -11.418
  261    HA   ILE  36           HA       ILE  36  -0.805  -8.970 -13.265
  262    HB   ILE  36           HB       ILE  36   0.747  -7.176 -13.477
  263   1HG1  ILE  36          2HG1      ILE  36   0.052  -5.143 -11.735
  264   2HG1  ILE  36          1HG1      ILE  36  -0.106  -6.579 -10.722
  265   1HG2  ILE  36          1HG2      ILE  36  -1.934  -5.867 -12.952
  266   2HG2  ILE  36          2HG2      ILE  36  -1.568  -6.805 -14.399
  267   3HG2  ILE  36          3HG2      ILE  36  -0.679  -5.320 -14.061
  268   1HD1  ILE  36          1HD1      ILE  36   2.170  -7.274 -11.283
  269   2HD1  ILE  36          2HD1      ILE  36   2.201  -5.623 -10.673
  270   3HD1  ILE  36          3HD1      ILE  36   2.335  -5.924 -12.405
  271    H    SER  37           H        SER  37   1.620  -9.255 -12.864
  272    HA   SER  37           HA       SER  37   1.907 -10.677 -10.334
  273   1HB   SER  37          2HB       SER  37   2.744 -11.334 -12.803
  274   2HB   SER  37          1HB       SER  37   4.187 -10.498 -12.234
  275    HG   SER  37           HG       SER  37   4.071 -12.794 -11.740
  276    H    THR  38           H        THR  38   2.459  -9.505  -8.622
  277    HA   THR  38           HA       THR  38   3.669  -7.004  -8.537
  278    HB   THR  38           HB       THR  38   4.261  -7.507  -6.194
  279    HG1  THR  38           HG1      THR  38   3.371 -10.121  -6.843
  280   1HG2  THR  38          1HG2      THR  38   1.567  -8.198  -7.301
  281   2HG2  THR  38          2HG2      THR  38   2.050  -6.823  -6.308
  282   3HG2  THR  38          3HG2      THR  38   1.862  -8.416  -5.576
  283    H    LYS  39           H        LYS  39   5.172 -10.214  -8.447
  284    HA   LYS  39           HA       LYS  39   7.832  -9.400  -7.988
  285   1HB   LYS  39          2HB       LYS  39   8.486 -11.586  -8.882
  286   2HB   LYS  39          1HB       LYS  39   7.094 -11.753  -7.814
  287   1HG   LYS  39          2HG       LYS  39   5.722 -11.457 -10.054
  288   2HG   LYS  39          1HG       LYS  39   7.226 -11.991 -10.803
  289   1HD   LYS  39          2HD       LYS  39   6.398 -13.595  -8.470
  290   2HD   LYS  39          1HD       LYS  39   5.293 -13.681  -9.842
  291   1HE   LYS  39          2HE       LYS  39   6.801 -14.778 -11.159
  292   2HE   LYS  39          1HE       LYS  39   8.172 -13.868 -10.522
  293   1HZ   LYS  39          1HZ       LYS  39   8.235 -16.209  -9.876
  294   2HZ   LYS  39          2HZ       LYS  39   6.742 -16.040  -9.083
  295   3HZ   LYS  39          3HZ       LYS  39   8.106 -15.195  -8.523
  296    H    GLU  40           H        GLU  40   5.873  -9.386 -10.889
  297    HA   GLU  40           HA       GLU  40   8.210  -8.712 -12.547
  298   1HB   GLU  40          2HB       GLU  40   5.361  -9.351 -13.349
  299   2HB   GLU  40          1HB       GLU  40   6.690  -9.027 -14.461
  300   1HG   GLU  40          2HG       GLU  40   7.929 -10.961 -13.518
  301   2HG   GLU  40          1HG       GLU  40   6.559 -11.304 -12.462
  302    H    LEU  41           H        LEU  41   6.755  -6.872 -10.547
  303    HA   LEU  41           HA       LEU  41   5.258  -4.895 -11.806
  304   1HB   LEU  41          2HB       LEU  41   6.464  -5.224  -9.309
  305   2HB   LEU  41          1HB       LEU  41   7.149  -3.744  -9.936
  306    HG   LEU  41           HG       LEU  41   5.235  -3.185  -8.600
  307   1HD1  LEU  41          1HD1      LEU  41   5.446  -1.813 -10.586
  308   2HD1  LEU  41          2HD1      LEU  41   3.730  -2.137 -10.324
  309   3HD1  LEU  41          3HD1      LEU  41   4.618  -3.025 -11.564
  310   1HD2  LEU  41          1HD2      LEU  41   4.002  -5.446 -10.112
  311   2HD2  LEU  41          2HD2      LEU  41   2.949  -4.118  -9.625
  312   3HD2  LEU  41          3HD2      LEU  41   3.851  -5.021  -8.408
  313    H    GLY  42           H        GLY  42   8.627  -5.605 -12.245
  314   1HA   GLY  42          2HA       GLY  42   9.762  -3.165 -12.885
  315   2HA   GLY  42          1HA       GLY  42  10.214  -4.690 -13.634
  316    H    LYS  43           H        LYS  43   7.563  -5.133 -14.858
  317    HA   LYS  43           HA       LYS  43   7.981  -3.742 -17.314
  318   1HB   LYS  43          2HB       LYS  43   5.911  -4.806 -18.066
  319   2HB   LYS  43          1HB       LYS  43   6.911  -5.976 -17.206
  320   1HG   LYS  43          2HG       LYS  43   5.571  -5.480 -15.129
  321   2HG   LYS  43          1HG       LYS  43   4.502  -4.493 -16.120
  322   1HD   LYS  43          2HD       LYS  43   3.373  -6.498 -16.244
  323   2HD   LYS  43          1HD       LYS  43   4.457  -6.695 -17.620
  324   1HE   LYS  43          2HE       LYS  43   6.096  -7.755 -15.926
  325   2HE   LYS  43          1HE       LYS  43   4.698  -7.881 -14.859
  326   1HZ   LYS  43          1HZ       LYS  43   4.859  -9.893 -16.075
  327   2HZ   LYS  43          2HZ       LYS  43   5.022  -9.076 -17.555
  328   3HZ   LYS  43          3HZ       LYS  43   3.543  -9.040 -16.718
  329    H    VAL  44           H        VAL  44   6.119  -3.059 -14.465
  330    HA   VAL  44           HA       VAL  44   4.544  -0.973 -15.780
  331    HB   VAL  44           HB       VAL  44   4.537  -1.519 -12.824
  332   1HG1  VAL  44          1HG1      VAL  44   2.467  -0.454 -12.882
  333   2HG1  VAL  44          2HG1      VAL  44   2.196  -0.848 -14.580
  334   3HG1  VAL  44          3HG1      VAL  44   3.344   0.413 -14.139
  335   1HG2  VAL  44          1HG2      VAL  44   4.274  -3.694 -14.118
  336   2HG2  VAL  44          2HG2      VAL  44   2.826  -2.996 -14.845
  337   3HG2  VAL  44          3HG2      VAL  44   2.896  -3.261 -13.104
  338    H    MET  45           H        MET  45   6.988  -1.375 -13.245
  339    HA   MET  45           HA       MET  45   7.249   1.239 -12.363
  340   1HB   MET  45          2HB       MET  45   9.291  -0.960 -12.680
  341   2HB   MET  45          1HB       MET  45   9.706   0.604 -11.981
  342   1HG   MET  45          2HG       MET  45   7.296  -0.841 -10.936
  343   2HG   MET  45          1HG       MET  45   8.895  -1.388 -10.433
  344   1HE   MET  45          1HE       MET  45   6.396   1.783  -8.783
  345   2HE   MET  45          2HE       MET  45   6.069   0.475  -9.917
  346   3HE   MET  45          3HE       MET  45   6.578   2.050 -10.522
  347    H    ARG  46           H        ARG  46   8.816  -0.327 -15.150
  348    HA   ARG  46           HA       ARG  46  10.368   1.924 -15.932
  349   1HB   ARG  46          2HB       ARG  46  10.641   0.782 -18.077
  350   2HB   ARG  46          1HB       ARG  46  10.830  -0.361 -16.749
  351   1HG   ARG  46          2HG       ARG  46   8.353  -0.915 -17.053
  352   2HG   ARG  46          1HG       ARG  46   8.434  -0.006 -18.561
  353   1HD   ARG  46          2HD       ARG  46  10.644  -1.638 -18.747
  354   2HD   ARG  46          1HD       ARG  46   9.490  -2.674 -17.919
  355    HE   ARG  46           HE       ARG  46   8.214  -2.744 -19.865
  356   1HH1  ARG  46          2HH1      ARG  46  10.635  -0.233 -20.089
  357   2HH1  ARG  46          1HH1      ARG  46  10.346   0.067 -21.768
  358   1HH2  ARG  46          1HH2      ARG  46   7.856  -2.329 -22.066
  359   2HH2  ARG  46          2HH2      ARG  46   8.780  -1.113 -22.883
  360    H    MET  47           H        MET  47   7.045   0.982 -16.575
  361    HA   MET  47           HA       MET  47   6.622   2.966 -18.641
  362   1HB   MET  47          2HB       MET  47   4.783   1.115 -17.120
  363   2HB   MET  47          1HB       MET  47   4.175   2.320 -18.255
  364   1HG   MET  47          2HG       MET  47   6.349   0.398 -19.073
  365   2HG   MET  47          1HG       MET  47   4.653  -0.077 -19.146
  366   1HE   MET  47          1HE       MET  47   7.487   1.647 -20.186
  367   2HE   MET  47          2HE       MET  47   7.090   2.934 -21.322
  368   3HE   MET  47          3HE       MET  47   7.213   1.272 -21.893
  369    H    LEU  48           H        LEU  48   6.211   2.736 -15.168
  370    HA   LEU  48           HA       LEU  48   4.560   5.078 -14.892
  371   1HB   LEU  48          2HB       LEU  48   5.995   3.226 -13.048
  372   2HB   LEU  48          1HB       LEU  48   5.523   4.796 -12.439
  373    HG   LEU  48           HG       LEU  48   3.278   4.266 -12.438
  374   1HD1  LEU  48          1HD1      LEU  48   2.381   2.346 -13.904
  375   2HD1  LEU  48          2HD1      LEU  48   3.936   2.412 -14.732
  376   3HD1  LEU  48          3HD1      LEU  48   2.875   3.820 -14.736
  377   1HD2  LEU  48          1HD2      LEU  48   3.200   1.608 -12.055
  378   2HD2  LEU  48          2HD2      LEU  48   3.910   2.702 -10.866
  379   3HD2  LEU  48          3HD2      LEU  48   4.951   1.832 -11.993
  380    H    GLY  49           H        GLY  49   7.986   4.410 -15.008
  381   1HA   GLY  49          2HA       GLY  49   9.442   6.269 -15.693
  382   2HA   GLY  49          1HA       GLY  49   8.550   7.288 -14.570
  383    H    GLN  50           H        GLN  50   9.507   3.988 -13.804
  384    HA   GLN  50           HA       GLN  50  11.640   4.993 -12.020
  385   1HB   GLN  50          2HB       GLN  50   9.689   2.831 -11.206
  386   2HB   GLN  50          1HB       GLN  50  10.886   3.639 -10.199
  387   1HG   GLN  50          2HG       GLN  50   8.556   5.075 -11.503
  388   2HG   GLN  50          1HG       GLN  50   8.516   4.448  -9.857
  389   1HE2  GLN  50          1HE2      GLN  50   8.614   7.329 -11.079
  390   2HE2  GLN  50          2HE2      GLN  50   9.842   8.081 -10.183
  391    H    ASN  51           H        ASN  51  13.143   3.286 -11.325
  392    HA   ASN  51           HA       ASN  51  13.150   0.824 -12.906
  393   1HB   ASN  51          2HB       ASN  51  14.394   2.811 -14.115
  394   2HB   ASN  51          1HB       ASN  51  15.673   2.445 -12.958
  395   1HD2  ASN  51          1HD2      ASN  51  15.326   1.917 -16.018
  396   2HD2  ASN  51          2HD2      ASN  51  15.737   0.278 -16.174
  397    HA   PRO  52           HA       PRO  52  15.033   0.466  -8.658
  398   1HB   PRO  52          2HB       PRO  52  13.012  -0.920  -7.449
  399   2HB   PRO  52          1HB       PRO  52  13.085   0.847  -7.510
  400   1HG   PRO  52          2HG       PRO  52  11.327  -1.009  -8.978
  401   2HG   PRO  52          1HG       PRO  52  11.080   0.696  -8.577
  402   1HD   PRO  52          2HD       PRO  52  11.908  -0.381 -11.097
  403   2HD   PRO  52          1HD       PRO  52  11.793   1.335 -10.647
  404    H    THR  53           H        THR  53  14.618  -1.893  -7.254
  405    HA   THR  53           HA       THR  53  15.534  -3.970  -9.157
  406    HB   THR  53           HB       THR  53  16.969  -4.806  -7.507
  407    HG1  THR  53           HG1      THR  53  16.478  -4.820  -5.447
  408   1HG2  THR  53          1HG2      THR  53  18.131  -2.892  -6.475
  409   2HG2  THR  53          2HG2      THR  53  16.762  -1.854  -6.872
  410   3HG2  THR  53          3HG2      THR  53  17.729  -2.570  -8.162
  411    HA   PRO  54           HA       PRO  54  12.162  -6.561  -7.953
  412   1HB   PRO  54          2HB       PRO  54  13.289  -8.997  -7.390
  413   2HB   PRO  54          1HB       PRO  54  13.092  -8.349  -9.026
  414   1HG   PRO  54          2HG       PRO  54  15.542  -8.524  -7.349
  415   2HG   PRO  54          1HG       PRO  54  15.369  -8.615  -9.108
  416   1HD   PRO  54          2HD       PRO  54  16.245  -6.371  -7.703
  417   2HD   PRO  54          1HD       PRO  54  15.602  -6.342  -9.361
  418    H    GLU  55           H        GLU  55  14.818  -6.452  -5.663
  419    HA   GLU  55           HA       GLU  55  13.261  -7.481  -3.438
  420   1HB   GLU  55          2HB       GLU  55  16.002  -6.211  -3.625
  421   2HB   GLU  55          1HB       GLU  55  15.271  -6.707  -2.099
  422   1HG   GLU  55          2HG       GLU  55  15.450  -8.956  -2.580
  423   2HG   GLU  55          1HG       GLU  55  15.298  -8.704  -4.319
  424    H    GLU  56           H        GLU  56  14.283  -4.353  -4.734
  425    HA   GLU  56           HA       GLU  56  13.324  -2.803  -2.517
  426   1HB   GLU  56          2HB       GLU  56  15.096  -2.131  -4.272
  427   2HB   GLU  56          1HB       GLU  56  13.722  -1.732  -5.302
  428   1HG   GLU  56          2HG       GLU  56  14.036   0.307  -4.245
  429   2HG   GLU  56          1HG       GLU  56  12.896  -0.445  -3.129
  430    H    LEU  57           H        LEU  57  12.050  -3.525  -5.784
  431    HA   LEU  57           HA       LEU  57   9.719  -1.957  -5.569
  432   1HB   LEU  57          2HB       LEU  57   8.914  -3.071  -7.475
  433   2HB   LEU  57          1HB       LEU  57  10.644  -2.960  -7.673
  434    HG   LEU  57           HG       LEU  57  10.621  -5.407  -6.696
  435   1HD1  LEU  57          1HD1      LEU  57   8.310  -6.255  -7.963
  436   2HD1  LEU  57          2HD1      LEU  57   7.780  -4.788  -7.140
  437   3HD1  LEU  57          3HD1      LEU  57   8.511  -6.102  -6.219
  438   1HD2  LEU  57          1HD2      LEU  57  11.321  -4.736  -8.982
  439   2HD2  LEU  57          2HD2      LEU  57   9.633  -4.752  -9.493
  440   3HD2  LEU  57          3HD2      LEU  57  10.419  -6.253  -9.003
  441    H    GLN  58           H        GLN  58  10.441  -5.226  -4.446
  442    HA   GLN  58           HA       GLN  58   7.804  -6.088  -3.929
  443   1HB   GLN  58          2HB       GLN  58  10.506  -6.909  -3.093
  444   2HB   GLN  58          1HB       GLN  58   9.237  -7.284  -1.928
  445   1HG   GLN  58          2HG       GLN  58   8.956  -7.935  -4.868
  446   2HG   GLN  58          1HG       GLN  58   9.691  -9.059  -3.724
  447   1HE2  GLN  58          1HE2      GLN  58   6.650  -7.740  -4.843
  448   2HE2  GLN  58          2HE2      GLN  58   5.655  -8.616  -3.781
  449    H    GLU  59           H        GLU  59   9.985  -4.013  -2.086
  450    HA   GLU  59           HA       GLU  59   8.617  -4.042   0.386
  451   1HB   GLU  59          2HB       GLU  59  10.448  -2.047  -0.927
  452   2HB   GLU  59          1HB       GLU  59   9.681  -1.694   0.620
  453   1HG   GLU  59          2HG       GLU  59  10.857  -3.344   1.741
  454   2HG   GLU  59          1HG       GLU  59  11.049  -4.337   0.296
  455    H    MET  60           H        MET  60   8.370  -1.729  -2.347
  456    HA   MET  60           HA       MET  60   6.290  -0.202  -1.163
  457   1HB   MET  60          2HB       MET  60   5.931   0.767  -3.385
  458   2HB   MET  60          1HB       MET  60   7.649   0.702  -3.001
  459   1HG   MET  60          2HG       MET  60   8.040  -1.080  -4.486
  460   2HG   MET  60          1HG       MET  60   6.338  -1.541  -4.530
  461   1HE   MET  60          1HE       MET  60   8.516   1.788  -6.742
  462   2HE   MET  60          2HE       MET  60   9.080   0.127  -6.576
  463   3HE   MET  60          3HE       MET  60   8.892   1.133  -5.142
  464    H    ILE  61           H        ILE  61   6.305  -3.151  -3.038
  465    HA   ILE  61           HA       ILE  61   3.531  -3.173  -3.712
  466    HB   ILE  61           HB       ILE  61   5.573  -5.396  -3.484
  467   1HG1  ILE  61          2HG1      ILE  61   5.955  -3.821  -5.320
  468   2HG1  ILE  61          1HG1      ILE  61   5.386  -5.359  -5.968
  469   1HG2  ILE  61          1HG2      ILE  61   3.801  -6.687  -4.817
  470   2HG2  ILE  61          2HG2      ILE  61   2.656  -5.461  -4.279
  471   3HG2  ILE  61          3HG2      ILE  61   3.486  -6.472  -3.098
  472   1HD1  ILE  61          1HD1      ILE  61   3.080  -4.428  -6.079
  473   2HD1  ILE  61          2HD1      ILE  61   4.214  -3.506  -7.063
  474   3HD1  ILE  61          3HD1      ILE  61   3.697  -2.882  -5.499
  475    H    ASP  62           H        ASP  62   5.425  -4.688  -1.095
  476    HA   ASP  62           HA       ASP  62   3.281  -5.977   0.198
  477   1HB   ASP  62          2HB       ASP  62   6.011  -5.094   1.016
  478   2HB   ASP  62          1HB       ASP  62   4.867  -5.514   2.290
  479    H    GLU  63           H        GLU  63   4.464  -2.660   0.361
  480    HA   GLU  63           HA       GLU  63   2.912  -1.878   2.635
  481   1HB   GLU  63          2HB       GLU  63   4.278  -0.307   0.446
  482   2HB   GLU  63          1HB       GLU  63   3.378   0.466   1.751
  483   1HG   GLU  63          2HG       GLU  63   4.836  -0.438   3.421
  484   2HG   GLU  63          1HG       GLU  63   5.589  -1.536   2.265
  485    H    VAL  64           H        VAL  64   2.474  -1.309  -0.884
  486    HA   VAL  64           HA       VAL  64  -0.080  -0.072  -0.577
  487    HB   VAL  64           HB       VAL  64   1.329   0.308  -2.569
  488   1HG1  VAL  64          1HG1      VAL  64   1.631  -1.374  -4.253
  489   2HG1  VAL  64          2HG1      VAL  64   0.540  -2.485  -3.427
  490   3HG1  VAL  64          3HG1      VAL  64   2.107  -2.100  -2.719
  491   1HG2  VAL  64          1HG2      VAL  64  -0.466   0.475  -4.072
  492   2HG2  VAL  64          2HG2      VAL  64  -1.284   0.398  -2.511
  493   3HG2  VAL  64          3HG2      VAL  64  -1.187  -1.040  -3.527
  494    H    ASP  65           H        ASP  65   0.943  -3.409  -1.206
  495    HA   ASP  65           HA       ASP  65  -1.722  -4.381  -1.677
  496   1HB   ASP  65          2HB       ASP  65   0.695  -5.428  -2.245
  497   2HB   ASP  65          1HB       ASP  65   0.381  -6.262  -0.727
  498    H    GLU  66           H        GLU  66  -3.184  -4.267  -0.115
  499    HA   GLU  66           HA       GLU  66  -2.531  -4.322   2.683
  500   1HB   GLU  66          2HB       GLU  66  -5.272  -4.701   1.460
  501   2HB   GLU  66          1HB       GLU  66  -4.890  -4.141   3.087
  502   1HG   GLU  66          2HG       GLU  66  -4.154  -2.679   0.533
  503   2HG   GLU  66          1HG       GLU  66  -5.514  -2.267   1.575
  504    H    ASP  67           H        ASP  67  -3.976  -6.617   0.402
  505    HA   ASP  67           HA       ASP  67  -4.297  -8.673   2.413
  506   1HB   ASP  67          2HB       ASP  67  -4.774 -10.133   0.353
  507   2HB   ASP  67          1HB       ASP  67  -5.900  -8.821   0.686
  508    H    GLY  68           H        GLY  68  -2.003  -7.951  -0.186
  509   1HA   GLY  68          2HA       GLY  68   0.181  -8.647  -0.478
  510   2HA   GLY  68          1HA       GLY  68   0.084  -9.457   1.083
  511    H    SER  69           H        SER  69  -1.818  -9.848  -1.898
  512    HA   SER  69           HA       SER  69  -1.587 -12.740  -1.712
  513   1HB   SER  69          2HB       SER  69  -3.120 -12.754  -3.644
  514   2HB   SER  69          1HB       SER  69  -3.738 -11.755  -2.332
  515    HG   SER  69           HG       SER  69  -3.701 -10.145  -3.671
  516    H    GLY  70           H        GLY  70   0.413 -10.400  -2.997
  517   1HA   GLY  70          2HA       GLY  70   2.324 -10.670  -4.284
  518   2HA   GLY  70          1HA       GLY  70   1.826 -12.322  -4.632
  519    H    THR  71           H        THR  71  -0.527  -9.838  -5.117
  520    HA   THR  71           HA       THR  71   0.081  -9.576  -7.973
  521    HB   THR  71           HB       THR  71  -2.128 -10.224  -8.681
  522    HG1  THR  71           HG1      THR  71  -2.657 -10.648  -5.922
  523   1HG2  THR  71          1HG2      THR  71  -2.143 -12.599  -8.089
  524   2HG2  THR  71          2HG2      THR  71  -1.093 -12.279  -6.707
  525   3HG2  THR  71          3HG2      THR  71  -0.487 -12.053  -8.348
  526    H    VAL  72           H        VAL  72  -0.518  -7.618  -8.806
  527    HA   VAL  72           HA       VAL  72  -1.585  -5.685  -6.872
  528    HB   VAL  72           HB       VAL  72  -0.534  -5.048  -9.625
  529   1HG1  VAL  72          1HG1      VAL  72  -0.576  -3.389  -7.095
  530   2HG1  VAL  72          2HG1      VAL  72  -1.890  -3.372  -8.271
  531   3HG1  VAL  72          3HG1      VAL  72  -0.277  -2.836  -8.742
  532   1HG2  VAL  72          1HG2      VAL  72   1.600  -4.473  -8.343
  533   2HG2  VAL  72          2HG2      VAL  72   1.284  -6.195  -8.566
  534   3HG2  VAL  72          3HG2      VAL  72   0.946  -5.429  -7.012
  535    H    ASP  73           H        ASP  73  -3.625  -5.161  -6.884
  536    HA   ASP  73           HA       ASP  73  -5.340  -5.791  -9.171
  537   1HB   ASP  73          2HB       ASP  73  -5.903  -4.785  -6.371
  538   2HB   ASP  73          1HB       ASP  73  -7.154  -4.933  -7.604
  539    H    PHE  74           H        PHE  74  -6.986  -4.010  -9.778
  540    HA   PHE  74           HA       PHE  74  -5.580  -1.785 -10.764
  541   1HB   PHE  74          2HB       PHE  74  -7.856  -2.709 -11.550
  542   2HB   PHE  74          1HB       PHE  74  -8.550  -1.674 -10.301
  543    HD1  PHE  74           HD1      PHE  74  -5.610  -1.215 -12.586
  544    HD2  PHE  74           HD2      PHE  74  -9.477   0.201 -11.359
  545    HE1  PHE  74           HE1      PHE  74  -5.386   0.731 -14.106
  546    HE2  PHE  74           HE2      PHE  74  -9.241   2.153 -12.874
  547    HZ   PHE  74           HZ       PHE  74  -7.198   2.413 -14.245
  548    H    ASP  75           H        ASP  75  -7.441  -2.169  -7.767
  549    HA   ASP  75           HA       ASP  75  -7.416   0.595  -7.051
  550   1HB   ASP  75          2HB       ASP  75  -7.987  -0.153  -4.782
  551   2HB   ASP  75          1HB       ASP  75  -8.975  -0.985  -5.979
  552    H    GLU  76           H        GLU  76  -5.218  -2.119  -6.447
  553    HA   GLU  76           HA       GLU  76  -3.423  -0.637  -4.748
  554   1HB   GLU  76          2HB       GLU  76  -2.897  -3.178  -6.318
  555   2HB   GLU  76          1HB       GLU  76  -1.941  -2.560  -4.972
  556   1HG   GLU  76          2HG       GLU  76  -3.750  -2.905  -3.423
  557   2HG   GLU  76          1HG       GLU  76  -4.879  -3.248  -4.727
  558    H    PHE  77           H        PHE  77  -3.758  -1.270  -8.174
  559    HA   PHE  77           HA       PHE  77  -1.195  -0.485  -9.070
  560   1HB   PHE  77          2HB       PHE  77  -3.417  -1.558 -10.232
  561   2HB   PHE  77          1HB       PHE  77  -3.523   0.098 -10.802
  562    HD1  PHE  77           HD1      PHE  77  -3.265  -0.821 -13.071
  563    HD2  PHE  77           HD2      PHE  77  -0.134  -1.190 -10.138
  564    HE1  PHE  77           HE1      PHE  77  -1.638  -1.333 -14.860
  565    HE2  PHE  77           HE2      PHE  77   1.482  -1.691 -11.937
  566    HZ   PHE  77           HZ       PHE  77   0.732  -1.774 -14.298
  567    H    LEU  78           H        LEU  78  -4.281   1.301  -8.964
  568    HA   LEU  78           HA       LEU  78  -3.174   3.793  -9.786
  569   1HB   LEU  78          2HB       LEU  78  -5.763   2.909  -8.595
  570   2HB   LEU  78          1HB       LEU  78  -5.377   4.619  -8.585
  571    HG   LEU  78           HG       LEU  78  -5.572   4.806 -10.893
  572   1HD1  LEU  78          1HD1      LEU  78  -5.284   1.805 -11.205
  573   2HD1  LEU  78          2HD1      LEU  78  -3.936   2.933 -11.349
  574   3HD1  LEU  78          3HD1      LEU  78  -5.280   3.017 -12.487
  575   1HD2  LEU  78          1HD2      LEU  78  -7.758   4.263 -10.011
  576   2HD2  LEU  78          2HD2      LEU  78  -7.399   2.538 -10.058
  577   3HD2  LEU  78          3HD2      LEU  78  -7.579   3.442 -11.561
  578    H    VAL  79           H        VAL  79  -3.751   2.304  -6.624
  579    HA   VAL  79           HA       VAL  79  -3.309   4.582  -5.013
  580    HB   VAL  79           HB       VAL  79  -3.138   1.622  -4.568
  581   1HG1  VAL  79          1HG1      VAL  79  -2.127   3.736  -2.637
  582   2HG1  VAL  79          2HG1      VAL  79  -1.187   2.424  -3.355
  583   3HG1  VAL  79          3HG1      VAL  79  -2.468   2.061  -2.198
  584   1HG2  VAL  79          1HG2      VAL  79  -5.239   3.131  -4.432
  585   2HG2  VAL  79          2HG2      VAL  79  -4.542   3.733  -2.928
  586   3HG2  VAL  79          3HG2      VAL  79  -4.942   2.024  -3.092
  587    H    MET  80           H        MET  80  -1.062   2.014  -6.058
  588    HA   MET  80           HA       MET  80   1.298   2.850  -4.928
  589   1HB   MET  80          2HB       MET  80   0.575   1.018  -6.907
  590   2HB   MET  80          1HB       MET  80   1.741   2.080  -7.695
  591   1HG   MET  80          2HG       MET  80   3.414   1.628  -6.071
  592   2HG   MET  80          1HG       MET  80   2.247   0.916  -4.956
  593   1HE   MET  80          1HE       MET  80   4.605  -0.493  -8.314
  594   2HE   MET  80          2HE       MET  80   3.732   1.034  -8.218
  595   3HE   MET  80          3HE       MET  80   3.027  -0.322  -9.093
  596    H    MET  81           H        MET  81  -0.391   4.310  -7.656
  597    HA   MET  81           HA       MET  81   1.726   5.888  -8.682
  598   1HB   MET  81          2HB       MET  81  -0.529   5.454  -9.776
  599   2HB   MET  81          1HB       MET  81  -1.196   6.662  -8.681
  600   1HG   MET  81          2HG       MET  81   1.002   7.974  -9.666
  601   2HG   MET  81          1HG       MET  81   0.505   7.021 -11.063
  602   1HE   MET  81          1HE       MET  81  -2.334   6.508 -10.545
  603   2HE   MET  81          2HE       MET  81  -2.091   7.197 -12.147
  604   3HE   MET  81          3HE       MET  81  -3.352   7.842 -11.101
  605    H    VAL  82           H        VAL  82  -0.977   6.821  -6.528
  606    HA   VAL  82           HA       VAL  82   0.105   9.374  -5.884
  607    HB   VAL  82           HB       VAL  82  -1.539   9.343  -3.988
  608   1HG1  VAL  82          1HG1      VAL  82  -3.532   9.296  -5.464
  609   2HG1  VAL  82          2HG1      VAL  82  -2.571   8.508  -6.715
  610   3HG1  VAL  82          3HG1      VAL  82  -2.184  10.154  -6.212
  611   1HG2  VAL  82          1HG2      VAL  82  -3.070   7.471  -3.769
  612   2HG2  VAL  82          2HG2      VAL  82  -1.424   6.858  -3.618
  613   3HG2  VAL  82          3HG2      VAL  82  -2.313   6.639  -5.127
  614    H    ARG  83           H        ARG  83   0.569   6.167  -4.552
  615    HA   ARG  83           HA       ARG  83   1.647   6.809  -2.034
  616   1HB   ARG  83          2HB       ARG  83   2.176   4.495  -3.906
  617   2HB   ARG  83          1HB       ARG  83   2.908   4.613  -2.308
  618   1HG   ARG  83          2HG       ARG  83   0.358   5.076  -1.612
  619   2HG   ARG  83          1HG       ARG  83   0.068   4.110  -3.060
  620   1HD   ARG  83          2HD       ARG  83   0.833   2.205  -2.097
  621   2HD   ARG  83          1HD       ARG  83   2.167   3.030  -1.298
  622    HE   ARG  83           HE       ARG  83  -0.443   2.472  -0.181
  623   1HH1  ARG  83          2HH1      ARG  83   2.382   4.526  -0.035
  624   2HH1  ARG  83          1HH1      ARG  83   2.117   4.981   1.613
  625   1HH2  ARG  83          1HH2      ARG  83  -0.766   3.086   1.977
  626   2HH2  ARG  83          2HH2      ARG  83   0.341   4.170   2.749
  627    H    CYS  84           H        CYS  84   3.032   6.940  -5.260
  628    HA   CYS  84           HA       CYS  84   5.761   7.247  -4.336
  629   1HB   CYS  84          2HB       CYS  84   4.439   7.486  -7.040
  630   2HB   CYS  84          1HB       CYS  84   6.136   7.892  -6.786
  631    HG   CYS  84           HG       CYS  84   5.923   5.328  -7.434
  632    H    MET  85           H        MET  85   3.216   9.371  -5.657
  633    HA   MET  85           HA       MET  85   4.744  11.757  -5.709
  634   1HB   MET  85          2HB       MET  85   1.835  11.100  -5.766
  635   2HB   MET  85          1HB       MET  85   2.286  12.753  -5.350
  636   1HG   MET  85          2HG       MET  85   2.275  13.005  -7.628
  637   2HG   MET  85          1HG       MET  85   3.915  12.377  -7.470
  638   1HE   MET  85          1HE       MET  85   4.516  10.997  -9.444
  639   2HE   MET  85          2HE       MET  85   3.289  12.082 -10.093
  640   3HE   MET  85          3HE       MET  85   3.274  10.378 -10.540
  641    H    LYS  86           H        LYS  86   2.248  10.758  -3.351
  642    HA   LYS  86           HA       LYS  86   3.347  12.636  -1.383
  643   1HB   LYS  86          2HB       LYS  86   0.761  11.892  -1.974
  644   2HB   LYS  86          1HB       LYS  86   1.113  10.911  -0.551
  645   1HG   LYS  86          2HG       LYS  86   2.179  13.378   0.125
  646   2HG   LYS  86          1HG       LYS  86   0.719  13.811  -0.765
  647   1HD   LYS  86          2HD       LYS  86  -0.659  12.993   0.850
  648   2HD   LYS  86          1HD       LYS  86   0.367  11.588   1.146
  649   1HE   LYS  86          2HE       LYS  86   1.956  13.037   2.393
  650   2HE   LYS  86          1HE       LYS  86   0.874  14.408   2.145
  651   1HZ   LYS  86          1HZ       LYS  86   0.195  11.895   3.578
  652   2HZ   LYS  86          2HZ       LYS  86  -0.863  13.201   3.322
  653   3HZ   LYS  86          3HZ       LYS  86   0.513  13.396   4.301
  654    H    ASP  87           H        ASP  87   3.045  11.551   1.000
  655    HA   ASP  87           HA       ASP  87   3.996  10.155   2.550
  656   1HB   ASP  87          2HB       ASP  87   2.430   8.520   1.424
  657   2HB   ASP  87          1HB       ASP  87   3.792   8.000   0.433
  658    H    ASP  88           H        ASP  88   5.943  11.435   2.271
  659    HA   ASP  88           HA       ASP  88   8.166   9.803   1.202
  660   1HB   ASP  88          2HB       ASP  88   9.286  12.034   0.642
  661   2HB   ASP  88          1HB       ASP  88   7.982  11.513  -0.421
  662    H    SER  89           HN       SER  89   7.124  10.014   3.900
  663    HA   SER  89           HA       SER  89   9.605  10.599   5.271
  664   1HB   SER  89          2HB       SER  89   8.376  12.826   5.134
  665   2HB   SER  89          1HB       SER  89   7.143  12.107   6.166
  666    HG   SER  89           HG       SER  89   8.618  13.092   7.494
  Start of MODEL   31
    1   1H    MET   1          1H        MET   1  -7.924   1.315   8.580
    2   2H    MET   1          2H        MET   1  -8.242  -0.112   7.714
    3   3H    MET   1          3H        MET   1  -9.190   0.296   9.063
    4    HA   MET   1           HA       MET   1 -10.431   0.771   7.083
    5   1HB   MET   1          2HB       MET   1  -9.460   2.939   8.871
    6   2HB   MET   1          1HB       MET   1 -10.298   3.456   7.409
    7   1HG   MET   1          2HG       MET   1 -12.301   2.476   8.042
    8   2HG   MET   1          1HG       MET   1 -11.509   1.248   9.028
    9   1HE   MET   1          1HE       MET   1 -13.746   4.590   9.842
   10   2HE   MET   1          2HE       MET   1 -12.780   4.446   8.375
   11   3HE   MET   1          3HE       MET   1 -12.291   5.574   9.636
   12    H    ASN   2           H        ASN   2  -7.720   3.112   7.170
   13    HA   ASN   2           HA       ASN   2  -6.491   4.098   5.501
   14   1HB   ASN   2          2HB       ASN   2  -6.714   1.238   4.689
   15   2HB   ASN   2          1HB       ASN   2  -6.102   2.374   3.488
   16   1HD2  ASN   2          1HD2      ASN   2  -5.642   2.218   7.075
   17   2HD2  ASN   2          2HD2      ASN   2  -3.948   2.215   6.994
   18    H    ASP   3           H        ASP   3  -8.913   5.067   5.414
   19    HA   ASP   3           HA       ASP   3 -10.111   4.719   2.774
   20   1HB   ASP   3          2HB       ASP   3 -10.877   6.411   5.158
   21   2HB   ASP   3          1HB       ASP   3 -11.747   6.442   3.623
   22    H    ILE   4           H        ILE   4  -7.786   6.780   4.261
   23    HA   ILE   4           HA       ILE   4  -8.201   9.187   2.883
   24    HB   ILE   4           HB       ILE   4  -5.930   9.779   3.370
   25   1HG1  ILE   4          2HG1      ILE   4  -4.969   7.536   2.582
   26   2HG1  ILE   4          1HG1      ILE   4  -4.203   8.258   3.989
   27   1HG2  ILE   4          1HG2      ILE   4  -7.017   8.027   5.592
   28   2HG2  ILE   4          2HG2      ILE   4  -7.487   9.696   5.274
   29   3HG2  ILE   4          3HG2      ILE   4  -5.839   9.324   5.780
   30   1HD1  ILE   4          1HD1      ILE   4  -5.945   6.788   5.324
   31   2HD1  ILE   4          2HD1      ILE   4  -4.465   6.061   4.704
   32   3HD1  ILE   4          3HD1      ILE   4  -5.982   5.848   3.833
   33    H    TYR   5           H        TYR   5  -6.675   6.198   1.849
   34    HA   TYR   5           HA       TYR   5  -5.527   7.256  -0.559
   35   1HB   TYR   5          2HB       TYR   5  -6.207   4.410   0.220
   36   2HB   TYR   5          1HB       TYR   5  -5.282   4.868  -1.210
   37    HD1  TYR   5           HD1      TYR   5  -3.134   6.233  -0.880
   38    HD2  TYR   5           HD2      TYR   5  -5.161   4.222   2.330
   39    HE1  TYR   5           HE1      TYR   5  -1.075   6.351   0.495
   40    HE2  TYR   5           HE2      TYR   5  -3.104   4.342   3.702
   41    HH   TYR   5           HH       TYR   5  -0.252   4.665   2.715
   42    H    LYS   6           H        LYS   6  -8.642   5.863   0.322
   43    HA   LYS   6           HA       LYS   6  -9.648   5.332  -2.261
   44   1HB   LYS   6          2HB       LYS   6 -10.847   5.786   0.427
   45   2HB   LYS   6          1HB       LYS   6 -11.910   5.971  -0.967
   46   1HG   LYS   6          2HG       LYS   6 -12.133   3.694  -0.565
   47   2HG   LYS   6          1HG       LYS   6 -10.800   3.691  -1.720
   48   1HD   LYS   6          2HD       LYS   6  -9.223   3.772   0.275
   49   2HD   LYS   6          1HD       LYS   6 -10.628   3.463   1.294
   50   1HE   LYS   6          2HE       LYS   6 -10.333   1.649  -1.029
   51   2HE   LYS   6          1HE       LYS   6  -9.087   1.495   0.208
   52   1HZ   LYS   6          1HZ       LYS   6 -12.010   1.436   0.734
   53   2HZ   LYS   6          2HZ       LYS   6 -10.772   1.180   1.871
   54   3HZ   LYS   6          3HZ       LYS   6 -11.022   0.063   0.615
   55    H    ALA   7           H        ALA   7  -9.447   8.308  -0.372
   56    HA   ALA   7           HA       ALA   7 -11.142   9.879  -2.048
   57   1HB   ALA   7          1HB       ALA   7 -10.445  10.451   0.322
   58   2HB   ALA   7          2HB       ALA   7 -10.324  11.773  -0.841
   59   3HB   ALA   7          3HB       ALA   7  -8.873  10.905  -0.338
   60    H    ALA   8           H        ALA   8  -7.723   9.019  -2.121
   61    HA   ALA   8           HA       ALA   8  -6.901  10.995  -4.013
   62   1HB   ALA   8          1HB       ALA   8  -5.498   8.378  -3.932
   63   2HB   ALA   8          2HB       ALA   8  -5.527   9.314  -2.437
   64   3HB   ALA   8          3HB       ALA   8  -4.837  10.013  -3.903
   65    H    VAL   9           H        VAL   9  -7.858   7.577  -4.292
   66    HA   VAL   9           HA       VAL   9  -7.564   7.465  -7.129
   67    HB   VAL   9           HB       VAL   9  -7.589   5.494  -5.541
   68   1HG1  VAL   9          1HG1      VAL   9  -9.505   6.004  -4.189
   69   2HG1  VAL   9          2HG1      VAL   9  -9.883   4.542  -5.100
   70   3HG1  VAL   9          3HG1      VAL   9 -10.556   6.093  -5.602
   71   1HG2  VAL   9          1HG2      VAL   9  -8.897   4.049  -7.161
   72   2HG2  VAL   9          2HG2      VAL   9  -7.696   5.095  -7.919
   73   3HG2  VAL   9          3HG2      VAL   9  -9.404   5.532  -7.971
   74    H    GLU  10           H        GLU  10 -10.085   8.547  -4.980
   75    HA   GLU  10           HA       GLU  10 -12.155   8.567  -7.011
   76   1HB   GLU  10          2HB       GLU  10 -11.976   9.323  -4.128
   77   2HB   GLU  10          1HB       GLU  10 -13.254  10.048  -5.103
   78   1HG   GLU  10          2HG       GLU  10 -14.208   7.948  -5.628
   79   2HG   GLU  10          1HG       GLU  10 -12.756   7.073  -5.145
   80    H    GLN  11           H        GLN  11  -9.602  10.694  -6.014
   81    HA   GLN  11           HA       GLN  11 -10.897  12.919  -7.478
   82   1HB   GLN  11          2HB       GLN  11  -9.878  14.491  -6.056
   83   2HB   GLN  11          1HB       GLN  11 -10.435  13.219  -4.971
   84   1HG   GLN  11          2HG       GLN  11  -8.003  12.238  -5.427
   85   2HG   GLN  11          1HG       GLN  11  -7.642  13.923  -5.794
   86   1HE2  GLN  11          1HE2      GLN  11  -9.594  15.010  -3.805
   87   2HE2  GLN  11          2HE2      GLN  11  -8.919  14.702  -2.280
   88    H    LEU  12           H        LEU  12  -8.850  10.632  -8.254
   89    HA   LEU  12           HA       LEU  12  -6.567  12.200  -9.134
   90   1HB   LEU  12          2HB       LEU  12  -6.038  10.021 -10.408
   91   2HB   LEU  12          1HB       LEU  12  -5.895  10.044  -8.667
   92    HG   LEU  12           HG       LEU  12  -7.989   8.835  -8.440
   93   1HD1  LEU  12          1HD1      LEU  12  -9.354   9.623 -10.203
   94   2HD1  LEU  12          2HD1      LEU  12  -9.018   7.949 -10.640
   95   3HD1  LEU  12          3HD1      LEU  12  -8.135   9.259 -11.425
   96   1HD2  LEU  12          1HD2      LEU  12  -7.316   6.725  -9.545
   97   2HD2  LEU  12          2HD2      LEU  12  -5.932   7.534  -8.812
   98   3HD2  LEU  12          3HD2      LEU  12  -6.184   7.622 -10.556
   99    H    THR  13           H        THR  13  -5.900  11.753 -11.558
  100    HA   THR  13           HA       THR  13  -8.088  12.841 -13.178
  101    HB   THR  13           HB       THR  13  -5.958  12.790 -14.867
  102    HG1  THR  13           HG1      THR  13  -4.481  12.010 -13.449
  103   1HG2  THR  13          1HG2      THR  13  -7.047  14.758 -12.920
  104   2HG2  THR  13          2HG2      THR  13  -6.932  14.852 -14.677
  105   3HG2  THR  13          3HG2      THR  13  -5.507  15.153 -13.684
  106    H    ASP  14           H        ASP  14  -8.261  12.085 -15.451
  107    HA   ASP  14           HA       ASP  14  -8.695   9.247 -15.533
  108   1HB   ASP  14          2HB       ASP  14  -8.819  11.367 -17.693
  109   2HB   ASP  14          1HB       ASP  14  -9.273   9.680 -17.938
  110    H    GLU  15           H        GLU  15  -6.194  11.455 -16.582
  111    HA   GLU  15           HA       GLU  15  -4.817   9.752 -18.380
  112   1HB   GLU  15          2HB       GLU  15  -2.990  11.297 -18.198
  113   2HB   GLU  15          1HB       GLU  15  -4.478  12.237 -18.136
  114   1HG   GLU  15          2HG       GLU  15  -4.242  11.929 -15.538
  115   2HG   GLU  15          1HG       GLU  15  -2.552  11.601 -15.919
  116    H    GLN  16           H        GLN  16  -4.774  10.072 -14.880
  117    HA   GLN  16           HA       GLN  16  -2.421   8.517 -14.406
  118   1HB   GLN  16          2HB       GLN  16  -4.593   9.696 -12.786
  119   2HB   GLN  16          1HB       GLN  16  -3.882   8.226 -12.121
  120   1HG   GLN  16          2HG       GLN  16  -1.690   9.177 -12.105
  121   2HG   GLN  16          1HG       GLN  16  -2.203  10.543 -13.099
  122   1HE2  GLN  16          1HE2      GLN  16  -3.674   9.081 -10.141
  123   2HE2  GLN  16          2HE2      GLN  16  -3.691  10.533  -9.262
  124    H    LYS  17           H        LYS  17  -5.905   7.829 -14.434
  125    HA   LYS  17           HA       LYS  17  -5.746   5.103 -13.687
  126   1HB   LYS  17          2HB       LYS  17  -7.823   6.522 -15.380
  127   2HB   LYS  17          1HB       LYS  17  -8.006   4.907 -14.699
  128   1HG   LYS  17          2HG       LYS  17  -8.161   5.697 -12.509
  129   2HG   LYS  17          1HG       LYS  17  -7.300   7.191 -12.880
  130   1HD   LYS  17          2HD       LYS  17  -9.561   7.862 -12.635
  131   2HD   LYS  17          1HD       LYS  17  -9.317   7.772 -14.379
  132   1HE   LYS  17          2HE       LYS  17 -10.270   5.471 -14.364
  133   2HE   LYS  17          1HE       LYS  17 -10.581   5.633 -12.637
  134   1HZ   LYS  17          1HZ       LYS  17 -12.016   7.507 -13.088
  135   2HZ   LYS  17          2HZ       LYS  17 -12.537   6.156 -13.977
  136   3HZ   LYS  17          3HZ       LYS  17 -11.686   7.408 -14.750
  137    H    ASN  18           H        ASN  18  -5.790   6.716 -16.860
  138    HA   ASN  18           HA       ASN  18  -5.704   4.321 -18.409
  139   1HB   ASN  18          2HB       ASN  18  -5.021   7.195 -19.032
  140   2HB   ASN  18          1HB       ASN  18  -4.838   5.909 -20.225
  141   1HD2  ASN  18          1HD2      ASN  18  -6.968   8.263 -19.431
  142   2HD2  ASN  18          2HD2      ASN  18  -8.429   7.499 -19.837
  143    H    GLU  19           H        GLU  19  -3.227   6.382 -16.984
  144    HA   GLU  19           HA       GLU  19  -0.955   5.497 -18.339
  145   1HB   GLU  19          2HB       GLU  19  -1.095   7.361 -16.621
  146   2HB   GLU  19          1HB       GLU  19  -1.039   6.110 -15.379
  147   1HG   GLU  19          2HG       GLU  19   1.146   5.532 -15.862
  148   2HG   GLU  19          1HG       GLU  19   1.030   6.058 -17.539
  149    H    PHE  20           H        PHE  20  -2.395   4.202 -15.339
  150    HA   PHE  20           HA       PHE  20  -0.584   1.943 -15.279
  151   1HB   PHE  20          2HB       PHE  20  -2.911   2.836 -13.609
  152   2HB   PHE  20          1HB       PHE  20  -2.278   1.200 -13.447
  153    HD1  PHE  20           HD1      PHE  20   0.018   0.806 -12.628
  154    HD2  PHE  20           HD2      PHE  20  -1.611   4.770 -12.927
  155    HE1  PHE  20           HE1      PHE  20   1.824   1.654 -11.166
  156    HE2  PHE  20           HE2      PHE  20   0.208   5.626 -11.480
  157    HZ   PHE  20           HZ       PHE  20   1.926   4.068 -10.595
  158    H    LYS  21           H        LYS  21  -4.033   2.469 -16.013
  159    HA   LYS  21           HA       LYS  21  -4.881  -0.155 -16.319
  160   1HB   LYS  21          2HB       LYS  21  -6.367   1.825 -16.408
  161   2HB   LYS  21          1HB       LYS  21  -5.748   2.193 -18.017
  162   1HG   LYS  21          2HG       LYS  21  -6.639  -0.592 -17.728
  163   2HG   LYS  21          1HG       LYS  21  -7.930   0.582 -17.475
  164   1HD   LYS  21          2HD       LYS  21  -6.154   1.140 -19.779
  165   2HD   LYS  21          1HD       LYS  21  -7.159  -0.301 -19.934
  166   1HE   LYS  21          2HE       LYS  21  -9.128   0.897 -19.928
  167   2HE   LYS  21          1HE       LYS  21  -8.471   2.176 -18.908
  168   1HZ   LYS  21          1HZ       LYS  21  -7.193   2.987 -20.770
  169   2HZ   LYS  21          2HZ       LYS  21  -8.835   2.910 -21.196
  170   3HZ   LYS  21          3HZ       LYS  21  -7.754   1.726 -21.757
  171    H    ALA  22           H        ALA  22  -3.050   1.841 -18.595
  172    HA   ALA  22           HA       ALA  22  -3.309   0.265 -20.906
  173   1HB   ALA  22          1HB       ALA  22  -2.220   2.522 -20.812
  174   2HB   ALA  22          2HB       ALA  22  -1.261   1.317 -21.673
  175   3HB   ALA  22          3HB       ALA  22  -0.834   1.769 -20.023
  176    H    ALA  23           H        ALA  23  -0.769   0.206 -18.411
  177    HA   ALA  23           HA       ALA  23   0.541  -2.127 -19.384
  178   1HB   ALA  23          1HB       ALA  23   0.823  -0.295 -17.146
  179   2HB   ALA  23          2HB       ALA  23   2.045  -1.299 -17.927
  180   3HB   ALA  23          3HB       ALA  23   1.050  -1.967 -16.632
  181    H    PHE  24           H        PHE  24  -2.045  -1.526 -17.066
  182    HA   PHE  24           HA       PHE  24  -2.182  -4.065 -15.864
  183   1HB   PHE  24          2HB       PHE  24  -3.448  -1.841 -15.302
  184   2HB   PHE  24          1HB       PHE  24  -4.664  -2.468 -16.415
  185    HD1  PHE  24           HD1      PHE  24  -5.722  -4.706 -15.976
  186    HD2  PHE  24           HD2      PHE  24  -3.147  -2.787 -13.128
  187    HE1  PHE  24           HE1      PHE  24  -6.571  -6.207 -14.196
  188    HE2  PHE  24           HE2      PHE  24  -3.994  -4.285 -11.351
  189    HZ   PHE  24           HZ       PHE  24  -5.704  -5.994 -11.886
  190    H    ASP  25           H        ASP  25  -3.700  -2.801 -18.819
  191    HA   ASP  25           HA       ASP  25  -5.342  -5.046 -19.358
  192   1HB   ASP  25          2HB       ASP  25  -4.964  -2.560 -20.509
  193   2HB   ASP  25          1HB       ASP  25  -4.366  -3.667 -21.744
  194    H    ILE  26           H        ILE  26  -2.009  -4.275 -20.320
  195    HA   ILE  26           HA       ILE  26  -1.783  -6.585 -22.035
  196    HB   ILE  26           HB       ILE  26   0.646  -5.994 -22.121
  197   1HG1  ILE  26          2HG1      ILE  26  -0.199  -3.651 -20.383
  198   2HG1  ILE  26          1HG1      ILE  26   0.744  -5.022 -19.805
  199   1HG2  ILE  26          1HG2      ILE  26  -0.861  -5.041 -23.755
  200   2HG2  ILE  26          2HG2      ILE  26   0.250  -3.773 -23.238
  201   3HG2  ILE  26          3HG2      ILE  26  -1.398  -3.810 -22.610
  202   1HD1  ILE  26          1HD1      ILE  26   1.812  -2.716 -20.846
  203   2HD1  ILE  26          2HD1      ILE  26   1.816  -3.784 -22.251
  204   3HD1  ILE  26          3HD1      ILE  26   2.650  -4.268 -20.774
  205    H    PHE  27           H        PHE  27  -0.806  -5.827 -18.702
  206    HA   PHE  27           HA       PHE  27   0.656  -8.293 -18.383
  207   1HB   PHE  27          2HB       PHE  27  -0.305  -6.295 -16.321
  208   2HB   PHE  27          1HB       PHE  27   0.740  -7.674 -15.974
  209    HD1  PHE  27           HD1      PHE  27   2.546  -7.776 -18.265
  210    HD2  PHE  27           HD2      PHE  27   1.026  -4.363 -16.142
  211    HE1  PHE  27           HE1      PHE  27   4.505  -6.449 -18.997
  212    HE2  PHE  27           HE2      PHE  27   2.987  -3.037 -16.884
  213    HZ   PHE  27           HZ       PHE  27   4.723  -4.081 -18.309
  214    H    ILE  28           H        ILE  28  -2.645  -7.226 -17.702
  215    HA   ILE  28           HA       ILE  28  -3.231  -9.838 -16.485
  216    HB   ILE  28           HB       ILE  28  -3.957  -7.444 -15.588
  217   1HG1  ILE  28          2HG1      ILE  28  -4.371  -9.685 -14.576
  218   2HG1  ILE  28          1HG1      ILE  28  -5.677  -8.534 -14.304
  219   1HG2  ILE  28          1HG2      ILE  28  -5.295  -7.146 -17.833
  220   2HG2  ILE  28          2HG2      ILE  28  -5.982  -6.595 -16.305
  221   3HG2  ILE  28          3HG2      ILE  28  -6.506  -8.125 -17.004
  222   1HD1  ILE  28          1HD1      ILE  28  -5.617 -10.776 -16.341
  223   2HD1  ILE  28          2HD1      ILE  28  -6.875  -9.543 -16.275
  224   3HD1  ILE  28          3HD1      ILE  28  -6.660 -10.657 -14.925
  225    H    GLN  29           H        GLN  29  -2.587  -9.793 -19.201
  226    HA   GLN  29           HA       GLN  29  -4.992  -9.873 -20.805
  227   1HB   GLN  29          2HB       GLN  29  -2.761  -9.226 -21.729
  228   2HB   GLN  29          1HB       GLN  29  -2.219 -10.885 -21.479
  229   1HG   GLN  29          2HG       GLN  29  -3.912 -11.727 -22.999
  230   2HG   GLN  29          1HG       GLN  29  -4.626 -10.120 -23.155
  231   1HE2  GLN  29          1HE2      GLN  29  -2.867  -8.378 -23.887
  232   2HE2  GLN  29          2HE2      GLN  29  -1.840  -8.882 -25.141
  233    H    ASP  30           H        ASP  30  -2.604 -12.284 -19.685
  234    HA   ASP  30           HA       ASP  30  -4.475 -14.442 -20.369
  235   1HB   ASP  30          2HB       ASP  30  -1.547 -14.412 -19.640
  236   2HB   ASP  30          1HB       ASP  30  -2.480 -15.904 -19.757
  237    H    ALA  31           H        ALA  31  -3.985 -12.521 -17.708
  238    HA   ALA  31           HA       ALA  31  -4.055 -14.594 -15.680
  239   1HB   ALA  31          1HB       ALA  31  -3.965 -11.614 -15.682
  240   2HB   ALA  31          2HB       ALA  31  -3.009 -12.770 -14.757
  241   3HB   ALA  31          3HB       ALA  31  -4.665 -12.411 -14.273
  242    H    GLU  32           H        GLU  32  -5.790 -14.938 -14.244
  243    HA   GLU  32           HA       GLU  32  -8.444 -14.134 -15.290
  244   1HB   GLU  32          2HB       GLU  32  -7.584 -16.803 -14.154
  245   2HB   GLU  32          1HB       GLU  32  -9.265 -16.352 -14.439
  246   1HG   GLU  32          2HG       GLU  32  -9.064 -16.914 -16.607
  247   2HG   GLU  32          1HG       GLU  32  -7.764 -15.738 -16.798
  248    H    ASP  33           H        ASP  33  -6.900 -12.787 -13.223
  249    HA   ASP  33           HA       ASP  33  -8.817 -13.092 -10.998
  250   1HB   ASP  33          2HB       ASP  33  -5.829 -13.197 -10.859
  251   2HB   ASP  33          1HB       ASP  33  -6.727 -12.484  -9.520
  252    H    GLY  34           H        GLY  34  -7.930 -11.071 -13.324
  253   1HA   GLY  34          2HA       GLY  34  -7.925  -8.792 -13.632
  254   2HA   GLY  34          1HA       GLY  34  -8.959  -8.741 -12.207
  255    H    CYS  35           H        CYS  35  -5.567  -9.793 -12.473
  256    HA   CYS  35           HA       CYS  35  -4.611  -7.414 -11.071
  257   1HB   CYS  35          2HB       CYS  35  -4.558 -10.186  -9.874
  258   2HB   CYS  35          1HB       CYS  35  -3.420  -8.932  -9.389
  259    HG   CYS  35           HG       CYS  35  -5.197  -8.052  -7.924
  260    H    ILE  36           H        ILE  36  -2.382  -7.109 -11.255
  261    HA   ILE  36           HA       ILE  36  -1.105  -8.663 -13.384
  262    HB   ILE  36           HB       ILE  36   0.542  -6.935 -13.514
  263   1HG1  ILE  36          2HG1      ILE  36  -0.073  -5.003 -11.604
  264   2HG1  ILE  36          1HG1      ILE  36  -0.197  -6.515 -10.707
  265   1HG2  ILE  36          1HG2      ILE  36  -1.945  -6.455 -14.181
  266   2HG2  ILE  36          2HG2      ILE  36  -0.784  -5.128 -14.166
  267   3HG2  ILE  36          3HG2      ILE  36  -1.905  -5.333 -12.821
  268   1HD1  ILE  36          1HD1      ILE  36   2.140  -6.430 -12.484
  269   2HD1  ILE  36          2HD1      ILE  36   2.044  -6.865 -10.775
  270   3HD1  ILE  36          3HD1      ILE  36   2.164  -5.169 -11.250
  271    H    SER  37           H        SER  37   1.413  -8.927 -12.967
  272    HA   SER  37           HA       SER  37   1.602 -10.585 -10.560
  273   1HB   SER  37          2HB       SER  37   2.474 -11.018 -13.107
  274   2HB   SER  37          1HB       SER  37   3.940 -10.404 -12.350
  275    HG   SER  37           HG       SER  37   3.255 -12.796 -12.219
  276    H    THR  38           H        THR  38   2.244  -9.605  -8.749
  277    HA   THR  38           HA       THR  38   3.548  -7.142  -8.506
  278    HB   THR  38           HB       THR  38   4.152  -7.866  -6.204
  279    HG1  THR  38           HG1      THR  38   4.402  -9.915  -5.933
  280   1HG2  THR  38          1HG2      THR  38   1.389  -8.320  -7.295
  281   2HG2  THR  38          2HG2      THR  38   1.990  -6.974  -6.328
  282   3HG2  THR  38          3HG2      THR  38   1.719  -8.546  -5.579
  283    H    LYS  39           H        LYS  39   4.874 -10.424  -8.678
  284    HA   LYS  39           HA       LYS  39   7.582  -9.785  -8.198
  285   1HB   LYS  39          2HB       LYS  39   8.099 -11.912  -9.391
  286   2HB   LYS  39          1HB       LYS  39   6.857 -12.101  -8.155
  287   1HG   LYS  39          2HG       LYS  39   5.459 -11.419 -10.503
  288   2HG   LYS  39          1HG       LYS  39   6.680 -12.584 -11.012
  289   1HD   LYS  39          2HD       LYS  39   5.746 -13.677  -8.646
  290   2HD   LYS  39          1HD       LYS  39   4.288 -12.992  -9.362
  291   1HE   LYS  39          2HE       LYS  39   4.568 -14.256 -11.374
  292   2HE   LYS  39          1HE       LYS  39   6.208 -14.727 -10.931
  293   1HZ   LYS  39          1HZ       LYS  39   5.291 -15.958  -9.049
  294   2HZ   LYS  39          2HZ       LYS  39   4.667 -16.525 -10.523
  295   3HZ   LYS  39          3HZ       LYS  39   3.719 -15.533  -9.523
  296    H    GLU  40           H        GLU  40   5.568  -9.452 -11.041
  297    HA   GLU  40           HA       GLU  40   7.892  -8.704 -12.688
  298   1HB   GLU  40          2HB       GLU  40   5.027  -9.357 -13.397
  299   2HB   GLU  40          1HB       GLU  40   6.185  -8.708 -14.558
  300   1HG   GLU  40          2HG       GLU  40   7.574 -10.616 -14.421
  301   2HG   GLU  40          1HG       GLU  40   6.827 -11.157 -12.917
  302    H    LEU  41           H        LEU  41   6.567  -7.030 -10.493
  303    HA   LEU  41           HA       LEU  41   5.095  -4.901 -11.541
  304   1HB   LEU  41          2HB       LEU  41   5.882  -5.474  -9.086
  305   2HB   LEU  41          1HB       LEU  41   7.190  -4.384  -9.474
  306    HG   LEU  41           HG       LEU  41   5.248  -3.362  -8.236
  307   1HD1  LEU  41          1HD1      LEU  41   5.528  -1.318  -9.305
  308   2HD1  LEU  41          2HD1      LEU  41   5.470  -2.034 -10.916
  309   3HD1  LEU  41          3HD1      LEU  41   6.917  -2.211  -9.923
  310   1HD2  LEU  41          1HD2      LEU  41   3.522  -4.671  -9.575
  311   2HD2  LEU  41          2HD2      LEU  41   3.837  -3.561 -10.910
  312   3HD2  LEU  41          3HD2      LEU  41   3.183  -2.950  -9.392
  313    H    GLY  42           H        GLY  42   8.579  -5.519 -11.588
  314   1HA   GLY  42          2HA       GLY  42   9.509  -2.994 -12.392
  315   2HA   GLY  42          1HA       GLY  42  10.298  -4.527 -12.755
  316    H    LYS  43           H        LYS  43   8.029  -5.626 -14.216
  317    HA   LYS  43           HA       LYS  43   8.622  -4.683 -16.832
  318   1HB   LYS  43          2HB       LYS  43   6.291  -6.388 -15.908
  319   2HB   LYS  43          1HB       LYS  43   6.827  -6.191 -17.575
  320   1HG   LYS  43          2HG       LYS  43   8.959  -6.997 -15.695
  321   2HG   LYS  43          1HG       LYS  43   7.681  -8.193 -15.909
  322   1HD   LYS  43          2HD       LYS  43   7.968  -8.042 -18.366
  323   2HD   LYS  43          1HD       LYS  43   9.277  -6.885 -18.129
  324   1HE   LYS  43          2HE       LYS  43  10.702  -8.492 -17.185
  325   2HE   LYS  43          1HE       LYS  43   9.370  -9.566 -16.764
  326   1HZ   LYS  43          1HZ       LYS  43   9.019 -10.005 -19.108
  327   2HZ   LYS  43          2HZ       LYS  43  10.615 -10.384 -18.670
  328   3HZ   LYS  43          3HZ       LYS  43  10.283  -8.955 -19.525
  329    H    VAL  44           H        VAL  44   6.203  -3.809 -14.464
  330    HA   VAL  44           HA       VAL  44   4.655  -2.292 -16.426
  331    HB   VAL  44           HB       VAL  44   2.912  -2.294 -14.963
  332   1HG1  VAL  44          1HG1      VAL  44   4.225  -4.289 -13.201
  333   2HG1  VAL  44          2HG1      VAL  44   4.203  -4.663 -14.923
  334   3HG1  VAL  44          3HG1      VAL  44   2.688  -4.380 -14.063
  335   1HG2  VAL  44          1HG2      VAL  44   3.408  -2.320 -12.369
  336   2HG2  VAL  44          2HG2      VAL  44   3.550  -0.817 -13.279
  337   3HG2  VAL  44          3HG2      VAL  44   4.995  -1.744 -12.870
  338    H    MET  45           H        MET  45   6.895  -1.833 -13.754
  339    HA   MET  45           HA       MET  45   6.642   0.931 -13.370
  340   1HB   MET  45          2HB       MET  45   8.884  -1.027 -12.989
  341   2HB   MET  45          1HB       MET  45   9.205   0.701 -12.825
  342   1HG   MET  45          2HG       MET  45   6.834  -0.475 -11.414
  343   2HG   MET  45          1HG       MET  45   8.441  -0.706 -10.724
  344   1HE   MET  45          1HE       MET  45   5.737   2.481  -9.847
  345   2HE   MET  45          2HE       MET  45   6.295   1.102  -8.904
  346   3HE   MET  45          3HE       MET  45   5.536   0.838 -10.472
  347    H    ARG  46           H        ARG  46   8.542  -0.937 -15.726
  348    HA   ARG  46           HA       ARG  46   9.911   1.279 -16.867
  349   1HB   ARG  46          2HB       ARG  46  10.326  -0.193 -18.806
  350   2HB   ARG  46          1HB       ARG  46  10.677  -1.001 -17.281
  351   1HG   ARG  46          2HG       ARG  46   8.678  -2.288 -17.381
  352   2HG   ARG  46          1HG       ARG  46   8.001  -1.280 -18.659
  353   1HD   ARG  46          2HD       ARG  46   8.782  -2.883 -20.056
  354   2HD   ARG  46          1HD       ARG  46  10.342  -2.110 -19.812
  355    HE   ARG  46           HE       ARG  46   9.438  -4.635 -18.640
  356   1HH1  ARG  46          2HH1      ARG  46  11.846  -2.097 -18.746
  357   2HH1  ARG  46          1HH1      ARG  46  13.061  -3.053 -17.974
  358   1HH2  ARG  46          1HH2      ARG  46  11.055  -5.861 -17.631
  359   2HH2  ARG  46          2HH2      ARG  46  12.619  -5.173 -17.346
  360    H    MET  47           H        MET  47   6.729  -0.113 -17.423
  361    HA   MET  47           HA       MET  47   6.152   1.386 -19.809
  362   1HB   MET  47          2HB       MET  47   4.748  -0.521 -18.075
  363   2HB   MET  47          1HB       MET  47   3.702   0.756 -18.696
  364   1HG   MET  47          2HG       MET  47   3.587  -0.838 -20.403
  365   2HG   MET  47          1HG       MET  47   4.860   0.234 -20.987
  366   1HE   MET  47          1HE       MET  47   7.761  -1.846 -21.529
  367   2HE   MET  47          2HE       MET  47   7.275  -0.216 -21.072
  368   3HE   MET  47          3HE       MET  47   6.432  -1.046 -22.377
  369    H    LEU  48           H        LEU  48   5.708   1.852 -16.344
  370    HA   LEU  48           HA       LEU  48   3.999   4.150 -16.527
  371   1HB   LEU  48          2HB       LEU  48   5.554   2.790 -14.379
  372   2HB   LEU  48          1HB       LEU  48   5.086   4.453 -14.110
  373    HG   LEU  48           HG       LEU  48   3.459   3.000 -13.084
  374   1HD1  LEU  48          1HD1      LEU  48   2.214   3.976 -15.659
  375   2HD1  LEU  48          2HD1      LEU  48   2.710   5.072 -14.368
  376   3HD1  LEU  48          3HD1      LEU  48   1.463   3.861 -14.068
  377   1HD2  LEU  48          1HD2      LEU  48   3.415   1.686 -15.804
  378   2HD2  LEU  48          2HD2      LEU  48   2.086   1.490 -14.661
  379   3HD2  LEU  48          3HD2      LEU  48   3.704   0.939 -14.232
  380    H    GLY  49           H        GLY  49   7.456   3.602 -16.515
  381   1HA   GLY  49          2HA       GLY  49   8.830   5.303 -17.658
  382   2HA   GLY  49          1HA       GLY  49   7.916   6.519 -16.775
  383    H    GLN  50           H        GLN  50   8.926   3.530 -15.237
  384    HA   GLN  50           HA       GLN  50  11.091   4.952 -13.808
  385   1HB   GLN  50          2HB       GLN  50   9.196   3.036 -12.437
  386   2HB   GLN  50          1HB       GLN  50  10.386   4.101 -11.694
  387   1HG   GLN  50          2HG       GLN  50   8.007   5.113 -13.280
  388   2HG   GLN  50          1HG       GLN  50   7.990   4.909 -11.529
  389   1HE2  GLN  50          1HE2      GLN  50   8.031   7.403 -13.436
  390   2HE2  GLN  50          2HE2      GLN  50   9.242   8.378 -12.756
  391    H    ASN  51           H        ASN  51  12.696   3.523 -12.855
  392    HA   ASN  51           HA       ASN  51  12.677   0.747 -13.835
  393   1HB   ASN  51          2HB       ASN  51  14.885   2.745 -14.387
  394   2HB   ASN  51          1HB       ASN  51  15.044   1.004 -14.615
  395   1HD2  ASN  51          1HD2      ASN  51  14.042   3.898 -16.148
  396   2HD2  ASN  51          2HD2      ASN  51  13.228   3.192 -17.459
  397    HA   PRO  52           HA       PRO  52  14.418   1.145  -9.559
  398   1HB   PRO  52          2HB       PRO  52  12.488  -0.307  -8.280
  399   2HB   PRO  52          1HB       PRO  52  12.368   1.433  -8.573
  400   1HG   PRO  52          2HG       PRO  52  10.935  -0.791  -9.876
  401   2HG   PRO  52          1HG       PRO  52  10.463   0.904  -9.702
  402   1HD   PRO  52          2HD       PRO  52  11.557  -0.340 -12.030
  403   2HD   PRO  52          1HD       PRO  52  11.246   1.396 -11.788
  404    H    THR  53           H        THR  53  14.161  -1.055  -7.874
  405    HA   THR  53           HA       THR  53  15.441  -3.225  -9.429
  406    HB   THR  53           HB       THR  53  16.825  -3.674  -7.595
  407    HG1  THR  53           HG1      THR  53  16.191  -3.465  -5.578
  408   1HG2  THR  53          1HG2      THR  53  16.251  -0.714  -7.347
  409   2HG2  THR  53          2HG2      THR  53  17.356  -1.451  -8.508
  410   3HG2  THR  53          3HG2      THR  53  17.706  -1.533  -6.781
  411    HA   PRO  54           HA       PRO  54  12.301  -6.032  -8.093
  412   1HB   PRO  54          2HB       PRO  54  13.649  -8.232  -7.165
  413   2HB   PRO  54          1HB       PRO  54  13.501  -7.809  -8.878
  414   1HG   PRO  54          2HG       PRO  54  15.828  -7.508  -7.054
  415   2HG   PRO  54          1HG       PRO  54  15.792  -7.798  -8.799
  416   1HD   PRO  54          2HD       PRO  54  16.298  -5.332  -7.581
  417   2HD   PRO  54          1HD       PRO  54  15.822  -5.554  -9.279
  418    H    GLU  55           H        GLU  55  14.761  -5.340  -5.685
  419    HA   GLU  55           HA       GLU  55  13.176  -6.273  -3.439
  420   1HB   GLU  55          2HB       GLU  55  15.811  -4.848  -3.728
  421   2HB   GLU  55          1HB       GLU  55  15.008  -4.931  -2.160
  422   1HG   GLU  55          2HG       GLU  55  15.019  -7.341  -2.195
  423   2HG   GLU  55          1HG       GLU  55  15.574  -7.367  -3.870
  424    H    GLU  56           H        GLU  56  13.930  -3.232  -5.072
  425    HA   GLU  56           HA       GLU  56  12.740  -1.491  -3.159
  426   1HB   GLU  56          2HB       GLU  56  14.374  -0.926  -5.090
  427   2HB   GLU  56          1HB       GLU  56  12.928  -0.868  -6.096
  428   1HG   GLU  56          2HG       GLU  56  12.163   0.602  -3.890
  429   2HG   GLU  56          1HG       GLU  56  13.865   1.033  -4.059
  430    H    LEU  57           H        LEU  57  11.552  -2.791  -6.285
  431    HA   LEU  57           HA       LEU  57   9.004  -1.600  -6.172
  432   1HB   LEU  57          2HB       LEU  57   8.361  -3.068  -7.908
  433   2HB   LEU  57          1HB       LEU  57  10.033  -2.654  -8.187
  434    HG   LEU  57           HG       LEU  57  10.470  -4.940  -6.918
  435   1HD1  LEU  57          1HD1      LEU  57   8.342  -6.287  -8.134
  436   2HD1  LEU  57          2HD1      LEU  57   7.583  -4.903  -7.349
  437   3HD1  LEU  57          3HD1      LEU  57   8.556  -6.029  -6.402
  438   1HD2  LEU  57          1HD2      LEU  57  10.450  -6.056  -9.129
  439   2HD2  LEU  57          2HD2      LEU  57  11.106  -4.423  -9.245
  440   3HD2  LEU  57          3HD2      LEU  57   9.456  -4.749  -9.773
  441    H    GLN  58           H        GLN  58  10.218  -4.650  -4.827
  442    HA   GLN  58           HA       GLN  58   7.737  -5.788  -4.118
  443   1HB   GLN  58          2HB       GLN  58  10.020  -6.919  -4.053
  444   2HB   GLN  58          1HB       GLN  58  10.273  -6.106  -2.509
  445   1HG   GLN  58          2HG       GLN  58   9.379  -8.298  -2.033
  446   2HG   GLN  58          1HG       GLN  58   8.104  -7.125  -1.709
  447   1HE2  GLN  58          1HE2      GLN  58   6.139  -7.399  -2.841
  448   2HE2  GLN  58          2HE2      GLN  58   5.924  -8.493  -4.121
  449    H    GLU  59           H        GLU  59   9.798  -3.429  -2.456
  450    HA   GLU  59           HA       GLU  59   8.439  -3.401   0.028
  451   1HB   GLU  59          2HB       GLU  59  10.147  -1.392  -1.423
  452   2HB   GLU  59          1HB       GLU  59   9.339  -0.962   0.085
  453   1HG   GLU  59          2HG       GLU  59  10.521  -2.582   1.325
  454   2HG   GLU  59          1HG       GLU  59  10.984  -3.480  -0.121
  455    H    MET  60           H        MET  60   7.903  -1.686  -3.020
  456    HA   MET  60           HA       MET  60   5.796   0.004  -2.065
  457   1HB   MET  60          2HB       MET  60   6.245  -0.885  -4.921
  458   2HB   MET  60          1HB       MET  60   5.398   0.560  -4.369
  459   1HG   MET  60          2HG       MET  60   7.525   1.396  -3.384
  460   2HG   MET  60          1HG       MET  60   8.353  -0.021  -4.025
  461   1HE   MET  60          1HE       MET  60   7.531   3.781  -5.078
  462   2HE   MET  60          2HE       MET  60   6.163   2.819  -4.526
  463   3HE   MET  60          3HE       MET  60   6.248   3.331  -6.209
  464    H    ILE  61           H        ILE  61   5.982  -3.199  -3.479
  465    HA   ILE  61           HA       ILE  61   3.192  -3.543  -3.972
  466    HB   ILE  61           HB       ILE  61   5.442  -5.538  -3.617
  467   1HG1  ILE  61          2HG1      ILE  61   5.607  -4.140  -5.627
  468   2HG1  ILE  61          1HG1      ILE  61   5.176  -5.788  -6.075
  469   1HG2  ILE  61          1HG2      ILE  61   2.582  -6.024  -4.509
  470   2HG2  ILE  61          2HG2      ILE  61   3.295  -6.579  -2.996
  471   3HG2  ILE  61          3HG2      ILE  61   3.880  -7.217  -4.530
  472   1HD1  ILE  61          1HD1      ILE  61   3.652  -4.555  -7.337
  473   2HD1  ILE  61          2HD1      ILE  61   3.477  -3.313  -6.098
  474   3HD1  ILE  61          3HD1      ILE  61   2.708  -4.885  -5.884
  475    H    ASP  62           H        ASP  62   5.337  -4.578  -1.317
  476    HA   ASP  62           HA       ASP  62   3.444  -5.963   0.209
  477   1HB   ASP  62          2HB       ASP  62   6.031  -5.697   0.519
  478   2HB   ASP  62          1HB       ASP  62   5.580  -4.339   1.551
  479    H    GLU  63           H        GLU  63   4.271  -2.500   0.229
  480    HA   GLU  63           HA       GLU  63   2.521  -1.880   2.413
  481   1HB   GLU  63          2HB       GLU  63   3.067   0.426   1.972
  482   2HB   GLU  63          1HB       GLU  63   4.530  -0.542   1.828
  483   1HG   GLU  63          2HG       GLU  63   4.266  -0.575  -0.625
  484   2HG   GLU  63          1HG       GLU  63   2.813   0.413  -0.481
  485    H    VAL  64           H        VAL  64   2.213  -1.666  -1.128
  486    HA   VAL  64           HA       VAL  64  -0.342  -0.333  -0.991
  487    HB   VAL  64           HB       VAL  64   1.219  -0.054  -2.913
  488   1HG1  VAL  64          1HG1      VAL  64   1.570  -1.783  -4.501
  489   2HG1  VAL  64          2HG1      VAL  64   0.293  -2.786  -3.812
  490   3HG1  VAL  64          3HG1      VAL  64   1.804  -2.554  -2.933
  491   1HG2  VAL  64          1HG2      VAL  64  -0.537   0.388  -4.302
  492   2HG2  VAL  64          2HG2      VAL  64  -1.506  -0.072  -2.901
  493   3HG2  VAL  64          3HG2      VAL  64  -1.181  -1.248  -4.173
  494    H    ASP  65           H        ASP  65   0.734  -3.683  -1.446
  495    HA   ASP  65           HA       ASP  65  -1.931  -4.656  -1.978
  496   1HB   ASP  65          2HB       ASP  65   0.645  -5.681  -2.320
  497   2HB   ASP  65          1HB       ASP  65  -0.064  -6.686  -1.061
  498    H    GLU  66           H        GLU  66  -3.310  -4.262  -0.349
  499    HA   GLU  66           HA       GLU  66  -2.753  -4.320   2.404
  500   1HB   GLU  66          2HB       GLU  66  -5.254  -4.599   2.669
  501   2HB   GLU  66          1HB       GLU  66  -4.750  -3.222   1.692
  502   1HG   GLU  66          2HG       GLU  66  -5.438  -4.216  -0.307
  503   2HG   GLU  66          1HG       GLU  66  -5.321  -5.848   0.345
  504    H    ASP  67           H        ASP  67  -3.689  -6.892   0.198
  505    HA   ASP  67           HA       ASP  67  -3.887  -8.812   2.409
  506   1HB   ASP  67          2HB       ASP  67  -4.562 -10.404   0.528
  507   2HB   ASP  67          1HB       ASP  67  -5.681  -9.094   0.893
  508    H    GLY  68           H        GLY  68  -1.903  -8.051  -0.406
  509   1HA   GLY  68          2HA       GLY  68   0.274  -8.668  -0.894
  510   2HA   GLY  68          1HA       GLY  68   0.344  -9.482   0.667
  511    H    SER  69           H        SER  69  -1.765  -9.925  -2.162
  512    HA   SER  69           HA       SER  69  -1.465 -12.811  -2.003
  513   1HB   SER  69          2HB       SER  69  -3.093 -12.807  -3.898
  514   2HB   SER  69          1HB       SER  69  -3.669 -11.947  -2.474
  515    HG   SER  69           HG       SER  69  -3.762 -10.212  -3.651
  516    H    GLY  70           H        GLY  70   0.542 -10.553  -3.302
  517   1HA   GLY  70          2HA       GLY  70   2.313 -10.784  -4.769
  518   2HA   GLY  70          1HA       GLY  70   1.782 -12.433  -5.092
  519    H    THR  71           H        THR  71  -0.589  -9.939  -5.393
  520    HA   THR  71           HA       THR  71  -0.178  -9.627  -8.274
  521    HB   THR  71           HB       THR  71  -2.392 -10.341  -8.872
  522    HG1  THR  71           HG1      THR  71  -3.929 -10.726  -7.422
  523   1HG2  THR  71          1HG2      THR  71  -0.728 -12.147  -8.641
  524   2HG2  THR  71          2HG2      THR  71  -2.344 -12.721  -8.227
  525   3HG2  THR  71          3HG2      THR  71  -1.186 -12.352  -6.949
  526    H    VAL  72           H        VAL  72  -0.620  -7.596  -8.898
  527    HA   VAL  72           HA       VAL  72  -1.842  -5.802  -6.918
  528    HB   VAL  72           HB       VAL  72  -0.566  -4.942  -9.509
  529   1HG1  VAL  72          1HG1      VAL  72  -1.867  -3.258  -8.302
  530   2HG1  VAL  72          2HG1      VAL  72  -0.149  -2.883  -8.170
  531   3HG1  VAL  72          3HG1      VAL  72  -0.997  -3.623  -6.812
  532   1HG2  VAL  72          1HG2      VAL  72   0.764  -5.515  -6.842
  533   2HG2  VAL  72          2HG2      VAL  72   1.522  -4.614  -8.155
  534   3HG2  VAL  72          3HG2      VAL  72   1.103  -6.314  -8.379
  535    H    ASP  73           H        ASP  73  -3.884  -5.248  -7.079
  536    HA   ASP  73           HA       ASP  73  -5.438  -5.770  -9.484
  537   1HB   ASP  73          2HB       ASP  73  -6.201  -5.949  -6.971
  538   2HB   ASP  73          1HB       ASP  73  -6.449  -4.213  -7.120
  539    H    PHE  74           H        PHE  74  -6.898  -3.926 -10.294
  540    HA   PHE  74           HA       PHE  74  -5.286  -1.792 -11.194
  541   1HB   PHE  74          2HB       PHE  74  -7.422  -2.632 -12.292
  542   2HB   PHE  74          1HB       PHE  74  -8.305  -1.703 -11.078
  543    HD1  PHE  74           HD1      PHE  74  -5.137  -1.027 -12.956
  544    HD2  PHE  74           HD2      PHE  74  -9.153   0.224 -12.100
  545    HE1  PHE  74           HE1      PHE  74  -4.780   1.029 -14.285
  546    HE2  PHE  74           HE2      PHE  74  -8.795   2.283 -13.432
  547    HZ   PHE  74           HZ       PHE  74  -6.612   2.685 -14.526
  548    H    ASP  75           H        ASP  75  -7.386  -2.163  -8.401
  549    HA   ASP  75           HA       ASP  75  -7.491   0.591  -7.646
  550   1HB   ASP  75          2HB       ASP  75  -7.805  -1.937  -6.000
  551   2HB   ASP  75          1HB       ASP  75  -8.113  -0.310  -5.393
  552    H    GLU  76           H        GLU  76  -5.422  -2.153  -6.727
  553    HA   GLU  76           HA       GLU  76  -3.754  -0.659  -4.941
  554   1HB   GLU  76          2HB       GLU  76  -3.116  -3.249  -6.385
  555   2HB   GLU  76          1HB       GLU  76  -2.298  -2.616  -4.958
  556   1HG   GLU  76          2HG       GLU  76  -4.366  -2.809  -3.650
  557   2HG   GLU  76          1HG       GLU  76  -5.239  -3.366  -5.077
  558    H    PHE  77           H        PHE  77  -3.792  -1.249  -8.386
  559    HA   PHE  77           HA       PHE  77  -1.116  -0.570  -9.017
  560   1HB   PHE  77          2HB       PHE  77  -3.214  -1.559 -10.427
  561   2HB   PHE  77          1HB       PHE  77  -3.250   0.113 -10.964
  562    HD1  PHE  77           HD1      PHE  77  -2.752  -0.748 -13.235
  563    HD2  PHE  77           HD2      PHE  77   0.023  -1.228  -9.980
  564    HE1  PHE  77           HE1      PHE  77  -0.932  -1.239 -14.843
  565    HE2  PHE  77           HE2      PHE  77   1.828  -1.716 -11.597
  566    HZ   PHE  77           HZ       PHE  77   1.355  -1.725 -14.028
  567    H    LEU  78           H        LEU  78  -4.120   1.356  -9.177
  568    HA   LEU  78           HA       LEU  78  -2.772   3.810  -9.800
  569   1HB   LEU  78          2HB       LEU  78  -5.557   3.034  -9.057
  570   2HB   LEU  78          1HB       LEU  78  -5.097   4.721  -8.929
  571    HG   LEU  78           HG       LEU  78  -4.725   4.890 -11.277
  572   1HD1  LEU  78          1HD1      LEU  78  -5.096   1.890 -11.466
  573   2HD1  LEU  78          2HD1      LEU  78  -3.529   2.698 -11.489
  574   3HD1  LEU  78          3HD1      LEU  78  -4.690   2.992 -12.783
  575   1HD2  LEU  78          1HD2      LEU  78  -7.080   4.926 -10.730
  576   2HD2  LEU  78          2HD2      LEU  78  -7.143   3.164 -10.685
  577   3HD2  LEU  78          3HD2      LEU  78  -6.889   3.998 -12.217
  578    H    VAL  79           H        VAL  79  -3.670   2.167  -6.848
  579    HA   VAL  79           HA       VAL  79  -3.559   4.340  -5.046
  580    HB   VAL  79           HB       VAL  79  -3.383   1.368  -4.823
  581   1HG1  VAL  79          1HG1      VAL  79  -1.541   2.044  -3.375
  582   2HG1  VAL  79          2HG1      VAL  79  -2.917   1.558  -2.381
  583   3HG1  VAL  79          3HG1      VAL  79  -2.554   3.269  -2.610
  584   1HG2  VAL  79          1HG2      VAL  79  -5.481   2.878  -4.734
  585   2HG2  VAL  79          2HG2      VAL  79  -4.921   3.334  -3.126
  586   3HG2  VAL  79          3HG2      VAL  79  -5.309   1.651  -3.481
  587    H    MET  80           H        MET  80  -1.092   1.983  -6.062
  588    HA   MET  80           HA       MET  80   1.082   2.704  -4.569
  589   1HB   MET  80          2HB       MET  80   0.662   1.189  -6.873
  590   2HB   MET  80          1HB       MET  80   1.861   2.390  -7.353
  591   1HG   MET  80          2HG       MET  80   3.413   1.668  -5.768
  592   2HG   MET  80          1HG       MET  80   2.173   0.963  -4.732
  593   1HE   MET  80          1HE       MET  80   3.685  -0.732  -8.733
  594   2HE   MET  80          2HE       MET  80   4.232   0.747  -7.946
  595   3HE   MET  80          3HE       MET  80   2.608   0.667  -8.624
  596    H    MET  81           H        MET  81  -0.237   4.440  -7.367
  597    HA   MET  81           HA       MET  81   1.931   6.288  -7.625
  598   1HB   MET  81          2HB       MET  81   0.351   5.845  -9.468
  599   2HB   MET  81          1HB       MET  81  -0.947   6.574  -8.525
  600   1HG   MET  81          2HG       MET  81   0.067   8.149 -10.194
  601   2HG   MET  81          1HG       MET  81   0.180   8.728  -8.533
  602   1HE   MET  81          1HE       MET  81   1.782   7.190 -11.550
  603   2HE   MET  81          2HE       MET  81   2.316   5.925 -10.447
  604   3HE   MET  81          3HE       MET  81   3.502   7.002 -11.179
  605    H    VAL  82           H        VAL  82  -1.376   6.711  -6.305
  606    HA   VAL  82           HA       VAL  82  -0.932   9.310  -5.283
  607    HB   VAL  82           HB       VAL  82  -2.959   8.935  -3.915
  608   1HG1  VAL  82          1HG1      VAL  82  -4.487   8.521  -5.815
  609   2HG1  VAL  82          2HG1      VAL  82  -3.134   7.903  -6.762
  610   3HG1  VAL  82          3HG1      VAL  82  -3.168   9.598  -6.275
  611   1HG2  VAL  82          1HG2      VAL  82  -4.084   6.823  -3.875
  612   2HG2  VAL  82          2HG2      VAL  82  -2.401   6.480  -3.477
  613   3HG2  VAL  82          3HG2      VAL  82  -3.008   6.150  -5.098
  614    H    ARG  83           H        ARG  83  -0.301   6.134  -3.919
  615    HA   ARG  83           HA       ARG  83  -0.059   6.652  -1.214
  616   1HB   ARG  83          2HB       ARG  83   1.505   4.840  -3.042
  617   2HB   ARG  83          1HB       ARG  83   1.872   4.934  -1.321
  618   1HG   ARG  83          2HG       ARG  83  -0.869   4.680  -1.303
  619   2HG   ARG  83          1HG       ARG  83  -0.418   3.683  -2.685
  620   1HD   ARG  83          2HD       ARG  83   0.564   2.110  -1.386
  621   2HD   ARG  83          1HD       ARG  83   1.328   3.313  -0.353
  622    HE   ARG  83           HE       ARG  83  -1.538   2.999   0.048
  623   1HH1  ARG  83          2HH1      ARG  83   1.680   2.000   0.968
  624   2HH1  ARG  83          1HH1      ARG  83   1.192   1.426   2.524
  625   1HH2  ARG  83          1HH2      ARG  83  -2.154   2.235   2.096
  626   2HH2  ARG  83          2HH2      ARG  83  -0.969   1.559   3.162
  627    H    CYS  84           H        CYS  84   2.206   7.428  -3.814
  628    HA   CYS  84           HA       CYS  84   4.208   8.462  -1.961
  629   1HB   CYS  84          2HB       CYS  84   4.610   7.288  -4.272
  630   2HB   CYS  84          1HB       CYS  84   4.316   8.900  -4.925
  631    HG   CYS  84           HG       CYS  84   6.687   8.144  -3.051
  632    H    MET  85           H        MET  85   1.885   9.724  -4.340
  633    HA   MET  85           HA       MET  85   2.646  12.434  -4.239
  634   1HB   MET  85          2HB       MET  85   0.943  11.162  -5.802
  635   2HB   MET  85          1HB       MET  85  -0.232  11.679  -4.594
  636   1HG   MET  85          2HG       MET  85  -0.292  13.555  -5.911
  637   2HG   MET  85          1HG       MET  85   1.095  14.001  -4.918
  638   1HE   MET  85          1HE       MET  85   0.054  14.947  -7.522
  639   2HE   MET  85          2HE       MET  85   0.057  13.690  -8.756
  640   3HE   MET  85          3HE       MET  85   1.280  14.959  -8.797
  641    H    LYS  86           H        LYS  86  -0.166  10.907  -2.625
  642    HA   LYS  86           HA       LYS  86  -0.293  13.146  -0.740
  643   1HB   LYS  86          2HB       LYS  86  -2.444  12.323  -0.116
  644   2HB   LYS  86          1HB       LYS  86  -2.355  12.156  -1.868
  645   1HG   LYS  86          2HG       LYS  86  -1.938   9.805  -1.718
  646   2HG   LYS  86          1HG       LYS  86  -1.639   9.897   0.017
  647   1HD   LYS  86          2HD       LYS  86  -4.299  10.704  -1.156
  648   2HD   LYS  86          1HD       LYS  86  -3.948   9.023  -0.756
  649   1HE   LYS  86          2HE       LYS  86  -4.493   9.466   1.382
  650   2HE   LYS  86          1HE       LYS  86  -3.104  10.548   1.473
  651   1HZ   LYS  86          1HZ       LYS  86  -5.878  11.241   0.680
  652   2HZ   LYS  86          2HZ       LYS  86  -4.559  12.296   0.490
  653   3HZ   LYS  86          3HZ       LYS  86  -5.028  11.788   2.042
  654    H    ASP  87           H        ASP  87  -1.349  11.850   1.501
  655    HA   ASP  87           HA       ASP  87  -0.707  10.852   3.463
  656   1HB   ASP  87          2HB       ASP  87  -0.428   8.909   1.542
  657   2HB   ASP  87          1HB       ASP  87   1.182   8.939   2.261
  658    H    ASP  88           H        ASP  88   0.641  13.136   2.807
  659    HA   ASP  88           HA       ASP  88   3.491  12.633   3.357
  660   1HB   ASP  88          2HB       ASP  88   2.221  15.315   2.792
  661   2HB   ASP  88          1HB       ASP  88   3.919  14.862   2.648
  662    H    SER  89           HN       SER  89   0.802  14.668   4.547
  663    HA   SER  89           HA       SER  89   1.971  14.504   7.250
  664   1HB   SER  89          2HB       SER  89   2.460  16.734   6.012
  665   2HB   SER  89          1HB       SER  89   0.751  17.073   6.269
  666    HG   SER  89           HG       SER  89   1.080  17.193   8.381
  Start of MODEL   32
    1   1H    MET   1          1H        MET   1  -8.039   1.564   8.922
    2   2H    MET   1          2H        MET   1  -6.683   1.457   7.903
    3   3H    MET   1          3H        MET   1  -8.249   1.443   7.245
    4    HA   MET   1           HA       MET   1  -8.627   3.695   7.809
    5   1HB   MET   1          2HB       MET   1  -6.658   3.117   9.803
    6   2HB   MET   1          1HB       MET   1  -6.073   4.480   8.849
    7   1HG   MET   1          2HG       MET   1  -7.395   5.483  10.536
    8   2HG   MET   1          1HG       MET   1  -8.452   5.450   9.126
    9   1HE   MET   1          1HE       MET   1 -10.764   5.272   9.744
   10   2HE   MET   1          2HE       MET   1 -10.165   5.963  11.249
   11   3HE   MET   1          3HE       MET   1 -11.334   4.645  11.297
   12    H    ASN   2           H        ASN   2  -8.373   3.125   5.479
   13    HA   ASN   2           HA       ASN   2  -5.909   4.346   4.370
   14   1HB   ASN   2          2HB       ASN   2  -7.520   2.085   3.157
   15   2HB   ASN   2          1HB       ASN   2  -6.093   2.838   2.446
   16   1HD2  ASN   2          1HD2      ASN   2  -7.146   1.039   5.376
   17   2HD2  ASN   2          2HD2      ASN   2  -5.630   0.336   5.671
   18    H    ASP   3           H        ASP   3  -8.624   5.457   5.049
   19    HA   ASP   3           HA       ASP   3 -10.113   5.920   2.692
   20   1HB   ASP   3          2HB       ASP   3 -11.136   7.801   3.917
   21   2HB   ASP   3          1HB       ASP   3 -11.064   6.345   4.907
   22    H    ILE   4           H        ILE   4  -7.257   7.474   3.989
   23    HA   ILE   4           HA       ILE   4  -7.358   9.852   2.461
   24    HB   ILE   4           HB       ILE   4  -5.020  10.168   2.968
   25   1HG1  ILE   4          2HG1      ILE   4  -4.453   7.679   2.502
   26   2HG1  ILE   4          1HG1      ILE   4  -3.552   8.503   3.766
   27   1HG2  ILE   4          1HG2      ILE   4  -6.823   9.129   5.118
   28   2HG2  ILE   4          2HG2      ILE   4  -6.210  10.760   4.855
   29   3HG2  ILE   4          3HG2      ILE   4  -5.154   9.520   5.528
   30   1HD1  ILE   4          1HD1      ILE   4  -5.555   7.547   5.277
   31   2HD1  ILE   4          2HD1      ILE   4  -4.118   6.593   4.922
   32   3HD1  ILE   4          3HD1      ILE   4  -5.595   6.340   3.994
   33    H    TYR   5           H        TYR   5  -6.256   6.614   1.684
   34    HA   TYR   5           HA       TYR   5  -4.969   7.413  -0.793
   35   1HB   TYR   5          2HB       TYR   5  -5.780   4.631   0.098
   36   2HB   TYR   5          1HB       TYR   5  -4.651   5.039  -1.194
   37    HD1  TYR   5           HD1      TYR   5  -5.038   4.434   2.325
   38    HD2  TYR   5           HD2      TYR   5  -2.537   6.381  -0.574
   39    HE1  TYR   5           HE1      TYR   5  -3.201   4.539   3.982
   40    HE2  TYR   5           HE2      TYR   5  -0.700   6.488   1.084
   41    HH   TYR   5           HH       TYR   5  -0.824   6.457   3.966
   42    H    LYS   6           H        LYS   6  -8.067   6.077   0.241
   43    HA   LYS   6           HA       LYS   6  -9.113   5.492  -2.340
   44   1HB   LYS   6          2HB       LYS   6 -10.466   6.074   0.303
   45   2HB   LYS   6          1HB       LYS   6 -11.341   5.597  -1.153
   46   1HG   LYS   6          2HG       LYS   6 -10.201   3.482  -1.244
   47   2HG   LYS   6          1HG       LYS   6  -9.065   3.973   0.013
   48   1HD   LYS   6          2HD       LYS   6 -11.305   4.339   1.404
   49   2HD   LYS   6          1HD       LYS   6 -11.931   3.150   0.263
   50   1HE   LYS   6          2HE       LYS   6  -9.317   2.653   1.671
   51   2HE   LYS   6          1HE       LYS   6 -10.842   2.313   2.491
   52   1HZ   LYS   6          1HZ       LYS   6  -9.999   0.374   1.311
   53   2HZ   LYS   6          2HZ       LYS   6 -10.034   1.229  -0.156
   54   3HZ   LYS   6          3HZ       LYS   6 -11.481   0.883   0.664
   55    H    ALA   7           H        ALA   7  -8.979   8.409  -0.376
   56    HA   ALA   7           HA       ALA   7 -10.877   9.918  -1.899
   57   1HB   ALA   7          1HB       ALA   7 -10.017  10.373   0.498
   58   2HB   ALA   7          2HB       ALA   7 -10.269  11.755  -0.567
   59   3HB   ALA   7          3HB       ALA   7  -8.640  11.136  -0.296
   60    H    ALA   8           H        ALA   8  -7.396   9.373  -2.098
   61    HA   ALA   8           HA       ALA   8  -6.879  11.469  -3.992
   62   1HB   ALA   8          1HB       ALA   8  -5.108  10.523  -2.539
   63   2HB   ALA   8          2HB       ALA   8  -4.688  10.438  -4.250
   64   3HB   ALA   8          3HB       ALA   8  -5.242   8.991  -3.405
   65    H    VAL   9           H        VAL   9  -7.390   7.950  -4.226
   66    HA   VAL   9           HA       VAL   9  -7.041   7.808  -7.052
   67    HB   VAL   9           HB       VAL   9  -6.919   5.860  -5.446
   68   1HG1  VAL   9          1HG1      VAL   9  -9.938   6.114  -5.592
   69   2HG1  VAL   9          2HG1      VAL   9  -8.939   6.306  -4.152
   70   3HG1  VAL   9          3HG1      VAL   9  -9.072   4.729  -4.926
   71   1HG2  VAL   9          1HG2      VAL   9  -7.830   4.273  -7.062
   72   2HG2  VAL   9          2HG2      VAL   9  -7.093   5.619  -7.932
   73   3HG2  VAL   9          3HG2      VAL   9  -8.847   5.529  -7.768
   74    H    GLU  10           H        GLU  10  -9.686   8.786  -5.025
   75    HA   GLU  10           HA       GLU  10 -11.719   8.485  -7.072
   76   1HB   GLU  10          2HB       GLU  10 -11.646   9.479  -4.255
   77   2HB   GLU  10          1HB       GLU  10 -12.969  10.004  -5.295
   78   1HG   GLU  10          2HG       GLU  10 -12.239   7.091  -5.198
   79   2HG   GLU  10          1HG       GLU  10 -13.211   7.785  -3.900
   80    H    GLN  11           H        GLN  11  -9.393  10.903  -6.173
   81    HA   GLN  11           HA       GLN  11 -10.890  12.966  -7.666
   82   1HB   GLN  11          2HB       GLN  11  -9.537  14.621  -6.538
   83   2HB   GLN  11          1HB       GLN  11 -10.229  13.531  -5.339
   84   1HG   GLN  11          2HG       GLN  11  -8.115  12.270  -5.249
   85   2HG   GLN  11          1HG       GLN  11  -7.417  13.338  -6.465
   86   1HE2  GLN  11          1HE2      GLN  11  -8.243  13.049  -3.067
   87   2HE2  GLN  11          2HE2      GLN  11  -7.617  14.553  -2.594
   88    H    LEU  12           H        LEU  12  -8.441  10.762  -8.252
   89    HA   LEU  12           HA       LEU  12  -6.550  12.398  -9.628
   90   1HB   LEU  12          2HB       LEU  12  -5.991  10.185 -10.818
   91   2HB   LEU  12          1HB       LEU  12  -5.670  10.330  -9.107
   92    HG   LEU  12           HG       LEU  12  -7.633   8.995  -8.589
   93   1HD1  LEU  12          1HD1      LEU  12  -8.820   7.901 -10.602
   94   2HD1  LEU  12          2HD1      LEU  12  -8.106   9.195 -11.565
   95   3HD1  LEU  12          3HD1      LEU  12  -9.218   9.584 -10.253
   96   1HD2  LEU  12          1HD2      LEU  12  -5.597   7.754  -9.034
   97   2HD2  LEU  12          2HD2      LEU  12  -5.880   7.833 -10.774
   98   3HD2  LEU  12          3HD2      LEU  12  -6.945   6.870  -9.749
   99    H    THR  13           H        THR  13  -6.109  11.937 -12.065
  100    HA   THR  13           HA       THR  13  -8.520  12.760 -13.495
  101    HB   THR  13           HB       THR  13  -6.597  12.681 -15.413
  102    HG1  THR  13           HG1      THR  13  -4.904  12.101 -14.203
  103   1HG2  THR  13          1HG2      THR  13  -6.128  15.136 -14.407
  104   2HG2  THR  13          2HG2      THR  13  -7.585  14.724 -13.501
  105   3HG2  THR  13          3HG2      THR  13  -7.611  14.717 -15.265
  106    H    ASP  14           H        ASP  14  -8.943  11.862 -15.660
  107    HA   ASP  14           HA       ASP  14  -9.273   9.025 -15.556
  108   1HB   ASP  14          2HB       ASP  14 -10.662  10.844 -16.851
  109   2HB   ASP  14          1HB       ASP  14  -9.471  10.566 -18.122
  110    H    GLU  15           H        GLU  15  -6.920  11.202 -16.982
  111    HA   GLU  15           HA       GLU  15  -5.668   9.370 -18.761
  112   1HB   GLU  15          2HB       GLU  15  -4.951  11.993 -17.543
  113   2HB   GLU  15          1HB       GLU  15  -3.631  11.011 -18.178
  114   1HG   GLU  15          2HG       GLU  15  -5.282  10.748 -20.249
  115   2HG   GLU  15          1HG       GLU  15  -5.923  12.271 -19.632
  116    H    GLN  16           H        GLN  16  -5.295  10.048 -15.322
  117    HA   GLN  16           HA       GLN  16  -2.887   8.556 -14.933
  118   1HB   GLN  16          2HB       GLN  16  -4.922   9.855 -13.213
  119   2HB   GLN  16          1HB       GLN  16  -4.066   8.495 -12.489
  120   1HG   GLN  16          2HG       GLN  16  -1.976   9.535 -12.685
  121   2HG   GLN  16          1HG       GLN  16  -2.533  10.630 -13.950
  122   1HE2  GLN  16          1HE2      GLN  16  -3.699   9.883 -10.603
  123   2HE2  GLN  16          2HE2      GLN  16  -3.780  11.508 -10.124
  124    H    LYS  17           H        LYS  17  -6.346   7.841 -14.591
  125    HA   LYS  17           HA       LYS  17  -6.082   5.201 -13.588
  126   1HB   LYS  17          2HB       LYS  17  -8.315   6.419 -15.240
  127   2HB   LYS  17          1HB       LYS  17  -8.413   4.890 -14.367
  128   1HG   LYS  17          2HG       LYS  17  -8.451   5.919 -12.288
  129   2HG   LYS  17          1HG       LYS  17  -7.575   7.340 -12.858
  130   1HD   LYS  17          2HD       LYS  17  -9.660   8.290 -12.777
  131   2HD   LYS  17          1HD       LYS  17  -9.800   7.558 -14.375
  132   1HE   LYS  17          2HE       LYS  17 -10.535   5.449 -12.845
  133   2HE   LYS  17          1HE       LYS  17 -11.084   6.771 -11.815
  134   1HZ   LYS  17          1HZ       LYS  17 -12.817   6.135 -13.340
  135   2HZ   LYS  17          2HZ       LYS  17 -11.787   6.362 -14.672
  136   3HZ   LYS  17          3HZ       LYS  17 -12.271   7.692 -13.732
  137    H    ASN  18           H        ASN  18  -6.407   6.513 -16.875
  138    HA   ASN  18           HA       ASN  18  -6.424   3.993 -18.212
  139   1HB   ASN  18          2HB       ASN  18  -5.858   6.811 -19.130
  140   2HB   ASN  18          1HB       ASN  18  -5.736   5.435 -20.224
  141   1HD2  ASN  18          1HD2      ASN  18  -7.702   7.515 -20.579
  142   2HD2  ASN  18          2HD2      ASN  18  -9.236   6.828 -20.338
  143    H    GLU  19           H        GLU  19  -3.869   6.158 -17.134
  144    HA   GLU  19           HA       GLU  19  -1.708   5.197 -18.629
  145   1HB   GLU  19          2HB       GLU  19  -1.665   7.188 -17.093
  146   2HB   GLU  19          1HB       GLU  19  -1.600   6.069 -15.731
  147   1HG   GLU  19          2HG       GLU  19   0.513   5.196 -16.422
  148   2HG   GLU  19          1HG       GLU  19   0.396   5.973 -18.003
  149    H    PHE  20           H        PHE  20  -2.933   4.104 -15.459
  150    HA   PHE  20           HA       PHE  20  -1.073   1.895 -15.324
  151   1HB   PHE  20          2HB       PHE  20  -3.388   2.825 -13.651
  152   2HB   PHE  20          1HB       PHE  20  -2.682   1.231 -13.393
  153    HD1  PHE  20           HD1      PHE  20  -2.133   4.858 -13.170
  154    HD2  PHE  20           HD2      PHE  20  -0.364   0.986 -12.604
  155    HE1  PHE  20           HE1      PHE  20  -0.312   5.886 -11.841
  156    HE2  PHE  20           HE2      PHE  20   1.449   2.006 -11.263
  157    HZ   PHE  20           HZ       PHE  20   1.481   4.460 -10.884
  158    H    LYS  21           H        LYS  21  -4.580   2.264 -15.877
  159    HA   LYS  21           HA       LYS  21  -5.303  -0.411 -16.083
  160   1HB   LYS  21          2HB       LYS  21  -6.830   1.620 -16.124
  161   2HB   LYS  21          1HB       LYS  21  -6.458   1.750 -17.840
  162   1HG   LYS  21          2HG       LYS  21  -8.499   0.468 -17.626
  163   2HG   LYS  21          1HG       LYS  21  -7.217  -0.644 -18.105
  164   1HD   LYS  21          2HD       LYS  21  -6.984  -1.481 -15.870
  165   2HD   LYS  21          1HD       LYS  21  -8.001  -0.196 -15.216
  166   1HE   LYS  21          2HE       LYS  21  -9.879  -1.110 -16.678
  167   2HE   LYS  21          1HE       LYS  21  -8.849  -2.510 -16.969
  168   1HZ   LYS  21          1HZ       LYS  21  -9.757  -1.539 -14.312
  169   2HZ   LYS  21          2HZ       LYS  21  -8.737  -2.872 -14.577
  170   3HZ   LYS  21          3HZ       LYS  21 -10.345  -2.906 -15.125
  171    H    ALA  22           H        ALA  22  -3.753   1.651 -18.506
  172    HA   ALA  22           HA       ALA  22  -4.094  -0.028 -20.757
  173   1HB   ALA  22          1HB       ALA  22  -3.284   2.287 -20.962
  174   2HB   ALA  22          2HB       ALA  22  -2.152   1.159 -21.706
  175   3HB   ALA  22          3HB       ALA  22  -1.800   1.845 -20.121
  176    H    ALA  23           H        ALA  23  -1.360   0.278 -18.490
  177    HA   ALA  23           HA       ALA  23   0.118  -1.935 -19.514
  178   1HB   ALA  23          1HB       ALA  23   1.198  -0.178 -18.173
  179   2HB   ALA  23          2HB       ALA  23   1.413  -1.754 -17.412
  180   3HB   ALA  23          3HB       ALA  23   0.214  -0.625 -16.777
  181    H    PHE  24           H        PHE  24  -2.305  -1.509 -17.014
  182    HA   PHE  24           HA       PHE  24  -2.126  -3.996 -15.716
  183   1HB   PHE  24          2HB       PHE  24  -3.480  -1.912 -15.055
  184   2HB   PHE  24          1HB       PHE  24  -4.708  -2.500 -16.174
  185    HD1  PHE  24           HD1      PHE  24  -5.600  -4.885 -15.844
  186    HD2  PHE  24           HD2      PHE  24  -3.306  -2.795 -12.880
  187    HE1  PHE  24           HE1      PHE  24  -6.439  -6.433 -14.101
  188    HE2  PHE  24           HE2      PHE  24  -4.145  -4.339 -11.140
  189    HZ   PHE  24           HZ       PHE  24  -5.718  -6.153 -11.749
  190    H    ASP  25           H        ASP  25  -4.123  -2.960 -18.481
  191    HA   ASP  25           HA       ASP  25  -5.501  -5.412 -18.822
  192   1HB   ASP  25          2HB       ASP  25  -6.128  -3.146 -19.789
  193   2HB   ASP  25          1HB       ASP  25  -4.915  -3.446 -21.034
  194    H    ILE  26           H        ILE  26  -2.482  -4.211 -20.280
  195    HA   ILE  26           HA       ILE  26  -2.240  -6.383 -22.125
  196    HB   ILE  26           HB       ILE  26   0.116  -5.621 -22.404
  197   1HG1  ILE  26          2HG1      ILE  26  -0.639  -3.507 -20.361
  198   2HG1  ILE  26          1HG1      ILE  26   0.407  -4.883 -20.011
  199   1HG2  ILE  26          1HG2      ILE  26  -2.190  -3.682 -22.516
  200   2HG2  ILE  26          2HG2      ILE  26  -1.419  -4.558 -23.838
  201   3HG2  ILE  26          3HG2      ILE  26  -0.584  -3.208 -23.070
  202   1HD1  ILE  26          1HD1      ILE  26   2.090  -3.505 -20.650
  203   2HD1  ILE  26          2HD1      ILE  26   0.995  -2.406 -21.488
  204   3HD1  ILE  26          3HD1      ILE  26   1.558  -3.873 -22.291
  205    H    PHE  27           H        PHE  27  -1.023  -5.843 -18.837
  206    HA   PHE  27           HA       PHE  27   0.617  -8.215 -18.861
  207   1HB   PHE  27          2HB       PHE  27  -0.282  -6.439 -16.580
  208   2HB   PHE  27          1HB       PHE  27   0.832  -7.796 -16.402
  209    HD1  PHE  27           HD1      PHE  27   2.481  -7.663 -18.814
  210    HD2  PHE  27           HD2      PHE  27   0.995  -4.471 -16.348
  211    HE1  PHE  27           HE1      PHE  27   4.344  -6.211 -19.568
  212    HE2  PHE  27           HE2      PHE  27   2.858  -3.023 -17.111
  213    HZ   PHE  27           HZ       PHE  27   4.531  -3.892 -18.716
  214    H    ILE  28           H        ILE  28  -2.695  -7.464 -17.894
  215    HA   ILE  28           HA       ILE  28  -3.008 -10.198 -16.825
  216    HB   ILE  28           HB       ILE  28  -5.127  -9.506 -15.924
  217   1HG1  ILE  28          2HG1      ILE  28  -5.483  -6.824 -16.363
  218   2HG1  ILE  28          1HG1      ILE  28  -4.840  -7.342 -17.921
  219   1HG2  ILE  28          1HG2      ILE  28  -3.149  -8.838 -14.636
  220   2HG2  ILE  28          2HG2      ILE  28  -4.431  -7.637 -14.466
  221   3HG2  ILE  28          3HG2      ILE  28  -3.061  -7.322 -15.532
  222   1HD1  ILE  28          1HD1      ILE  28  -6.635  -8.732 -18.361
  223   2HD1  ILE  28          2HD1      ILE  28  -7.443  -7.486 -17.407
  224   3HD1  ILE  28          3HD1      ILE  28  -6.974  -9.010 -16.651
  225    H    GLN  29           H        GLN  29  -2.929  -9.056 -19.792
  226    HA   GLN  29           HA       GLN  29  -5.316  -9.459 -21.111
  227   1HB   GLN  29          2HB       GLN  29  -3.327  -8.664 -22.260
  228   2HB   GLN  29          1HB       GLN  29  -2.526 -10.215 -22.011
  229   1HG   GLN  29          2HG       GLN  29  -4.148 -11.343 -23.417
  230   2HG   GLN  29          1HG       GLN  29  -5.108  -9.870 -23.560
  231   1HE2  GLN  29          1HE2      GLN  29  -3.719  -7.904 -24.462
  232   2HE2  GLN  29          2HE2      GLN  29  -2.682  -8.280 -25.752
  233    H    ASP  30           H        ASP  30  -3.000 -11.900 -20.010
  234    HA   ASP  30           HA       ASP  30  -4.830 -14.033 -20.928
  235   1HB   ASP  30          2HB       ASP  30  -1.924 -14.249 -20.101
  236   2HB   ASP  30          1HB       ASP  30  -2.921 -15.545 -20.763
  237    H    ALA  31           H        ALA  31  -4.892 -12.331 -18.344
  238    HA   ALA  31           HA       ALA  31  -4.648 -14.473 -16.342
  239   1HB   ALA  31          1HB       ALA  31  -4.782 -12.753 -14.671
  240   2HB   ALA  31          2HB       ALA  31  -5.253 -11.549 -15.870
  241   3HB   ALA  31          3HB       ALA  31  -3.621 -12.219 -15.887
  242    H    GLU  32           H        GLU  32  -6.355 -14.991 -14.960
  243    HA   GLU  32           HA       GLU  32  -9.043 -14.157 -15.886
  244   1HB   GLU  32          2HB       GLU  32  -8.047 -16.906 -15.119
  245   2HB   GLU  32          1HB       GLU  32  -9.763 -16.496 -15.135
  246   1HG   GLU  32          2HG       GLU  32  -9.854 -16.375 -17.422
  247   2HG   GLU  32          1HG       GLU  32  -8.217 -15.734 -17.557
  248    H    ASP  33           H        ASP  33  -7.724 -12.775 -13.907
  249    HA   ASP  33           HA       ASP  33  -9.341 -13.454 -11.537
  250   1HB   ASP  33          2HB       ASP  33  -6.390 -12.793 -11.501
  251   2HB   ASP  33          1HB       ASP  33  -7.417 -12.850 -10.069
  252    H    GLY  34           H        GLY  34  -7.182 -11.016 -12.993
  253   1HA   GLY  34          2HA       GLY  34  -8.037  -8.792 -13.496
  254   2HA   GLY  34          1HA       GLY  34  -9.046  -8.913 -12.057
  255    H    CYS  35           H        CYS  35  -5.618  -9.709 -12.513
  256    HA   CYS  35           HA       CYS  35  -4.692  -7.402 -11.028
  257   1HB   CYS  35          2HB       CYS  35  -3.590  -8.824  -9.259
  258   2HB   CYS  35          1HB       CYS  35  -5.343  -8.695  -9.125
  259    HG   CYS  35           HG       CYS  35  -3.858 -11.225 -10.207
  260    H    ILE  36           H        ILE  36  -2.516  -7.022 -11.311
  261    HA   ILE  36           HA       ILE  36  -1.222  -8.620 -13.380
  262    HB   ILE  36           HB       ILE  36   0.370  -6.868 -13.585
  263   1HG1  ILE  36          2HG1      ILE  36  -0.146  -4.947 -11.639
  264   2HG1  ILE  36          1HG1      ILE  36  -0.225  -6.463 -10.741
  265   1HG2  ILE  36          1HG2      ILE  36  -1.010  -5.171 -14.277
  266   2HG2  ILE  36          2HG2      ILE  36  -1.923  -5.152 -12.768
  267   3HG2  ILE  36          3HG2      ILE  36  -2.245  -6.394 -13.978
  268   1HD1  ILE  36          1HD1      ILE  36   2.011  -6.396 -12.634
  269   2HD1  ILE  36          2HD1      ILE  36   2.008  -6.799 -10.915
  270   3HD1  ILE  36          3HD1      ILE  36   2.104  -5.113 -11.427
  271    H    SER  37           H        SER  37   1.270  -8.916 -13.023
  272    HA   SER  37           HA       SER  37   1.529 -10.501 -10.574
  273   1HB   SER  37          2HB       SER  37   2.189 -11.434 -12.819
  274   2HB   SER  37          1HB       SER  37   3.497 -10.256 -12.861
  275    HG   SER  37           HG       SER  37   3.837 -12.500 -11.916
  276    H    THR  38           H        THR  38   2.236  -9.475  -8.818
  277    HA   THR  38           HA       THR  38   3.589  -7.017  -8.722
  278    HB   THR  38           HB       THR  38   4.167  -7.596  -6.397
  279    HG1  THR  38           HG1      THR  38   4.575  -9.634  -6.135
  280   1HG2  THR  38          1HG2      THR  38   1.740  -8.373  -5.750
  281   2HG2  THR  38          2HG2      THR  38   1.427  -8.140  -7.469
  282   3HG2  THR  38          3HG2      THR  38   1.992  -6.791  -6.485
  283    H    LYS  39           H        LYS  39   4.777 -10.316  -8.989
  284    HA   LYS  39           HA       LYS  39   7.525  -9.836  -8.495
  285   1HB   LYS  39          2HB       LYS  39   6.377 -11.883 -10.414
  286   2HB   LYS  39          1HB       LYS  39   7.951 -11.937  -9.623
  287   1HG   LYS  39          2HG       LYS  39   7.072 -12.611  -7.614
  288   2HG   LYS  39          1HG       LYS  39   5.583 -11.694  -7.841
  289   1HD   LYS  39          2HD       LYS  39   5.022 -13.393  -9.693
  290   2HD   LYS  39          1HD       LYS  39   6.316 -14.379  -9.012
  291   1HE   LYS  39          2HE       LYS  39   5.209 -14.540  -6.899
  292   2HE   LYS  39          1HE       LYS  39   4.050 -13.285  -7.334
  293   1HZ   LYS  39          1HZ       LYS  39   3.159 -14.736  -9.040
  294   2HZ   LYS  39          2HZ       LYS  39   3.092 -15.500  -7.524
  295   3HZ   LYS  39          3HZ       LYS  39   4.287 -15.939  -8.648
  296    H    GLU  40           H        GLU  40   5.488  -9.475 -11.332
  297    HA   GLU  40           HA       GLU  40   7.793  -8.580 -12.934
  298   1HB   GLU  40          2HB       GLU  40   4.994  -9.435 -13.687
  299   2HB   GLU  40          1HB       GLU  40   6.098  -8.671 -14.830
  300   1HG   GLU  40          2HG       GLU  40   7.573 -10.478 -14.825
  301   2HG   GLU  40          1HG       GLU  40   7.040 -11.037 -13.238
  302    H    LEU  41           H        LEU  41   6.462  -6.979 -10.751
  303    HA   LEU  41           HA       LEU  41   4.829  -4.951 -11.853
  304   1HB   LEU  41          2HB       LEU  41   6.007  -5.462  -9.346
  305   2HB   LEU  41          1HB       LEU  41   6.578  -3.883  -9.829
  306    HG   LEU  41           HG       LEU  41   3.693  -4.750  -9.528
  307   1HD1  LEU  41          1HD1      LEU  41   4.739  -2.418  -8.068
  308   2HD1  LEU  41          2HD1      LEU  41   5.501  -3.942  -7.616
  309   3HD1  LEU  41          3HD1      LEU  41   3.753  -3.759  -7.487
  310   1HD2  LEU  41          1HD2      LEU  41   3.917  -1.942  -9.809
  311   2HD2  LEU  41          2HD2      LEU  41   3.177  -3.070 -10.943
  312   3HD2  LEU  41          3HD2      LEU  41   4.877  -2.636 -11.116
  313    H    GLY  42           H        GLY  42   8.320  -5.412 -11.814
  314   1HA   GLY  42          2HA       GLY  42   9.199  -2.848 -12.510
  315   2HA   GLY  42          1HA       GLY  42  10.014  -4.346 -12.954
  316    H    LYS  43           H        LYS  43   7.828  -5.437 -14.499
  317    HA   LYS  43           HA       LYS  43   8.400  -4.322 -17.041
  318   1HB   LYS  43          2HB       LYS  43   6.195  -6.190 -16.143
  319   2HB   LYS  43          1HB       LYS  43   6.493  -5.763 -17.827
  320   1HG   LYS  43          2HG       LYS  43   8.830  -6.606 -17.591
  321   2HG   LYS  43          1HG       LYS  43   8.446  -7.125 -15.949
  322   1HD   LYS  43          2HD       LYS  43   6.754  -8.657 -16.763
  323   2HD   LYS  43          1HD       LYS  43   6.938  -8.051 -18.409
  324   1HE   LYS  43          2HE       LYS  43   9.117  -8.980 -18.621
  325   2HE   LYS  43          1HE       LYS  43   9.252  -9.257 -16.885
  326   1HZ   LYS  43          1HZ       LYS  43   8.766 -11.302 -18.077
  327   2HZ   LYS  43          2HZ       LYS  43   7.343 -10.620 -18.708
  328   3HZ   LYS  43          3HZ       LYS  43   7.490 -10.895 -17.038
  329    H    VAL  44           H        VAL  44   5.920  -3.640 -14.663
  330    HA   VAL  44           HA       VAL  44   4.406  -2.006 -16.567
  331    HB   VAL  44           HB       VAL  44   2.592  -2.273 -15.249
  332   1HG1  VAL  44          1HG1      VAL  44   4.200  -4.214 -13.589
  333   2HG1  VAL  44          2HG1      VAL  44   3.767  -4.561 -15.262
  334   3HG1  VAL  44          3HG1      VAL  44   2.503  -4.313 -14.058
  335   1HG2  VAL  44          1HG2      VAL  44   2.786  -2.231 -12.674
  336   2HG2  VAL  44          2HG2      VAL  44   3.103  -0.726 -13.535
  337   3HG2  VAL  44          3HG2      VAL  44   4.445  -1.703 -12.934
  338    H    MET  45           H        MET  45   6.362  -1.679 -13.632
  339    HA   MET  45           HA       MET  45   5.980   1.119 -13.307
  340   1HB   MET  45          2HB       MET  45   7.321  -0.909 -11.905
  341   2HB   MET  45          1HB       MET  45   8.581   0.228 -12.384
  342   1HG   MET  45          2HG       MET  45   7.907   1.318 -10.487
  343   2HG   MET  45          1HG       MET  45   6.682   1.977 -11.570
  344   1HE   MET  45          1HE       MET  45   4.367   0.458 -12.060
  345   2HE   MET  45          2HE       MET  45   4.415   1.977 -11.168
  346   3HE   MET  45          3HE       MET  45   3.439   0.639 -10.566
  347    H    ARG  46           H        ARG  46   8.553  -0.794 -14.863
  348    HA   ARG  46           HA       ARG  46  10.127   1.423 -15.692
  349   1HB   ARG  46          2HB       ARG  46   9.916  -1.348 -16.895
  350   2HB   ARG  46          1HB       ARG  46  11.157  -0.161 -17.298
  351   1HG   ARG  46          2HG       ARG  46  12.100  -0.240 -15.125
  352   2HG   ARG  46          1HG       ARG  46  10.676  -1.025 -14.445
  353   1HD   ARG  46          2HD       ARG  46  11.945  -2.907 -14.673
  354   2HD   ARG  46          1HD       ARG  46  11.338  -2.851 -16.324
  355    HE   ARG  46           HE       ARG  46  13.701  -1.304 -16.169
  356   1HH1  ARG  46          2HH1      ARG  46  12.615  -4.619 -15.985
  357   2HH1  ARG  46          1HH1      ARG  46  14.107  -5.272 -16.572
  358   1HH2  ARG  46          1HH2      ARG  46  15.649  -2.184 -16.937
  359   2HH2  ARG  46          2HH2      ARG  46  15.819  -3.898 -17.109
  360    H    MET  47           H        MET  47   7.349  -0.215 -17.090
  361    HA   MET  47           HA       MET  47   7.490   1.012 -19.676
  362   1HB   MET  47          2HB       MET  47   5.651  -0.741 -18.239
  363   2HB   MET  47          1HB       MET  47   4.799   0.467 -19.197
  364   1HG   MET  47          2HG       MET  47   5.233  -1.555 -20.534
  365   2HG   MET  47          1HG       MET  47   6.114  -0.174 -21.185
  366   1HE   MET  47          1HE       MET  47   7.969  -0.308 -22.028
  367   2HE   MET  47          2HE       MET  47   9.361  -1.342 -21.719
  368   3HE   MET  47          3HE       MET  47   9.065   0.055 -20.688
  369    H    LEU  48           H        LEU  48   6.039   1.846 -16.584
  370    HA   LEU  48           HA       LEU  48   4.529   4.103 -17.531
  371   1HB   LEU  48          2HB       LEU  48   5.218   2.895 -14.913
  372   2HB   LEU  48          1HB       LEU  48   4.857   4.605 -14.901
  373    HG   LEU  48           HG       LEU  48   2.621   4.251 -15.576
  374   1HD1  LEU  48          1HD1      LEU  48   2.322   2.772 -17.268
  375   2HD1  LEU  48          2HD1      LEU  48   2.203   1.543 -16.008
  376   3HD1  LEU  48          3HD1      LEU  48   3.744   1.836 -16.811
  377   1HD2  LEU  48          1HD2      LEU  48   2.616   3.630 -13.337
  378   2HD2  LEU  48          2HD2      LEU  48   3.673   2.244 -13.611
  379   3HD2  LEU  48          3HD2      LEU  48   1.972   2.162 -14.075
  380    H    GLY  49           H        GLY  49   7.749   3.567 -16.224
  381   1HA   GLY  49          2HA       GLY  49   9.435   5.201 -17.151
  382   2HA   GLY  49          1HA       GLY  49   8.366   6.449 -16.524
  383    H    GLN  50           H        GLN  50   8.991   3.429 -14.803
  384    HA   GLN  50           HA       GLN  50  10.701   4.877 -12.873
  385   1HB   GLN  50          2HB       GLN  50   8.580   2.884 -12.056
  386   2HB   GLN  50          1HB       GLN  50   9.542   3.925 -11.009
  387   1HG   GLN  50          2HG       GLN  50   7.606   4.973 -13.089
  388   2HG   GLN  50          1HG       GLN  50   7.180   4.734 -11.396
  389   1HE2  GLN  50          1HE2      GLN  50   7.699   7.254 -13.235
  390   2HE2  GLN  50          2HE2      GLN  50   8.691   8.222 -12.256
  391    H    ASN  51           H        ASN  51  12.524   3.840 -12.397
  392    HA   ASN  51           HA       ASN  51  12.680   0.919 -12.888
  393   1HB   ASN  51          2HB       ASN  51  14.781   3.003 -13.547
  394   2HB   ASN  51          1HB       ASN  51  15.019   1.260 -13.659
  395   1HD2  ASN  51          1HD2      ASN  51  13.015   3.933 -14.993
  396   2HD2  ASN  51          2HD2      ASN  51  12.671   3.143 -16.454
  397    HA   PRO  52           HA       PRO  52  14.193   1.809  -8.622
  398   1HB   PRO  52          2HB       PRO  52  12.582   0.007  -7.350
  399   2HB   PRO  52          1HB       PRO  52  12.087   1.661  -7.736
  400   1HG   PRO  52          2HG       PRO  52  11.264  -0.885  -8.978
  401   2HG   PRO  52          1HG       PRO  52  10.410   0.664  -8.914
  402   1HD   PRO  52          2HD       PRO  52  11.878  -0.392 -11.128
  403   2HD   PRO  52          1HD       PRO  52  11.170   1.234 -10.992
  404    H    THR  53           H        THR  53  14.358  -0.306  -6.828
  405    HA   THR  53           HA       THR  53  16.252  -2.144  -8.166
  406    HB   THR  53           HB       THR  53  17.468  -2.242  -6.162
  407    HG1  THR  53           HG1      THR  53  16.553  -2.199  -4.254
  408   1HG2  THR  53          1HG2      THR  53  17.795   0.031  -5.401
  409   2HG2  THR  53          2HG2      THR  53  16.207   0.503  -6.005
  410   3HG2  THR  53          3HG2      THR  53  17.484   0.058  -7.138
  411    HA   PRO  54           HA       PRO  54  13.752  -5.633  -7.069
  412   1HB   PRO  54          2HB       PRO  54  15.443  -7.410  -5.846
  413   2HB   PRO  54          1HB       PRO  54  15.449  -7.075  -7.585
  414   1HG   PRO  54          2HG       PRO  54  17.346  -6.176  -5.484
  415   2HG   PRO  54          1HG       PRO  54  17.633  -6.496  -7.201
  416   1HD   PRO  54          2HD       PRO  54  17.343  -3.961  -6.046
  417   2HD   PRO  54          1HD       PRO  54  17.202  -4.318  -7.782
  418    H    GLU  55           H        GLU  55  15.582  -4.263  -4.411
  419    HA   GLU  55           HA       GLU  55  14.026  -5.537  -2.327
  420   1HB   GLU  55          2HB       GLU  55  16.078  -3.318  -2.336
  421   2HB   GLU  55          1HB       GLU  55  15.194  -3.772  -0.880
  422   1HG   GLU  55          2HG       GLU  55  15.960  -6.185  -1.388
  423   2HG   GLU  55          1HG       GLU  55  17.114  -5.448  -2.500
  424    H    GLU  56           H        GLU  56  14.174  -2.371  -3.939
  425    HA   GLU  56           HA       GLU  56  12.097  -1.186  -2.351
  426   1HB   GLU  56          2HB       GLU  56  13.983  -0.109  -3.924
  427   2HB   GLU  56          1HB       GLU  56  12.655  -0.149  -5.085
  428   1HG   GLU  56          2HG       GLU  56  11.298   1.252  -3.770
  429   2HG   GLU  56          1HG       GLU  56  12.221   0.928  -2.303
  430    H    LEU  57           H        LEU  57  12.236  -2.877  -5.461
  431    HA   LEU  57           HA       LEU  57   9.689  -2.348  -6.449
  432   1HB   LEU  57          2HB       LEU  57  11.160  -3.450  -7.887
  433   2HB   LEU  57          1HB       LEU  57  11.615  -4.631  -6.685
  434    HG   LEU  57           HG       LEU  57  10.235  -5.434  -8.664
  435   1HD1  LEU  57          1HD1      LEU  57   9.664  -7.195  -7.364
  436   2HD1  LEU  57          2HD1      LEU  57   8.653  -6.204  -6.312
  437   3HD1  LEU  57          3HD1      LEU  57  10.397  -6.274  -6.050
  438   1HD2  LEU  57          1HD2      LEU  57   8.581  -3.336  -7.931
  439   2HD2  LEU  57          2HD2      LEU  57   7.736  -4.747  -7.298
  440   3HD2  LEU  57          3HD2      LEU  57   8.139  -4.657  -9.012
  441    H    GLN  58           H        GLN  58  10.794  -4.949  -4.269
  442    HA   GLN  58           HA       GLN  58   8.175  -6.058  -3.902
  443   1HB   GLN  58          2HB       GLN  58  10.848  -6.706  -3.067
  444   2HB   GLN  58          1HB       GLN  58   9.779  -6.727  -1.665
  445   1HG   GLN  58          2HG       GLN  58   9.321  -8.208  -4.276
  446   2HG   GLN  58          1HG       GLN  58   9.802  -8.935  -2.743
  447   1HE2  GLN  58          1HE2      GLN  58   7.110  -8.395  -4.656
  448   2HE2  GLN  58          2HE2      GLN  58   5.911  -8.436  -3.458
  449    H    GLU  59           H        GLU  59  10.095  -3.619  -2.229
  450    HA   GLU  59           HA       GLU  59   8.642  -3.416   0.168
  451   1HB   GLU  59          2HB       GLU  59  10.391  -1.575  -1.397
  452   2HB   GLU  59          1HB       GLU  59   9.371  -0.864  -0.148
  453   1HG   GLU  59          2HG       GLU  59  10.348  -2.219   1.559
  454   2HG   GLU  59          1HG       GLU  59  11.140  -3.261   0.377
  455    H    MET  60           H        MET  60   8.162  -1.795  -2.971
  456    HA   MET  60           HA       MET  60   5.994  -0.154  -2.219
  457   1HB   MET  60          2HB       MET  60   6.546  -1.373  -4.937
  458   2HB   MET  60          1HB       MET  60   5.483  -0.005  -4.615
  459   1HG   MET  60          2HG       MET  60   7.681   0.952  -3.442
  460   2HG   MET  60          1HG       MET  60   8.463  -0.143  -4.580
  461   1HE   MET  60          1HE       MET  60   6.231   3.725  -5.286
  462   2HE   MET  60          2HE       MET  60   6.586   2.865  -3.791
  463   3HE   MET  60          3HE       MET  60   5.221   2.363  -4.784
  464    H    ILE  61           H        ILE  61   6.097  -3.382  -3.650
  465    HA   ILE  61           HA       ILE  61   3.313  -3.799  -3.866
  466    HB   ILE  61           HB       ILE  61   5.500  -5.854  -3.451
  467   1HG1  ILE  61          2HG1      ILE  61   4.199  -5.203  -6.078
  468   2HG1  ILE  61          1HG1      ILE  61   5.479  -4.149  -5.477
  469   1HG2  ILE  61          1HG2      ILE  61   3.898  -7.427  -4.443
  470   2HG2  ILE  61          2HG2      ILE  61   2.699  -6.143  -4.587
  471   3HG2  ILE  61          3HG2      ILE  61   3.204  -6.702  -2.993
  472   1HD1  ILE  61          1HD1      ILE  61   7.023  -6.014  -5.336
  473   2HD1  ILE  61          2HD1      ILE  61   6.321  -5.992  -6.952
  474   3HD1  ILE  61          3HD1      ILE  61   5.748  -7.154  -5.757
  475    H    ASP  62           H        ASP  62   5.574  -4.954  -1.347
  476    HA   ASP  62           HA       ASP  62   3.732  -6.160   0.350
  477   1HB   ASP  62          2HB       ASP  62   6.368  -5.940   0.462
  478   2HB   ASP  62          1HB       ASP  62   5.985  -4.618   1.563
  479    H    GLU  63           H        GLU  63   4.380  -2.739  -0.097
  480    HA   GLU  63           HA       GLU  63   2.924  -1.980   2.311
  481   1HB   GLU  63          2HB       GLU  63   4.394  -0.465   0.171
  482   2HB   GLU  63          1HB       GLU  63   3.327   0.372   1.298
  483   1HG   GLU  63          2HG       GLU  63   4.607  -0.320   3.187
  484   2HG   GLU  63          1HG       GLU  63   5.497  -1.512   2.241
  485    H    VAL  64           H        VAL  64   2.506  -1.572  -1.227
  486    HA   VAL  64           HA       VAL  64  -0.039  -0.285  -0.966
  487    HB   VAL  64           HB       VAL  64   1.442   0.059  -2.919
  488   1HG1  VAL  64          1HG1      VAL  64   1.960  -2.517  -2.969
  489   2HG1  VAL  64          2HG1      VAL  64   1.921  -1.606  -4.478
  490   3HG1  VAL  64          3HG1      VAL  64   0.535  -2.590  -4.008
  491   1HG2  VAL  64          1HG2      VAL  64  -0.334   0.427  -4.340
  492   2HG2  VAL  64          2HG2      VAL  64  -1.237   0.097  -2.863
  493   3HG2  VAL  64          3HG2      VAL  64  -1.023  -1.173  -4.067
  494    H    ASP  65           H        ASP  65   0.946  -3.634  -1.657
  495    HA   ASP  65           HA       ASP  65  -1.696  -4.576  -2.197
  496   1HB   ASP  65          2HB       ASP  65   0.885  -5.639  -2.370
  497   2HB   ASP  65          1HB       ASP  65   0.090  -6.612  -1.137
  498    H    GLU  66           H        GLU  66  -3.235  -4.370  -0.701
  499    HA   GLU  66           HA       GLU  66  -2.816  -4.287   2.105
  500   1HB   GLU  66          2HB       GLU  66  -5.388  -5.003   0.672
  501   2HB   GLU  66          1HB       GLU  66  -5.229  -4.386   2.316
  502   1HG   GLU  66          2HG       GLU  66  -4.224  -2.296   1.403
  503   2HG   GLU  66          1HG       GLU  66  -4.491  -2.912  -0.228
  504    H    ASP  67           H        ASP  67  -4.016  -6.832  -0.041
  505    HA   ASP  67           HA       ASP  67  -4.144  -8.786   2.094
  506   1HB   ASP  67          2HB       ASP  67  -4.615 -10.378   0.133
  507   2HB   ASP  67          1HB       ASP  67  -5.804  -9.119   0.459
  508    H    GLY  68           H        GLY  68  -1.985  -8.060  -0.617
  509   1HA   GLY  68          2HA       GLY  68   0.239  -8.638  -0.921
  510   2HA   GLY  68          1HA       GLY  68   0.204  -9.435   0.649
  511    H    SER  69           H        SER  69  -1.711  -9.940  -2.305
  512    HA   SER  69           HA       SER  69  -1.321 -12.820  -2.100
  513   1HB   SER  69          2HB       SER  69  -2.934 -12.910  -3.986
  514   2HB   SER  69          1HB       SER  69  -3.554 -12.011  -2.604
  515    HG   SER  69           HG       SER  69  -3.901 -10.592  -4.163
  516    H    GLY  70           H        GLY  70   0.668 -10.543  -3.305
  517   1HA   GLY  70          2HA       GLY  70   2.460 -10.693  -4.753
  518   2HA   GLY  70          1HA       GLY  70   1.974 -12.348  -5.114
  519    H    THR  71           H        THR  71  -0.413  -9.852  -5.408
  520    HA   THR  71           HA       THR  71   0.018  -9.528  -8.286
  521    HB   THR  71           HB       THR  71  -2.226 -10.213  -8.879
  522    HG1  THR  71           HG1      THR  71  -3.527  -9.824  -7.234
  523   1HG2  THR  71          1HG2      THR  71  -2.126 -12.614  -8.333
  524   2HG2  THR  71          2HG2      THR  71  -0.944 -12.279  -7.066
  525   3HG2  THR  71          3HG2      THR  71  -0.528 -11.999  -8.758
  526    H    VAL  72           H        VAL  72  -0.400  -7.482  -8.888
  527    HA   VAL  72           HA       VAL  72  -1.624  -5.687  -6.922
  528    HB   VAL  72           HB       VAL  72  -0.562  -4.840  -9.610
  529   1HG1  VAL  72          1HG1      VAL  72  -1.902  -3.287  -8.125
  530   2HG1  VAL  72          2HG1      VAL  72  -0.281  -2.713  -8.519
  531   3HG1  VAL  72          3HG1      VAL  72  -0.606  -3.420  -6.936
  532   1HG2  VAL  72          1HG2      VAL  72   1.615  -4.419  -8.463
  533   2HG2  VAL  72          2HG2      VAL  72   1.234  -6.140  -8.567
  534   3HG2  VAL  72          3HG2      VAL  72   1.005  -5.275  -7.046
  535    H    ASP  73           H        ASP  73  -3.722  -5.345  -6.972
  536    HA   ASP  73           HA       ASP  73  -5.323  -5.927  -9.330
  537   1HB   ASP  73          2HB       ASP  73  -6.066  -4.772  -6.623
  538   2HB   ASP  73          1HB       ASP  73  -7.223  -5.176  -7.891
  539    H    PHE  74           H        PHE  74  -6.902  -4.187 -10.120
  540    HA   PHE  74           HA       PHE  74  -5.465  -1.944 -11.004
  541   1HB   PHE  74          2HB       PHE  74  -7.608  -2.866 -12.023
  542   2HB   PHE  74          1HB       PHE  74  -8.475  -1.977 -10.768
  543    HD1  PHE  74           HD1      PHE  74  -5.398  -1.167 -12.745
  544    HD2  PHE  74           HD2      PHE  74  -9.434  -0.081 -11.760
  545    HE1  PHE  74           HE1      PHE  74  -5.161   0.914 -14.065
  546    HE2  PHE  74           HE2      PHE  74  -9.194   2.004 -13.080
  547    HZ   PHE  74           HZ       PHE  74  -7.059   2.501 -14.233
  548    H    ASP  75           H        ASP  75  -7.501  -2.405  -8.165
  549    HA   ASP  75           HA       ASP  75  -7.666   0.329  -7.380
  550   1HB   ASP  75          2HB       ASP  75  -7.807  -2.200  -5.712
  551   2HB   ASP  75          1HB       ASP  75  -8.215  -0.586  -5.130
  552    H    GLU  76           H        GLU  76  -5.430  -2.318  -6.579
  553    HA   GLU  76           HA       GLU  76  -3.789  -0.754  -4.815
  554   1HB   GLU  76          2HB       GLU  76  -3.052  -3.306  -6.275
  555   2HB   GLU  76          1HB       GLU  76  -2.264  -2.642  -4.845
  556   1HG   GLU  76          2HG       GLU  76  -4.302  -2.961  -3.527
  557   2HG   GLU  76          1HG       GLU  76  -5.167  -3.523  -4.955
  558    H    PHE  77           H        PHE  77  -3.886  -1.373  -8.251
  559    HA   PHE  77           HA       PHE  77  -1.267  -0.591  -8.960
  560   1HB   PHE  77          2HB       PHE  77  -3.302  -1.685 -10.330
  561   2HB   PHE  77          1HB       PHE  77  -3.521  -0.013 -10.819
  562    HD1  PHE  77           HD1      PHE  77  -3.041  -0.831 -13.133
  563    HD2  PHE  77           HD2      PHE  77  -0.090  -0.980 -10.001
  564    HE1  PHE  77           HE1      PHE  77  -1.244  -1.107 -14.817
  565    HE2  PHE  77           HE2      PHE  77   1.688  -1.242 -11.692
  566    HZ   PHE  77           HZ       PHE  77   1.115  -1.311 -14.103
  567    H    LEU  78           H        LEU  78  -4.335   1.249  -9.092
  568    HA   LEU  78           HA       LEU  78  -3.074   3.726  -9.758
  569   1HB   LEU  78          2HB       LEU  78  -5.809   2.888  -8.930
  570   2HB   LEU  78          1HB       LEU  78  -5.388   4.583  -8.778
  571    HG   LEU  78           HG       LEU  78  -5.112   4.827 -11.123
  572   1HD1  LEU  78          1HD1      LEU  78  -3.802   2.728 -11.447
  573   2HD1  LEU  78          2HD1      LEU  78  -5.034   2.964 -12.686
  574   3HD1  LEU  78          3HD1      LEU  78  -5.309   1.814 -11.374
  575   1HD2  LEU  78          1HD2      LEU  78  -7.453   4.711 -10.500
  576   2HD2  LEU  78          2HD2      LEU  78  -7.420   2.948 -10.546
  577   3HD2  LEU  78          3HD2      LEU  78  -7.250   3.874 -12.039
  578    H    VAL  79           H        VAL  79  -3.891   2.125  -6.744
  579    HA   VAL  79           HA       VAL  79  -3.687   4.328  -4.988
  580    HB   VAL  79           HB       VAL  79  -3.563   1.362  -4.733
  581   1HG1  VAL  79          1HG1      VAL  79  -1.611   2.020  -3.411
  582   2HG1  VAL  79          2HG1      VAL  79  -2.926   1.518  -2.347
  583   3HG1  VAL  79          3HG1      VAL  79  -2.572   3.233  -2.562
  584   1HG2  VAL  79          1HG2      VAL  79  -4.937   3.386  -2.964
  585   2HG2  VAL  79          2HG2      VAL  79  -5.391   1.710  -3.275
  586   3HG2  VAL  79          3HG2      VAL  79  -5.605   2.929  -4.531
  587    H    MET  80           H        MET  80  -1.260   1.976  -6.114
  588    HA   MET  80           HA       MET  80   0.970   2.761  -4.685
  589   1HB   MET  80          2HB       MET  80   0.491   1.117  -6.891
  590   2HB   MET  80          1HB       MET  80   1.661   2.301  -7.472
  591   1HG   MET  80          2HG       MET  80   3.050   1.835  -5.430
  592   2HG   MET  80          1HG       MET  80   1.927   0.539  -5.020
  593   1HE   MET  80          1HE       MET  80   1.086  -0.970  -6.503
  594   2HE   MET  80          2HE       MET  80   2.328  -2.207  -6.661
  595   3HE   MET  80          3HE       MET  80   1.685  -1.429  -8.103
  596    H    MET  81           H        MET  81  -0.550   4.390  -7.408
  597    HA   MET  81           HA       MET  81   1.568   6.173  -8.051
  598   1HB   MET  81          2HB       MET  81  -0.644   5.605  -9.344
  599   2HB   MET  81          1HB       MET  81  -1.312   6.933  -8.395
  600   1HG   MET  81          2HG       MET  81   1.027   8.051  -9.241
  601   2HG   MET  81          1HG       MET  81   0.653   7.000 -10.606
  602   1HE   MET  81          1HE       MET  81  -1.954   6.525 -10.690
  603   2HE   MET  81          2HE       MET  81  -1.969   7.493 -12.160
  604   3HE   MET  81          3HE       MET  81  -3.158   7.802 -10.898
  605    H    VAL  82           H        VAL  82  -1.267   6.480  -5.915
  606    HA   VAL  82           HA       VAL  82  -0.561   9.166  -5.106
  607    HB   VAL  82           HB       VAL  82  -2.433   8.957  -3.519
  608   1HG1  VAL  82          1HG1      VAL  82  -2.870   8.063  -6.374
  609   2HG1  VAL  82          2HG1      VAL  82  -3.054   9.683  -5.701
  610   3HG1  VAL  82          3HG1      VAL  82  -4.212   8.419  -5.287
  611   1HG2  VAL  82          1HG2      VAL  82  -3.656   6.956  -3.217
  612   2HG2  VAL  82          2HG2      VAL  82  -1.974   6.427  -3.184
  613   3HG2  VAL  82          3HG2      VAL  82  -2.940   6.203  -4.643
  614    H    ARG  83           H        ARG  83  -0.027   5.922  -3.897
  615    HA   ARG  83           HA       ARG  83   0.688   6.531  -1.232
  616   1HB   ARG  83          2HB       ARG  83   1.636   4.287  -3.032
  617   2HB   ARG  83          1HB       ARG  83   1.933   4.371  -1.296
  618   1HG   ARG  83          2HG       ARG  83  -0.786   4.800  -1.436
  619   2HG   ARG  83          1HG       ARG  83  -0.524   3.648  -2.745
  620   1HD   ARG  83          2HD       ARG  83   0.218   1.983  -1.322
  621   2HD   ARG  83          1HD       ARG  83   0.810   3.126  -0.121
  622    HE   ARG  83           HE       ARG  83  -2.060   3.182  -0.382
  623   1HH1  ARG  83          2HH1      ARG  83   0.643   1.521   1.079
  624   2HH1  ARG  83          1HH1      ARG  83  -0.289   0.907   2.401
  625   1HH2  ARG  83          1HH2      ARG  83  -3.261   2.364   1.355
  626   2HH2  ARG  83          2HH2      ARG  83  -2.494   1.384   2.560
  627    H    CYS  84           H        CYS  84   2.602   6.373  -4.224
  628    HA   CYS  84           HA       CYS  84   5.124   6.829  -2.977
  629   1HB   CYS  84          2HB       CYS  84   6.027   7.065  -5.143
  630   2HB   CYS  84          1HB       CYS  84   4.700   5.923  -5.339
  631    HG   CYS  84           HG       CYS  84   3.352   7.662  -6.586
  632    H    MET  85           H        MET  85   2.548   8.962  -3.992
  633    HA   MET  85           HA       MET  85   4.183  11.359  -3.844
  634   1HB   MET  85          2HB       MET  85   1.391  10.711  -4.597
  635   2HB   MET  85          1HB       MET  85   1.641  12.298  -3.870
  636   1HG   MET  85          2HG       MET  85   3.573  11.434  -5.975
  637   2HG   MET  85          1HG       MET  85   1.952  11.890  -6.498
  638   1HE   MET  85          1HE       MET  85   5.076  13.049  -6.751
  639   2HE   MET  85          2HE       MET  85   4.813  14.785  -6.899
  640   3HE   MET  85          3HE       MET  85   3.825  13.668  -7.838
  641    H    LYS  86           H        LYS  86   1.474   9.953  -1.976
  642    HA   LYS  86           HA       LYS  86   2.444  11.425   0.394
  643   1HB   LYS  86          2HB       LYS  86   0.392  12.495  -0.687
  644   2HB   LYS  86          1HB       LYS  86  -0.491  11.050  -0.198
  645   1HG   LYS  86          2HG       LYS  86   1.145  12.186   1.961
  646   2HG   LYS  86          1HG       LYS  86  -0.099  13.291   1.379
  647   1HD   LYS  86          2HD       LYS  86  -1.821  11.584   1.717
  648   2HD   LYS  86          1HD       LYS  86  -0.595  10.417   2.214
  649   1HE   LYS  86          2HE       LYS  86  -1.398  11.214   4.270
  650   2HE   LYS  86          1HE       LYS  86   0.035  12.208   4.009
  651   1HZ   LYS  86          1HZ       LYS  86  -1.961  13.481   4.676
  652   2HZ   LYS  86          2HZ       LYS  86  -2.714  13.012   3.227
  653   3HZ   LYS  86          3HZ       LYS  86  -1.316  13.978   3.189
  654    H    ASP  87           H        ASP  87   3.194   9.859   1.655
  655    HA   ASP  87           HA       ASP  87   1.477   7.992   2.918
  656   1HB   ASP  87          2HB       ASP  87   1.902   6.946   0.563
  657   2HB   ASP  87          1HB       ASP  87   3.510   6.591   1.188
  658    H    ASP  88           H        ASP  88   2.762   9.559   4.346
  659    HA   ASP  88           HA       ASP  88   4.877   8.060   5.625
  660   1HB   ASP  88          2HB       ASP  88   5.971   9.436   3.717
  661   2HB   ASP  88          1HB       ASP  88   5.642  10.836   4.738
  662    H    SER  89           HN       SER  89   3.657  11.418   5.403
  663    HA   SER  89           HA       SER  89   2.715  12.815   6.957
  664   1HB   SER  89          2HB       SER  89   1.532  10.525   7.542
  665   2HB   SER  89          1HB       SER  89   2.514  10.644   8.999
  666    HG   SER  89           HG       SER  89   0.939  11.907   9.622
  Start of MODEL   33
    1   1H    MET   1          1H        MET   1  -4.921   7.464  10.172
    2   2H    MET   1          2H        MET   1  -5.534   8.703  11.157
    3   3H    MET   1          3H        MET   1  -4.298   9.035  10.039
    4    HA   MET   1           HA       MET   1  -6.933   8.011   9.177
    5   1HB   MET   1          2HB       MET   1  -7.377  10.489   8.601
    6   2HB   MET   1          1HB       MET   1  -7.577  10.003  10.283
    7   1HG   MET   1          2HG       MET   1  -5.744  11.191  10.988
    8   2HG   MET   1          1HG       MET   1  -4.862  10.930   9.485
    9   1HE   MET   1          1HE       MET   1  -4.217  13.110  10.419
   10   2HE   MET   1          2HE       MET   1  -5.427  14.226  11.045
   11   3HE   MET   1          3HE       MET   1  -4.672  14.540   9.484
   12    H    ASN   2           H        ASN   2  -6.411   7.114   7.293
   13    HA   ASN   2           HA       ASN   2  -4.636   8.615   5.452
   14   1HB   ASN   2          2HB       ASN   2  -4.971   5.612   5.695
   15   2HB   ASN   2          1HB       ASN   2  -3.988   6.432   4.482
   16   1HD2  ASN   2          1HD2      ASN   2  -4.361   6.245   8.066
   17   2HD2  ASN   2          2HD2      ASN   2  -2.706   6.445   8.392
   18    H    ASP   3           H        ASP   3  -7.541   8.813   5.774
   19    HA   ASP   3           HA       ASP   3  -8.856   7.395   3.673
   20   1HB   ASP   3          2HB       ASP   3  -9.589   9.835   5.287
   21   2HB   ASP   3          1HB       ASP   3 -10.623   9.222   3.995
   22    H    ILE   4           H        ILE   4  -6.950  10.306   3.768
   23    HA   ILE   4           HA       ILE   4  -7.906  11.658   1.512
   24    HB   ILE   4           HB       ILE   4  -5.825  12.824   1.400
   25   1HG1  ILE   4          2HG1      ILE   4  -4.405  10.701   1.502
   26   2HG1  ILE   4          1HG1      ILE   4  -3.768  12.093   2.367
   27   1HG2  ILE   4          1HG2      ILE   4  -5.570  13.589   3.677
   28   2HG2  ILE   4          2HG2      ILE   4  -6.265  12.097   4.307
   29   3HG2  ILE   4          3HG2      ILE   4  -7.272  13.224   3.399
   30   1HD1  ILE   4          1HD1      ILE   4  -3.501  10.300   3.882
   31   2HD1  ILE   4          2HD1      ILE   4  -5.085   9.626   3.500
   32   3HD1  ILE   4          3HD1      ILE   4  -4.961  11.112   4.442
   33    H    TYR   5           H        TYR   5  -5.917   8.789   1.739
   34    HA   TYR   5           HA       TYR   5  -4.819   8.720  -0.853
   35   1HB   TYR   5          2HB       TYR   5  -5.564   6.588   1.139
   36   2HB   TYR   5          1HB       TYR   5  -5.011   6.143  -0.475
   37    HD1  TYR   5           HD1      TYR   5  -4.057   8.581   2.224
   38    HD2  TYR   5           HD2      TYR   5  -2.734   5.736  -0.707
   39    HE1  TYR   5           HE1      TYR   5  -1.717   8.958   2.922
   40    HE2  TYR   5           HE2      TYR   5  -0.387   6.112  -0.005
   41    HH   TYR   5           HH       TYR   5   0.633   7.124   2.562
   42    H    LYS   6           H        LYS   6  -7.931   7.573   0.411
   43    HA   LYS   6           HA       LYS   6  -8.862   6.438  -2.039
   44   1HB   LYS   6          2HB       LYS   6  -9.727   6.270   0.512
   45   2HB   LYS   6          1HB       LYS   6 -10.857   7.476  -0.103
   46   1HG   LYS   6          2HG       LYS   6 -12.012   5.588  -0.730
   47   2HG   LYS   6          1HG       LYS   6 -10.974   5.738  -2.147
   48   1HD   LYS   6          2HD       LYS   6 -10.687   3.488  -1.518
   49   2HD   LYS   6          1HD       LYS   6  -9.292   4.286  -0.791
   50   1HE   LYS   6          2HE       LYS   6 -10.061   3.082   1.034
   51   2HE   LYS   6          1HE       LYS   6 -10.954   4.585   1.260
   52   1HZ   LYS   6          1HZ       LYS   6 -12.427   2.705   1.445
   53   2HZ   LYS   6          2HZ       LYS   6 -11.957   2.132  -0.083
   54   3HZ   LYS   6          3HZ       LYS   6 -12.819   3.591   0.053
   55    H    ALA   7           H        ALA   7  -9.110   9.645  -0.565
   56    HA   ALA   7           HA       ALA   7 -11.062  10.715  -2.311
   57   1HB   ALA   7          1HB       ALA   7 -10.067  12.940  -1.646
   58   2HB   ALA   7          2HB       ALA   7  -8.856  12.042  -0.729
   59   3HB   ALA   7          3HB       ALA   7 -10.560  11.914  -0.298
   60    H    ALA   8           H        ALA   8  -7.615  10.165  -2.692
   61    HA   ALA   8           HA       ALA   8  -7.227  11.944  -4.902
   62   1HB   ALA   8          1HB       ALA   8  -5.298  11.244  -3.635
   63   2HB   ALA   8          2HB       ALA   8  -5.141  10.605  -5.271
   64   3HB   ALA   8          3HB       ALA   8  -5.646   9.545  -3.955
   65    H    VAL   9           H        VAL   9  -7.807   8.438  -4.620
   66    HA   VAL   9           HA       VAL   9  -7.826   7.993  -7.451
   67    HB   VAL   9           HB       VAL   9  -7.372   6.254  -5.666
   68   1HG1  VAL   9          1HG1      VAL   9  -9.439   5.083  -4.811
   69   2HG1  VAL   9          2HG1      VAL   9 -10.380   6.460  -5.381
   70   3HG1  VAL   9          3HG1      VAL   9  -9.161   6.681  -4.125
   71   1HG2  VAL   9          1HG2      VAL   9  -7.874   5.738  -8.074
   72   2HG2  VAL   9          2HG2      VAL   9  -9.574   5.561  -7.638
   73   3HG2  VAL   9          3HG2      VAL   9  -8.372   4.458  -6.967
   74    H    GLU  10           H        GLU  10 -10.150   9.116  -5.137
   75    HA   GLU  10           HA       GLU  10 -12.476   8.564  -6.779
   76   1HB   GLU  10          2HB       GLU  10 -12.031  10.025  -4.182
   77   2HB   GLU  10          1HB       GLU  10 -13.574  10.114  -5.028
   78   1HG   GLU  10          2HG       GLU  10 -13.864   7.723  -4.906
   79   2HG   GLU  10          1HG       GLU  10 -12.223   7.503  -4.297
   80    H    GLN  11           H        GLN  11 -10.117  11.113  -6.476
   81    HA   GLN  11           HA       GLN  11 -11.811  12.850  -8.177
   82   1HB   GLN  11          2HB       GLN  11 -11.018  14.769  -7.098
   83   2HB   GLN  11          1HB       GLN  11 -11.239  13.628  -5.773
   84   1HG   GLN  11          2HG       GLN  11  -8.699  13.024  -6.376
   85   2HG   GLN  11          1HG       GLN  11  -8.711  14.682  -6.971
   86   1HE2  GLN  11          1HE2      GLN  11 -10.603  15.731  -4.969
   87   2HE2  GLN  11          2HE2      GLN  11  -9.788  15.726  -3.482
   88    H    LEU  12           H        LEU  12  -9.532  10.755  -8.722
   89    HA   LEU  12           HA       LEU  12  -7.396  12.283  -9.871
   90   1HB   LEU  12          2HB       LEU  12  -6.980  10.053 -11.131
   91   2HB   LEU  12          1HB       LEU  12  -6.688  10.150  -9.411
   92    HG   LEU  12           HG       LEU  12  -8.717   8.942  -8.939
   93   1HD1  LEU  12          1HD1      LEU  12 -10.036   8.042 -10.966
   94   2HD1  LEU  12          2HD1      LEU  12  -9.240   9.317 -11.888
   95   3HD1  LEU  12          3HD1      LEU  12 -10.285   9.732 -10.528
   96   1HD2  LEU  12          1HD2      LEU  12  -6.991   7.789 -11.131
   97   2HD2  LEU  12          2HD2      LEU  12  -8.263   6.841 -10.361
   98   3HD2  LEU  12          3HD2      LEU  12  -6.922   7.463  -9.399
   99    H    THR  13           H        THR  13  -6.819  11.899 -12.263
  100    HA   THR  13           HA       THR  13  -9.070  12.897 -13.848
  101    HB   THR  13           HB       THR  13  -6.952  12.805 -15.579
  102    HG1  THR  13           HG1      THR  13  -5.455  12.148 -14.117
  103   1HG2  THR  13          1HG2      THR  13  -7.244  15.043 -15.554
  104   2HG2  THR  13          2HG2      THR  13  -6.910  15.161 -13.826
  105   3HG2  THR  13          3HG2      THR  13  -8.523  14.715 -14.386
  106    H    ASP  14           H        ASP  14  -9.128  12.118 -16.195
  107    HA   ASP  14           HA       ASP  14  -9.658   9.294 -16.205
  108   1HB   ASP  14          2HB       ASP  14 -10.817  11.156 -17.607
  109   2HB   ASP  14          1HB       ASP  14  -9.444  10.969 -18.696
  110    H    GLU  15           H        GLU  15  -7.060  11.400 -17.233
  111    HA   GLU  15           HA       GLU  15  -5.638   9.585 -18.871
  112   1HB   GLU  15          2HB       GLU  15  -3.753  11.088 -18.600
  113   2HB   GLU  15          1HB       GLU  15  -5.225  12.034 -18.800
  114   1HG   GLU  15          2HG       GLU  15  -4.721  13.111 -16.891
  115   2HG   GLU  15          1HG       GLU  15  -4.984  11.601 -16.025
  116    H    GLN  16           H        GLN  16  -5.796  10.046 -15.394
  117    HA   GLN  16           HA       GLN  16  -3.515   8.391 -14.779
  118   1HB   GLN  16          2HB       GLN  16  -5.614   9.825 -13.236
  119   2HB   GLN  16          1HB       GLN  16  -4.886   8.418 -12.463
  120   1HG   GLN  16          2HG       GLN  16  -2.751   9.357 -12.448
  121   2HG   GLN  16          1HG       GLN  16  -3.117  10.451 -13.782
  122   1HE2  GLN  16          1HE2      GLN  16  -4.636   9.848 -10.551
  123   2HE2  GLN  16          2HE2      GLN  16  -4.675  11.487 -10.113
  124    H    LYS  17           H        LYS  17  -7.042   7.996 -14.842
  125    HA   LYS  17           HA       LYS  17  -7.199   5.378 -13.810
  126   1HB   LYS  17          2HB       LYS  17  -8.957   6.845 -15.791
  127   2HB   LYS  17          1HB       LYS  17  -9.340   5.242 -15.165
  128   1HG   LYS  17          2HG       LYS  17  -9.726   6.022 -13.010
  129   2HG   LYS  17          1HG       LYS  17  -8.681   7.427 -13.221
  130   1HD   LYS  17          2HD       LYS  17 -10.863   8.337 -13.263
  131   2HD   LYS  17          1HD       LYS  17 -10.419   8.219 -14.965
  132   1HE   LYS  17          2HE       LYS  17 -11.571   5.965 -15.015
  133   2HE   LYS  17          1HE       LYS  17 -12.172   6.313 -13.395
  134   1HZ   LYS  17          1HZ       LYS  17 -13.761   6.930 -15.130
  135   2HZ   LYS  17          2HZ       LYS  17 -12.631   8.014 -15.788
  136   3HZ   LYS  17          3HZ       LYS  17 -13.261   8.278 -14.232
  137    H    ASN  18           H        ASN  18  -6.756   6.591 -17.117
  138    HA   ASN  18           HA       ASN  18  -6.607   3.939 -18.271
  139   1HB   ASN  18          2HB       ASN  18  -6.308   6.739 -19.304
  140   2HB   ASN  18          1HB       ASN  18  -5.712   5.389 -20.271
  141   1HD2  ASN  18          1HD2      ASN  18  -8.644   6.839 -18.884
  142   2HD2  ASN  18          2HD2      ASN  18  -9.735   5.919 -19.804
  143    H    GLU  19           H        GLU  19  -4.391   6.218 -16.864
  144    HA   GLU  19           HA       GLU  19  -1.971   5.557 -18.089
  145   1HB   GLU  19          2HB       GLU  19  -2.440   7.362 -16.315
  146   2HB   GLU  19          1HB       GLU  19  -2.221   6.081 -15.127
  147   1HG   GLU  19          2HG       GLU  19   0.029   5.713 -15.776
  148   2HG   GLU  19          1HG       GLU  19  -0.170   6.626 -17.273
  149    H    PHE  20           H        PHE  20  -3.372   4.178 -15.104
  150    HA   PHE  20           HA       PHE  20  -1.414   2.043 -15.047
  151   1HB   PHE  20          2HB       PHE  20  -3.760   2.810 -13.337
  152   2HB   PHE  20          1HB       PHE  20  -2.989   1.237 -13.150
  153    HD1  PHE  20           HD1      PHE  20  -2.542   4.884 -12.831
  154    HD2  PHE  20           HD2      PHE  20  -0.708   1.037 -12.321
  155    HE1  PHE  20           HE1      PHE  20  -0.741   5.922 -11.480
  156    HE2  PHE  20           HE2      PHE  20   1.085   2.062 -10.964
  157    HZ   PHE  20           HZ       PHE  20   1.076   4.512 -10.543
  158    H    LYS  21           H        LYS  21  -4.905   2.345 -15.719
  159    HA   LYS  21           HA       LYS  21  -5.562  -0.344 -15.986
  160   1HB   LYS  21          2HB       LYS  21  -7.235   1.441 -16.034
  161   2HB   LYS  21          1HB       LYS  21  -6.634   1.981 -17.598
  162   1HG   LYS  21          2HG       LYS  21  -7.299  -0.892 -17.485
  163   2HG   LYS  21          1HG       LYS  21  -8.679   0.178 -17.250
  164   1HD   LYS  21          2HD       LYS  21  -6.763   0.768 -19.481
  165   2HD   LYS  21          1HD       LYS  21  -7.938  -0.530 -19.691
  166   1HE   LYS  21          2HE       LYS  21  -8.822   2.169 -18.690
  167   2HE   LYS  21          1HE       LYS  21  -8.604   1.888 -20.416
  168   1HZ   LYS  21          1HZ       LYS  21 -10.100  -0.049 -20.195
  169   2HZ   LYS  21          2HZ       LYS  21 -10.860   1.428 -19.837
  170   3HZ   LYS  21          3HZ       LYS  21 -10.390   0.386 -18.581
  171    H    ALA  22           H        ALA  22  -3.886   1.759 -18.282
  172    HA   ALA  22           HA       ALA  22  -4.082   0.113 -20.575
  173   1HB   ALA  22          1HB       ALA  22  -1.934   2.070 -19.730
  174   2HB   ALA  22          2HB       ALA  22  -3.292   2.384 -20.811
  175   3HB   ALA  22          3HB       ALA  22  -1.994   1.300 -21.316
  176    H    ALA  23           H        ALA  23  -1.408   0.438 -18.230
  177    HA   ALA  23           HA       ALA  23   0.096  -1.769 -19.198
  178   1HB   ALA  23          1HB       ALA  23   1.397  -1.556 -17.163
  179   2HB   ALA  23          2HB       ALA  23   0.125  -0.600 -16.402
  180   3HB   ALA  23          3HB       ALA  23   1.030   0.060 -17.765
  181    H    PHE  24           H        PHE  24  -2.405  -1.392 -16.756
  182    HA   PHE  24           HA       PHE  24  -2.234  -3.906 -15.504
  183   1HB   PHE  24          2HB       PHE  24  -3.639  -1.853 -14.833
  184   2HB   PHE  24          1HB       PHE  24  -4.825  -2.436 -15.997
  185    HD1  PHE  24           HD1      PHE  24  -5.695  -4.835 -15.745
  186    HD2  PHE  24           HD2      PHE  24  -3.498  -2.798 -12.672
  187    HE1  PHE  24           HE1      PHE  24  -6.548  -6.444 -14.066
  188    HE2  PHE  24           HE2      PHE  24  -4.349  -4.403 -10.996
  189    HZ   PHE  24           HZ       PHE  24  -5.878  -6.220 -11.688
  190    H    ASP  25           H        ASP  25  -4.159  -2.821 -18.302
  191    HA   ASP  25           HA       ASP  25  -5.521  -5.250 -18.761
  192   1HB   ASP  25          2HB       ASP  25  -5.926  -2.884 -19.764
  193   2HB   ASP  25          1HB       ASP  25  -4.790  -3.401 -21.010
  194    H    ILE  26           H        ILE  26  -2.419  -4.067 -20.069
  195    HA   ILE  26           HA       ILE  26  -2.092  -6.297 -21.844
  196    HB   ILE  26           HB       ILE  26   0.252  -5.493 -22.093
  197   1HG1  ILE  26          2HG1      ILE  26  -0.614  -3.371 -20.099
  198   2HG1  ILE  26          1HG1      ILE  26   0.534  -4.664 -19.758
  199   1HG2  ILE  26          1HG2      ILE  26  -1.860  -3.320 -22.220
  200   2HG2  ILE  26          2HG2      ILE  26  -1.617  -4.571 -23.440
  201   3HG2  ILE  26          3HG2      ILE  26  -0.362  -3.368 -23.148
  202   1HD1  ILE  26          1HD1      ILE  26   2.045  -3.817 -21.487
  203   2HD1  ILE  26          2HD1      ILE  26   1.670  -2.533 -20.338
  204   3HD1  ILE  26          3HD1      ILE  26   0.882  -2.561 -21.915
  205    H    PHE  27           H        PHE  27  -0.945  -5.578 -18.556
  206    HA   PHE  27           HA       PHE  27   0.745  -7.889 -18.398
  207   1HB   PHE  27          2HB       PHE  27  -0.378  -6.063 -16.267
  208   2HB   PHE  27          1HB       PHE  27   0.704  -7.412 -15.914
  209    HD1  PHE  27           HD1      PHE  27   2.560  -7.373 -18.199
  210    HD2  PHE  27           HD2      PHE  27   0.907  -4.108 -15.947
  211    HE1  PHE  27           HE1      PHE  27   4.497  -5.962 -18.821
  212    HE2  PHE  27           HE2      PHE  27   2.845  -2.699 -16.573
  213    HZ   PHE  27           HZ       PHE  27   4.642  -3.623 -18.009
  214    H    ILE  28           H        ILE  28  -2.654  -7.266 -17.623
  215    HA   ILE  28           HA       ILE  28  -2.914  -9.958 -16.471
  216    HB   ILE  28           HB       ILE  28  -5.163  -9.358 -15.839
  217   1HG1  ILE  28          2HG1      ILE  28  -5.680  -6.764 -16.394
  218   2HG1  ILE  28          1HG1      ILE  28  -4.742  -7.180 -17.830
  219   1HG2  ILE  28          1HG2      ILE  28  -2.983  -8.317 -14.717
  220   2HG2  ILE  28          2HG2      ILE  28  -4.601  -7.882 -14.165
  221   3HG2  ILE  28          3HG2      ILE  28  -3.724  -6.809 -15.252
  222   1HD1  ILE  28          1HD1      ILE  28  -7.355  -7.571 -17.789
  223   2HD1  ILE  28          2HD1      ILE  28  -6.907  -9.047 -16.932
  224   3HD1  ILE  28          3HD1      ILE  28  -6.290  -8.749 -18.559
  225    H    GLN  29           H        GLN  29  -2.739  -8.858 -19.516
  226    HA   GLN  29           HA       GLN  29  -4.978  -9.687 -20.927
  227   1HB   GLN  29          2HB       GLN  29  -3.124  -8.543 -22.013
  228   2HB   GLN  29          1HB       GLN  29  -2.059  -9.913 -21.704
  229   1HG   GLN  29          2HG       GLN  29  -3.389 -11.342 -23.146
  230   2HG   GLN  29          1HG       GLN  29  -4.592 -10.069 -23.362
  231   1HE2  GLN  29          1HE2      GLN  29  -3.517  -7.890 -24.230
  232   2HE2  GLN  29          2HE2      GLN  29  -2.383  -8.095 -25.476
  233    H    ASP  30           H        ASP  30  -2.269 -11.615 -19.711
  234    HA   ASP  30           HA       ASP  30  -3.640 -14.080 -20.598
  235   1HB   ASP  30          2HB       ASP  30  -0.749 -13.486 -19.970
  236   2HB   ASP  30          1HB       ASP  30  -1.362 -15.134 -20.098
  237    H    ALA  31           H        ALA  31  -4.175 -12.410 -18.110
  238    HA   ALA  31           HA       ALA  31  -3.471 -14.337 -16.001
  239   1HB   ALA  31          1HB       ALA  31  -4.782 -11.618 -15.733
  240   2HB   ALA  31          2HB       ALA  31  -3.049 -11.910 -15.585
  241   3HB   ALA  31          3HB       ALA  31  -4.167 -12.626 -14.423
  242    H    GLU  32           H        GLU  32  -5.119 -15.087 -14.544
  243    HA   GLU  32           HA       GLU  32  -7.793 -15.234 -15.812
  244   1HB   GLU  32          2HB       GLU  32  -6.283 -17.283 -14.184
  245   2HB   GLU  32          1HB       GLU  32  -8.001 -17.424 -14.560
  246   1HG   GLU  32          2HG       GLU  32  -7.623 -17.784 -16.815
  247   2HG   GLU  32          1HG       GLU  32  -6.114 -16.870 -16.815
  248    H    ASP  33           H        ASP  33  -6.552 -13.392 -13.609
  249    HA   ASP  33           HA       ASP  33  -8.854 -13.649 -11.784
  250   1HB   ASP  33          2HB       ASP  33  -5.970 -13.337 -10.928
  251   2HB   ASP  33          1HB       ASP  33  -7.352 -13.114  -9.856
  252    H    GLY  34           H        GLY  34  -7.577 -11.720 -14.001
  253   1HA   GLY  34          2HA       GLY  34  -7.583  -9.459 -14.433
  254   2HA   GLY  34          1HA       GLY  34  -8.851  -9.369 -13.216
  255    H    CYS  35           H        CYS  35  -5.401 -10.224 -12.966
  256    HA   CYS  35           HA       CYS  35  -4.825  -7.799 -11.430
  257   1HB   CYS  35          2HB       CYS  35  -4.461 -10.585 -10.291
  258   2HB   CYS  35          1HB       CYS  35  -3.807  -9.112  -9.577
  259    HG   CYS  35           HG       CYS  35  -6.752  -9.989  -9.494
  260    H    ILE  36           H        ILE  36  -2.639  -7.240 -11.466
  261    HA   ILE  36           HA       ILE  36  -1.052  -8.650 -13.474
  262    HB   ILE  36           HB       ILE  36   0.430  -6.802 -13.465
  263   1HG1  ILE  36          2HG1      ILE  36  -0.277  -5.007 -11.495
  264   2HG1  ILE  36          1HG1      ILE  36  -0.455  -6.553 -10.665
  265   1HG2  ILE  36          1HG2      ILE  36  -1.790  -6.281 -14.416
  266   2HG2  ILE  36          2HG2      ILE  36  -1.043  -4.850 -13.706
  267   3HG2  ILE  36          3HG2      ILE  36  -2.325  -5.698 -12.839
  268   1HD1  ILE  36          1HD1      ILE  36   1.830  -7.189 -11.312
  269   2HD1  ILE  36          2HD1      ILE  36   1.851  -5.654 -10.446
  270   3HD1  ILE  36          3HD1      ILE  36   2.012  -5.678 -12.202
  271    H    SER  37           H        SER  37   1.298  -9.079 -12.980
  272    HA   SER  37           HA       SER  37   1.441 -10.540 -10.444
  273   1HB   SER  37          2HB       SER  37   2.122 -11.680 -12.541
  274   2HB   SER  37          1HB       SER  37   3.400 -10.488 -12.755
  275    HG   SER  37           HG       SER  37   3.376 -12.698 -11.237
  276    H    THR  38           H        THR  38   2.203  -9.520  -8.723
  277    HA   THR  38           HA       THR  38   3.523  -7.059  -8.647
  278    HB   THR  38           HB       THR  38   4.188  -7.646  -6.340
  279    HG1  THR  38           HG1      THR  38   4.597  -9.670  -6.035
  280   1HG2  THR  38          1HG2      THR  38   1.427  -8.236  -7.344
  281   2HG2  THR  38          2HG2      THR  38   1.990  -6.889  -6.355
  282   3HG2  THR  38          3HG2      THR  38   1.794  -8.487  -5.638
  283    H    LYS  39           H        LYS  39   4.787 -10.324  -8.943
  284    HA   LYS  39           HA       LYS  39   7.550  -9.723  -8.578
  285   1HB   LYS  39          2HB       LYS  39   6.373 -11.964 -10.244
  286   2HB   LYS  39          1HB       LYS  39   7.982 -11.905  -9.528
  287   1HG   LYS  39          2HG       LYS  39   7.212 -12.369  -7.410
  288   2HG   LYS  39          1HG       LYS  39   5.671 -11.558  -7.681
  289   1HD   LYS  39          2HD       LYS  39   4.971 -13.767  -7.687
  290   2HD   LYS  39          1HD       LYS  39   5.302 -13.539  -9.405
  291   1HE   LYS  39          2HE       LYS  39   6.515 -15.471  -9.053
  292   2HE   LYS  39          1HE       LYS  39   7.755 -14.284  -8.649
  293   1HZ   LYS  39          1HZ       LYS  39   7.127 -14.477  -6.321
  294   2HZ   LYS  39          2HZ       LYS  39   7.587 -15.987  -6.950
  295   3HZ   LYS  39          3HZ       LYS  39   5.943 -15.628  -6.714
  296    H    GLU  40           H        GLU  40   5.363  -9.654 -11.337
  297    HA   GLU  40           HA       GLU  40   7.558  -8.969 -13.168
  298   1HB   GLU  40          2HB       GLU  40   4.623  -9.523 -13.667
  299   2HB   GLU  40          1HB       GLU  40   5.781  -9.087 -14.923
  300   1HG   GLU  40          2HG       GLU  40   6.235 -11.432 -13.070
  301   2HG   GLU  40          1HG       GLU  40   5.353 -11.595 -14.588
  302    H    LEU  41           H        LEU  41   6.351  -7.160 -10.969
  303    HA   LEU  41           HA       LEU  41   5.005  -5.050 -12.351
  304   1HB   LEU  41          2HB       LEU  41   5.101  -5.610  -9.792
  305   2HB   LEU  41          1HB       LEU  41   6.518  -4.581  -9.819
  306    HG   LEU  41           HG       LEU  41   4.165  -3.409 -11.143
  307   1HD1  LEU  41          1HD1      LEU  41   3.344  -4.811  -9.067
  308   2HD1  LEU  41          2HD1      LEU  41   2.767  -3.158  -9.296
  309   3HD1  LEU  41          3HD1      LEU  41   4.062  -3.490  -8.144
  310   1HD2  LEU  41          1HD2      LEU  41   6.148  -2.537  -9.021
  311   2HD2  LEU  41          2HD2      LEU  41   4.881  -1.492  -9.665
  312   3HD2  LEU  41          3HD2      LEU  41   6.152  -2.095 -10.729
  313    H    GLY  42           H        GLY  42   8.273  -6.025 -12.301
  314   1HA   GLY  42          2HA       GLY  42   9.665  -3.581 -12.397
  315   2HA   GLY  42          1HA       GLY  42  10.186  -5.078 -13.169
  316    H    LYS  43           H        LYS  43   7.878  -5.395 -14.853
  317    HA   LYS  43           HA       LYS  43   8.648  -3.771 -17.085
  318   1HB   LYS  43          2HB       LYS  43   6.267  -5.609 -16.720
  319   2HB   LYS  43          1HB       LYS  43   6.757  -4.877 -18.248
  320   1HG   LYS  43          2HG       LYS  43   8.955  -6.002 -18.077
  321   2HG   LYS  43          1HG       LYS  43   8.446  -6.753 -16.564
  322   1HD   LYS  43          2HD       LYS  43   6.508  -7.775 -17.820
  323   2HD   LYS  43          1HD       LYS  43   7.237  -7.175 -19.310
  324   1HE   LYS  43          2HE       LYS  43   8.818  -8.868 -17.375
  325   2HE   LYS  43          1HE       LYS  43   7.786  -9.606 -18.599
  326   1HZ   LYS  43          1HZ       LYS  43   9.959  -9.403 -19.500
  327   2HZ   LYS  43          2HZ       LYS  43  10.074  -7.770 -19.049
  328   3HZ   LYS  43          3HZ       LYS  43   8.993  -8.242 -20.271
  329    H    VAL  44           H        VAL  44   6.443  -3.342 -14.484
  330    HA   VAL  44           HA       VAL  44   4.669  -1.506 -15.859
  331    HB   VAL  44           HB       VAL  44   4.948  -1.880 -12.869
  332   1HG1  VAL  44          1HG1      VAL  44   2.544  -1.140 -14.552
  333   2HG1  VAL  44          2HG1      VAL  44   3.631   0.055 -13.842
  334   3HG1  VAL  44          3HG1      VAL  44   2.710  -1.026 -12.801
  335   1HG2  VAL  44          1HG2      VAL  44   4.549  -4.030 -14.320
  336   2HG2  VAL  44          2HG2      VAL  44   2.933  -3.356 -14.550
  337   3HG2  VAL  44          3HG2      VAL  44   3.509  -3.728 -12.927
  338    H    MET  45           H        MET  45   7.193  -1.344 -13.353
  339    HA   MET  45           HA       MET  45   7.194   1.414 -12.921
  340   1HB   MET  45          2HB       MET  45   8.787  -0.772 -12.114
  341   2HB   MET  45          1HB       MET  45   9.894   0.400 -12.831
  342   1HG   MET  45          2HG       MET  45   9.801   1.302 -10.720
  343   2HG   MET  45          1HG       MET  45   8.370   2.088 -11.384
  344   1HE   MET  45          1HE       MET  45   5.461   0.890  -9.923
  345   2HE   MET  45          2HE       MET  45   6.427   2.027 -10.858
  346   3HE   MET  45          3HE       MET  45   6.434   2.116  -9.099
  347    H    ARG  46           H        ARG  46   8.969  -0.504 -15.351
  348    HA   ARG  46           HA       ARG  46  10.483   1.631 -16.428
  349   1HB   ARG  46          2HB       ARG  46  10.731   0.222 -18.446
  350   2HB   ARG  46          1HB       ARG  46  11.038  -0.682 -16.965
  351   1HG   ARG  46          2HG       ARG  46   8.999  -1.839 -17.098
  352   2HG   ARG  46          1HG       ARG  46   8.288  -0.655 -18.192
  353   1HD   ARG  46          2HD       ARG  46   9.974  -1.348 -19.923
  354   2HD   ARG  46          1HD       ARG  46  10.483  -2.638 -18.839
  355    HE   ARG  46           HE       ARG  46   7.717  -2.883 -19.132
  356   1HH1  ARG  46          2HH1      ARG  46  10.570  -3.011 -21.144
  357   2HH1  ARG  46          1HH1      ARG  46   9.874  -4.123 -22.273
  358   1HH2  ARG  46          1HH2      ARG  46   6.828  -4.338 -20.622
  359   2HH2  ARG  46          2HH2      ARG  46   7.761  -4.872 -21.979
  360    H    MET  47           H        MET  47   7.171   0.595 -16.997
  361    HA   MET  47           HA       MET  47   6.779   2.320 -19.291
  362   1HB   MET  47          2HB       MET  47   4.851   0.750 -17.566
  363   2HB   MET  47          1HB       MET  47   4.361   1.707 -18.963
  364   1HG   MET  47          2HG       MET  47   6.493  -0.425 -19.161
  365   2HG   MET  47          1HG       MET  47   4.783  -0.794 -19.375
  366   1HE   MET  47          1HE       MET  47   7.232  -0.495 -22.582
  367   2HE   MET  47          2HE       MET  47   7.465  -0.939 -20.893
  368   3HE   MET  47          3HE       MET  47   7.996   0.642 -21.462
  369    H    LEU  48           H        LEU  48   6.283   2.472 -15.814
  370    HA   LEU  48           HA       LEU  48   4.643   4.837 -15.850
  371   1HB   LEU  48          2HB       LEU  48   5.993   3.192 -13.768
  372   2HB   LEU  48          1HB       LEU  48   5.577   4.839 -13.356
  373    HG   LEU  48           HG       LEU  48   3.273   4.424 -13.492
  374   1HD1  LEU  48          1HD1      LEU  48   4.104   2.208 -15.323
  375   2HD1  LEU  48          2HD1      LEU  48   2.822   3.403 -15.518
  376   3HD1  LEU  48          3HD1      LEU  48   2.590   2.029 -14.436
  377   1HD2  LEU  48          1HD2      LEU  48   3.845   3.323 -11.525
  378   2HD2  LEU  48          2HD2      LEU  48   4.831   2.123 -12.361
  379   3HD2  LEU  48          3HD2      LEU  48   3.071   2.007 -12.412
  380    H    GLY  49           H        GLY  49   8.083   4.155 -15.723
  381   1HA   GLY  49          2HA       GLY  49   9.443   6.032 -16.696
  382   2HA   GLY  49          1HA       GLY  49   8.627   7.067 -15.535
  383    H    GLN  50           H        GLN  50   9.569   3.859 -14.509
  384    HA   GLN  50           HA       GLN  50  11.984   4.927 -13.189
  385   1HB   GLN  50          2HB       GLN  50   9.886   3.240 -11.804
  386   2HB   GLN  50          1HB       GLN  50  11.376   3.855 -11.088
  387   1HG   GLN  50          2HG       GLN  50  10.371   5.808 -10.598
  388   2HG   GLN  50          1HG       GLN  50   9.941   6.035 -12.292
  389   1HE2  GLN  50          1HE2      GLN  50   7.749   5.875 -12.813
  390   2HE2  GLN  50          2HE2      GLN  50   6.561   5.255 -11.774
  391    H    ASN  51           H        ASN  51  13.344   3.144 -12.253
  392    HA   ASN  51           HA       ASN  51  12.971   0.508 -13.453
  393   1HB   ASN  51          2HB       ASN  51  15.413   0.606 -14.302
  394   2HB   ASN  51          1HB       ASN  51  14.171   1.392 -15.271
  395   1HD2  ASN  51          1HD2      ASN  51  15.698   2.939 -16.181
  396   2HD2  ASN  51          2HD2      ASN  51  16.349   4.196 -15.245
  397    HA   PRO  52           HA       PRO  52  15.062   0.476  -9.314
  398   1HB   PRO  52          2HB       PRO  52  13.061  -0.792  -7.950
  399   2HB   PRO  52          1HB       PRO  52  13.144   0.962  -8.159
  400   1HG   PRO  52          2HG       PRO  52  11.350  -0.999  -9.445
  401   2HG   PRO  52          1HG       PRO  52  11.108   0.730  -9.156
  402   1HD   PRO  52          2HD       PRO  52  11.861  -0.503 -11.616
  403   2HD   PRO  52          1HD       PRO  52  11.803   1.241 -11.267
  404    H    THR  53           H        THR  53  14.634  -1.762  -7.702
  405    HA   THR  53           HA       THR  53  15.582  -3.978  -9.421
  406    HB   THR  53           HB       THR  53  16.948  -4.698  -7.666
  407    HG1  THR  53           HG1      THR  53  16.543  -3.857  -5.485
  408   1HG2  THR  53          1HG2      THR  53  16.736  -1.718  -7.190
  409   2HG2  THR  53          2HG2      THR  53  17.705  -2.482  -8.451
  410   3HG2  THR  53          3HG2      THR  53  18.101  -2.742  -6.751
  411    HA   PRO  54           HA       PRO  54  12.183  -6.483  -8.130
  412   1HB   PRO  54          2HB       PRO  54  13.286  -8.864  -7.339
  413   2HB   PRO  54          1HB       PRO  54  13.158  -8.341  -9.025
  414   1HG   PRO  54          2HG       PRO  54  15.537  -8.413  -7.250
  415   2HG   PRO  54          1HG       PRO  54  15.435  -8.583  -9.009
  416   1HD   PRO  54          2HD       PRO  54  16.234  -6.273  -7.636
  417   2HD   PRO  54          1HD       PRO  54  15.739  -6.335  -9.344
  418    H    GLU  55           H        GLU  55  14.751  -6.238  -5.726
  419    HA   GLU  55           HA       GLU  55  13.035  -7.070  -3.531
  420   1HB   GLU  55          2HB       GLU  55  14.938  -6.471  -2.080
  421   2HB   GLU  55          1HB       GLU  55  15.434  -7.551  -3.381
  422   1HG   GLU  55          2HG       GLU  55  16.405  -5.736  -4.626
  423   2HG   GLU  55          1HG       GLU  55  15.700  -4.537  -3.542
  424    H    GLU  56           H        GLU  56  14.108  -4.080  -5.050
  425    HA   GLU  56           HA       GLU  56  13.205  -2.326  -2.966
  426   1HB   GLU  56          2HB       GLU  56  13.977  -1.928  -5.852
  427   2HB   GLU  56          1HB       GLU  56  13.303  -0.609  -4.895
  428   1HG   GLU  56          2HG       GLU  56  15.129  -1.326  -3.139
  429   2HG   GLU  56          1HG       GLU  56  15.908  -2.063  -4.540
  430    H    LEU  57           H        LEU  57  11.851  -3.366  -6.107
  431    HA   LEU  57           HA       LEU  57   9.452  -1.870  -5.901
  432   1HB   LEU  57          2HB       LEU  57   8.651  -3.140  -7.732
  433   2HB   LEU  57          1HB       LEU  57  10.353  -2.861  -8.004
  434    HG   LEU  57           HG       LEU  57  10.593  -5.265  -6.925
  435   1HD1  LEU  57          1HD1      LEU  57   8.564  -6.141  -6.401
  436   2HD1  LEU  57          2HD1      LEU  57   8.369  -6.379  -8.137
  437   3HD1  LEU  57          3HD1      LEU  57   7.703  -4.941  -7.365
  438   1HD2  LEU  57          1HD2      LEU  57  10.422  -6.208  -9.211
  439   2HD2  LEU  57          2HD2      LEU  57  11.232  -4.642  -9.224
  440   3HD2  LEU  57          3HD2      LEU  57   9.549  -4.767  -9.733
  441    H    GLN  58           H        GLN  58  10.411  -5.048  -4.714
  442    HA   GLN  58           HA       GLN  58   7.852  -6.058  -4.079
  443   1HB   GLN  58          2HB       GLN  58  10.630  -6.716  -3.385
  444   2HB   GLN  58          1HB       GLN  58   9.472  -7.104  -2.113
  445   1HG   GLN  58          2HG       GLN  58   9.053  -7.900  -5.005
  446   2HG   GLN  58          1HG       GLN  58   9.858  -8.943  -3.834
  447   1HE2  GLN  58          1HE2      GLN  58   6.742  -7.675  -4.849
  448   2HE2  GLN  58          2HE2      GLN  58   5.812  -8.551  -3.731
  449    H    GLU  59           H        GLU  59  10.022  -3.865  -2.348
  450    HA   GLU  59           HA       GLU  59   8.733  -3.858   0.163
  451   1HB   GLU  59          2HB       GLU  59  10.239  -1.647  -1.262
  452   2HB   GLU  59          1HB       GLU  59   9.718  -1.564   0.420
  453   1HG   GLU  59          2HG       GLU  59  11.305  -3.942  -0.490
  454   2HG   GLU  59          1HG       GLU  59  12.145  -2.424  -0.175
  455    H    MET  60           H        MET  60   8.124  -2.043  -2.815
  456    HA   MET  60           HA       MET  60   6.077  -0.354  -1.775
  457   1HB   MET  60          2HB       MET  60   6.391  -1.276  -4.642
  458   2HB   MET  60          1HB       MET  60   5.553   0.169  -4.073
  459   1HG   MET  60          2HG       MET  60   7.852   0.803  -3.022
  460   2HG   MET  60          1HG       MET  60   8.510  -0.392  -4.140
  461   1HE   MET  60          1HE       MET  60   8.733   3.009  -3.825
  462   2HE   MET  60          2HE       MET  60   6.998   2.981  -3.521
  463   3HE   MET  60          3HE       MET  60   7.627   3.862  -4.910
  464    H    ILE  61           H        ILE  61   6.122  -3.542  -3.259
  465    HA   ILE  61           HA       ILE  61   3.315  -3.870  -3.557
  466    HB   ILE  61           HB       ILE  61   5.534  -5.906  -3.231
  467   1HG1  ILE  61          2HG1      ILE  61   5.681  -4.518  -5.265
  468   2HG1  ILE  61          1HG1      ILE  61   5.250  -6.176  -5.674
  469   1HG2  ILE  61          1HG2      ILE  61   2.598  -6.257  -3.879
  470   2HG2  ILE  61          2HG2      ILE  61   3.514  -7.009  -2.573
  471   3HG2  ILE  61          3HG2      ILE  61   3.814  -7.480  -4.245
  472   1HD1  ILE  61          1HD1      ILE  61   2.779  -5.010  -5.283
  473   2HD1  ILE  61          2HD1      ILE  61   3.548  -5.247  -6.851
  474   3HD1  ILE  61          3HD1      ILE  61   3.703  -3.700  -6.018
  475    H    ASP  62           H        ASP  62   5.581  -4.739  -0.965
  476    HA   ASP  62           HA       ASP  62   3.785  -6.094   0.714
  477   1HB   ASP  62          2HB       ASP  62   6.360  -4.627   1.183
  478   2HB   ASP  62          1HB       ASP  62   5.420  -5.209   2.557
  479    H    GLU  63           H        GLU  63   4.591  -2.614   0.555
  480    HA   GLU  63           HA       GLU  63   2.835  -1.984   2.762
  481   1HB   GLU  63          2HB       GLU  63   3.498   0.294   2.451
  482   2HB   GLU  63          1HB       GLU  63   4.928  -0.714   2.247
  483   1HG   GLU  63          2HG       GLU  63   4.480  -0.641  -0.255
  484   2HG   GLU  63          1HG       GLU  63   3.284   0.610   0.081
  485    H    VAL  64           H        VAL  64   2.686  -1.541  -0.786
  486    HA   VAL  64           HA       VAL  64   0.172  -0.185  -0.748
  487    HB   VAL  64           HB       VAL  64   1.527  -1.698  -2.994
  488   1HG1  VAL  64          1HG1      VAL  64   0.045   0.157  -4.233
  489   2HG1  VAL  64          2HG1      VAL  64  -0.955  -0.053  -2.795
  490   3HG1  VAL  64          3HG1      VAL  64  -0.604  -1.435  -3.831
  491   1HG2  VAL  64          1HG2      VAL  64   2.708   0.279  -1.831
  492   2HG2  VAL  64          2HG2      VAL  64   1.447   1.286  -2.548
  493   3HG2  VAL  64          3HG2      VAL  64   2.534   0.361  -3.584
  494    H    ASP  65           H        ASP  65   0.968  -3.454  -1.969
  495    HA   ASP  65           HA       ASP  65  -1.684  -4.368  -2.157
  496   1HB   ASP  65          2HB       ASP  65   0.843  -5.407  -2.723
  497   2HB   ASP  65          1HB       ASP  65   0.202  -6.488  -1.492
  498    H    GLU  66           H        GLU  66  -2.937  -4.008  -0.396
  499    HA   GLU  66           HA       GLU  66  -2.243  -4.291   2.296
  500   1HB   GLU  66          2HB       GLU  66  -4.679  -4.427   2.746
  501   2HB   GLU  66          1HB       GLU  66  -4.265  -3.113   1.648
  502   1HG   GLU  66          2HG       GLU  66  -4.842  -4.626  -0.279
  503   2HG   GLU  66          1HG       GLU  66  -5.407  -5.820   0.889
  504    H    ASP  67           H        ASP  67  -3.587  -6.703   0.065
  505    HA   ASP  67           HA       ASP  67  -3.685  -8.715   2.171
  506   1HB   ASP  67          2HB       ASP  67  -4.373 -10.232   0.208
  507   2HB   ASP  67          1HB       ASP  67  -5.490  -8.956   0.684
  508    H    GLY  68           H        GLY  68  -1.714  -7.949  -0.665
  509   1HA   GLY  68          2HA       GLY  68   0.417  -8.635  -1.235
  510   2HA   GLY  68          1HA       GLY  68   0.544  -9.362   0.365
  511    H    SER  69           H        SER  69  -1.641  -9.934  -2.384
  512    HA   SER  69           HA       SER  69  -1.349 -12.808  -2.061
  513   1HB   SER  69          2HB       SER  69  -3.060 -12.903  -3.886
  514   2HB   SER  69          1HB       SER  69  -3.573 -11.976  -2.478
  515    HG   SER  69           HG       SER  69  -2.901 -11.130  -5.054
  516    H    GLY  70           H        GLY  70   0.654 -10.689  -3.472
  517   1HA   GLY  70          2HA       GLY  70   2.401 -11.029  -4.954
  518   2HA   GLY  70          1HA       GLY  70   1.749 -12.628  -5.304
  519    H    THR  71           H        THR  71  -0.619 -10.202  -5.517
  520    HA   THR  71           HA       THR  71  -0.164  -9.684  -8.363
  521    HB   THR  71           HB       THR  71  -2.341 -10.417  -9.032
  522    HG1  THR  71           HG1      THR  71  -3.811 -10.158  -7.561
  523   1HG2  THR  71          1HG2      THR  71  -0.710 -12.232  -8.852
  524   2HG2  THR  71          2HG2      THR  71  -2.311 -12.824  -8.408
  525   3HG2  THR  71          3HG2      THR  71  -1.124 -12.462  -7.152
  526    H    VAL  72           H        VAL  72  -0.845  -7.686  -8.984
  527    HA   VAL  72           HA       VAL  72  -1.951  -5.978  -6.859
  528    HB   VAL  72           HB       VAL  72  -0.867  -5.082  -9.532
  529   1HG1  VAL  72          1HG1      VAL  72  -1.343  -3.702  -6.873
  530   2HG1  VAL  72          2HG1      VAL  72  -2.222  -3.423  -8.377
  531   3HG1  VAL  72          3HG1      VAL  72  -0.525  -2.958  -8.248
  532   1HG2  VAL  72          1HG2      VAL  72   0.936  -6.272  -8.450
  533   2HG2  VAL  72          2HG2      VAL  72   0.558  -5.535  -6.892
  534   3HG2  VAL  72          3HG2      VAL  72   1.219  -4.549  -8.197
  535    H    ASP  73           H        ASP  73  -3.989  -5.394  -6.865
  536    HA   ASP  73           HA       ASP  73  -5.712  -5.965  -9.149
  537   1HB   ASP  73          2HB       ASP  73  -6.195  -4.934  -6.347
  538   2HB   ASP  73          1HB       ASP  73  -7.463  -4.903  -7.571
  539    H    PHE  74           H        PHE  74  -7.200  -4.177  -9.948
  540    HA   PHE  74           HA       PHE  74  -5.691  -1.995 -10.860
  541   1HB   PHE  74          2HB       PHE  74  -7.855  -2.840 -11.871
  542   2HB   PHE  74          1HB       PHE  74  -8.700  -1.951 -10.602
  543    HD1  PHE  74           HD1      PHE  74  -5.608  -1.161 -12.544
  544    HD2  PHE  74           HD2      PHE  74  -9.645  -0.050 -11.601
  545    HE1  PHE  74           HE1      PHE  74  -5.344   0.929 -13.859
  546    HE2  PHE  74           HE2      PHE  74  -9.378   2.039 -12.911
  547    HZ   PHE  74           HZ       PHE  74  -7.229   2.526 -14.040
  548    H    ASP  75           H        ASP  75  -7.682  -2.371  -7.980
  549    HA   ASP  75           HA       ASP  75  -7.726   0.394  -7.239
  550   1HB   ASP  75          2HB       ASP  75  -8.141  -2.158  -5.665
  551   2HB   ASP  75          1HB       ASP  75  -8.253  -0.557  -4.934
  552    H    GLU  76           H        GLU  76  -5.664  -2.379  -6.384
  553    HA   GLU  76           HA       GLU  76  -3.953  -0.914  -4.606
  554   1HB   GLU  76          2HB       GLU  76  -3.359  -3.486  -6.104
  555   2HB   GLU  76          1HB       GLU  76  -2.502  -2.875  -4.690
  556   1HG   GLU  76          2HG       GLU  76  -4.553  -3.067  -3.342
  557   2HG   GLU  76          1HG       GLU  76  -5.440  -3.638  -4.754
  558    H    PHE  77           H        PHE  77  -4.097  -1.428  -8.053
  559    HA   PHE  77           HA       PHE  77  -1.433  -0.750  -8.751
  560   1HB   PHE  77          2HB       PHE  77  -3.484  -1.759 -10.146
  561   2HB   PHE  77          1HB       PHE  77  -3.697  -0.070 -10.575
  562    HD1  PHE  77           HD1      PHE  77  -3.262  -0.815 -12.913
  563    HD2  PHE  77           HD2      PHE  77  -0.253  -1.088  -9.846
  564    HE1  PHE  77           HE1      PHE  77  -1.507  -1.048 -14.638
  565    HE2  PHE  77           HE2      PHE  77   1.488  -1.313 -11.583
  566    HZ   PHE  77           HZ       PHE  77   0.863  -1.298 -13.983
  567    H    LEU  78           H        LEU  78  -4.448   1.161  -8.790
  568    HA   LEU  78           HA       LEU  78  -3.175   3.637  -9.422
  569   1HB   LEU  78          2HB       LEU  78  -5.892   2.838  -8.462
  570   2HB   LEU  78          1HB       LEU  78  -5.425   4.527  -8.385
  571    HG   LEU  78           HG       LEU  78  -5.286   4.705 -10.745
  572   1HD1  LEU  78          1HD1      LEU  78  -4.035   2.519 -11.014
  573   2HD1  LEU  78          2HD1      LEU  78  -5.227   2.857 -12.269
  574   3HD1  LEU  78          3HD1      LEU  78  -5.601   1.707 -10.983
  575   1HD2  LEU  78          1HD2      LEU  78  -7.603   4.528  -9.857
  576   2HD2  LEU  78          2HD2      LEU  78  -7.566   2.791 -10.164
  577   3HD2  LEU  78          3HD2      LEU  78  -7.478   3.926 -11.511
  578    H    VAL  79           H        VAL  79  -3.861   1.935  -6.435
  579    HA   VAL  79           HA       VAL  79  -3.580   4.080  -4.611
  580    HB   VAL  79           HB       VAL  79  -3.447   1.105  -4.456
  581   1HG1  VAL  79          1HG1      VAL  79  -1.450   1.753  -3.187
  582   2HG1  VAL  79          2HG1      VAL  79  -2.719   1.191  -2.096
  583   3HG1  VAL  79          3HG1      VAL  79  -2.401   2.919  -2.263
  584   1HG2  VAL  79          1HG2      VAL  79  -5.491   2.646  -4.144
  585   2HG2  VAL  79          2HG2      VAL  79  -4.771   3.080  -2.594
  586   3HG2  VAL  79          3HG2      VAL  79  -5.225   1.407  -2.919
  587    H    MET  80           H        MET  80  -1.225   1.747  -5.908
  588    HA   MET  80           HA       MET  80   1.080   2.445  -4.575
  589   1HB   MET  80          2HB       MET  80   0.474   0.911  -6.810
  590   2HB   MET  80          1HB       MET  80   1.570   2.139  -7.440
  591   1HG   MET  80          2HG       MET  80   2.892   1.528  -5.183
  592   2HG   MET  80          1HG       MET  80   2.073  -0.012  -5.443
  593   1HE   MET  80          1HE       MET  80   2.277  -1.492  -7.489
  594   2HE   MET  80          2HE       MET  80   3.131  -1.073  -8.972
  595   3HE   MET  80          3HE       MET  80   1.706  -0.154  -8.495
  596    H    MET  81           H        MET  81  -0.547   4.222  -7.155
  597    HA   MET  81           HA       MET  81   1.542   6.028  -7.798
  598   1HB   MET  81          2HB       MET  81  -0.672   5.590  -9.055
  599   2HB   MET  81          1HB       MET  81  -1.385   6.736  -7.922
  600   1HG   MET  81          2HG       MET  81   0.876   8.079  -8.710
  601   2HG   MET  81          1HG       MET  81   0.437   7.222 -10.187
  602   1HE   MET  81          1HE       MET  81  -2.432   6.745  -9.962
  603   2HE   MET  81          2HE       MET  81  -1.971   7.544 -11.463
  604   3HE   MET  81          3HE       MET  81  -3.341   8.149 -10.537
  605    H    VAL  82           H        VAL  82  -1.327   6.456  -5.703
  606    HA   VAL  82           HA       VAL  82  -0.497   8.988  -4.685
  607    HB   VAL  82           HB       VAL  82  -2.255   8.635  -2.961
  608   1HG1  VAL  82          1HG1      VAL  82  -4.147   8.321  -4.666
  609   2HG1  VAL  82          2HG1      VAL  82  -2.877   8.089  -5.867
  610   3HG1  VAL  82          3HG1      VAL  82  -2.999   9.617  -4.995
  611   1HG2  VAL  82          1HG2      VAL  82  -1.878   6.124  -2.838
  612   2HG2  VAL  82          2HG2      VAL  82  -2.757   5.997  -4.363
  613   3HG2  VAL  82          3HG2      VAL  82  -3.569   6.621  -2.926
  614    H    ARG  83           H        ARG  83   0.122   5.679  -3.715
  615    HA   ARG  83           HA       ARG  83   0.961   6.051  -1.063
  616   1HB   ARG  83          2HB       ARG  83   1.823   4.074  -3.177
  617   2HB   ARG  83          1HB       ARG  83   2.440   4.023  -1.526
  618   1HG   ARG  83          2HG       ARG  83  -0.470   4.295  -1.607
  619   2HG   ARG  83          1HG       ARG  83   0.088   2.833  -2.421
  620   1HD   ARG  83          2HD       ARG  83   0.895   1.901  -0.491
  621   2HD   ARG  83          1HD       ARG  83   1.379   3.454   0.180
  622    HE   ARG  83           HE       ARG  83  -1.470   3.230   0.075
  623   1HH1  ARG  83          2HH1      ARG  83   1.356   2.158   1.827
  624   2HH1  ARG  83          1HH1      ARG  83   0.501   1.923   3.313
  625   1HH2  ARG  83          1HH2      ARG  83  -2.571   2.917   2.031
  626   2HH2  ARG  83          2HH2      ARG  83  -1.719   2.351   3.429
  627    H    CYS  84           H        CYS  84   2.662   6.522  -4.119
  628    HA   CYS  84           HA       CYS  84   5.180   7.164  -2.792
  629   1HB   CYS  84          2HB       CYS  84   4.896   6.013  -5.106
  630   2HB   CYS  84          1HB       CYS  84   4.610   7.646  -5.707
  631    HG   CYS  84           HG       CYS  84   7.267   6.793  -4.283
  632    H    MET  85           H        MET  85   2.544   8.830  -4.472
  633    HA   MET  85           HA       MET  85   3.693  11.402  -4.617
  634   1HB   MET  85          2HB       MET  85   1.488  10.485  -5.666
  635   2HB   MET  85          1HB       MET  85   0.750  11.003  -4.152
  636   1HG   MET  85          2HG       MET  85   1.856  13.270  -4.538
  637   2HG   MET  85          1HG       MET  85   2.229  12.708  -6.168
  638   1HE   MET  85          1HE       MET  85   0.756  12.345  -7.986
  639   2HE   MET  85          2HE       MET  85  -1.006  12.328  -7.981
  640   3HE   MET  85          3HE       MET  85  -0.117  11.031  -7.186
  641    H    LYS  86           H        LYS  86   1.522   9.980  -2.163
  642    HA   LYS  86           HA       LYS  86   1.248  10.417   0.072
  643   1HB   LYS  86          2HB       LYS  86   3.944  11.019  -0.380
  644   2HB   LYS  86          1HB       LYS  86   3.303  12.422   0.470
  645   1HG   LYS  86          2HG       LYS  86   3.900  11.012   2.238
  646   2HG   LYS  86          1HG       LYS  86   2.185  10.650   2.034
  647   1HD   LYS  86          2HD       LYS  86   3.164   8.512   2.115
  648   2HD   LYS  86          1HD       LYS  86   3.006   8.807   0.384
  649   1HE   LYS  86          2HE       LYS  86   5.218   8.178   0.413
  650   2HE   LYS  86          1HE       LYS  86   5.435   9.893   0.757
  651   1HZ   LYS  86          1HZ       LYS  86   6.662   8.536   2.321
  652   2HZ   LYS  86          2HZ       LYS  86   5.242   7.723   2.778
  653   3HZ   LYS  86          3HZ       LYS  86   5.427   9.377   3.123
  654    H    ASP  87           H        ASP  87   0.533  12.119   1.554
  655    HA   ASP  87           HA       ASP  87  -0.679  14.340   0.053
  656   1HB   ASP  87          2HB       ASP  87  -1.878  12.626   1.744
  657   2HB   ASP  87          1HB       ASP  87  -1.395  13.864   2.902
  658    H    ASP  88           H        ASP  88   1.539  15.309   0.018
  659    HA   ASP  88           HA       ASP  88   1.964  16.923   2.464
  660   1HB   ASP  88          2HB       ASP  88   4.430  17.001   1.623
  661   2HB   ASP  88          1HB       ASP  88   3.872  15.588   2.511
  662    H    SER  89           HN       SER  89   0.291  18.027   0.839
  663    HA   SER  89           HA       SER  89  -0.166  19.955  -0.311
  664   1HB   SER  89          2HB       SER  89   1.801  20.789   1.135
  665   2HB   SER  89          1HB       SER  89   2.773  20.623  -0.323
  666    HG   SER  89           HG       SER  89   1.939  22.685  -0.284
  Start of MODEL   34
    1   1H    MET   1          1H        MET   1  -4.516   4.283   9.278
    2   2H    MET   1          2H        MET   1  -6.072   4.875   8.937
    3   3H    MET   1          3H        MET   1  -5.421   5.042  10.496
    4    HA   MET   1           HA       MET   1  -5.406   7.095   9.034
    5   1HB   MET   1          2HB       MET   1  -3.917   6.452  11.126
    6   2HB   MET   1          1HB       MET   1  -2.630   6.367   9.925
    7   1HG   MET   1          2HG       MET   1  -2.477   8.607  10.453
    8   2HG   MET   1          1HG       MET   1  -3.693   8.709   9.180
    9   1HE   MET   1          1HE       MET   1  -3.157   9.950  12.964
   10   2HE   MET   1          2HE       MET   1  -2.795   8.253  12.655
   11   3HE   MET   1          3HE       MET   1  -4.166   8.683  13.675
   12    H    ASN   2           H        ASN   2  -5.567   5.355   6.957
   13    HA   ASN   2           HA       ASN   2  -3.379   6.255   5.224
   14   1HB   ASN   2          2HB       ASN   2  -3.238   3.936   4.211
   15   2HB   ASN   2          1HB       ASN   2  -2.546   4.096   5.823
   16   1HD2  ASN   2          1HD2      ASN   2  -5.248   2.708   3.994
   17   2HD2  ASN   2          2HD2      ASN   2  -5.831   1.738   5.259
   18    H    ASP   3           H        ASP   3  -6.151   7.032   5.478
   19    HA   ASP   3           HA       ASP   3  -7.519   5.860   3.178
   20   1HB   ASP   3          2HB       ASP   3  -9.397   7.287   3.811
   21   2HB   ASP   3          1HB       ASP   3  -8.807   6.402   5.216
   22    H    ILE   4           H        ILE   4  -5.306   8.379   3.703
   23    HA   ILE   4           HA       ILE   4  -6.229  10.406   2.003
   24    HB   ILE   4           HB       ILE   4  -3.980  11.231   1.889
   25   1HG1  ILE   4          2HG1      ILE   4  -2.977   8.923   1.363
   26   2HG1  ILE   4          1HG1      ILE   4  -2.020   9.982   2.390
   27   1HG2  ILE   4          1HG2      ILE   4  -5.166  11.386   4.072
   28   2HG2  ILE   4          2HG2      ILE   4  -3.413  11.351   4.247
   29   3HG2  ILE   4          3HG2      ILE   4  -4.360   9.905   4.587
   30   1HD1  ILE   4          1HD1      ILE   4  -3.540   7.500   3.125
   31   2HD1  ILE   4          2HD1      ILE   4  -3.286   8.745   4.347
   32   3HD1  ILE   4          3HD1      ILE   4  -1.903   7.978   3.570
   33    H    TYR   5           H        TYR   5  -4.742   7.330   1.260
   34    HA   TYR   5           HA       TYR   5  -4.102   7.935  -1.476
   35   1HB   TYR   5          2HB       TYR   5  -4.532   5.231  -0.172
   36   2HB   TYR   5          1HB       TYR   5  -3.752   5.526  -1.726
   37    HD1  TYR   5           HD1      TYR   5  -3.248   5.206   1.793
   38    HD2  TYR   5           HD2      TYR   5  -1.694   7.136  -1.716
   39    HE1  TYR   5           HE1      TYR   5  -1.084   5.566   2.949
   40    HE2  TYR   5           HE2      TYR   5   0.468   7.500  -0.559
   41    HH   TYR   5           HH       TYR   5   0.948   7.528   2.477
   42    H    LYS   6           H        LYS   6  -6.831   6.444   0.217
   43    HA   LYS   6           HA       LYS   6  -8.288   5.669  -2.110
   44   1HB   LYS   6          2HB       LYS   6  -9.015   6.055   0.784
   45   2HB   LYS   6          1HB       LYS   6 -10.258   5.723  -0.422
   46   1HG   LYS   6          2HG       LYS   6  -9.701   3.541  -0.490
   47   2HG   LYS   6          1HG       LYS   6  -8.008   3.933  -0.780
   48   1HD   LYS   6          2HD       LYS   6  -8.063   2.724   1.285
   49   2HD   LYS   6          1HD       LYS   6  -7.818   4.417   1.714
   50   1HE   LYS   6          2HE       LYS   6  -9.949   4.651   2.581
   51   2HE   LYS   6          1HE       LYS   6 -10.632   3.421   1.518
   52   1HZ   LYS   6          1HZ       LYS   6 -10.479   2.695   3.844
   53   2HZ   LYS   6          2HZ       LYS   6  -8.791   2.870   3.785
   54   3HZ   LYS   6          3HZ       LYS   6  -9.563   1.715   2.806
   55    H    ALA   7           H        ALA   7  -7.905   8.694  -0.423
   56    HA   ALA   7           HA       ALA   7 -10.305   9.959  -1.290
   57   1HB   ALA   7          1HB       ALA   7  -8.998  12.087  -0.792
   58   2HB   ALA   7          2HB       ALA   7  -7.648  11.044  -0.346
   59   3HB   ALA   7          3HB       ALA   7  -9.164  10.956   0.550
   60    H    ALA   8           H        ALA   8  -7.046   9.697  -2.664
   61    HA   ALA   8           HA       ALA   8  -7.503  11.546  -4.809
   62   1HB   ALA   8          1HB       ALA   8  -5.487   9.405  -5.161
   63   2HB   ALA   8          2HB       ALA   8  -5.262  10.466  -3.772
   64   3HB   ALA   8          3HB       ALA   8  -5.337  11.146  -5.397
   65    H    VAL   9           H        VAL   9  -7.517   7.992  -4.554
   66    HA   VAL   9           HA       VAL   9  -8.108   7.492  -7.284
   67    HB   VAL   9           HB       VAL   9  -7.221   5.813  -5.616
   68   1HG1  VAL   9          1HG1      VAL   9 -10.137   5.692  -4.794
   69   2HG1  VAL   9          2HG1      VAL   9  -8.816   6.307  -3.802
   70   3HG1  VAL   9          3HG1      VAL   9  -8.863   4.603  -4.247
   71   1HG2  VAL   9          1HG2      VAL   9  -9.723   4.996  -7.131
   72   2HG2  VAL   9          2HG2      VAL   9  -8.406   3.930  -6.643
   73   3HG2  VAL   9          3HG2      VAL   9  -8.123   5.181  -7.853
   74    H    GLU  10           H        GLU  10 -10.078   8.515  -4.615
   75    HA   GLU  10           HA       GLU  10 -12.589   7.720  -5.817
   76   1HB   GLU  10          2HB       GLU  10 -11.779   9.178  -3.334
   77   2HB   GLU  10          1HB       GLU  10 -13.426   9.373  -3.933
   78   1HG   GLU  10          2HG       GLU  10 -12.171   6.647  -3.572
   79   2HG   GLU  10          1HG       GLU  10 -13.033   7.458  -2.266
   80    H    GLN  11           H        GLN  11 -10.434  10.418  -6.082
   81    HA   GLN  11           HA       GLN  11 -12.509  11.865  -7.612
   82   1HB   GLN  11          2HB       GLN  11 -11.734  13.992  -6.757
   83   2HB   GLN  11          1HB       GLN  11 -12.141  12.951  -5.395
   84   1HG   GLN  11          2HG       GLN  11  -9.587  12.286  -5.527
   85   2HG   GLN  11          1HG       GLN  11  -9.439  13.827  -6.368
   86   1HE2  GLN  11          1HE2      GLN  11  -8.262  13.375  -3.774
   87   2HE2  GLN  11          2HE2      GLN  11  -9.056  14.380  -2.659
   88    H    LEU  12           H        LEU  12 -10.361  10.048  -8.501
   89    HA   LEU  12           HA       LEU  12  -8.339  11.749  -9.709
   90   1HB   LEU  12          2HB       LEU  12  -7.820   9.546 -10.972
   91   2HB   LEU  12          1HB       LEU  12  -7.423   9.692  -9.278
   92    HG   LEU  12           HG       LEU  12  -9.272   8.300  -8.652
   93   1HD1  LEU  12          1HD1      LEU  12 -10.083   8.539 -11.560
   94   2HD1  LEU  12          2HD1      LEU  12 -11.005   9.041 -10.143
   95   3HD1  LEU  12          3HD1      LEU  12 -10.754   7.327 -10.468
   96   1HD2  LEU  12          1HD2      LEU  12  -7.111   7.398  -9.945
   97   2HD2  LEU  12          2HD2      LEU  12  -8.338   6.856 -11.091
   98   3HD2  LEU  12          3HD2      LEU  12  -8.394   6.310  -9.415
   99    H    THR  13           H        THR  13  -7.943  11.035 -12.209
  100    HA   THR  13           HA       THR  13 -10.441  11.824 -13.586
  101    HB   THR  13           HB       THR  13  -8.455  12.204 -15.433
  102    HG1  THR  13           HG1      THR  13  -6.725  11.965 -14.189
  103   1HG2  THR  13          1HG2      THR  13  -8.558  14.646 -14.353
  104   2HG2  THR  13          2HG2      THR  13  -9.906  13.913 -13.482
  105   3HG2  THR  13          3HG2      THR  13  -9.912  13.953 -15.246
  106    H    ASP  14           H        ASP  14 -10.506  11.118 -15.928
  107    HA   ASP  14           HA       ASP  14 -10.573   8.282 -16.081
  108   1HB   ASP  14          2HB       ASP  14 -10.689  10.386 -18.259
  109   2HB   ASP  14          1HB       ASP  14 -10.984   8.667 -18.524
  110    H    GLU  15           H        GLU  15  -8.191  10.713 -16.932
  111    HA   GLU  15           HA       GLU  15  -6.512   9.252 -18.637
  112   1HB   GLU  15          2HB       GLU  15  -6.019  11.483 -16.680
  113   2HB   GLU  15          1HB       GLU  15  -4.672  10.724 -17.530
  114   1HG   GLU  15          2HG       GLU  15  -6.260  11.106 -19.640
  115   2HG   GLU  15          1HG       GLU  15  -6.903  12.391 -18.617
  116    H    GLN  16           H        GLN  16  -6.752   9.300 -15.103
  117    HA   GLN  16           HA       GLN  16  -4.451   7.693 -14.576
  118   1HB   GLN  16          2HB       GLN  16  -6.779   8.693 -13.043
  119   2HB   GLN  16          1HB       GLN  16  -6.074   7.188 -12.450
  120   1HG   GLN  16          2HG       GLN  16  -4.477   8.415 -11.459
  121   2HG   GLN  16          1HG       GLN  16  -3.882   8.833 -13.064
  122   1HE2  GLN  16          1HE2      GLN  16  -5.576  10.043 -10.262
  123   2HE2  GLN  16          2HE2      GLN  16  -5.833  11.612 -10.851
  124    H    LYS  17           H        LYS  17  -7.907   6.995 -14.933
  125    HA   LYS  17           HA       LYS  17  -7.863   4.241 -14.383
  126   1HB   LYS  17          2HB       LYS  17  -9.685   5.695 -16.317
  127   2HB   LYS  17          1HB       LYS  17  -9.987   4.122 -15.585
  128   1HG   LYS  17          2HG       LYS  17  -9.584   6.665 -13.984
  129   2HG   LYS  17          1HG       LYS  17 -11.166   6.039 -14.442
  130   1HD   LYS  17          2HD       LYS  17  -9.590   3.921 -13.285
  131   2HD   LYS  17          1HD       LYS  17  -9.611   5.304 -12.194
  132   1HE   LYS  17          2HE       LYS  17 -12.179   4.432 -13.478
  133   2HE   LYS  17          1HE       LYS  17 -11.556   3.514 -12.110
  134   1HZ   LYS  17          1HZ       LYS  17 -13.079   5.342 -11.485
  135   2HZ   LYS  17          2HZ       LYS  17 -11.950   6.456 -12.093
  136   3HZ   LYS  17          3HZ       LYS  17 -11.548   5.468 -10.770
  137    H    ASN  18           H        ASN  18  -6.863   6.007 -17.230
  138    HA   ASN  18           HA       ASN  18  -6.682   3.527 -18.807
  139   1HB   ASN  18          2HB       ASN  18  -6.846   6.416 -19.447
  140   2HB   ASN  18          1HB       ASN  18  -5.805   5.453 -20.496
  141   1HD2  ASN  18          1HD2      ASN  18  -9.072   6.301 -19.869
  142   2HD2  ASN  18          2HD2      ASN  18  -9.800   5.141 -20.871
  143    H    GLU  19           H        GLU  19  -4.703   5.931 -17.201
  144    HA   GLU  19           HA       GLU  19  -2.233   5.538 -18.447
  145   1HB   GLU  19          2HB       GLU  19  -2.805   7.286 -16.701
  146   2HB   GLU  19          1HB       GLU  19  -2.598   6.027 -15.484
  147   1HG   GLU  19          2HG       GLU  19  -0.289   5.629 -16.347
  148   2HG   GLU  19          1HG       GLU  19  -0.505   6.979 -17.462
  149    H    PHE  20           H        PHE  20  -3.506   3.933 -15.519
  150    HA   PHE  20           HA       PHE  20  -1.311   2.037 -15.498
  151   1HB   PHE  20          2HB       PHE  20  -3.688   2.554 -13.751
  152   2HB   PHE  20          1HB       PHE  20  -2.829   1.021 -13.625
  153    HD1  PHE  20           HD1      PHE  20  -2.651   4.642 -13.090
  154    HD2  PHE  20           HD2      PHE  20  -0.459   0.950 -12.923
  155    HE1  PHE  20           HE1      PHE  20  -0.897   5.743 -11.733
  156    HE2  PHE  20           HE2      PHE  20   1.287   2.043 -11.555
  157    HZ   PHE  20           HZ       PHE  20   1.075   4.445 -10.962
  158    H    LYS  21           H        LYS  21  -4.757   2.026 -16.356
  159    HA   LYS  21           HA       LYS  21  -5.119  -0.747 -16.584
  160   1HB   LYS  21          2HB       LYS  21  -6.993   0.807 -16.642
  161   2HB   LYS  21          1HB       LYS  21  -6.428   1.467 -18.172
  162   1HG   LYS  21          2HG       LYS  21  -6.680  -1.444 -18.261
  163   2HG   LYS  21          1HG       LYS  21  -8.206  -0.659 -17.856
  164   1HD   LYS  21          2HD       LYS  21  -6.657   0.604 -20.050
  165   2HD   LYS  21          1HD       LYS  21  -7.332  -0.986 -20.406
  166   1HE   LYS  21          2HE       LYS  21  -9.562  -0.237 -19.802
  167   2HE   LYS  21          1HE       LYS  21  -8.933   1.319 -19.258
  168   1HZ   LYS  21          1HZ       LYS  21  -8.672   0.304 -22.036
  169   2HZ   LYS  21          2HZ       LYS  21  -8.283   1.858 -21.470
  170   3HZ   LYS  21          3HZ       LYS  21  -9.903   1.351 -21.523
  171    H    ALA  22           H        ALA  22  -3.604   1.553 -18.786
  172    HA   ALA  22           HA       ALA  22  -3.577  -0.006 -21.135
  173   1HB   ALA  22          1HB       ALA  22  -1.708   1.370 -21.852
  174   2HB   ALA  22          2HB       ALA  22  -1.400   1.880 -20.192
  175   3HB   ALA  22          3HB       ALA  22  -2.874   2.395 -21.014
  176    H    ALA  23           H        ALA  23  -1.118   0.314 -18.565
  177    HA   ALA  23           HA       ALA  23   0.537  -1.802 -19.539
  178   1HB   ALA  23          1HB       ALA  23   1.852  -1.465 -17.621
  179   2HB   ALA  23          2HB       ALA  23   0.481  -0.894 -16.668
  180   3HB   ALA  23          3HB       ALA  23   1.168   0.131 -17.929
  181    H    PHE  24           H        PHE  24  -2.176  -1.582 -17.314
  182    HA   PHE  24           HA       PHE  24  -1.932  -4.094 -16.048
  183   1HB   PHE  24          2HB       PHE  24  -3.589  -2.050 -15.643
  184   2HB   PHE  24          1HB       PHE  24  -4.645  -2.999 -16.686
  185    HD1  PHE  24           HD1      PHE  24  -4.657  -5.632 -16.077
  186    HD2  PHE  24           HD2      PHE  24  -3.721  -2.446 -13.361
  187    HE1  PHE  24           HE1      PHE  24  -5.216  -7.100 -14.154
  188    HE2  PHE  24           HE2      PHE  24  -4.272  -3.911 -11.445
  189    HZ   PHE  24           HZ       PHE  24  -5.031  -6.227 -11.839
  190    H    ASP  25           H        ASP  25  -3.476  -3.104 -19.083
  191    HA   ASP  25           HA       ASP  25  -4.716  -5.593 -19.662
  192   1HB   ASP  25          2HB       ASP  25  -5.009  -3.184 -20.738
  193   2HB   ASP  25          1HB       ASP  25  -3.825  -3.810 -21.885
  194    H    ILE  26           H        ILE  26  -1.571  -4.208 -20.654
  195    HA   ILE  26           HA       ILE  26  -0.868  -6.395 -22.343
  196    HB   ILE  26           HB       ILE  26   1.476  -5.510 -22.157
  197   1HG1  ILE  26          2HG1      ILE  26   0.163  -3.392 -20.423
  198   2HG1  ILE  26          1HG1      ILE  26   1.235  -4.650 -19.814
  199   1HG2  ILE  26          1HG2      ILE  26  -0.019  -4.683 -23.888
  200   2HG2  ILE  26          2HG2      ILE  26   0.914  -3.329 -23.250
  201   3HG2  ILE  26          3HG2      ILE  26  -0.763  -3.555 -22.755
  202   1HD1  ILE  26          1HD1      ILE  26   3.107  -3.772 -20.957
  203   2HD1  ILE  26          2HD1      ILE  26   2.277  -2.345 -20.334
  204   3HD1  ILE  26          3HD1      ILE  26   2.102  -2.796 -22.029
  205    H    PHE  27           H        PHE  27  -0.254  -5.713 -18.908
  206    HA   PHE  27           HA       PHE  27   1.382  -8.080 -18.565
  207   1HB   PHE  27          2HB       PHE  27   0.165  -6.176 -16.545
  208   2HB   PHE  27          1HB       PHE  27   1.228  -7.520 -16.126
  209    HD1  PHE  27           HD1      PHE  27   3.327  -7.581 -18.024
  210    HD2  PHE  27           HD2      PHE  27   1.306  -4.127 -16.447
  211    HE1  PHE  27           HE1      PHE  27   5.295  -6.181 -18.572
  212    HE2  PHE  27           HE2      PHE  27   3.278  -2.730 -17.012
  213    HZ   PHE  27           HZ       PHE  27   5.270  -3.756 -18.066
  214    H    ILE  28           H        ILE  28  -1.985  -7.178 -18.079
  215    HA   ILE  28           HA       ILE  28  -2.609  -9.994 -17.441
  216    HB   ILE  28           HB       ILE  28  -3.730  -7.457 -16.245
  217   1HG1  ILE  28          2HG1      ILE  28  -1.779  -8.537 -15.177
  218   2HG1  ILE  28          1HG1      ILE  28  -3.208  -8.607 -14.147
  219   1HG2  ILE  28          1HG2      ILE  28  -5.778  -8.424 -16.389
  220   2HG2  ILE  28          2HG2      ILE  28  -5.193  -9.448 -15.079
  221   3HG2  ILE  28          3HG2      ILE  28  -5.110 -10.016 -16.746
  222   1HD1  ILE  28          1HD1      ILE  28  -1.644 -10.775 -14.774
  223   2HD1  ILE  28          2HD1      ILE  28  -2.922 -10.905 -15.983
  224   3HD1  ILE  28          3HD1      ILE  28  -3.329 -10.880 -14.267
  225    H    GLN  29           H        GLN  29  -2.651 -10.008 -19.823
  226    HA   GLN  29           HA       GLN  29  -4.808  -8.632 -21.173
  227   1HB   GLN  29          2HB       GLN  29  -2.569  -9.192 -22.221
  228   2HB   GLN  29          1HB       GLN  29  -3.110 -10.870 -22.276
  229   1HG   GLN  29          2HG       GLN  29  -4.905 -10.360 -23.742
  230   2HG   GLN  29          1HG       GLN  29  -4.766  -8.628 -23.435
  231   1HE2  GLN  29          1HE2      GLN  29  -2.695  -7.567 -24.247
  232   2HE2  GLN  29          2HE2      GLN  29  -1.950  -8.214 -25.629
  233    H    ASP  30           H        ASP  30  -4.026 -12.087 -20.668
  234    HA   ASP  30           HA       ASP  30  -6.890 -12.693 -21.088
  235   1HB   ASP  30          2HB       ASP  30  -4.457 -14.470 -21.385
  236   2HB   ASP  30          1HB       ASP  30  -6.125 -15.002 -21.598
  237    H    ALA  31           H        ALA  31  -6.015 -11.736 -18.541
  238    HA   ALA  31           HA       ALA  31  -6.020 -14.156 -16.859
  239   1HB   ALA  31          1HB       ALA  31  -4.482 -11.989 -16.554
  240   2HB   ALA  31          2HB       ALA  31  -5.061 -12.933 -15.181
  241   3HB   ALA  31          3HB       ALA  31  -5.890 -11.447 -15.639
  242    H    GLU  32           H        GLU  32  -7.503 -14.350 -15.119
  243    HA   GLU  32           HA       GLU  32 -10.078 -12.974 -15.620
  244   1HB   GLU  32          2HB       GLU  32  -9.506 -15.731 -14.524
  245   2HB   GLU  32          1HB       GLU  32 -11.101 -14.979 -14.490
  246   1HG   GLU  32          2HG       GLU  32 -11.451 -15.381 -16.687
  247   2HG   GLU  32          1HG       GLU  32  -9.842 -14.807 -17.127
  248    H    ASP  33           H        ASP  33  -7.536 -13.205 -13.381
  249    HA   ASP  33           HA       ASP  33  -9.137 -12.842 -10.992
  250   1HB   ASP  33          2HB       ASP  33  -6.193 -12.898 -11.587
  251   2HB   ASP  33          1HB       ASP  33  -6.770 -12.262 -10.047
  252    H    GLY  34           H        GLY  34  -7.357 -10.824 -13.271
  253   1HA   GLY  34          2HA       GLY  34  -7.577  -8.543 -13.665
  254   2HA   GLY  34          1HA       GLY  34  -8.709  -8.447 -12.318
  255    H    CYS  35           H        CYS  35  -5.423  -9.763 -12.291
  256    HA   CYS  35           HA       CYS  35  -4.431  -7.469 -10.741
  257   1HB   CYS  35          2HB       CYS  35  -3.898 -10.249  -9.735
  258   2HB   CYS  35          1HB       CYS  35  -3.733  -8.716  -8.887
  259    HG   CYS  35           HG       CYS  35  -6.318  -8.587  -8.661
  260    H    ILE  36           H        ILE  36  -2.395  -6.947 -11.335
  261    HA   ILE  36           HA       ILE  36  -1.059  -8.580 -13.323
  262    HB   ILE  36           HB       ILE  36   0.507  -6.824 -13.579
  263   1HG1  ILE  36          2HG1      ILE  36   0.061  -4.906 -11.613
  264   2HG1  ILE  36          1HG1      ILE  36   0.004  -6.423 -10.717
  265   1HG2  ILE  36          1HG2      ILE  36  -1.922  -5.289 -12.669
  266   2HG2  ILE  36          2HG2      ILE  36  -1.975  -6.318 -14.100
  267   3HG2  ILE  36          3HG2      ILE  36  -0.856  -4.957 -14.033
  268   1HD1  ILE  36          1HD1      ILE  36   2.226  -6.809 -11.000
  269   2HD1  ILE  36          2HD1      ILE  36   2.318  -5.097 -11.417
  270   3HD1  ILE  36          3HD1      ILE  36   2.184  -6.305 -12.694
  271    H    SER  37           H        SER  37   1.427  -8.877 -13.004
  272    HA   SER  37           HA       SER  37   1.712 -10.477 -10.578
  273   1HB   SER  37          2HB       SER  37   2.386 -11.431 -12.756
  274   2HB   SER  37          1HB       SER  37   3.595 -10.162 -12.928
  275    HG   SER  37           HG       SER  37   3.701 -12.467 -11.525
  276    H    THR  38           H        THR  38   2.356  -9.449  -8.800
  277    HA   THR  38           HA       THR  38   3.770  -7.021  -8.643
  278    HB   THR  38           HB       THR  38   4.246  -7.618  -6.303
  279    HG1  THR  38           HG1      THR  38   4.588  -9.654  -5.991
  280   1HG2  THR  38          1HG2      THR  38   1.534  -8.121  -7.467
  281   2HG2  THR  38          2HG2      THR  38   2.086  -6.783  -6.461
  282   3HG2  THR  38          3HG2      THR  38   1.789  -8.363  -5.740
  283    H    LYS  39           H        LYS  39   4.842 -10.336  -8.999
  284    HA   LYS  39           HA       LYS  39   7.591  -9.983  -8.370
  285   1HB   LYS  39          2HB       LYS  39   6.541 -11.929 -10.432
  286   2HB   LYS  39          1HB       LYS  39   7.967 -12.095  -9.411
  287   1HG   LYS  39          2HG       LYS  39   5.059 -12.283  -8.593
  288   2HG   LYS  39          1HG       LYS  39   6.311 -13.512  -8.436
  289   1HD   LYS  39          2HD       LYS  39   6.506 -10.851  -7.017
  290   2HD   LYS  39          1HD       LYS  39   5.674 -12.230  -6.301
  291   1HE   LYS  39          2HE       LYS  39   8.127 -13.244  -7.248
  292   2HE   LYS  39          1HE       LYS  39   8.518 -11.711  -6.470
  293   1HZ   LYS  39          1HZ       LYS  39   7.223 -12.460  -4.530
  294   2HZ   LYS  39          2HZ       LYS  39   8.563 -13.454  -4.850
  295   3HZ   LYS  39          3HZ       LYS  39   7.000 -13.966  -5.277
  296    H    GLU  40           H        GLU  40   5.650  -9.418 -11.229
  297    HA   GLU  40           HA       GLU  40   8.012  -8.652 -12.804
  298   1HB   GLU  40          2HB       GLU  40   5.114  -8.926 -13.643
  299   2HB   GLU  40          1HB       GLU  40   6.466  -8.564 -14.715
  300   1HG   GLU  40          2HG       GLU  40   6.320 -11.061 -13.004
  301   2HG   GLU  40          1HG       GLU  40   5.780 -10.999 -14.681
  302    H    LEU  41           H        LEU  41   6.639  -7.066 -10.508
  303    HA   LEU  41           HA       LEU  41   5.378  -4.784 -11.553
  304   1HB   LEU  41          2HB       LEU  41   5.868  -5.613  -9.066
  305   2HB   LEU  41          1HB       LEU  41   7.189  -4.479  -9.211
  306    HG   LEU  41           HG       LEU  41   5.172  -3.524  -8.121
  307   1HD1  LEU  41          1HD1      LEU  41   6.855  -2.290  -9.774
  308   2HD1  LEU  41          2HD1      LEU  41   5.462  -1.451  -9.093
  309   3HD1  LEU  41          3HD1      LEU  41   5.389  -2.091 -10.734
  310   1HD2  LEU  41          1HD2      LEU  41   3.166  -3.085  -9.456
  311   2HD2  LEU  41          2HD2      LEU  41   3.500  -4.817  -9.448
  312   3HD2  LEU  41          3HD2      LEU  41   3.908  -3.847 -10.863
  313    H    GLY  42           H        GLY  42   8.767  -5.692 -11.445
  314   1HA   GLY  42          2HA       GLY  42   9.879  -3.103 -11.898
  315   2HA   GLY  42          1HA       GLY  42  10.678  -4.642 -12.205
  316    H    LYS  43           H        LYS  43   8.256  -5.395 -13.939
  317    HA   LYS  43           HA       LYS  43   9.334  -4.429 -16.441
  318   1HB   LYS  43          2HB       LYS  43   8.277  -6.776 -15.808
  319   2HB   LYS  43          1HB       LYS  43   6.776  -5.970 -16.265
  320   1HG   LYS  43          2HG       LYS  43   7.451  -6.818 -18.306
  321   2HG   LYS  43          1HG       LYS  43   8.181  -5.216 -18.366
  322   1HD   LYS  43          2HD       LYS  43  10.157  -6.585 -17.108
  323   2HD   LYS  43          1HD       LYS  43   9.473  -7.877 -18.094
  324   1HE   LYS  43          2HE       LYS  43  10.176  -5.171 -19.248
  325   2HE   LYS  43          1HE       LYS  43  11.338  -6.494 -19.179
  326   1HZ   LYS  43          1HZ       LYS  43  10.206  -6.478 -21.295
  327   2HZ   LYS  43          2HZ       LYS  43   8.691  -6.558 -20.530
  328   3HZ   LYS  43          3HZ       LYS  43   9.769  -7.868 -20.427
  329    H    VAL  44           H        VAL  44   6.631  -3.729 -14.351
  330    HA   VAL  44           HA       VAL  44   5.327  -2.065 -16.375
  331    HB   VAL  44           HB       VAL  44   3.921  -3.535 -14.960
  332   1HG1  VAL  44          1HG1      VAL  44   5.261  -3.478 -12.918
  333   2HG1  VAL  44          2HG1      VAL  44   3.608  -2.955 -12.581
  334   3HG1  VAL  44          3HG1      VAL  44   4.902  -1.763 -12.708
  335   1HG2  VAL  44          1HG2      VAL  44   2.361  -1.978 -15.379
  336   2HG2  VAL  44          2HG2      VAL  44   3.599  -0.721 -15.440
  337   3HG2  VAL  44          3HG2      VAL  44   2.832  -1.129 -13.905
  338    H    MET  45           H        MET  45   7.198  -1.844 -13.407
  339    HA   MET  45           HA       MET  45   6.788   0.856 -12.757
  340   1HB   MET  45          2HB       MET  45   8.767  -1.211 -12.110
  341   2HB   MET  45          1HB       MET  45   9.447   0.415 -12.138
  342   1HG   MET  45          2HG       MET  45   7.919   1.201 -10.499
  343   2HG   MET  45          1HG       MET  45   6.875  -0.208 -10.685
  344   1HE   MET  45          1HE       MET  45   8.225  -0.536  -7.070
  345   2HE   MET  45          2HE       MET  45   6.899  -0.049  -8.122
  346   3HE   MET  45          3HE       MET  45   8.255   1.044  -7.865
  347    H    ARG  46           H        ARG  46   9.018  -0.708 -15.036
  348    HA   ARG  46           HA       ARG  46  10.488   1.604 -15.761
  349   1HB   ARG  46          2HB       ARG  46  11.050   0.360 -17.845
  350   2HB   ARG  46          1HB       ARG  46  11.307  -0.590 -16.384
  351   1HG   ARG  46          2HG       ARG  46   9.421  -1.932 -16.767
  352   2HG   ARG  46          1HG       ARG  46   8.688  -0.760 -17.860
  353   1HD   ARG  46          2HD       ARG  46  10.634  -1.183 -19.435
  354   2HD   ARG  46          1HD       ARG  46  11.083  -2.530 -18.394
  355    HE   ARG  46           HE       ARG  46   8.458  -3.021 -18.959
  356   1HH1  ARG  46          2HH1      ARG  46  11.288  -2.366 -20.899
  357   2HH1  ARG  46          1HH1      ARG  46  10.711  -3.259 -22.262
  358   1HH2  ARG  46          1HH2      ARG  46   7.723  -4.182 -20.756
  359   2HH2  ARG  46          2HH2      ARG  46   8.699  -4.286 -22.183
  360    H    MET  47           H        MET  47   7.368   0.364 -16.781
  361    HA   MET  47           HA       MET  47   7.033   2.132 -19.026
  362   1HB   MET  47          2HB       MET  47   5.474   0.059 -17.667
  363   2HB   MET  47          1HB       MET  47   4.488   1.420 -18.194
  364   1HG   MET  47          2HG       MET  47   4.569  -0.165 -20.010
  365   2HG   MET  47          1HG       MET  47   5.565   1.217 -20.467
  366   1HE   MET  47          1HE       MET  47   7.982   1.355 -20.525
  367   2HE   MET  47          2HE       MET  47   7.447   0.511 -21.975
  368   3HE   MET  47          3HE       MET  47   8.894  -0.034 -21.132
  369    H    LEU  48           H        LEU  48   6.392   2.260 -15.577
  370    HA   LEU  48           HA       LEU  48   4.657   4.553 -15.647
  371   1HB   LEU  48          2HB       LEU  48   5.996   2.920 -13.570
  372   2HB   LEU  48          1HB       LEU  48   5.659   4.580 -13.136
  373    HG   LEU  48           HG       LEU  48   3.824   3.313 -12.343
  374   1HD1  LEU  48          1HD1      LEU  48   2.663   4.162 -14.971
  375   2HD1  LEU  48          2HD1      LEU  48   3.412   5.387 -13.947
  376   3HD1  LEU  48          3HD1      LEU  48   2.058   4.437 -13.337
  377   1HD2  LEU  48          1HD2      LEU  48   2.542   1.949 -14.263
  378   2HD2  LEU  48          2HD2      LEU  48   3.843   1.221 -13.322
  379   3HD2  LEU  48          3HD2      LEU  48   4.171   1.864 -14.932
  380    H    GLY  49           H        GLY  49   8.104   3.991 -15.417
  381   1HA   GLY  49          2HA       GLY  49   9.506   5.831 -16.336
  382   2HA   GLY  49          1HA       GLY  49   8.566   6.919 -15.323
  383    H    GLN  50           H        GLN  50   9.703   3.718 -14.312
  384    HA   GLN  50           HA       GLN  50  11.953   4.809 -12.833
  385   1HB   GLN  50          2HB       GLN  50  11.120   4.002 -10.625
  386   2HB   GLN  50          1HB       GLN  50  10.191   5.358 -11.262
  387   1HG   GLN  50          2HG       GLN  50   8.921   3.087 -12.303
  388   2HG   GLN  50          1HG       GLN  50   9.309   2.654 -10.640
  389   1HE2  GLN  50          1HE2      GLN  50   7.831   5.348 -12.534
  390   2HE2  GLN  50          2HE2      GLN  50   6.740   5.796 -11.313
  391    H    ASN  51           H        ASN  51  13.406   3.245 -12.132
  392    HA   ASN  51           HA       ASN  51  12.705   0.426 -12.606
  393   1HB   ASN  51          2HB       ASN  51  14.973   0.129 -13.722
  394   2HB   ASN  51          1HB       ASN  51  13.748   0.959 -14.677
  395   1HD2  ASN  51          1HD2      ASN  51  16.946   1.218 -13.469
  396   2HD2  ASN  51          2HD2      ASN  51  17.184   2.865 -13.807
  397    HA   PRO  52           HA       PRO  52  15.109   0.936  -8.715
  398   1HB   PRO  52          2HB       PRO  52  13.283  -0.313  -7.107
  399   2HB   PRO  52          1HB       PRO  52  13.227   1.409  -7.503
  400   1HG   PRO  52          2HG       PRO  52  11.518  -0.797  -8.470
  401   2HG   PRO  52          1HG       PRO  52  11.164   0.932  -8.343
  402   1HD   PRO  52          2HD       PRO  52  11.866  -0.494 -10.708
  403   2HD   PRO  52          1HD       PRO  52  11.715   1.270 -10.531
  404    H    THR  53           H        THR  53  14.918  -1.167  -6.848
  405    HA   THR  53           HA       THR  53  16.159  -3.373  -8.353
  406    HB   THR  53           HB       THR  53  17.322  -3.920  -6.398
  407    HG1  THR  53           HG1      THR  53  16.439  -3.845  -4.484
  408   1HG2  THR  53          1HG2      THR  53  17.702  -1.495  -7.227
  409   2HG2  THR  53          2HG2      THR  53  18.340  -1.946  -5.647
  410   3HG2  THR  53          3HG2      THR  53  16.843  -1.022  -5.762
  411    HA   PRO  54           HA       PRO  54  12.865  -6.193  -7.512
  412   1HB   PRO  54          2HB       PRO  54  14.064  -8.436  -6.488
  413   2HB   PRO  54          1HB       PRO  54  14.133  -7.962  -8.193
  414   1HG   PRO  54          2HG       PRO  54  16.218  -7.737  -6.087
  415   2HG   PRO  54          1HG       PRO  54  16.396  -7.992  -7.831
  416   1HD   PRO  54          2HD       PRO  54  16.783  -5.560  -6.514
  417   2HD   PRO  54          1HD       PRO  54  16.492  -5.736  -8.259
  418    H    GLU  55           H        GLU  55  15.002  -5.577  -4.799
  419    HA   GLU  55           HA       GLU  55  13.149  -6.560  -2.793
  420   1HB   GLU  55          2HB       GLU  55  15.791  -5.115  -2.701
  421   2HB   GLU  55          1HB       GLU  55  14.796  -5.270  -1.253
  422   1HG   GLU  55          2HG       GLU  55  14.698  -7.820  -2.034
  423   2HG   GLU  55          1HG       GLU  55  16.223  -7.387  -2.810
  424    H    GLU  56           H        GLU  56  14.078  -3.479  -4.263
  425    HA   GLU  56           HA       GLU  56  12.648  -1.797  -2.458
  426   1HB   GLU  56          2HB       GLU  56  14.493  -1.249  -4.290
  427   2HB   GLU  56          1HB       GLU  56  13.071  -0.974  -5.297
  428   1HG   GLU  56          2HG       GLU  56  12.355   0.322  -2.990
  429   2HG   GLU  56          1HG       GLU  56  14.097   0.602  -3.021
  430    H    LEU  57           H        LEU  57  11.866  -3.115  -5.693
  431    HA   LEU  57           HA       LEU  57   9.304  -1.927  -5.881
  432   1HB   LEU  57          2HB       LEU  57   8.910  -3.333  -7.727
  433   2HB   LEU  57          1HB       LEU  57  10.609  -2.934  -7.775
  434    HG   LEU  57           HG       LEU  57  10.845  -5.257  -6.512
  435   1HD1  LEU  57          1HD1      LEU  57   8.054  -5.184  -7.455
  436   2HD1  LEU  57          2HD1      LEU  57   8.810  -6.244  -6.266
  437   3HD1  LEU  57          3HD1      LEU  57   8.945  -6.610  -7.986
  438   1HD2  LEU  57          1HD2      LEU  57  11.177  -6.302  -8.710
  439   2HD2  LEU  57          2HD2      LEU  57  11.780  -4.645  -8.735
  440   3HD2  LEU  57          3HD2      LEU  57  10.226  -5.030  -9.476
  441    H    GLN  58           H        GLN  58  10.432  -4.965  -4.458
  442    HA   GLN  58           HA       GLN  58   7.864  -6.108  -4.018
  443   1HB   GLN  58          2HB       GLN  58  10.622  -6.674  -3.156
  444   2HB   GLN  58          1HB       GLN  58   9.391  -7.128  -1.979
  445   1HG   GLN  58          2HG       GLN  58   9.189  -7.878  -4.904
  446   2HG   GLN  58          1HG       GLN  58   9.980  -8.910  -3.715
  447   1HE2  GLN  58          1HE2      GLN  58   6.858  -7.738  -4.845
  448   2HE2  GLN  58          2HE2      GLN  58   5.915  -8.698  -3.811
  449    H    GLU  59           H        GLU  59   9.924  -3.942  -2.106
  450    HA   GLU  59           HA       GLU  59   8.453  -3.954   0.296
  451   1HB   GLU  59          2HB       GLU  59  10.193  -1.872  -1.021
  452   2HB   GLU  59          1HB       GLU  59   9.367  -1.544   0.502
  453   1HG   GLU  59          2HG       GLU  59  11.035  -4.032   0.157
  454   2HG   GLU  59          1HG       GLU  59  11.781  -2.499   0.604
  455    H    MET  60           H        MET  60   8.062  -2.103  -2.699
  456    HA   MET  60           HA       MET  60   6.001  -0.366  -1.838
  457   1HB   MET  60          2HB       MET  60   6.385  -1.482  -4.628
  458   2HB   MET  60          1HB       MET  60   5.503  -0.020  -4.191
  459   1HG   MET  60          2HG       MET  60   8.405  -0.340  -3.451
  460   2HG   MET  60          1HG       MET  60   7.943   0.227  -5.054
  461   1HE   MET  60          1HE       MET  60   8.880   2.733  -1.745
  462   2HE   MET  60          2HE       MET  60   9.700   2.325  -3.249
  463   3HE   MET  60          3HE       MET  60   9.264   1.047  -2.119
  464    H    ILE  61           H        ILE  61   5.982  -3.604  -3.229
  465    HA   ILE  61           HA       ILE  61   3.167  -3.888  -3.494
  466    HB   ILE  61           HB       ILE  61   5.267  -6.032  -3.053
  467   1HG1  ILE  61          2HG1      ILE  61   5.726  -4.679  -5.053
  468   2HG1  ILE  61          1HG1      ILE  61   5.163  -6.280  -5.522
  469   1HG2  ILE  61          1HG2      ILE  61   2.401  -6.160  -4.030
  470   2HG2  ILE  61          2HG2      ILE  61   3.072  -6.919  -2.586
  471   3HG2  ILE  61          3HG2      ILE  61   3.554  -7.487  -4.183
  472   1HD1  ILE  61          1HD1      ILE  61   3.869  -3.640  -5.885
  473   2HD1  ILE  61          2HD1      ILE  61   2.791  -4.944  -5.385
  474   3HD1  ILE  61          3HD1      ILE  61   3.740  -5.103  -6.863
  475    H    ASP  62           H        ASP  62   5.427  -4.949  -0.940
  476    HA   ASP  62           HA       ASP  62   3.584  -6.117   0.801
  477   1HB   ASP  62          2HB       ASP  62   6.207  -4.719   1.300
  478   2HB   ASP  62          1HB       ASP  62   5.265  -5.418   2.617
  479    H    GLU  63           H        GLU  63   4.302  -2.708   0.267
  480    HA   GLU  63           HA       GLU  63   2.758  -1.883   2.605
  481   1HB   GLU  63          2HB       GLU  63   4.185  -0.298   0.458
  482   2HB   GLU  63          1HB       GLU  63   3.303   0.428   1.804
  483   1HG   GLU  63          2HG       GLU  63   4.778  -0.557   3.420
  484   2HG   GLU  63          1HG       GLU  63   5.524  -1.592   2.202
  485    H    VAL  64           H        VAL  64   2.586  -1.326  -0.932
  486    HA   VAL  64           HA       VAL  64   0.043  -0.084  -0.913
  487    HB   VAL  64           HB       VAL  64   1.433  -1.604  -3.135
  488   1HG1  VAL  64          1HG1      VAL  64  -1.072   0.031  -2.998
  489   2HG1  VAL  64          2HG1      VAL  64  -0.728  -1.420  -3.938
  490   3HG1  VAL  64          3HG1      VAL  64  -0.076   0.138  -4.451
  491   1HG2  VAL  64          1HG2      VAL  64   1.295   1.378  -2.614
  492   2HG2  VAL  64          2HG2      VAL  64   2.272   0.548  -3.825
  493   3HG2  VAL  64          3HG2      VAL  64   2.647   0.363  -2.109
  494    H    ASP  65           H        ASP  65   0.910  -3.362  -2.028
  495    HA   ASP  65           HA       ASP  65  -1.675  -4.365  -2.343
  496   1HB   ASP  65          2HB       ASP  65   0.907  -5.375  -2.592
  497   2HB   ASP  65          1HB       ASP  65   0.188  -6.373  -1.334
  498    H    GLU  66           H        GLU  66  -3.161  -4.066  -0.776
  499    HA   GLU  66           HA       GLU  66  -2.682  -4.107   2.012
  500   1HB   GLU  66          2HB       GLU  66  -5.323  -4.706   0.657
  501   2HB   GLU  66          1HB       GLU  66  -5.077  -4.103   2.295
  502   1HG   GLU  66          2HG       GLU  66  -4.007  -2.056   1.328
  503   2HG   GLU  66          1HG       GLU  66  -4.420  -2.650  -0.281
  504    H    ASP  67           H        ASP  67  -4.001  -6.593  -0.161
  505    HA   ASP  67           HA       ASP  67  -4.189  -8.543   1.971
  506   1HB   ASP  67          2HB       ASP  67  -4.660 -10.141   0.013
  507   2HB   ASP  67          1HB       ASP  67  -5.831  -8.860   0.316
  508    H    GLY  68           H        GLY  68  -1.948  -7.862  -0.679
  509   1HA   GLY  68          2HA       GLY  68   0.251  -8.518  -0.960
  510   2HA   GLY  68          1HA       GLY  68   0.182  -9.269   0.631
  511    H    SER  69           H        SER  69  -1.710  -9.812  -2.332
  512    HA   SER  69           HA       SER  69  -1.368 -12.694  -2.042
  513   1HB   SER  69          2HB       SER  69  -2.973 -12.811  -3.941
  514   2HB   SER  69          1HB       SER  69  -3.590 -11.881  -2.578
  515    HG   SER  69           HG       SER  69  -3.702 -10.984  -4.853
  516    H    GLY  70           H        GLY  70   0.618 -10.444  -3.313
  517   1HA   GLY  70          2HA       GLY  70   2.443 -10.658  -4.712
  518   2HA   GLY  70          1HA       GLY  70   1.935 -12.306  -5.065
  519    H    THR  71           H        THR  71  -0.408  -9.779  -5.419
  520    HA   THR  71           HA       THR  71   0.075  -9.472  -8.285
  521    HB   THR  71           HB       THR  71  -2.162 -10.160  -8.918
  522    HG1  THR  71           HG1      THR  71  -3.369  -9.658  -7.150
  523   1HG2  THR  71          1HG2      THR  71  -0.460 -11.931  -8.799
  524   2HG2  THR  71          2HG2      THR  71  -2.047 -12.567  -8.365
  525   3HG2  THR  71          3HG2      THR  71  -0.863 -12.213  -7.105
  526    H    VAL  72           H        VAL  72  -0.371  -7.443  -8.935
  527    HA   VAL  72           HA       VAL  72  -1.616  -5.631  -6.990
  528    HB   VAL  72           HB       VAL  72  -0.430  -4.794  -9.628
  529   1HG1  VAL  72          1HG1      VAL  72  -0.088  -2.689  -8.448
  530   2HG1  VAL  72          2HG1      VAL  72  -0.644  -3.412  -6.939
  531   3HG1  VAL  72          3HG1      VAL  72  -1.771  -3.181  -8.274
  532   1HG2  VAL  72          1HG2      VAL  72   1.003  -5.307  -7.005
  533   2HG2  VAL  72          2HG2      VAL  72   1.696  -4.411  -8.356
  534   3HG2  VAL  72          3HG2      VAL  72   1.301  -6.121  -8.541
  535    H    ASP  73           H        ASP  73  -3.694  -5.238  -7.108
  536    HA   ASP  73           HA       ASP  73  -5.227  -5.726  -9.544
  537   1HB   ASP  73          2HB       ASP  73  -5.907  -6.037  -6.960
  538   2HB   ASP  73          1HB       ASP  73  -6.442  -4.373  -7.176
  539    H    PHE  74           H        PHE  74  -6.838  -3.886 -10.167
  540    HA   PHE  74           HA       PHE  74  -5.345  -1.649 -10.993
  541   1HB   PHE  74          2HB       PHE  74  -7.637  -2.553 -11.872
  542   2HB   PHE  74          1HB       PHE  74  -8.318  -1.436 -10.686
  543    HD1  PHE  74           HD1      PHE  74  -5.303  -1.286 -12.896
  544    HD2  PHE  74           HD2      PHE  74  -9.038   0.509 -11.777
  545    HE1  PHE  74           HE1      PHE  74  -4.881   0.582 -14.471
  546    HE2  PHE  74           HE2      PHE  74  -8.605   2.387 -13.341
  547    HZ   PHE  74           HZ       PHE  74  -6.526   2.419 -14.688
  548    H    ASP  75           H        ASP  75  -7.354  -2.170  -8.137
  549    HA   ASP  75           HA       ASP  75  -7.426   0.530  -7.242
  550   1HB   ASP  75          2HB       ASP  75  -7.828  -2.140  -5.927
  551   2HB   ASP  75          1HB       ASP  75  -7.677  -0.697  -4.926
  552    H    GLU  76           H        GLU  76  -5.219  -2.179  -6.642
  553    HA   GLU  76           HA       GLU  76  -3.486  -0.677  -4.887
  554   1HB   GLU  76          2HB       GLU  76  -2.925  -3.294  -6.306
  555   2HB   GLU  76          1HB       GLU  76  -2.070  -2.647  -4.905
  556   1HG   GLU  76          2HG       GLU  76  -4.052  -2.849  -3.521
  557   2HG   GLU  76          1HG       GLU  76  -5.037  -3.289  -4.914
  558    H    PHE  77           H        PHE  77  -3.766  -1.178  -8.316
  559    HA   PHE  77           HA       PHE  77  -1.082  -0.590  -9.081
  560   1HB   PHE  77          2HB       PHE  77  -3.246  -1.559 -10.390
  561   2HB   PHE  77          1HB       PHE  77  -3.320   0.118 -10.900
  562    HD1  PHE  77           HD1      PHE  77  -2.999  -0.868 -13.177
  563    HD2  PHE  77           HD2      PHE  77   0.064  -1.059 -10.162
  564    HE1  PHE  77           HE1      PHE  77  -1.311  -1.338 -14.915
  565    HE2  PHE  77           HE2      PHE  77   1.749  -1.519 -11.917
  566    HZ   PHE  77           HZ       PHE  77   1.053  -1.664 -14.292
  567    H    LEU  78           H        LEU  78  -4.078   1.337  -9.055
  568    HA   LEU  78           HA       LEU  78  -2.838   3.786  -9.820
  569   1HB   LEU  78          2HB       LEU  78  -5.498   3.025  -8.685
  570   2HB   LEU  78          1HB       LEU  78  -5.035   4.715  -8.729
  571    HG   LEU  78           HG       LEU  78  -4.978   4.732 -11.114
  572   1HD1  LEU  78          1HD1      LEU  78  -5.095   2.771 -12.501
  573   2HD1  LEU  78          2HD1      LEU  78  -5.424   1.737 -11.111
  574   3HD1  LEU  78          3HD1      LEU  78  -3.836   2.477 -11.303
  575   1HD2  LEU  78          1HD2      LEU  78  -7.269   3.408 -11.571
  576   2HD2  LEU  78          2HD2      LEU  78  -7.226   4.920 -10.665
  577   3HD2  LEU  78          3HD2      LEU  78  -7.292   3.381  -9.808
  578    H    VAL  79           H        VAL  79  -3.391   2.206  -6.725
  579    HA   VAL  79           HA       VAL  79  -3.024   4.428  -5.015
  580    HB   VAL  79           HB       VAL  79  -2.777   1.459  -4.717
  581   1HG1  VAL  79          1HG1      VAL  79  -2.088   1.801  -2.327
  582   2HG1  VAL  79          2HG1      VAL  79  -1.750   3.490  -2.712
  583   3HG1  VAL  79          3HG1      VAL  79  -0.823   2.204  -3.490
  584   1HG2  VAL  79          1HG2      VAL  79  -4.183   3.436  -2.926
  585   2HG2  VAL  79          2HG2      VAL  79  -4.575   1.742  -3.222
  586   3HG2  VAL  79          3HG2      VAL  79  -4.893   2.950  -4.466
  587    H    MET  80           H        MET  80  -0.706   2.001  -6.215
  588    HA   MET  80           HA       MET  80   1.646   2.815  -5.070
  589   1HB   MET  80          2HB       MET  80   0.947   1.124  -7.159
  590   2HB   MET  80          1HB       MET  80   2.019   2.300  -7.918
  591   1HG   MET  80          2HG       MET  80   3.356   1.800  -5.584
  592   2HG   MET  80          1HG       MET  80   2.619   0.230  -5.899
  593   1HE   MET  80          1HE       MET  80   2.305   0.333  -9.029
  594   2HE   MET  80          2HE       MET  80   2.820  -1.081  -8.114
  595   3HE   MET  80          3HE       MET  80   3.748  -0.564  -9.520
  596    H    MET  81           H        MET  81  -0.081   4.401  -7.726
  597    HA   MET  81           HA       MET  81   2.001   6.156  -8.536
  598   1HB   MET  81          2HB       MET  81  -0.048   5.710  -9.879
  599   2HB   MET  81          1HB       MET  81  -0.987   6.618  -8.698
  600   1HG   MET  81          2HG       MET  81   0.455   8.608  -9.131
  601   2HG   MET  81          1HG       MET  81   1.297   7.692 -10.381
  602   1HE   MET  81          1HE       MET  81  -1.961   8.520  -8.903
  603   2HE   MET  81          2HE       MET  81  -2.806   7.325  -9.884
  604   3HE   MET  81          3HE       MET  81  -3.035   9.042 -10.209
  605    H    VAL  82           H        VAL  82  -0.882   6.797  -6.510
  606    HA   VAL  82           HA       VAL  82  -0.052   9.377  -5.674
  607    HB   VAL  82           HB       VAL  82  -1.748   9.102  -3.858
  608   1HG1  VAL  82          1HG1      VAL  82  -3.684   8.751  -5.471
  609   2HG1  VAL  82          2HG1      VAL  82  -2.477   8.384  -6.704
  610   3HG1  VAL  82          3HG1      VAL  82  -2.511   9.978  -5.951
  611   1HG2  VAL  82          1HG2      VAL  82  -2.291   6.406  -5.123
  612   2HG2  VAL  82          2HG2      VAL  82  -3.026   7.085  -3.670
  613   3HG2  VAL  82          3HG2      VAL  82  -1.333   6.593  -3.654
  614    H    ARG  83           H        ARG  83   0.698   6.169  -4.516
  615    HA   ARG  83           HA       ARG  83   1.600   6.771  -1.913
  616   1HB   ARG  83          2HB       ARG  83   2.403   4.617  -3.876
  617   2HB   ARG  83          1HB       ARG  83   3.063   4.712  -2.245
  618   1HG   ARG  83          2HG       ARG  83   0.100   4.869  -2.492
  619   2HG   ARG  83          1HG       ARG  83   0.839   3.303  -2.826
  620   1HD   ARG  83          2HD       ARG  83   1.178   4.947  -0.305
  621   2HD   ARG  83          1HD       ARG  83   0.270   3.449  -0.456
  622    HE   ARG  83           HE       ARG  83   2.736   2.682  -1.245
  623   1HH1  ARG  83          2HH1      ARG  83   1.601   4.505   1.510
  624   2HH1  ARG  83          1HH1      ARG  83   2.925   4.038   2.520
  625   1HH2  ARG  83          1HH2      ARG  83   4.462   2.088   0.099
  626   2HH2  ARG  83          2HH2      ARG  83   4.538   2.675   1.727
  627    H    CYS  84           H        CYS  84   3.167   6.962  -5.070
  628    HA   CYS  84           HA       CYS  84   5.722   7.767  -3.885
  629   1HB   CYS  84          2HB       CYS  84   4.823   7.208  -6.709
  630   2HB   CYS  84          1HB       CYS  84   6.384   7.949  -6.358
  631    HG   CYS  84           HG       CYS  84   7.232   5.697  -5.810
  632    H    MET  85           H        MET  85   3.152   9.119  -5.939
  633    HA   MET  85           HA       MET  85   4.354  11.655  -6.359
  634   1HB   MET  85          2HB       MET  85   2.317  10.541  -7.550
  635   2HB   MET  85          1HB       MET  85   1.376  11.286  -6.257
  636   1HG   MET  85          2HG       MET  85   1.968  13.466  -6.908
  637   2HG   MET  85          1HG       MET  85   3.374  12.911  -7.818
  638   1HE   MET  85          1HE       MET  85   3.173  13.821 -10.020
  639   2HE   MET  85          2HE       MET  85   2.282  12.917 -11.242
  640   3HE   MET  85          3HE       MET  85   3.398  12.073 -10.173
  641    H    LYS  86           H        LYS  86   2.352  10.358  -3.776
  642    HA   LYS  86           HA       LYS  86   1.949  11.114  -1.648
  643   1HB   LYS  86          2HB       LYS  86   4.308  12.089  -1.833
  644   2HB   LYS  86          1HB       LYS  86   3.531  13.612  -2.263
  645   1HG   LYS  86          2HG       LYS  86   3.849  13.703   0.101
  646   2HG   LYS  86          1HG       LYS  86   2.139  13.343  -0.135
  647   1HD   LYS  86          2HD       LYS  86   2.546  10.966   0.253
  648   2HD   LYS  86          1HD       LYS  86   4.280  11.260   0.384
  649   1HE   LYS  86          2HE       LYS  86   3.553  12.962   2.261
  650   2HE   LYS  86          1HE       LYS  86   2.088  11.982   2.304
  651   1HZ   LYS  86          1HZ       LYS  86   4.865  10.977   2.629
  652   2HZ   LYS  86          2HZ       LYS  86   3.464  10.016   2.636
  653   3HZ   LYS  86          3HZ       LYS  86   3.720  11.157   3.867
  654    H    ASP  87           H        ASP  87  -0.029  11.757  -1.175
  655    HA   ASP  87           HA       ASP  87  -1.441  13.649  -2.848
  656   1HB   ASP  87          2HB       ASP  87  -2.388  11.531  -1.659
  657   2HB   ASP  87          1HB       ASP  87  -2.502  12.576  -0.244
  658    H    ASP  88           H        ASP  88  -0.087  15.508  -2.460
  659    HA   ASP  88           HA       ASP  88  -1.002  17.055  -0.148
  660   1HB   ASP  88          2HB       ASP  88   1.855  16.288  -0.661
  661   2HB   ASP  88          1HB       ASP  88   1.492  17.860   0.052
  662    H    SER  89           HN       SER  89  -2.089  18.482  -1.429
  663    HA   SER  89           HA       SER  89  -0.952  19.599  -3.830
  664   1HB   SER  89          2HB       SER  89  -3.354  20.553  -2.249
  665   2HB   SER  89          1HB       SER  89  -2.948  20.996  -3.904
  666    HG   SER  89           HG       SER  89  -4.106  18.712  -2.901
  Start of MODEL   35
    1   1H    MET   1          1H        MET   1  -7.105   8.518   9.734
    2   2H    MET   1          2H        MET   1  -7.723   8.213   8.181
    3   3H    MET   1          3H        MET   1  -6.318   9.148   8.371
    4    HA   MET   1           HA       MET   1  -5.124   7.232   9.242
    5   1HB   MET   1          2HB       MET   1  -7.844   5.987   8.869
    6   2HB   MET   1          1HB       MET   1  -6.392   4.990   8.794
    7   1HG   MET   1          2HG       MET   1  -5.900   5.288  11.029
    8   2HG   MET   1          1HG       MET   1  -6.646   6.884  11.089
    9   1HE   MET   1          1HE       MET   1  -8.675   6.697  13.147
   10   2HE   MET   1          2HE       MET   1 -10.031   6.626  12.025
   11   3HE   MET   1          3HE       MET   1  -8.573   7.510  11.580
   12    H    ASN   2           H        ASN   2  -4.039   8.062   7.408
   13    HA   ASN   2           HA       ASN   2  -3.405   8.247   5.192
   14   1HB   ASN   2          2HB       ASN   2  -2.893   5.991   4.186
   15   2HB   ASN   2          1HB       ASN   2  -2.220   6.261   5.791
   16   1HD2  ASN   2          1HD2      ASN   2  -4.784   4.525   4.023
   17   2HD2  ASN   2          2HD2      ASN   2  -5.122   3.425   5.271
   18    H    ASP   3           H        ASP   3  -6.074   8.862   5.326
   19    HA   ASP   3           HA       ASP   3  -7.561   7.343   3.354
   20   1HB   ASP   3          2HB       ASP   3  -9.316   9.042   3.680
   21   2HB   ASP   3          1HB       ASP   3  -8.759   8.392   5.220
   22    H    ILE   4           H        ILE   4  -5.453  10.098   3.365
   23    HA   ILE   4           HA       ILE   4  -6.327  11.519   1.136
   24    HB   ILE   4           HB       ILE   4  -4.128  12.455   0.951
   25   1HG1  ILE   4          2HG1      ILE   4  -2.937  10.197   1.074
   26   2HG1  ILE   4          1HG1      ILE   4  -2.149  11.527   1.912
   27   1HG2  ILE   4          1HG2      ILE   4  -3.781  13.236   3.207
   28   2HG2  ILE   4          2HG2      ILE   4  -4.600  11.825   3.875
   29   3HG2  ILE   4          3HG2      ILE   4  -5.514  13.024   2.961
   30   1HD1  ILE   4          1HD1      ILE   4  -3.469  10.678   4.001
   31   2HD1  ILE   4          2HD1      ILE   4  -2.039   9.788   3.482
   32   3HD1  ILE   4          3HD1      ILE   4  -3.645   9.187   3.073
   33    H    TYR   5           H        TYR   5  -4.602   8.475   1.275
   34    HA   TYR   5           HA       TYR   5  -3.676   8.397  -1.410
   35   1HB   TYR   5          2HB       TYR   5  -4.359   6.185   0.542
   36   2HB   TYR   5          1HB       TYR   5  -3.669   5.889  -1.054
   37    HD1  TYR   5           HD1      TYR   5  -1.389   6.667  -1.609
   38    HD2  TYR   5           HD2      TYR   5  -3.045   7.172   2.322
   39    HE1  TYR   5           HE1      TYR   5   0.873   7.147  -0.716
   40    HE2  TYR   5           HE2      TYR   5  -0.782   7.652   3.213
   41    HH   TYR   5           HH       TYR   5   1.623   8.636   1.693
   42    H    LYS   6           H        LYS   6  -6.632   7.174   0.146
   43    HA   LYS   6           HA       LYS   6  -7.780   6.229  -2.330
   44   1HB   LYS   6          2HB       LYS   6  -8.902   6.581   0.455
   45   2HB   LYS   6          1HB       LYS   6  -9.863   5.987  -0.899
   46   1HG   LYS   6          2HG       LYS   6  -9.101   3.957  -0.143
   47   2HG   LYS   6          1HG       LYS   6  -7.718   4.371  -1.156
   48   1HD   LYS   6          2HD       LYS   6  -6.429   5.090   0.694
   49   2HD   LYS   6          1HD       LYS   6  -7.843   5.215   1.739
   50   1HE   LYS   6          2HE       LYS   6  -7.220   2.538   0.568
   51   2HE   LYS   6          1HE       LYS   6  -6.193   3.120   1.878
   52   1HZ   LYS   6          1HZ       LYS   6  -9.156   2.910   1.960
   53   2HZ   LYS   6          2HZ       LYS   6  -8.169   3.483   3.219
   54   3HZ   LYS   6          3HZ       LYS   6  -8.066   1.861   2.727
   55    H    ALA   7           H        ALA   7  -7.743   9.233  -0.576
   56    HA   ALA   7           HA       ALA   7 -10.134  10.372  -1.615
   57   1HB   ALA   7          1HB       ALA   7  -9.434  12.386  -0.647
   58   2HB   ALA   7          2HB       ALA   7  -7.724  11.999  -0.847
   59   3HB   ALA   7          3HB       ALA   7  -8.681  11.166   0.379
   60    H    ALA   8           H        ALA   8  -6.883  10.032  -2.884
   61    HA   ALA   8           HA       ALA   8  -7.235  12.015  -4.967
   62   1HB   ALA   8          1HB       ALA   8  -5.139   9.933  -5.229
   63   2HB   ALA   8          2HB       ALA   8  -5.023  10.998  -3.828
   64   3HB   ALA   8          3HB       ALA   8  -5.030  11.679  -5.456
   65    H    VAL   9           H        VAL   9  -7.153   8.449  -4.802
   66    HA   VAL   9           HA       VAL   9  -7.536   7.995  -7.565
   67    HB   VAL   9           HB       VAL   9  -6.758   6.271  -5.921
   68   1HG1  VAL   9          1HG1      VAL   9  -9.702   6.215  -5.187
   69   2HG1  VAL   9          2HG1      VAL   9  -8.371   6.685  -4.131
   70   3HG1  VAL   9          3HG1      VAL   9  -8.510   5.016  -4.681
   71   1HG2  VAL   9          1HG2      VAL   9  -9.223   5.369  -7.430
   72   2HG2  VAL   9          2HG2      VAL   9  -7.758   4.444  -7.099
   73   3HG2  VAL   9          3HG2      VAL   9  -7.713   5.787  -8.241
   74    H    GLU  10           H        GLU  10  -9.789   8.838  -5.025
   75    HA   GLU  10           HA       GLU  10 -12.128   8.060  -6.544
   76   1HB   GLU  10          2HB       GLU  10 -13.410   8.969  -4.716
   77   2HB   GLU  10          1HB       GLU  10 -12.071   8.039  -4.046
   78   1HG   GLU  10          2HG       GLU  10 -10.874   9.973  -3.432
   79   2HG   GLU  10          1HG       GLU  10 -11.811  11.009  -4.504
   80    H    GLN  11           H        GLN  11 -10.054  10.831  -6.430
   81    HA   GLN  11           HA       GLN  11 -12.094  12.376  -7.923
   82   1HB   GLN  11          2HB       GLN  11 -11.250  14.419  -6.987
   83   2HB   GLN  11          1HB       GLN  11 -11.575  13.310  -5.656
   84   1HG   GLN  11          2HG       GLN  11  -9.154  12.664  -5.669
   85   2HG   GLN  11          1HG       GLN  11  -8.869  13.897  -6.897
   86   1HE2  GLN  11          1HE2      GLN  11 -10.476  13.668  -3.657
   87   2HE2  GLN  11          2HE2      GLN  11  -9.898  15.169  -3.116
   88    H    LEU  12           H        LEU  12  -9.771  10.551  -8.818
   89    HA   LEU  12           HA       LEU  12  -7.964  12.402 -10.140
   90   1HB   LEU  12          2HB       LEU  12  -7.272  10.223 -11.369
   91   2HB   LEU  12          1HB       LEU  12  -6.828  10.462  -9.697
   92    HG   LEU  12           HG       LEU  12  -8.546   8.931  -8.967
   93   1HD1  LEU  12          1HD1      LEU  12  -9.382   8.997 -11.871
   94   2HD1  LEU  12          2HD1      LEU  12 -10.363   9.352 -10.449
   95   3HD1  LEU  12          3HD1      LEU  12  -9.867   7.694 -10.785
   96   1HD2  LEU  12          1HD2      LEU  12  -6.792   8.037 -11.248
   97   2HD2  LEU  12          2HD2      LEU  12  -7.831   6.885 -10.407
   98   3HD2  LEU  12          3HD2      LEU  12  -6.581   7.757  -9.520
   99    H    THR  13           H        THR  13  -7.574  11.814 -12.617
  100    HA   THR  13           HA       THR  13 -10.092  12.479 -13.950
  101    HB   THR  13           HB       THR  13  -8.228  12.387 -15.948
  102    HG1  THR  13           HG1      THR  13  -6.413  12.103 -14.883
  103   1HG2  THR  13          1HG2      THR  13  -9.257  14.493 -14.112
  104   2HG2  THR  13          2HG2      THR  13  -9.427  14.338 -15.862
  105   3HG2  THR  13          3HG2      THR  13  -7.913  14.923 -15.172
  106    H    ASP  14           H        ASP  14 -10.428  11.472 -16.169
  107    HA   ASP  14           HA       ASP  14 -10.689   8.628 -15.876
  108   1HB   ASP  14          2HB       ASP  14 -11.291  10.607 -18.055
  109   2HB   ASP  14          1HB       ASP  14 -11.273   8.883 -18.431
  110    H    GLU  15           H        GLU  15  -8.471  10.829 -17.472
  111    HA   GLU  15           HA       GLU  15  -7.084   8.909 -19.057
  112   1HB   GLU  15          2HB       GLU  15  -5.453  10.624 -19.412
  113   2HB   GLU  15          1HB       GLU  15  -7.024  11.419 -19.356
  114   1HG   GLU  15          2HG       GLU  15  -6.651  12.074 -17.030
  115   2HG   GLU  15          1HG       GLU  15  -5.111  11.214 -17.012
  116    H    GLN  16           H        GLN  16  -6.834   9.970 -15.729
  117    HA   GLN  16           HA       GLN  16  -4.277   8.882 -15.125
  118   1HB   GLN  16          2HB       GLN  16  -6.099  10.415 -13.753
  119   2HB   GLN  16          1HB       GLN  16  -6.246   8.861 -12.936
  120   1HG   GLN  16          2HG       GLN  16  -3.787   8.800 -12.625
  121   2HG   GLN  16          1HG       GLN  16  -3.662  10.376 -13.410
  122   1HE2  GLN  16          1HE2      GLN  16  -5.260  12.096 -12.329
  123   2HE2  GLN  16          2HE2      GLN  16  -5.276  12.088 -10.632
  124    H    LYS  17           H        LYS  17  -7.590   7.631 -14.826
  125    HA   LYS  17           HA       LYS  17  -6.865   5.105 -13.713
  126   1HB   LYS  17          2HB       LYS  17  -9.337   5.892 -15.281
  127   2HB   LYS  17          1HB       LYS  17  -9.149   4.406 -14.352
  128   1HG   LYS  17          2HG       LYS  17  -9.277   5.497 -12.316
  129   2HG   LYS  17          1HG       LYS  17  -8.620   7.001 -12.960
  130   1HD   LYS  17          2HD       LYS  17 -10.873   7.555 -12.667
  131   2HD   LYS  17          1HD       LYS  17 -10.841   7.060 -14.358
  132   1HE   LYS  17          2HE       LYS  17 -11.218   4.730 -12.716
  133   2HE   LYS  17          1HE       LYS  17 -12.401   5.953 -12.253
  134   1HZ   LYS  17          1HZ       LYS  17 -13.024   6.180 -14.577
  135   2HZ   LYS  17          2HZ       LYS  17 -13.220   4.574 -14.055
  136   3HZ   LYS  17          3HZ       LYS  17 -11.889   5.000 -15.020
  137    H    ASN  18           H        ASN  18  -7.539   6.245 -17.012
  138    HA   ASN  18           HA       ASN  18  -7.251   3.735 -18.309
  139   1HB   ASN  18          2HB       ASN  18  -7.080   6.589 -19.253
  140   2HB   ASN  18          1HB       ASN  18  -6.726   5.249 -20.344
  141   1HD2  ASN  18          1HD2      ASN  18  -9.195   7.257 -19.696
  142   2HD2  ASN  18          2HD2      ASN  18 -10.516   6.211 -19.902
  143    H    GLU  19           H        GLU  19  -4.942   6.149 -17.240
  144    HA   GLU  19           HA       GLU  19  -2.703   5.472 -18.775
  145   1HB   GLU  19          2HB       GLU  19  -2.875   7.414 -17.175
  146   2HB   GLU  19          1HB       GLU  19  -2.649   6.267 -15.854
  147   1HG   GLU  19          2HG       GLU  19  -0.469   5.661 -16.628
  148   2HG   GLU  19          1HG       GLU  19  -0.709   6.496 -18.163
  149    H    PHE  20           H        PHE  20  -3.769   4.164 -15.624
  150    HA   PHE  20           HA       PHE  20  -1.686   2.141 -15.638
  151   1HB   PHE  20          2HB       PHE  20  -3.912   2.881 -13.772
  152   2HB   PHE  20          1HB       PHE  20  -3.132   1.308 -13.623
  153    HD1  PHE  20           HD1      PHE  20  -0.832   1.104 -12.896
  154    HD2  PHE  20           HD2      PHE  20  -2.629   4.964 -13.444
  155    HE1  PHE  20           HE1      PHE  20   1.054   2.147 -11.680
  156    HE2  PHE  20           HE2      PHE  20  -0.737   6.017 -12.241
  157    HZ   PHE  20           HZ       PHE  20   1.107   4.610 -11.356
  158    H    LYS  21           H        LYS  21  -5.237   2.230 -15.963
  159    HA   LYS  21           HA       LYS  21  -5.759  -0.485 -16.137
  160   1HB   LYS  21          2HB       LYS  21  -7.437   1.430 -16.121
  161   2HB   LYS  21          1HB       LYS  21  -7.167   1.551 -17.855
  162   1HG   LYS  21          2HG       LYS  21  -9.068   0.111 -17.560
  163   2HG   LYS  21          1HG       LYS  21  -7.715  -0.930 -18.001
  164   1HD   LYS  21          2HD       LYS  21  -7.526  -1.826 -15.872
  165   2HD   LYS  21          1HD       LYS  21  -8.205  -0.396 -15.097
  166   1HE   LYS  21          2HE       LYS  21 -10.434  -0.965 -16.020
  167   2HE   LYS  21          1HE       LYS  21  -9.749  -2.418 -16.747
  168   1HZ   LYS  21          1HZ       LYS  21  -9.788  -1.792 -13.844
  169   2HZ   LYS  21          2HZ       LYS  21  -9.132  -3.193 -14.547
  170   3HZ   LYS  21          3HZ       LYS  21 -10.804  -2.900 -14.629
  171    H    ALA  22           H        ALA  22  -4.614   1.695 -18.706
  172    HA   ALA  22           HA       ALA  22  -4.880  -0.047 -20.900
  173   1HB   ALA  22          1HB       ALA  22  -2.764   2.055 -20.368
  174   2HB   ALA  22          2HB       ALA  22  -4.285   2.295 -21.228
  175   3HB   ALA  22          3HB       ALA  22  -3.031   1.272 -21.926
  176    H    ALA  23           H        ALA  23  -2.054   0.533 -18.807
  177    HA   ALA  23           HA       ALA  23  -0.467  -1.580 -19.861
  178   1HB   ALA  23          1HB       ALA  23   0.251   0.469 -18.416
  179   2HB   ALA  23          2HB       ALA  23   1.070  -1.071 -18.165
  180   3HB   ALA  23          3HB       ALA  23  -0.189  -0.550 -17.045
  181    H    PHE  24           H        PHE  24  -2.792  -1.294 -17.239
  182    HA   PHE  24           HA       PHE  24  -2.348  -3.694 -15.879
  183   1HB   PHE  24          2HB       PHE  24  -3.933  -1.792 -15.241
  184   2HB   PHE  24          1HB       PHE  24  -5.082  -2.495 -16.377
  185    HD1  PHE  24           HD1      PHE  24  -5.864  -4.875 -16.035
  186    HD2  PHE  24           HD2      PHE  24  -3.585  -2.743 -13.088
  187    HE1  PHE  24           HE1      PHE  24  -6.568  -6.504 -14.310
  188    HE2  PHE  24           HE2      PHE  24  -4.285  -4.375 -11.365
  189    HZ   PHE  24           HZ       PHE  24  -5.779  -6.250 -11.978
  190    H    ASP  25           H        ASP  25  -4.326  -3.009 -18.754
  191    HA   ASP  25           HA       ASP  25  -5.502  -5.561 -19.026
  192   1HB   ASP  25          2HB       ASP  25  -4.967  -3.308 -20.942
  193   2HB   ASP  25          1HB       ASP  25  -5.598  -4.845 -21.532
  194    H    ILE  26           H        ILE  26  -2.515  -4.213 -20.462
  195    HA   ILE  26           HA       ILE  26  -1.894  -6.613 -21.903
  196    HB   ILE  26           HB       ILE  26   0.385  -5.592 -22.178
  197   1HG1  ILE  26          2HG1      ILE  26  -0.865  -3.302 -20.624
  198   2HG1  ILE  26          1HG1      ILE  26   0.406  -4.355 -20.012
  199   1HG2  ILE  26          1HG2      ILE  26  -1.517  -5.161 -23.730
  200   2HG2  ILE  26          2HG2      ILE  26  -0.411  -3.792 -23.624
  201   3HG2  ILE  26          3HG2      ILE  26  -1.951  -3.750 -22.766
  202   1HD1  ILE  26          1HD1      ILE  26   2.021  -3.307 -21.215
  203   2HD1  ILE  26          2HD1      ILE  26   0.852  -1.990 -21.317
  204   3HD1  ILE  26          3HD1      ILE  26   0.992  -3.150 -22.638
  205    H    PHE  27           H        PHE  27  -0.905  -5.323 -18.742
  206    HA   PHE  27           HA       PHE  27   0.985  -7.414 -18.206
  207   1HB   PHE  27          2HB       PHE  27  -0.358  -5.340 -16.474
  208   2HB   PHE  27          1HB       PHE  27   0.683  -6.587 -15.783
  209    HD1  PHE  27           HD1      PHE  27   2.966  -6.950 -17.167
  210    HD2  PHE  27           HD2      PHE  27   0.667  -3.324 -17.061
  211    HE1  PHE  27           HE1      PHE  27   4.963  -5.662 -17.875
  212    HE2  PHE  27           HE2      PHE  27   2.663  -2.037 -17.775
  213    HZ   PHE  27           HZ       PHE  27   4.812  -3.206 -18.180
  214    H    ILE  28           H        ILE  28  -2.474  -7.060 -17.787
  215    HA   ILE  28           HA       ILE  28  -2.587  -9.618 -16.323
  216    HB   ILE  28           HB       ILE  28  -3.722  -7.364 -15.550
  217   1HG1  ILE  28          2HG1      ILE  28  -3.869  -9.669 -14.515
  218   2HG1  ILE  28          1HG1      ILE  28  -5.256  -8.620 -14.236
  219   1HG2  ILE  28          1HG2      ILE  28  -4.981  -7.341 -17.858
  220   2HG2  ILE  28          2HG2      ILE  28  -5.805  -6.825 -16.388
  221   3HG2  ILE  28          3HG2      ILE  28  -6.089  -8.438 -17.034
  222   1HD1  ILE  28          1HD1      ILE  28  -6.410  -9.736 -16.168
  223   2HD1  ILE  28          2HD1      ILE  28  -6.068 -10.829 -14.827
  224   3HD1  ILE  28          3HD1      ILE  28  -5.053 -10.858 -16.268
  225    H    GLN  29           H        GLN  29  -1.910  -9.638 -19.015
  226    HA   GLN  29           HA       GLN  29  -4.217 -10.168 -20.667
  227   1HB   GLN  29          2HB       GLN  29  -2.011  -9.272 -21.519
  228   2HB   GLN  29          1HB       GLN  29  -1.329 -10.871 -21.230
  229   1HG   GLN  29          2HG       GLN  29  -1.976 -11.112 -23.436
  230   2HG   GLN  29          1HG       GLN  29  -3.448 -11.652 -22.628
  231   1HE2  GLN  29          1HE2      GLN  29  -1.957  -8.592 -23.851
  232   2HE2  GLN  29          2HE2      GLN  29  -3.429  -7.912 -24.354
  233    H    ASP  30           H        ASP  30  -1.523 -12.160 -19.427
  234    HA   ASP  30           HA       ASP  30  -2.864 -14.623 -20.137
  235   1HB   ASP  30          2HB       ASP  30  -0.920 -15.732 -19.148
  236   2HB   ASP  30          1HB       ASP  30  -0.408 -14.447 -20.240
  237    H    ALA  31           H        ALA  31  -3.371 -12.506 -17.602
  238    HA   ALA  31           HA       ALA  31  -3.921 -14.631 -15.641
  239   1HB   ALA  31          1HB       ALA  31  -2.882 -12.991 -14.417
  240   2HB   ALA  31          2HB       ALA  31  -4.541 -12.406 -14.291
  241   3HB   ALA  31          3HB       ALA  31  -3.443 -11.696 -15.474
  242    H    GLU  32           H        GLU  32  -5.979 -14.727 -14.594
  243    HA   GLU  32           HA       GLU  32  -8.203 -13.412 -16.026
  244   1HB   GLU  32          2HB       GLU  32  -9.480 -15.562 -15.939
  245   2HB   GLU  32          1HB       GLU  32  -8.081 -15.618 -17.010
  246   1HG   GLU  32          2HG       GLU  32  -7.065 -17.215 -15.766
  247   2HG   GLU  32          1HG       GLU  32  -7.422 -16.378 -14.256
  248    H    ASP  33           H        ASP  33  -7.058 -12.720 -13.510
  249    HA   ASP  33           HA       ASP  33  -9.275 -13.434 -11.678
  250   1HB   ASP  33          2HB       ASP  33  -6.350 -12.981 -11.104
  251   2HB   ASP  33          1HB       ASP  33  -7.576 -12.858  -9.843
  252    H    GLY  34           H        GLY  34  -7.179 -10.883 -12.916
  253   1HA   GLY  34          2HA       GLY  34  -8.114  -8.665 -13.247
  254   2HA   GLY  34          1HA       GLY  34  -9.007  -8.873 -11.744
  255    H    CYS  35           H        CYS  35  -5.609  -9.660 -12.371
  256    HA   CYS  35           HA       CYS  35  -4.592  -7.338 -10.991
  257   1HB   CYS  35          2HB       CYS  35  -3.446  -8.766  -9.227
  258   2HB   CYS  35          1HB       CYS  35  -5.179  -8.525  -9.013
  259    HG   CYS  35           HG       CYS  35  -5.602 -10.939  -9.878
  260    H    ILE  36           H        ILE  36  -2.480  -6.967 -11.499
  261    HA   ILE  36           HA       ILE  36  -1.275  -8.705 -13.494
  262    HB   ILE  36           HB       ILE  36   0.372  -6.988 -13.807
  263   1HG1  ILE  36          2HG1      ILE  36  -0.190  -4.919 -12.043
  264   2HG1  ILE  36          1HG1      ILE  36  -0.296  -6.352 -11.020
  265   1HG2  ILE  36          1HG2      ILE  36  -2.260  -5.622 -13.175
  266   2HG2  ILE  36          2HG2      ILE  36  -1.932  -6.523 -14.655
  267   3HG2  ILE  36          3HG2      ILE  36  -1.023  -5.056 -14.297
  268   1HD1  ILE  36          1HD1      ILE  36   2.051  -5.078 -11.688
  269   2HD1  ILE  36          2HD1      ILE  36   1.996  -6.384 -12.872
  270   3HD1  ILE  36          3HD1      ILE  36   1.936  -6.753 -11.145
  271    H    SER  37           H        SER  37   1.303  -8.852 -13.181
  272    HA   SER  37           HA       SER  37   1.635 -10.440 -10.743
  273   1HB   SER  37          2HB       SER  37   2.439 -10.901 -13.305
  274   2HB   SER  37          1HB       SER  37   3.905 -10.208 -12.618
  275    HG   SER  37           HG       SER  37   3.282 -12.629 -12.400
  276    H    THR  38           H        THR  38   2.278  -9.377  -8.977
  277    HA   THR  38           HA       THR  38   3.527  -6.870  -8.867
  278    HB   THR  38           HB       THR  38   4.120  -7.421  -6.538
  279    HG1  THR  38           HG1      THR  38   4.402  -9.411  -6.015
  280   1HG2  THR  38          1HG2      THR  38   1.713  -8.301  -5.916
  281   2HG2  THR  38          2HG2      THR  38   1.410  -8.041  -7.632
  282   3HG2  THR  38          3HG2      THR  38   1.927  -6.697  -6.615
  283    H    LYS  39           H        LYS  39   4.912 -10.130  -8.957
  284    HA   LYS  39           HA       LYS  39   7.611  -9.421  -8.506
  285   1HB   LYS  39          2HB       LYS  39   8.165 -11.557  -9.690
  286   2HB   LYS  39          1HB       LYS  39   6.977 -11.751  -8.404
  287   1HG   LYS  39          2HG       LYS  39   5.484 -11.160 -10.724
  288   2HG   LYS  39          1HG       LYS  39   6.709 -12.322 -11.231
  289   1HD   LYS  39          2HD       LYS  39   5.913 -13.407  -8.849
  290   2HD   LYS  39          1HD       LYS  39   4.408 -12.683  -9.412
  291   1HE   LYS  39          2HE       LYS  39   4.243 -14.094 -11.217
  292   2HE   LYS  39          1HE       LYS  39   5.991 -14.205 -11.424
  293   1HZ   LYS  39          1HZ       LYS  39   4.446 -15.494  -9.239
  294   2HZ   LYS  39          2HZ       LYS  39   6.117 -15.643  -9.511
  295   3HZ   LYS  39          3HZ       LYS  39   5.010 -16.284 -10.629
  296    H    GLU  40           H        GLU  40   5.571  -9.207 -11.342
  297    HA   GLU  40           HA       GLU  40   7.852  -8.446 -13.040
  298   1HB   GLU  40          2HB       GLU  40   4.948  -8.975 -13.728
  299   2HB   GLU  40          1HB       GLU  40   6.193  -8.520 -14.890
  300   1HG   GLU  40          2HG       GLU  40   6.658 -10.881 -13.092
  301   2HG   GLU  40          1HG       GLU  40   5.627 -11.064 -14.511
  302    H    LEU  41           H        LEU  41   6.397  -6.819 -10.804
  303    HA   LEU  41           HA       LEU  41   5.046  -4.656 -12.010
  304   1HB   LEU  41          2HB       LEU  41   4.903  -5.084  -9.623
  305   2HB   LEU  41          1HB       LEU  41   6.616  -4.786  -9.436
  306    HG   LEU  41           HG       LEU  41   6.274  -2.418 -10.009
  307   1HD1  LEU  41          1HD1      LEU  41   4.449  -1.816 -11.178
  308   2HD1  LEU  41          2HD1      LEU  41   3.450  -2.185  -9.771
  309   3HD1  LEU  41          3HD1      LEU  41   3.759  -3.427 -10.985
  310   1HD2  LEU  41          1HD2      LEU  41   5.868  -3.484  -7.645
  311   2HD2  LEU  41          2HD2      LEU  41   4.178  -3.082  -7.954
  312   3HD2  LEU  41          3HD2      LEU  41   5.398  -1.808  -7.925
  313    H    GLY  42           H        GLY  42   8.459  -5.392 -11.686
  314   1HA   GLY  42          2HA       GLY  42   9.522  -2.793 -12.046
  315   2HA   GLY  42          1HA       GLY  42  10.351  -4.301 -12.419
  316    H    LYS  43           H        LYS  43   7.887  -4.901 -14.248
  317    HA   LYS  43           HA       LYS  43   9.072  -3.792 -16.657
  318   1HB   LYS  43          2HB       LYS  43   6.719  -5.645 -16.214
  319   2HB   LYS  43          1HB       LYS  43   7.285  -5.131 -17.804
  320   1HG   LYS  43          2HG       LYS  43   9.478  -6.121 -17.388
  321   2HG   LYS  43          1HG       LYS  43   8.996  -6.558 -15.747
  322   1HD   LYS  43          2HD       LYS  43   8.464  -8.554 -16.721
  323   2HD   LYS  43          1HD       LYS  43   6.979  -7.708 -17.155
  324   1HE   LYS  43          2HE       LYS  43   9.382  -7.518 -18.953
  325   2HE   LYS  43          1HE       LYS  43   8.344  -8.941 -19.026
  326   1HZ   LYS  43          1HZ       LYS  43   6.448  -7.266 -19.208
  327   2HZ   LYS  43          2HZ       LYS  43   7.435  -7.486 -20.573
  328   3HZ   LYS  43          3HZ       LYS  43   7.647  -6.124 -19.581
  329    H    VAL  44           H        VAL  44   6.224  -3.306 -14.666
  330    HA   VAL  44           HA       VAL  44   5.080  -1.428 -16.601
  331    HB   VAL  44           HB       VAL  44   3.577  -3.043 -15.467
  332   1HG1  VAL  44          1HG1      VAL  44   4.797  -3.119 -13.309
  333   2HG1  VAL  44          2HG1      VAL  44   3.076  -2.793 -13.098
  334   3HG1  VAL  44          3HG1      VAL  44   4.244  -1.479 -12.964
  335   1HG2  VAL  44          1HG2      VAL  44   3.237  -0.258 -15.815
  336   2HG2  VAL  44          2HG2      VAL  44   2.483  -0.653 -14.270
  337   3HG2  VAL  44          3HG2      VAL  44   1.976  -1.488 -15.741
  338    H    MET  45           H        MET  45   6.569  -1.515 -13.398
  339    HA   MET  45           HA       MET  45   6.097   1.121 -12.578
  340   1HB   MET  45          2HB       MET  45   7.286  -0.917 -11.369
  341   2HB   MET  45          1HB       MET  45   8.744  -0.140 -11.987
  342   1HG   MET  45          2HG       MET  45   8.293   1.879 -10.814
  343   2HG   MET  45          1HG       MET  45   6.626   1.406 -10.485
  344   1HE   MET  45          1HE       MET  45   7.401   2.476  -8.430
  345   2HE   MET  45          2HE       MET  45   9.091   2.238  -7.993
  346   3HE   MET  45          3HE       MET  45   7.822   1.519  -7.003
  347    H    ARG  46           H        ARG  46   8.589  -0.233 -14.717
  348    HA   ARG  46           HA       ARG  46  10.189   2.092 -14.939
  349   1HB   ARG  46          2HB       ARG  46  10.985   1.109 -17.086
  350   2HB   ARG  46          1HB       ARG  46  11.022  -0.043 -15.752
  351   1HG   ARG  46          2HG       ARG  46   9.135  -1.210 -16.546
  352   2HG   ARG  46          1HG       ARG  46   8.629   0.124 -17.580
  353   1HD   ARG  46          2HD       ARG  46  10.742  -0.227 -18.916
  354   2HD   ARG  46          1HD       ARG  46  11.021  -1.688 -17.974
  355    HE   ARG  46           HE       ARG  46   8.449  -1.932 -18.979
  356   1HH1  ARG  46          2HH1      ARG  46  11.666  -1.519 -20.274
  357   2HH1  ARG  46          1HH1      ARG  46  11.316  -2.362 -21.743
  358   1HH2  ARG  46          1HH2      ARG  46   8.014  -3.033 -20.913
  359   2HH2  ARG  46          2HH2      ARG  46   9.257  -3.217 -22.106
  360    H    MET  47           H        MET  47   7.215   1.093 -16.538
  361    HA   MET  47           HA       MET  47   7.194   3.127 -18.548
  362   1HB   MET  47          2HB       MET  47   4.976   1.463 -17.325
  363   2HB   MET  47          1HB       MET  47   4.726   2.593 -18.654
  364   1HG   MET  47          2HG       MET  47   6.794   0.389 -18.774
  365   2HG   MET  47          1HG       MET  47   5.132   0.155 -19.315
  366   1HE   MET  47          1HE       MET  47   8.258   1.068 -22.024
  367   2HE   MET  47          2HE       MET  47   7.568  -0.329 -21.202
  368   3HE   MET  47          3HE       MET  47   8.521   0.837 -20.289
  369    H    LEU  48           H        LEU  48   6.153   2.913 -15.199
  370    HA   LEU  48           HA       LEU  48   4.609   5.317 -15.116
  371   1HB   LEU  48          2HB       LEU  48   5.841   3.492 -13.101
  372   2HB   LEU  48          1HB       LEU  48   5.356   5.088 -12.582
  373    HG   LEU  48           HG       LEU  48   3.040   4.613 -13.230
  374   1HD1  LEU  48          1HD1      LEU  48   4.043   1.838 -13.932
  375   2HD1  LEU  48          2HD1      LEU  48   3.629   3.070 -15.124
  376   3HD1  LEU  48          3HD1      LEU  48   2.385   2.423 -14.055
  377   1HD2  LEU  48          1HD2      LEU  48   4.481   3.469 -11.115
  378   2HD2  LEU  48          2HD2      LEU  48   3.505   2.142 -11.749
  379   3HD2  LEU  48          3HD2      LEU  48   2.729   3.633 -11.214
  380    H    GLY  49           H        GLY  49   8.010   4.517 -14.698
  381   1HA   GLY  49          2HA       GLY  49   9.469   6.480 -15.421
  382   2HA   GLY  49          1HA       GLY  49   8.632   7.359 -14.150
  383    H    GLN  50           H        GLN  50   8.978   4.218 -13.043
  384    HA   GLN  50           HA       GLN  50  11.606   4.797 -11.804
  385   1HB   GLN  50          2HB       GLN  50   9.302   3.424 -10.402
  386   2HB   GLN  50          1HB       GLN  50  10.833   3.940  -9.696
  387   1HG   GLN  50          2HG       GLN  50   9.781   5.862  -9.141
  388   2HG   GLN  50          1HG       GLN  50   9.835   6.264 -10.857
  389   1HE2  GLN  50          1HE2      GLN  50   7.824   6.663 -11.786
  390   2HE2  GLN  50          2HE2      GLN  50   6.345   6.086 -11.185
  391    H    ASN  51           H        ASN  51  13.064   3.202 -11.901
  392    HA   ASN  51           HA       ASN  51  12.117   0.479 -12.559
  393   1HB   ASN  51          2HB       ASN  51  14.231   0.271 -13.974
  394   2HB   ASN  51          1HB       ASN  51  12.941   1.271 -14.636
  395   1HD2  ASN  51          1HD2      ASN  51  13.228   3.660 -14.507
  396   2HD2  ASN  51          2HD2      ASN  51  14.785   4.316 -14.337
  397    HA   PRO  52           HA       PRO  52  15.017   0.293  -8.971
  398   1HB   PRO  52          2HB       PRO  52  13.274  -0.927  -7.252
  399   2HB   PRO  52          1HB       PRO  52  13.380   0.827  -7.463
  400   1HG   PRO  52          2HG       PRO  52  11.296  -1.050  -8.382
  401   2HG   PRO  52          1HG       PRO  52  11.184   0.684  -8.052
  402   1HD   PRO  52          2HD       PRO  52  11.402  -0.563 -10.612
  403   2HD   PRO  52          1HD       PRO  52  11.468   1.180 -10.258
  404    H    THR  53           H        THR  53  14.813  -1.965  -7.314
  405    HA   THR  53           HA       THR  53  15.471  -4.141  -9.195
  406    HB   THR  53           HB       THR  53  16.881  -5.038  -7.537
  407    HG1  THR  53           HG1      THR  53  16.407  -4.968  -5.491
  408   1HG2  THR  53          1HG2      THR  53  16.937  -2.069  -6.978
  409   2HG2  THR  53          2HG2      THR  53  17.707  -2.848  -8.360
  410   3HG2  THR  53          3HG2      THR  53  18.257  -3.209  -6.724
  411    HA   PRO  54           HA       PRO  54  12.031  -6.578  -7.891
  412   1HB   PRO  54          2HB       PRO  54  13.084  -9.054  -7.347
  413   2HB   PRO  54          1HB       PRO  54  12.846  -8.409  -8.980
  414   1HG   PRO  54          2HG       PRO  54  15.351  -8.664  -7.396
  415   2HG   PRO  54          1HG       PRO  54  15.107  -8.762  -9.148
  416   1HD   PRO  54          2HD       PRO  54  16.124  -6.547  -7.806
  417   2HD   PRO  54          1HD       PRO  54  15.405  -6.499  -9.431
  418    H    GLU  55           H        GLU  55  14.756  -6.531  -5.685
  419    HA   GLU  55           HA       GLU  55  13.237  -7.491  -3.404
  420   1HB   GLU  55          2HB       GLU  55  15.941  -6.122  -3.452
  421   2HB   GLU  55          1HB       GLU  55  15.243  -7.021  -2.107
  422   1HG   GLU  55          2HG       GLU  55  15.949  -8.181  -4.823
  423   2HG   GLU  55          1HG       GLU  55  16.882  -8.398  -3.343
  424    H    GLU  56           H        GLU  56  14.333  -4.407  -4.757
  425    HA   GLU  56           HA       GLU  56  13.504  -2.790  -2.545
  426   1HB   GLU  56          2HB       GLU  56  14.368  -2.266  -5.362
  427   2HB   GLU  56          1HB       GLU  56  13.577  -0.977  -4.454
  428   1HG   GLU  56          2HG       GLU  56  15.242  -1.398  -2.592
  429   2HG   GLU  56          1HG       GLU  56  16.104  -2.467  -3.700
  430    H    LEU  57           H        LEU  57  11.998  -3.716  -5.637
  431    HA   LEU  57           HA       LEU  57   9.682  -2.069  -5.240
  432   1HB   LEU  57          2HB       LEU  57   8.775  -3.165  -7.179
  433   2HB   LEU  57          1HB       LEU  57  10.434  -2.710  -7.476
  434    HG   LEU  57           HG       LEU  57  10.922  -5.213  -6.790
  435   1HD1  LEU  57          1HD1      LEU  57   8.866  -6.501  -7.900
  436   2HD1  LEU  57          2HD1      LEU  57   7.972  -5.112  -7.283
  437   3HD1  LEU  57          3HD1      LEU  57   8.885  -6.135  -6.173
  438   1HD2  LEU  57          1HD2      LEU  57  11.310  -4.151  -9.014
  439   2HD2  LEU  57          2HD2      LEU  57   9.630  -4.483  -9.439
  440   3HD2  LEU  57          3HD2      LEU  57  10.750  -5.817  -9.160
  441    H    GLN  58           H        GLN  58  10.603  -5.286  -4.256
  442    HA   GLN  58           HA       GLN  58   8.083  -6.467  -3.919
  443   1HB   GLN  58          2HB       GLN  58  10.790  -7.024  -3.065
  444   2HB   GLN  58          1HB       GLN  58   9.646  -7.375  -1.771
  445   1HG   GLN  58          2HG       GLN  58   9.404  -8.380  -4.624
  446   2HG   GLN  58          1HG       GLN  58   9.989  -9.334  -3.262
  447   1HE2  GLN  58          1HE2      GLN  58   7.120  -8.103  -4.840
  448   2HE2  GLN  58          2HE2      GLN  58   5.995  -8.785  -3.769
  449    H    GLU  59           H        GLU  59  10.035  -4.666  -1.508
  450    HA   GLU  59           HA       GLU  59   8.147  -4.774   0.576
  451   1HB   GLU  59          2HB       GLU  59   9.354  -2.930   1.601
  452   2HB   GLU  59          1HB       GLU  59  10.506  -4.060   0.891
  453   1HG   GLU  59          2HG       GLU  59  10.149  -2.422  -1.222
  454   2HG   GLU  59          1HG       GLU  59   9.833  -1.277   0.079
  455    H    MET  60           H        MET  60   8.393  -2.609  -2.197
  456    HA   MET  60           HA       MET  60   6.528  -0.653  -1.297
  457   1HB   MET  60          2HB       MET  60   7.133  -1.436  -4.159
  458   2HB   MET  60          1HB       MET  60   6.422   0.081  -3.607
  459   1HG   MET  60          2HG       MET  60   8.596   0.279  -2.164
  460   2HG   MET  60          1HG       MET  60   9.246  -0.903  -3.298
  461   1HE   MET  60          1HE       MET  60   8.878   3.348  -3.334
  462   2HE   MET  60          2HE       MET  60   7.920   2.213  -2.386
  463   3HE   MET  60          3HE       MET  60   7.235   2.934  -3.840
  464    H    ILE  61           H        ILE  61   6.262  -3.627  -3.166
  465    HA   ILE  61           HA       ILE  61   3.486  -3.444  -3.753
  466    HB   ILE  61           HB       ILE  61   5.277  -5.879  -3.524
  467   1HG1  ILE  61          2HG1      ILE  61   4.260  -4.695  -6.088
  468   2HG1  ILE  61          1HG1      ILE  61   5.631  -3.929  -5.283
  469   1HG2  ILE  61          1HG2      ILE  61   3.550  -7.084  -4.711
  470   2HG2  ILE  61          2HG2      ILE  61   2.586  -5.620  -4.897
  471   3HG2  ILE  61          3HG2      ILE  61   2.802  -6.337  -3.301
  472   1HD1  ILE  61          1HD1      ILE  61   6.101  -5.814  -7.022
  473   2HD1  ILE  61          2HD1      ILE  61   5.606  -6.905  -5.729
  474   3HD1  ILE  61          3HD1      ILE  61   6.985  -5.832  -5.496
  475    H    ASP  62           H        ASP  62   5.302  -5.158  -1.199
  476    HA   ASP  62           HA       ASP  62   3.204  -6.375   0.150
  477   1HB   ASP  62          2HB       ASP  62   5.732  -5.136   1.259
  478   2HB   ASP  62          1HB       ASP  62   4.626  -6.116   2.219
  479    H    GLU  63           H        GLU  63   4.210  -2.990   0.228
  480    HA   GLU  63           HA       GLU  63   2.524  -2.259   2.444
  481   1HB   GLU  63          2HB       GLU  63   4.075  -0.688   0.391
  482   2HB   GLU  63          1HB       GLU  63   3.008   0.106   1.550
  483   1HG   GLU  63          2HG       GLU  63   4.304  -1.358   3.313
  484   2HG   GLU  63          1HG       GLU  63   5.536  -1.438   2.053
  485    H    VAL  64           H        VAL  64   2.350  -1.548  -1.075
  486    HA   VAL  64           HA       VAL  64  -0.238  -0.378  -0.950
  487    HB   VAL  64           HB       VAL  64   1.300   0.058  -2.819
  488   1HG1  VAL  64          1HG1      VAL  64   1.798  -1.594  -4.485
  489   2HG1  VAL  64          2HG1      VAL  64   0.661  -2.742  -3.778
  490   3HG1  VAL  64          3HG1      VAL  64   2.149  -2.335  -2.924
  491   1HG2  VAL  64          1HG2      VAL  64  -0.385   0.288  -4.392
  492   2HG2  VAL  64          2HG2      VAL  64  -1.358  -0.036  -2.957
  493   3HG2  VAL  64          3HG2      VAL  64  -1.019  -1.332  -4.103
  494    H    ASP  65           H        ASP  65   0.844  -3.697  -1.513
  495    HA   ASP  65           HA       ASP  65  -1.786  -4.677  -2.188
  496   1HB   ASP  65          2HB       ASP  65   0.827  -5.654  -2.434
  497   2HB   ASP  65          1HB       ASP  65   0.071  -6.708  -1.245
  498    H    GLU  66           H        GLU  66  -3.236  -4.343  -0.569
  499    HA   GLU  66           HA       GLU  66  -2.731  -4.495   2.196
  500   1HB   GLU  66          2HB       GLU  66  -5.381  -5.090   0.855
  501   2HB   GLU  66          1HB       GLU  66  -5.125  -4.535   2.510
  502   1HG   GLU  66          2HG       GLU  66  -3.871  -2.537   1.291
  503   2HG   GLU  66          1HG       GLU  66  -4.903  -3.011  -0.057
  504    H    ASP  67           H        ASP  67  -4.011  -6.914  -0.062
  505    HA   ASP  67           HA       ASP  67  -4.145  -8.972   1.968
  506   1HB   ASP  67          2HB       ASP  67  -4.631 -10.475  -0.025
  507   2HB   ASP  67          1HB       ASP  67  -5.780  -9.171   0.252
  508    H    GLY  68           H        GLY  68  -1.963  -8.131  -0.697
  509   1HA   GLY  68          2HA       GLY  68   0.264  -8.691  -1.007
  510   2HA   GLY  68          1HA       GLY  68   0.223  -9.532   0.541
  511    H    SER  69           H        SER  69  -1.685  -9.967  -2.428
  512    HA   SER  69           HA       SER  69  -1.303 -12.848  -2.298
  513   1HB   SER  69          2HB       SER  69  -2.858 -12.881  -4.234
  514   2HB   SER  69          1HB       SER  69  -3.514 -12.010  -2.851
  515    HG   SER  69           HG       SER  69  -3.651 -10.350  -4.121
  516    H    GLY  70           H        GLY  70   0.638 -10.457  -3.492
  517   1HA   GLY  70          2HA       GLY  70   2.500 -10.599  -4.859
  518   2HA   GLY  70          1HA       GLY  70   2.049 -12.258  -5.243
  519    H    THR  71           H        THR  71  -0.373  -9.807  -5.585
  520    HA   THR  71           HA       THR  71   0.132  -9.458  -8.447
  521    HB   THR  71           HB       THR  71  -2.102 -10.166  -9.086
  522    HG1  THR  71           HG1      THR  71  -3.330  -9.730  -7.333
  523   1HG2  THR  71          1HG2      THR  71  -1.941 -12.578  -8.571
  524   2HG2  THR  71          2HG2      THR  71  -0.760 -12.222  -7.308
  525   3HG2  THR  71          3HG2      THR  71  -0.367 -11.907  -9.001
  526    H    VAL  72           H        VAL  72  -0.265  -7.408  -9.030
  527    HA   VAL  72           HA       VAL  72  -1.508  -5.619  -7.090
  528    HB   VAL  72           HB       VAL  72  -0.509  -4.819  -9.819
  529   1HG1  VAL  72          1HG1      VAL  72  -0.196  -2.656  -8.721
  530   2HG1  VAL  72          2HG1      VAL  72  -0.689  -3.346  -7.175
  531   3HG1  VAL  72          3HG1      VAL  72  -1.857  -3.204  -8.488
  532   1HG2  VAL  72          1HG2      VAL  72   1.074  -5.122  -7.249
  533   2HG2  VAL  72          2HG2      VAL  72   1.655  -4.295  -8.693
  534   3HG2  VAL  72          3HG2      VAL  72   1.325  -6.028  -8.742
  535    H    ASP  73           H        ASP  73  -3.601  -5.310  -7.076
  536    HA   ASP  73           HA       ASP  73  -5.272  -5.920  -9.377
  537   1HB   ASP  73          2HB       ASP  73  -5.909  -4.819  -6.622
  538   2HB   ASP  73          1HB       ASP  73  -7.126  -5.144  -7.856
  539    H    PHE  74           H        PHE  74  -6.961  -4.183 -10.019
  540    HA   PHE  74           HA       PHE  74  -5.596  -1.942 -11.028
  541   1HB   PHE  74          2HB       PHE  74  -7.791  -2.894 -11.889
  542   2HB   PHE  74          1HB       PHE  74  -8.581  -2.009 -10.582
  543    HD1  PHE  74           HD1      PHE  74  -5.673  -1.186 -12.786
  544    HD2  PHE  74           HD2      PHE  74  -9.630  -0.131 -11.498
  545    HE1  PHE  74           HE1      PHE  74  -5.569   0.891 -14.148
  546    HE2  PHE  74           HE2      PHE  74  -9.522   1.942 -12.853
  547    HZ   PHE  74           HZ       PHE  74  -7.494   2.451 -14.177
  548    H    ASP  75           H        ASP  75  -7.492  -2.363  -8.070
  549    HA   ASP  75           HA       ASP  75  -7.569   0.380  -7.309
  550   1HB   ASP  75          2HB       ASP  75  -8.881  -1.675  -6.342
  551   2HB   ASP  75          1HB       ASP  75  -7.477  -1.842  -5.287
  552    H    GLU  76           H        GLU  76  -5.313  -2.281  -6.646
  553    HA   GLU  76           HA       GLU  76  -3.581  -0.713  -4.960
  554   1HB   GLU  76          2HB       GLU  76  -2.983  -3.322  -6.379
  555   2HB   GLU  76          1HB       GLU  76  -2.100  -2.638  -5.013
  556   1HG   GLU  76          2HG       GLU  76  -4.024  -2.886  -3.560
  557   2HG   GLU  76          1HG       GLU  76  -5.045  -3.365  -4.912
  558    H    PHE  77           H        PHE  77  -3.924  -1.249  -8.368
  559    HA   PHE  77           HA       PHE  77  -1.288  -0.600  -9.222
  560   1HB   PHE  77          2HB       PHE  77  -3.414  -1.645 -10.475
  561   2HB   PHE  77          1HB       PHE  77  -3.655   0.032 -10.928
  562    HD1  PHE  77           HD1      PHE  77  -3.366  -0.749 -13.263
  563    HD2  PHE  77           HD2      PHE  77  -0.163  -0.986 -10.391
  564    HE1  PHE  77           HE1      PHE  77  -1.732  -1.030 -15.092
  565    HE2  PHE  77           HE2      PHE  77   1.460  -1.258 -12.238
  566    HZ   PHE  77           HZ       PHE  77   0.671  -1.285 -14.589
  567    H    LEU  78           H        LEU  78  -4.319   1.289  -9.208
  568    HA   LEU  78           HA       LEU  78  -3.122   3.759  -9.949
  569   1HB   LEU  78          2HB       LEU  78  -5.756   2.939  -8.798
  570   2HB   LEU  78          1HB       LEU  78  -5.320   4.637  -8.780
  571    HG   LEU  78           HG       LEU  78  -5.318   4.764 -11.153
  572   1HD1  LEU  78          1HD1      LEU  78  -5.603   1.753 -11.274
  573   2HD1  LEU  78          2HD1      LEU  78  -4.073   2.603 -11.488
  574   3HD1  LEU  78          3HD1      LEU  78  -5.391   2.860 -12.631
  575   1HD2  LEU  78          1HD2      LEU  78  -7.550   2.900 -10.291
  576   2HD2  LEU  78          2HD2      LEU  78  -7.554   3.876 -11.760
  577   3HD2  LEU  78          3HD2      LEU  78  -7.569   4.660 -10.182
  578    H    VAL  79           H        VAL  79  -3.700   2.174  -6.854
  579    HA   VAL  79           HA       VAL  79  -3.236   4.391  -5.150
  580    HB   VAL  79           HB       VAL  79  -3.179   1.414  -4.840
  581   1HG1  VAL  79          1HG1      VAL  79  -2.460   1.687  -2.466
  582   2HG1  VAL  79          2HG1      VAL  79  -2.060   3.371  -2.811
  583   3HG1  VAL  79          3HG1      VAL  79  -1.178   2.072  -3.618
  584   1HG2  VAL  79          1HG2      VAL  79  -4.468   3.507  -3.087
  585   2HG2  VAL  79          2HG2      VAL  79  -4.951   1.828  -3.327
  586   3HG2  VAL  79          3HG2      VAL  79  -5.202   3.011  -4.611
  587    H    MET  80           H        MET  80  -1.059   1.837  -6.348
  588    HA   MET  80           HA       MET  80   1.324   2.519  -5.161
  589   1HB   MET  80          2HB       MET  80   0.558   0.839  -7.239
  590   2HB   MET  80          1HB       MET  80   1.715   1.937  -7.993
  591   1HG   MET  80          2HG       MET  80   2.472   0.909  -5.314
  592   2HG   MET  80          1HG       MET  80   2.451  -0.280  -6.616
  593   1HE   MET  80          1HE       MET  80   3.584   1.477  -9.336
  594   2HE   MET  80          2HE       MET  80   3.367  -0.139  -8.669
  595   3HE   MET  80          3HE       MET  80   4.990   0.455  -9.008
  596    H    MET  81           H        MET  81  -0.300   4.194  -7.805
  597    HA   MET  81           HA       MET  81   1.866   5.794  -8.687
  598   1HB   MET  81          2HB       MET  81  -0.405   5.444  -9.824
  599   2HB   MET  81          1HB       MET  81  -1.026   6.659  -8.709
  600   1HG   MET  81          2HG       MET  81   1.287   7.839  -9.673
  601   2HG   MET  81          1HG       MET  81   0.654   7.000 -11.089
  602   1HE   MET  81          1HE       MET  81  -3.107   8.019 -10.777
  603   2HE   MET  81          2HE       MET  81  -2.008   6.646 -10.768
  604   3HE   MET  81          3HE       MET  81  -2.047   7.723 -12.160
  605    H    VAL  82           H        VAL  82  -0.851   6.592  -6.499
  606    HA   VAL  82           HA       VAL  82   0.209   9.118  -5.714
  607    HB   VAL  82           HB       VAL  82  -1.443   8.978  -3.839
  608   1HG1  VAL  82          1HG1      VAL  82  -2.469   8.273  -6.603
  609   2HG1  VAL  82          2HG1      VAL  82  -2.065   9.893  -6.035
  610   3HG1  VAL  82          3HG1      VAL  82  -3.421   9.020  -5.320
  611   1HG2  VAL  82          1HG2      VAL  82  -2.920   7.091  -3.664
  612   2HG2  VAL  82          2HG2      VAL  82  -1.276   6.449  -3.665
  613   3HG2  VAL  82          3HG2      VAL  82  -2.257   6.362  -5.127
  614    H    ARG  83           H        ARG  83   0.727   5.855  -4.588
  615    HA   ARG  83           HA       ARG  83   1.738   6.372  -2.006
  616   1HB   ARG  83          2HB       ARG  83   2.338   4.172  -3.992
  617   2HB   ARG  83          1HB       ARG  83   3.026   4.209  -2.367
  618   1HG   ARG  83          2HG       ARG  83   0.383   4.654  -1.825
  619   2HG   ARG  83          1HG       ARG  83   0.266   3.600  -3.232
  620   1HD   ARG  83          2HD       ARG  83   0.363   2.074  -1.452
  621   2HD   ARG  83          1HD       ARG  83   2.031   2.138  -2.009
  622    HE   ARG  83           HE       ARG  83   2.618   3.114   0.013
  623   1HH1  ARG  83          2HH1      ARG  83  -0.846   3.282  -0.429
  624   2HH1  ARG  83          1HH1      ARG  83  -1.145   3.870   1.170
  625   1HH2  ARG  83          1HH2      ARG  83   2.197   3.885   2.103
  626   2HH2  ARG  83          2HH2      ARG  83   0.569   4.210   2.599
  627    H    CYS  84           H        CYS  84   3.212   6.542  -5.200
  628    HA   CYS  84           HA       CYS  84   5.886   6.996  -4.152
  629   1HB   CYS  84          2HB       CYS  84   5.209   5.868  -6.418
  630   2HB   CYS  84          1HB       CYS  84   5.112   7.530  -7.001
  631    HG   CYS  84           HG       CYS  84   7.616   6.317  -7.104
  632    H    MET  85           H        MET  85   3.360   8.901  -5.803
  633    HA   MET  85           HA       MET  85   4.794  11.345  -5.886
  634   1HB   MET  85          2HB       MET  85   2.578  10.625  -7.091
  635   2HB   MET  85          1HB       MET  85   1.804  11.271  -5.644
  636   1HG   MET  85          2HG       MET  85   1.898  13.183  -6.947
  637   2HG   MET  85          1HG       MET  85   3.430  13.314  -6.085
  638   1HE   MET  85          1HE       MET  85   4.594  14.657  -7.313
  639   2HE   MET  85          2HE       MET  85   5.367  14.382  -8.871
  640   3HE   MET  85          3HE       MET  85   5.851  13.423  -7.476
  641    H    LYS  86           H        LYS  86   2.690   9.874  -3.468
  642    HA   LYS  86           HA       LYS  86   2.454  10.272  -1.225
  643   1HB   LYS  86          2HB       LYS  86   4.969  11.142  -1.585
  644   2HB   LYS  86          1HB       LYS  86   4.200  12.677  -1.178
  645   1HG   LYS  86          2HG       LYS  86   4.905  11.725   0.900
  646   2HG   LYS  86          1HG       LYS  86   3.160  11.479   0.821
  647   1HD   LYS  86          2HD       LYS  86   3.828   9.344   1.417
  648   2HD   LYS  86          1HD       LYS  86   3.884   9.194  -0.339
  649   1HE   LYS  86          2HE       LYS  86   6.276   9.636  -0.351
  650   2HE   LYS  86          1HE       LYS  86   6.260   9.954   1.383
  651   1HZ   LYS  86          1HZ       LYS  86   7.018   7.718   0.934
  652   2HZ   LYS  86          2HZ       LYS  86   5.593   7.371   0.076
  653   3HZ   LYS  86          3HZ       LYS  86   5.531   7.670   1.748
  654    H    ASP  87           H        ASP  87   0.482  10.966  -0.834
  655    HA   ASP  87           HA       ASP  87  -0.589  13.408  -1.921
  656   1HB   ASP  87          2HB       ASP  87  -1.614  11.229  -0.145
  657   2HB   ASP  87          1HB       ASP  87  -2.478  12.766  -0.184
  658    H    ASP  88           H        ASP  88   0.913  12.469   1.097
  659    HA   ASP  88           HA       ASP  88  -0.015  14.765   2.581
  660   1HB   ASP  88          2HB       ASP  88   0.735  12.422   3.482
  661   2HB   ASP  88          1HB       ASP  88   2.353  13.116   3.402
  662    H    SER  89           HN       SER  89   0.668  16.321   0.957
  663    HA   SER  89           HA       SER  89   3.434  16.806   0.402
  664   1HB   SER  89          2HB       SER  89   0.910  18.392   0.006
  665   2HB   SER  89          1HB       SER  89   2.483  19.141  -0.254
  666    HG   SER  89           HG       SER  89   2.527  18.140  -2.090
  Start of MODEL   36
    1   1H    MET   1          1H        MET   1  -7.182   4.651   9.601
    2   2H    MET   1          2H        MET   1  -7.220   3.666   8.217
    3   3H    MET   1          3H        MET   1  -7.115   5.356   8.061
    4    HA   MET   1           HA       MET   1  -4.932   5.344   9.103
    5   1HB   MET   1          2HB       MET   1  -5.651   3.023  10.234
    6   2HB   MET   1          1HB       MET   1  -4.804   2.372   8.831
    7   1HG   MET   1          2HG       MET   1  -3.136   2.588  10.515
    8   2HG   MET   1          1HG       MET   1  -2.888   3.966   9.443
    9   1HE   MET   1          1HE       MET   1  -3.685   2.545  12.701
   10   2HE   MET   1          2HE       MET   1  -3.568   3.904  13.817
   11   3HE   MET   1          3HE       MET   1  -2.175   3.457  12.834
   12    H    ASN   2           H        ASN   2  -3.562   5.857   7.526
   13    HA   ASN   2           HA       ASN   2  -2.579   6.019   5.460
   14   1HB   ASN   2          2HB       ASN   2  -3.185   3.059   5.233
   15   2HB   ASN   2          1HB       ASN   2  -1.963   3.962   4.340
   16   1HD2  ASN   2          1HD2      ASN   2  -0.881   5.546   6.466
   17   2HD2  ASN   2          2HD2      ASN   2  -0.128   4.506   7.579
   18    H    ASP   3           H        ASP   3  -5.301   6.701   5.610
   19    HA   ASP   3           HA       ASP   3  -6.524   5.652   3.156
   20   1HB   ASP   3          2HB       ASP   3  -8.546   6.791   3.877
   21   2HB   ASP   3          1HB       ASP   3  -7.904   5.837   5.213
   22    H    ILE   4           H        ILE   4  -4.262   7.893   3.680
   23    HA   ILE   4           HA       ILE   4  -5.280  10.247   2.469
   24    HB   ILE   4           HB       ILE   4  -3.006  10.990   2.245
   25   1HG1  ILE   4          2HG1      ILE   4  -2.205   8.701   1.335
   26   2HG1  ILE   4          1HG1      ILE   4  -1.085   9.611   2.340
   27   1HG2  ILE   4          1HG2      ILE   4  -2.211  10.714   4.543
   28   2HG2  ILE   4          2HG2      ILE   4  -3.272   9.324   4.764
   29   3HG2  ILE   4          3HG2      ILE   4  -3.961  10.929   4.524
   30   1HD1  ILE   4          1HD1      ILE   4  -2.226   8.195   4.288
   31   2HD1  ILE   4          2HD1      ILE   4  -0.906   7.529   3.331
   32   3HD1  ILE   4          3HD1      ILE   4  -2.572   7.090   2.959
   33    H    TYR   5           H        TYR   5  -4.135   7.233   1.174
   34    HA   TYR   5           HA       TYR   5  -3.665   8.176  -1.507
   35   1HB   TYR   5          2HB       TYR   5  -4.231   5.329  -0.647
   36   2HB   TYR   5          1HB       TYR   5  -3.382   5.864  -2.096
   37    HD1  TYR   5           HD1      TYR   5  -1.300   7.482  -1.608
   38    HD2  TYR   5           HD2      TYR   5  -2.955   4.669   1.184
   39    HE1  TYR   5           HE1      TYR   5   0.834   7.477  -0.346
   40    HE2  TYR   5           HE2      TYR   5  -0.820   4.661   2.444
   41    HH   TYR   5           HH       TYR   5   1.262   6.705   2.543
   42    H    LYS   6           H        LYS   6  -6.378   6.852   0.294
   43    HA   LYS   6           HA       LYS   6  -8.096   6.223  -1.855
   44   1HB   LYS   6          2HB       LYS   6  -8.303   5.779   0.742
   45   2HB   LYS   6          1HB       LYS   6  -9.211   7.290   0.706
   46   1HG   LYS   6          2HG       LYS   6 -10.748   6.393  -0.948
   47   2HG   LYS   6          1HG       LYS   6  -9.786   4.923  -1.100
   48   1HD   LYS   6          2HD       LYS   6 -10.943   5.776   1.556
   49   2HD   LYS   6          1HD       LYS   6 -11.878   4.815   0.411
   50   1HE   LYS   6          2HE       LYS   6 -10.611   2.939   0.743
   51   2HE   LYS   6          1HE       LYS   6  -9.119   3.859   0.942
   52   1HZ   LYS   6          1HZ       LYS   6  -9.896   4.532   3.147
   53   2HZ   LYS   6          2HZ       LYS   6  -9.759   2.844   3.017
   54   3HZ   LYS   6          3HZ       LYS   6 -11.288   3.582   2.953
   55    H    ALA   7           H        ALA   7  -7.265   9.275  -0.346
   56    HA   ALA   7           HA       ALA   7  -9.480  10.818  -1.169
   57   1HB   ALA   7          1HB       ALA   7  -7.803  12.752  -1.034
   58   2HB   ALA   7          2HB       ALA   7  -6.616  11.540  -0.553
   59   3HB   ALA   7          3HB       ALA   7  -8.051  11.810   0.437
   60    H    ALA   8           H        ALA   8  -6.428  10.018  -2.817
   61    HA   ALA   8           HA       ALA   8  -6.935  11.732  -5.072
   62   1HB   ALA   8          1HB       ALA   8  -4.645  11.150  -4.537
   63   2HB   ALA   8          2HB       ALA   8  -5.044  10.486  -6.121
   64   3HB   ALA   8          3HB       ALA   8  -5.004   9.432  -4.708
   65    H    VAL   9           H        VAL   9  -7.232   8.233  -4.497
   66    HA   VAL   9           HA       VAL   9  -8.083   7.582  -7.124
   67    HB   VAL   9           HB       VAL   9  -7.186   5.967  -5.400
   68   1HG1  VAL   9          1HG1      VAL   9  -8.771   5.001  -3.809
   69   2HG1  VAL   9          2HG1      VAL   9 -10.034   6.097  -4.369
   70   3HG1  VAL   9          3HG1      VAL   9  -8.621   6.735  -3.531
   71   1HG2  VAL   9          1HG2      VAL   9  -9.852   5.019  -6.438
   72   2HG2  VAL   9          2HG2      VAL   9  -8.317   4.153  -6.376
   73   3HG2  VAL   9          3HG2      VAL   9  -8.558   5.436  -7.561
   74    H    GLU  10           H        GLU  10  -9.744   9.001  -4.430
   75    HA   GLU  10           HA       GLU  10 -12.397   8.284  -5.343
   76   1HB   GLU  10          2HB       GLU  10 -11.287   9.920  -3.098
   77   2HB   GLU  10          1HB       GLU  10 -12.963  10.175  -3.588
   78   1HG   GLU  10          2HG       GLU  10 -13.380   7.734  -3.344
   79   2HG   GLU  10          1HG       GLU  10 -11.724   7.528  -2.774
   80    H    GLN  11           H        GLN  11 -10.110  10.814  -5.991
   81    HA   GLN  11           HA       GLN  11 -12.174  12.188  -7.606
   82   1HB   GLN  11          2HB       GLN  11 -10.945  14.364  -7.033
   83   2HB   GLN  11          1HB       GLN  11 -11.962  13.673  -5.770
   84   1HG   GLN  11          2HG       GLN  11 -10.176  13.057  -4.469
   85   2HG   GLN  11          1HG       GLN  11  -9.116  12.790  -5.850
   86   1HE2  GLN  11          1HE2      GLN  11  -8.813  14.503  -3.304
   87   2HE2  GLN  11          2HE2      GLN  11  -8.375  16.031  -3.893
   88    H    LEU  12           H        LEU  12 -10.174  10.225  -8.361
   89    HA   LEU  12           HA       LEU  12  -8.005  11.624  -9.657
   90   1HB   LEU  12          2HB       LEU  12  -7.751   9.360 -10.858
   91   2HB   LEU  12          1HB       LEU  12  -7.386   9.466  -9.155
   92    HG   LEU  12           HG       LEU  12  -9.330   8.260  -8.559
   93   1HD1  LEU  12          1HD1      LEU  12 -11.050   9.258  -9.863
   94   2HD1  LEU  12          2HD1      LEU  12 -10.990   7.578 -10.394
   95   3HD1  LEU  12          3HD1      LEU  12 -10.250   8.839 -11.378
   96   1HD2  LEU  12          1HD2      LEU  12  -7.607   7.281 -10.709
   97   2HD2  LEU  12          2HD2      LEU  12  -9.161   6.444 -10.654
   98   3HD2  LEU  12          3HD2      LEU  12  -8.123   6.472  -9.229
   99    H    THR  13           H        THR  13  -7.696  10.889 -12.131
  100    HA   THR  13           HA       THR  13 -10.133  11.830 -13.524
  101    HB   THR  13           HB       THR  13  -8.143  12.206 -15.343
  102    HG1  THR  13           HG1      THR  13  -6.338  12.093 -14.311
  103   1HG2  THR  13          1HG2      THR  13  -8.119  14.610 -14.219
  104   2HG2  THR  13          2HG2      THR  13  -9.448  13.924 -13.284
  105   3HG2  THR  13          3HG2      THR  13  -9.550  13.996 -15.045
  106    H    ASP  14           H        ASP  14 -10.253  11.116 -15.828
  107    HA   ASP  14           HA       ASP  14 -10.214   8.262 -15.967
  108   1HB   ASP  14          2HB       ASP  14 -11.625  10.144 -17.305
  109   2HB   ASP  14          1HB       ASP  14 -10.375   9.802 -18.500
  110    H    GLU  15           H        GLU  15  -8.100  10.848 -17.072
  111    HA   GLU  15           HA       GLU  15  -6.438   9.211 -18.740
  112   1HB   GLU  15          2HB       GLU  15  -6.053  11.923 -17.467
  113   2HB   GLU  15          1HB       GLU  15  -4.794  11.146 -18.427
  114   1HG   GLU  15          2HG       GLU  15  -7.601  11.488 -19.488
  115   2HG   GLU  15          1HG       GLU  15  -6.387  12.756 -19.664
  116    H    GLN  16           H        GLN  16  -6.440  10.126 -15.331
  117    HA   GLN  16           HA       GLN  16  -3.844   9.198 -14.661
  118   1HB   GLN  16          2HB       GLN  16  -5.400  10.659 -13.237
  119   2HB   GLN  16          1HB       GLN  16  -6.213   9.160 -12.787
  120   1HG   GLN  16          2HG       GLN  16  -3.776   8.328 -12.253
  121   2HG   GLN  16          1HG       GLN  16  -3.411  10.050 -12.174
  122   1HE2  GLN  16          1HE2      GLN  16  -5.505  11.210 -10.898
  123   2HE2  GLN  16          2HE2      GLN  16  -5.779  10.503  -9.382
  124    H    LYS  17           H        LYS  17  -7.052   7.647 -14.385
  125    HA   LYS  17           HA       LYS  17  -5.972   5.141 -13.513
  126   1HB   LYS  17          2HB       LYS  17  -8.258   4.248 -13.965
  127   2HB   LYS  17          1HB       LYS  17  -8.257   5.669 -12.924
  128   1HG   LYS  17          2HG       LYS  17  -8.590   7.002 -15.144
  129   2HG   LYS  17          1HG       LYS  17  -9.093   5.445 -15.806
  130   1HD   LYS  17          2HD       LYS  17 -10.265   6.653 -13.289
  131   2HD   LYS  17          1HD       LYS  17 -10.982   6.847 -14.887
  132   1HE   LYS  17          2HE       LYS  17 -12.080   4.911 -14.481
  133   2HE   LYS  17          1HE       LYS  17 -10.530   4.108 -14.719
  134   1HZ   LYS  17          1HZ       LYS  17 -11.564   5.126 -12.126
  135   2HZ   LYS  17          2HZ       LYS  17 -10.080   4.333 -12.361
  136   3HZ   LYS  17          3HZ       LYS  17 -11.539   3.500 -12.606
  137    H    ASN  18           H        ASN  18  -6.750   6.549 -16.648
  138    HA   ASN  18           HA       ASN  18  -6.663   4.171 -18.198
  139   1HB   ASN  18          2HB       ASN  18  -6.379   7.088 -18.777
  140   2HB   ASN  18          1HB       ASN  18  -5.808   5.950 -19.995
  141   1HD2  ASN  18          1HD2      ASN  18  -8.118   7.687 -20.351
  142   2HD2  ASN  18          2HD2      ASN  18  -9.481   6.687 -20.510
  143    H    GLU  19           H        GLU  19  -4.173   6.376 -17.015
  144    HA   GLU  19           HA       GLU  19  -1.979   5.551 -18.539
  145   1HB   GLU  19          2HB       GLU  19  -2.005   7.465 -16.906
  146   2HB   GLU  19          1HB       GLU  19  -1.900   6.284 -15.601
  147   1HG   GLU  19          2HG       GLU  19   0.239   5.504 -16.360
  148   2HG   GLU  19          1HG       GLU  19   0.100   6.403 -17.872
  149    H    PHE  20           H        PHE  20  -3.165   4.275 -15.424
  150    HA   PHE  20           HA       PHE  20  -1.241   2.115 -15.402
  151   1HB   PHE  20          2HB       PHE  20  -3.552   2.916 -13.663
  152   2HB   PHE  20          1HB       PHE  20  -2.836   1.314 -13.500
  153    HD1  PHE  20           HD1      PHE  20  -2.276   4.930 -13.122
  154    HD2  PHE  20           HD2      PHE  20  -0.533   1.027 -12.723
  155    HE1  PHE  20           HE1      PHE  20  -0.428   5.892 -11.785
  156    HE2  PHE  20           HE2      PHE  20   1.311   1.983 -11.375
  157    HZ   PHE  20           HZ       PHE  20   1.369   4.419 -10.910
  158    H    LYS  21           H        LYS  21  -4.750   2.412 -15.964
  159    HA   LYS  21           HA       LYS  21  -5.435  -0.253 -16.273
  160   1HB   LYS  21          2HB       LYS  21  -7.044   1.642 -16.295
  161   2HB   LYS  21          1HB       LYS  21  -6.513   2.038 -17.928
  162   1HG   LYS  21          2HG       LYS  21  -7.256  -0.794 -17.535
  163   2HG   LYS  21          1HG       LYS  21  -8.589   0.346 -17.349
  164   1HD   LYS  21          2HD       LYS  21  -7.605   1.391 -19.565
  165   2HD   LYS  21          1HD       LYS  21  -6.896  -0.212 -19.763
  166   1HE   LYS  21          2HE       LYS  21  -9.474  -0.834 -19.047
  167   2HE   LYS  21          1HE       LYS  21  -9.709   0.637 -19.991
  168   1HZ   LYS  21          1HZ       LYS  21  -8.224  -1.782 -20.865
  169   2HZ   LYS  21          2HZ       LYS  21  -8.387  -0.354 -21.770
  170   3HZ   LYS  21          3HZ       LYS  21  -9.754  -1.298 -21.413
  171    H    ALA  22           H        ALA  22  -3.879   1.900 -18.625
  172    HA   ALA  22           HA       ALA  22  -4.078   0.288 -20.920
  173   1HB   ALA  22          1HB       ALA  22  -2.075   1.491 -21.722
  174   2HB   ALA  22          2HB       ALA  22  -1.809   2.122 -20.097
  175   3HB   ALA  22          3HB       ALA  22  -3.243   2.601 -21.004
  176    H    ALA  23           H        ALA  23  -1.441   0.500 -18.528
  177    HA   ALA  23           HA       ALA  23   0.045  -1.704 -19.551
  178   1HB   ALA  23          1HB       ALA  23   0.437   0.257 -17.579
  179   2HB   ALA  23          2HB       ALA  23   1.568  -1.014 -18.045
  180   3HB   ALA  23          3HB       ALA  23   0.446  -1.278 -16.710
  181    H    PHE  24           H        PHE  24  -2.508  -1.339 -17.161
  182    HA   PHE  24           HA       PHE  24  -2.363  -3.854 -15.910
  183   1HB   PHE  24          2HB       PHE  24  -3.839  -1.788 -15.339
  184   2HB   PHE  24          1HB       PHE  24  -4.987  -2.493 -16.474
  185    HD1  PHE  24           HD1      PHE  24  -5.807  -4.863 -16.089
  186    HD2  PHE  24           HD2      PHE  24  -3.560  -2.683 -13.156
  187    HE1  PHE  24           HE1      PHE  24  -6.562  -6.442 -14.331
  188    HE2  PHE  24           HE2      PHE  24  -4.312  -4.254 -11.404
  189    HZ   PHE  24           HZ       PHE  24  -5.816  -6.130 -11.992
  190    H    ASP  25           H        ASP  25  -4.051  -2.796 -18.850
  191    HA   ASP  25           HA       ASP  25  -5.446  -5.196 -19.368
  192   1HB   ASP  25          2HB       ASP  25  -5.490  -2.751 -20.497
  193   2HB   ASP  25          1HB       ASP  25  -4.513  -3.603 -21.693
  194    H    ILE  26           H        ILE  26  -2.241  -4.071 -20.455
  195    HA   ILE  26           HA       ILE  26  -1.771  -6.401 -22.071
  196    HB   ILE  26           HB       ILE  26   0.576  -5.561 -22.214
  197   1HG1  ILE  26          2HG1      ILE  26  -0.485  -3.298 -20.488
  198   2HG1  ILE  26          1HG1      ILE  26   0.641  -4.535 -19.933
  199   1HG2  ILE  26          1HG2      ILE  26  -1.319  -4.796 -23.704
  200   2HG2  ILE  26          2HG2      ILE  26   0.008  -3.644 -23.557
  201   3HG2  ILE  26          3HG2      ILE  26  -1.486  -3.387 -22.657
  202   1HD1  ILE  26          1HD1      ILE  26   1.474  -3.217 -22.427
  203   2HD1  ILE  26          2HD1      ILE  26   2.403  -3.555 -20.966
  204   3HD1  ILE  26          3HD1      ILE  26   1.371  -2.126 -21.044
  205    H    PHE  27           H        PHE  27  -0.813  -5.435 -18.778
  206    HA   PHE  27           HA       PHE  27   0.893  -7.712 -18.377
  207   1HB   PHE  27          2HB       PHE  27  -0.346  -5.765 -16.422
  208   2HB   PHE  27          1HB       PHE  27   0.738  -7.069 -15.941
  209    HD1  PHE  27           HD1      PHE  27   0.777  -3.724 -16.368
  210    HD2  PHE  27           HD2      PHE  27   2.809  -7.176 -17.918
  211    HE1  PHE  27           HE1      PHE  27   2.717  -2.309 -16.979
  212    HE2  PHE  27           HE2      PHE  27   4.749  -5.758 -18.526
  213    HZ   PHE  27           HZ       PHE  27   4.702  -3.325 -18.058
  214    H    ILE  28           H        ILE  28  -2.530  -7.048 -17.818
  215    HA   ILE  28           HA       ILE  28  -2.852  -9.710 -16.599
  216    HB   ILE  28           HB       ILE  28  -3.820  -7.418 -15.684
  217   1HG1  ILE  28          2HG1      ILE  28  -4.057  -9.743 -14.748
  218   2HG1  ILE  28          1HG1      ILE  28  -5.413  -8.667 -14.417
  219   1HG2  ILE  28          1HG2      ILE  28  -5.904  -6.746 -16.426
  220   2HG2  ILE  28          2HG2      ILE  28  -6.264  -8.299 -17.175
  221   3HG2  ILE  28          3HG2      ILE  28  -5.129  -7.191 -17.946
  222   1HD1  ILE  28          1HD1      ILE  28  -5.277 -10.822 -16.542
  223   2HD1  ILE  28          2HD1      ILE  28  -6.598  -9.664 -16.397
  224   3HD1  ILE  28          3HD1      ILE  28  -6.293 -10.821 -15.101
  225    H    GLN  29           H        GLN  29  -2.188  -9.535 -19.314
  226    HA   GLN  29           HA       GLN  29  -4.555  -9.866 -20.944
  227   1HB   GLN  29          2HB       GLN  29  -2.417  -8.928 -21.835
  228   2HB   GLN  29          1HB       GLN  29  -1.672 -10.509 -21.607
  229   1HG   GLN  29          2HG       GLN  29  -3.213 -11.531 -23.169
  230   2HG   GLN  29          1HG       GLN  29  -4.146 -10.039 -23.293
  231   1HE2  GLN  29          1HE2      GLN  29  -2.709  -8.052 -24.026
  232   2HE2  GLN  29          2HE2      GLN  29  -1.588  -8.375 -25.259
  233    H    ASP  30           H        ASP  30  -1.899 -11.986 -19.839
  234    HA   ASP  30           HA       ASP  30  -3.327 -14.362 -20.723
  235   1HB   ASP  30          2HB       ASP  30  -0.660 -13.954 -19.362
  236   2HB   ASP  30          1HB       ASP  30  -1.323 -15.548 -19.726
  237    H    ALA  31           H        ALA  31  -3.643 -12.437 -18.021
  238    HA   ALA  31           HA       ALA  31  -4.095 -14.691 -16.182
  239   1HB   ALA  31          1HB       ALA  31  -4.616 -12.618 -14.616
  240   2HB   ALA  31          2HB       ALA  31  -3.670 -11.752 -15.827
  241   3HB   ALA  31          3HB       ALA  31  -2.955 -13.105 -14.950
  242    H    GLU  32           H        GLU  32  -6.082 -14.902 -15.063
  243    HA   GLU  32           HA       GLU  32  -8.392 -13.543 -16.325
  244   1HB   GLU  32          2HB       GLU  32  -8.183 -16.484 -15.625
  245   2HB   GLU  32          1HB       GLU  32  -9.649 -15.675 -16.181
  246   1HG   GLU  32          2HG       GLU  32  -8.269 -14.935 -18.222
  247   2HG   GLU  32          1HG       GLU  32  -7.081 -16.131 -17.707
  248    H    ASP  33           H        ASP  33  -7.063 -12.846 -13.878
  249    HA   ASP  33           HA       ASP  33  -9.141 -13.551 -11.883
  250   1HB   ASP  33          2HB       ASP  33  -6.216 -12.887 -11.501
  251   2HB   ASP  33          1HB       ASP  33  -7.379 -12.936 -10.176
  252    H    GLY  34           H        GLY  34  -7.119 -10.971 -13.223
  253   1HA   GLY  34          2HA       GLY  34  -8.069  -8.772 -13.590
  254   2HA   GLY  34          1HA       GLY  34  -9.003  -8.981 -12.112
  255    H    CYS  35           H        CYS  35  -5.574  -9.718 -12.624
  256    HA   CYS  35           HA       CYS  35  -4.653  -7.367 -11.211
  257   1HB   CYS  35          2HB       CYS  35  -3.525  -8.748  -9.418
  258   2HB   CYS  35          1HB       CYS  35  -5.277  -8.626  -9.269
  259    HG   CYS  35           HG       CYS  35  -5.250 -11.103  -9.288
  260    H    ILE  36           H        ILE  36  -2.481  -6.987 -11.531
  261    HA   ILE  36           HA       ILE  36  -1.197  -8.638 -13.571
  262    HB   ILE  36           HB       ILE  36   0.380  -6.872 -13.847
  263   1HG1  ILE  36          2HG1      ILE  36  -0.159  -4.870 -12.006
  264   2HG1  ILE  36          1HG1      ILE  36  -0.273  -6.333 -11.027
  265   1HG2  ILE  36          1HG2      ILE  36  -1.975  -6.417 -14.615
  266   2HG2  ILE  36          2HG2      ILE  36  -1.030  -4.963 -14.295
  267   3HG2  ILE  36          3HG2      ILE  36  -2.229  -5.511 -13.124
  268   1HD1  ILE  36          1HD1      ILE  36   1.981  -6.786 -12.594
  269   2HD1  ILE  36          2HD1      ILE  36   1.992  -6.262 -10.910
  270   3HD1  ILE  36          3HD1      ILE  36   2.091  -5.069 -12.208
  271    H    SER  37           H        SER  37   1.218  -9.034 -13.307
  272    HA   SER  37           HA       SER  37   1.616 -10.537 -10.875
  273   1HB   SER  37          2HB       SER  37   2.541 -10.907 -13.374
  274   2HB   SER  37          1HB       SER  37   3.902 -10.013 -12.708
  275    HG   SER  37           HG       SER  37   4.258 -12.139 -12.246
  276    H    THR  38           H        THR  38   1.832  -9.264  -9.105
  277    HA   THR  38           HA       THR  38   3.022  -6.738  -8.973
  278    HB   THR  38           HB       THR  38   1.565  -7.965  -7.227
  279    HG1  THR  38           HG1      THR  38   2.116  -6.383  -5.970
  280   1HG2  THR  38          1HG2      THR  38   2.655  -9.199  -5.532
  281   2HG2  THR  38          2HG2      THR  38   4.257  -8.720  -6.094
  282   3HG2  THR  38          3HG2      THR  38   3.291  -9.853  -7.042
  283    H    LYS  39           H        LYS  39   4.459  -9.950  -8.804
  284    HA   LYS  39           HA       LYS  39   7.031  -9.144  -7.878
  285   1HB   LYS  39          2HB       LYS  39   7.804 -11.327  -8.679
  286   2HB   LYS  39          1HB       LYS  39   6.281 -11.499  -7.809
  287   1HG   LYS  39          2HG       LYS  39   5.354 -11.100 -10.339
  288   2HG   LYS  39          1HG       LYS  39   6.875 -11.925 -10.681
  289   1HD   LYS  39          2HD       LYS  39   4.958 -12.983  -8.604
  290   2HD   LYS  39          1HD       LYS  39   4.776 -13.393 -10.309
  291   1HE   LYS  39          2HE       LYS  39   6.653 -14.707 -10.336
  292   2HE   LYS  39          1HE       LYS  39   7.510 -13.687  -9.181
  293   1HZ   LYS  39          1HZ       LYS  39   6.981 -15.783  -8.170
  294   2HZ   LYS  39          2HZ       LYS  39   5.337 -15.616  -8.562
  295   3HZ   LYS  39          3HZ       LYS  39   6.055 -14.571  -7.430
  296    H    GLU  40           H        GLU  40   5.455  -9.123 -11.001
  297    HA   GLU  40           HA       GLU  40   7.956  -8.521 -12.406
  298   1HB   GLU  40          2HB       GLU  40   5.130  -8.977 -13.393
  299   2HB   GLU  40          1HB       GLU  40   6.476  -8.528 -14.441
  300   1HG   GLU  40          2HG       GLU  40   7.724 -10.540 -13.630
  301   2HG   GLU  40          1HG       GLU  40   6.294 -11.014 -12.713
  302    H    LEU  41           H        LEU  41   6.428  -6.652 -10.447
  303    HA   LEU  41           HA       LEU  41   5.265  -4.495 -11.746
  304   1HB   LEU  41          2HB       LEU  41   6.160  -5.031  -9.157
  305   2HB   LEU  41          1HB       LEU  41   7.049  -3.607  -9.640
  306    HG   LEU  41           HG       LEU  41   5.020  -2.973  -8.458
  307   1HD1  LEU  41          1HD1      LEU  41   5.870  -1.741 -10.597
  308   2HD1  LEU  41          2HD1      LEU  41   4.277  -1.331  -9.961
  309   3HD1  LEU  41          3HD1      LEU  41   4.422  -2.403 -11.354
  310   1HD2  LEU  41          1HD2      LEU  41   2.798  -3.484  -9.660
  311   2HD2  LEU  41          2HD2      LEU  41   3.557  -4.816  -8.788
  312   3HD2  LEU  41          3HD2      LEU  41   3.697  -4.718 -10.543
  313    H    GLY  42           H        GLY  42   8.654  -5.420 -11.638
  314   1HA   GLY  42          2HA       GLY  42   9.888  -2.988 -12.305
  315   2HA   GLY  42          1HA       GLY  42  10.503  -4.583 -12.733
  316    H    LYS  43           H        LYS  43   8.331  -5.448 -14.334
  317    HA   LYS  43           HA       LYS  43   8.992  -4.273 -16.854
  318   1HB   LYS  43          2HB       LYS  43   6.764  -6.173 -16.071
  319   2HB   LYS  43          1HB       LYS  43   7.156  -5.727 -17.731
  320   1HG   LYS  43          2HG       LYS  43   9.464  -6.591 -17.393
  321   2HG   LYS  43          1HG       LYS  43   9.015  -7.097 -15.764
  322   1HD   LYS  43          2HD       LYS  43   7.529  -8.745 -16.549
  323   2HD   LYS  43          1HD       LYS  43   7.413  -8.010 -18.148
  324   1HE   LYS  43          2HE       LYS  43   8.810  -9.939 -18.401
  325   2HE   LYS  43          1HE       LYS  43   9.885  -8.542 -18.441
  326   1HZ   LYS  43          1HZ       LYS  43  10.635 -10.403 -16.987
  327   2HZ   LYS  43          2HZ       LYS  43   9.305 -10.092 -15.976
  328   3HZ   LYS  43          3HZ       LYS  43  10.505  -8.908 -16.196
  329    H    VAL  44           H        VAL  44   6.624  -3.581 -14.432
  330    HA   VAL  44           HA       VAL  44   4.845  -2.104 -16.196
  331    HB   VAL  44           HB       VAL  44   4.835  -2.041 -13.177
  332   1HG1  VAL  44          1HG1      VAL  44   3.409  -0.569 -14.885
  333   2HG1  VAL  44          2HG1      VAL  44   2.705  -1.185 -13.391
  334   3HG1  VAL  44          3HG1      VAL  44   2.408  -2.020 -14.916
  335   1HG2  VAL  44          1HG2      VAL  44   4.859  -4.417 -14.053
  336   2HG2  VAL  44          2HG2      VAL  44   3.371  -4.043 -14.922
  337   3HG2  VAL  44          3HG2      VAL  44   3.401  -3.985 -13.162
  338    H    MET  45           H        MET  45   7.118  -1.439 -13.547
  339    HA   MET  45           HA       MET  45   6.896   1.346 -13.473
  340   1HB   MET  45          2HB       MET  45   8.560  -0.604 -12.275
  341   2HB   MET  45          1HB       MET  45   9.634   0.574 -13.029
  342   1HG   MET  45          2HG       MET  45   9.266   1.627 -11.003
  343   2HG   MET  45          1HG       MET  45   7.932   2.303 -11.935
  344   1HE   MET  45          1HE       MET  45   5.403   2.064  -9.547
  345   2HE   MET  45          2HE       MET  45   6.564   2.979 -10.503
  346   3HE   MET  45          3HE       MET  45   6.967   2.512  -8.852
  347    H    ARG  46           H        ARG  46   9.042  -0.720 -15.447
  348    HA   ARG  46           HA       ARG  46  10.492   1.367 -16.680
  349   1HB   ARG  46          2HB       ARG  46  11.019  -0.265 -18.464
  350   2HB   ARG  46          1HB       ARG  46  11.244  -0.948 -16.857
  351   1HG   ARG  46          2HG       ARG  46   9.984  -2.664 -17.655
  352   2HG   ARG  46          1HG       ARG  46   8.629  -1.586 -17.333
  353   1HD   ARG  46          2HD       ARG  46   8.152  -1.887 -19.535
  354   2HD   ARG  46          1HD       ARG  46   9.420  -0.696 -19.789
  355    HE   ARG  46           HE       ARG  46  10.812  -2.393 -20.580
  356   1HH1  ARG  46          2HH1      ARG  46   7.945  -3.743 -19.104
  357   2HH1  ARG  46          1HH1      ARG  46   8.254  -5.344 -19.679
  358   1HH2  ARG  46          1HH2      ARG  46  11.190  -4.501 -21.323
  359   2HH2  ARG  46          2HH2      ARG  46  10.081  -5.774 -20.931
  360    H    MET  47           H        MET  47   7.347  -0.038 -17.404
  361    HA   MET  47           HA       MET  47   7.002   1.301 -19.927
  362   1HB   MET  47          2HB       MET  47   5.718  -0.777 -18.712
  363   2HB   MET  47          1HB       MET  47   4.587   0.539 -18.399
  364   1HG   MET  47          2HG       MET  47   3.954  -0.421 -20.507
  365   2HG   MET  47          1HG       MET  47   4.743   1.114 -20.869
  366   1HE   MET  47          1HE       MET  47   5.527  -2.499 -19.966
  367   2HE   MET  47          2HE       MET  47   6.410  -3.124 -21.357
  368   3HE   MET  47          3HE       MET  47   4.710  -2.693 -21.523
  369    H    LEU  48           H        LEU  48   6.262   1.983 -16.555
  370    HA   LEU  48           HA       LEU  48   4.600   4.275 -17.062
  371   1HB   LEU  48          2HB       LEU  48   5.840   3.001 -14.676
  372   2HB   LEU  48          1HB       LEU  48   5.362   4.677 -14.544
  373    HG   LEU  48           HG       LEU  48   3.077   4.166 -14.783
  374   1HD1  LEU  48          1HD1      LEU  48   2.550   1.598 -15.315
  375   2HD1  LEU  48          2HD1      LEU  48   4.103   1.711 -16.144
  376   3HD1  LEU  48          3HD1      LEU  48   2.779   2.779 -16.606
  377   1HD2  LEU  48          1HD2      LEU  48   3.405   3.437 -12.632
  378   2HD2  LEU  48          2HD2      LEU  48   4.660   2.291 -13.101
  379   3HD2  LEU  48          3HD2      LEU  48   2.960   1.881 -13.334
  380    H    GLY  49           H        GLY  49   8.035   3.709 -16.563
  381   1HA   GLY  49          2HA       GLY  49   9.463   5.428 -17.709
  382   2HA   GLY  49          1HA       GLY  49   8.531   6.622 -16.818
  383    H    GLN  50           H        GLN  50   9.286   3.710 -15.089
  384    HA   GLN  50           HA       GLN  50  11.625   4.976 -13.804
  385   1HB   GLN  50          2HB       GLN  50   9.342   3.655 -12.315
  386   2HB   GLN  50          1HB       GLN  50  10.786   4.367 -11.597
  387   1HG   GLN  50          2HG       GLN  50   9.837   6.407 -11.618
  388   2HG   GLN  50          1HG       GLN  50   9.551   6.285 -13.353
  389   1HE2  GLN  50          1HE2      GLN  50   7.402   5.943 -14.040
  390   2HE2  GLN  50          2HE2      GLN  50   6.111   5.639 -12.984
  391    H    ASN  51           H        ASN  51  12.718   3.343 -12.279
  392    HA   ASN  51           HA       ASN  51  12.366   0.542 -12.908
  393   1HB   ASN  51          2HB       ASN  51  13.865   1.802 -14.755
  394   2HB   ASN  51          1HB       ASN  51  15.118   1.464 -13.561
  395   1HD2  ASN  51          1HD2      ASN  51  15.839  -0.712 -13.358
  396   2HD2  ASN  51          2HD2      ASN  51  15.189  -1.998 -14.256
  397    HA   PRO  52           HA       PRO  52  14.217   1.282  -8.785
  398   1HB   PRO  52          2HB       PRO  52  12.411  -0.253  -7.422
  399   2HB   PRO  52          1HB       PRO  52  12.136   1.442  -7.845
  400   1HG   PRO  52          2HG       PRO  52  10.939  -0.996  -8.990
  401   2HG   PRO  52          1HG       PRO  52  10.310   0.657  -8.958
  402   1HD   PRO  52          2HD       PRO  52  11.561  -0.657 -11.165
  403   2HD   PRO  52          1HD       PRO  52  11.086   1.054 -11.067
  404    H    THR  53           H        THR  53  14.138  -0.769  -6.929
  405    HA   THR  53           HA       THR  53  15.739  -2.893  -8.225
  406    HB   THR  53           HB       THR  53  16.996  -3.059  -6.263
  407    HG1  THR  53           HG1      THR  53  16.121  -2.095  -4.267
  408   1HG2  THR  53          1HG2      THR  53  16.068  -0.190  -6.095
  409   2HG2  THR  53          2HG2      THR  53  17.202  -0.781  -7.310
  410   3HG2  THR  53          3HG2      THR  53  17.630  -0.840  -5.600
  411    HA   PRO  54           HA       PRO  54  12.858  -5.989  -6.956
  412   1HB   PRO  54          2HB       PRO  54  14.333  -7.904  -5.661
  413   2HB   PRO  54          1HB       PRO  54  14.349  -7.652  -7.414
  414   1HG   PRO  54          2HG       PRO  54  16.380  -6.903  -5.380
  415   2HG   PRO  54          1HG       PRO  54  16.592  -7.328  -7.086
  416   1HD   PRO  54          2HD       PRO  54  16.636  -4.730  -6.039
  417   2HD   PRO  54          1HD       PRO  54  16.423  -5.140  -7.757
  418    H    GLU  55           H        GLU  55  14.913  -4.839  -4.328
  419    HA   GLU  55           HA       GLU  55  13.078  -5.745  -2.257
  420   1HB   GLU  55          2HB       GLU  55  14.564  -4.527  -0.695
  421   2HB   GLU  55          1HB       GLU  55  15.455  -5.663  -1.704
  422   1HG   GLU  55          2HG       GLU  55  16.302  -3.916  -3.094
  423   2HG   GLU  55          1HG       GLU  55  15.170  -2.740  -2.429
  424    H    GLU  56           H        GLU  56  13.722  -2.853  -4.122
  425    HA   GLU  56           HA       GLU  56  12.157  -1.074  -2.487
  426   1HB   GLU  56          2HB       GLU  56  14.055  -0.604  -4.312
  427   2HB   GLU  56          1HB       GLU  56  12.643  -0.465  -5.361
  428   1HG   GLU  56          2HG       GLU  56  11.805   1.376  -4.225
  429   2HG   GLU  56          1HG       GLU  56  12.602   0.940  -2.715
  430    H    LEU  57           H        LEU  57  11.595  -2.992  -5.426
  431    HA   LEU  57           HA       LEU  57   8.975  -1.916  -5.884
  432   1HB   LEU  57          2HB       LEU  57   8.778  -3.485  -7.629
  433   2HB   LEU  57          1HB       LEU  57  10.433  -2.930  -7.650
  434    HG   LEU  57           HG       LEU  57  10.869  -5.114  -6.237
  435   1HD1  LEU  57          1HD1      LEU  57   9.178  -6.833  -7.453
  436   2HD1  LEU  57          2HD1      LEU  57   8.105  -5.442  -7.301
  437   3HD1  LEU  57          3HD1      LEU  57   8.846  -6.145  -5.862
  438   1HD2  LEU  57          1HD2      LEU  57  10.213  -5.240  -9.198
  439   2HD2  LEU  57          2HD2      LEU  57  11.331  -6.291  -8.328
  440   3HD2  LEU  57          3HD2      LEU  57  11.709  -4.581  -8.535
  441    H    GLN  58           H        GLN  58  10.279  -4.638  -4.063
  442    HA   GLN  58           HA       GLN  58   7.730  -5.927  -3.706
  443   1HB   GLN  58          2HB       GLN  58   9.983  -7.085  -3.582
  444   2HB   GLN  58          1HB       GLN  58  10.186  -6.331  -2.000
  445   1HG   GLN  58          2HG       GLN  58   9.254  -8.533  -1.645
  446   2HG   GLN  58          1HG       GLN  58   7.985  -7.355  -1.316
  447   1HE2  GLN  58          1HE2      GLN  58   6.077  -7.470  -2.597
  448   2HE2  GLN  58          2HE2      GLN  58   5.882  -8.546  -3.895
  449    H    GLU  59           H        GLU  59   9.770  -3.786  -1.700
  450    HA   GLU  59           HA       GLU  59   8.179  -3.898   0.626
  451   1HB   GLU  59          2HB       GLU  59   9.291  -1.817   1.303
  452   2HB   GLU  59          1HB       GLU  59  10.446  -2.977   0.652
  453   1HG   GLU  59          2HG       GLU  59  11.148  -1.253  -0.644
  454   2HG   GLU  59          1HG       GLU  59   9.715  -1.604  -1.606
  455    H    MET  60           H        MET  60   7.842  -1.959  -2.318
  456    HA   MET  60           HA       MET  60   5.791  -0.268  -1.186
  457   1HB   MET  60          2HB       MET  60   5.484   0.591  -3.455
  458   2HB   MET  60          1HB       MET  60   7.196   0.552  -3.043
  459   1HG   MET  60          2HG       MET  60   7.559  -1.417  -4.357
  460   2HG   MET  60          1HG       MET  60   5.827  -1.680  -4.561
  461   1HE   MET  60          1HE       MET  60   8.367   1.717  -6.227
  462   2HE   MET  60          2HE       MET  60   8.997   0.072  -6.278
  463   3HE   MET  60          3HE       MET  60   8.558   0.792  -4.731
  464    H    ILE  61           H        ILE  61   5.951  -3.302  -2.907
  465    HA   ILE  61           HA       ILE  61   3.209  -3.487  -3.673
  466    HB   ILE  61           HB       ILE  61   5.375  -5.551  -3.230
  467   1HG1  ILE  61          2HG1      ILE  61   3.899  -4.899  -5.777
  468   2HG1  ILE  61          1HG1      ILE  61   5.249  -3.901  -5.235
  469   1HG2  ILE  61          1HG2      ILE  61   2.471  -5.950  -3.996
  470   2HG2  ILE  61          2HG2      ILE  61   3.356  -6.722  -2.680
  471   3HG2  ILE  61          3HG2      ILE  61   3.726  -7.138  -4.352
  472   1HD1  ILE  61          1HD1      ILE  61   6.179  -5.565  -6.690
  473   2HD1  ILE  61          2HD1      ILE  61   5.287  -6.856  -5.886
  474   3HD1  ILE  61          3HD1      ILE  61   6.607  -6.042  -5.049
  475    H    ASP  62           H        ASP  62   5.053  -4.875  -0.958
  476    HA   ASP  62           HA       ASP  62   2.944  -6.102   0.403
  477   1HB   ASP  62          2HB       ASP  62   5.565  -4.941   1.314
  478   2HB   ASP  62          1HB       ASP  62   4.417  -5.592   2.485
  479    H    GLU  63           H        GLU  63   3.991  -2.727   0.403
  480    HA   GLU  63           HA       GLU  63   2.381  -1.883   2.604
  481   1HB   GLU  63          2HB       GLU  63   3.891  -0.510   0.422
  482   2HB   GLU  63          1HB       GLU  63   2.688   0.415   1.320
  483   1HG   GLU  63          2HG       GLU  63   4.712  -1.257   2.792
  484   2HG   GLU  63          1HG       GLU  63   5.145   0.349   2.208
  485    H    VAL  64           H        VAL  64   1.940  -1.482  -0.935
  486    HA   VAL  64           HA       VAL  64  -0.688  -0.387  -0.683
  487    HB   VAL  64           HB       VAL  64   0.735   0.052  -2.653
  488   1HG1  VAL  64          1HG1      VAL  64   0.122  -2.791  -3.495
  489   2HG1  VAL  64          2HG1      VAL  64   1.650  -2.317  -2.755
  490   3HG1  VAL  64          3HG1      VAL  64   1.171  -1.631  -4.306
  491   1HG2  VAL  64          1HG2      VAL  64  -1.047   0.166  -4.136
  492   2HG2  VAL  64          2HG2      VAL  64  -1.911  -0.095  -2.622
  493   3HG2  VAL  64          3HG2      VAL  64  -1.632  -1.445  -3.720
  494    H    ASP  65           H        ASP  65   0.531  -3.660  -1.318
  495    HA   ASP  65           HA       ASP  65  -2.045  -4.799  -1.834
  496   1HB   ASP  65          2HB       ASP  65   0.504  -5.682  -2.229
  497   2HB   ASP  65          1HB       ASP  65   0.061  -6.593  -0.788
  498    H    GLU  66           H        GLU  66  -3.575  -4.767  -0.333
  499    HA   GLU  66           HA       GLU  66  -3.029  -4.800   2.492
  500   1HB   GLU  66          2HB       GLU  66  -5.688  -5.295   1.130
  501   2HB   GLU  66          1HB       GLU  66  -5.419  -4.760   2.789
  502   1HG   GLU  66          2HG       GLU  66  -4.179  -2.749   1.732
  503   2HG   GLU  66          1HG       GLU  66  -4.969  -3.228   0.230
  504    H    ASP  67           H        ASP  67  -4.226  -7.129   0.116
  505    HA   ASP  67           HA       ASP  67  -4.484  -9.251   2.079
  506   1HB   ASP  67          2HB       ASP  67  -4.904 -10.677  -0.006
  507   2HB   ASP  67          1HB       ASP  67  -6.078  -9.409   0.338
  508    H    GLY  68           H        GLY  68  -2.218  -8.338  -0.482
  509   1HA   GLY  68          2HA       GLY  68   0.005  -8.915  -0.769
  510   2HA   GLY  68          1HA       GLY  68  -0.075  -9.805   0.749
  511    H    SER  69           H        SER  69  -1.882 -10.112  -2.301
  512    HA   SER  69           HA       SER  69  -1.523 -13.006  -2.248
  513   1HB   SER  69          2HB       SER  69  -3.102 -13.011  -4.136
  514   2HB   SER  69          1HB       SER  69  -3.735 -12.092  -2.773
  515    HG   SER  69           HG       SER  69  -2.807 -11.226  -5.265
  516    H    GLY  70           H        GLY  70   0.522 -10.682  -3.263
  517   1HA   GLY  70          2HA       GLY  70   2.347 -10.752  -4.672
  518   2HA   GLY  70          1HA       GLY  70   1.906 -12.405  -5.084
  519    H    THR  71           H        THR  71  -0.347  -9.749  -5.419
  520    HA   THR  71           HA       THR  71   0.125  -9.442  -8.281
  521    HB   THR  71           HB       THR  71  -2.098 -10.071  -8.967
  522    HG1  THR  71           HG1      THR  71  -3.614 -10.759  -7.470
  523   1HG2  THR  71          1HG2      THR  71  -0.482 -11.921  -8.786
  524   2HG2  THR  71          2HG2      THR  71  -2.113 -12.479  -8.413
  525   3HG2  THR  71          3HG2      THR  71  -0.962 -12.181  -7.108
  526    H    VAL  72           H        VAL  72  -0.715  -7.517  -9.105
  527    HA   VAL  72           HA       VAL  72  -1.801  -5.681  -7.057
  528    HB   VAL  72           HB       VAL  72  -0.613  -4.855  -9.701
  529   1HG1  VAL  72          1HG1      VAL  72  -0.964  -3.387  -7.074
  530   2HG1  VAL  72          2HG1      VAL  72  -2.061  -3.252  -8.448
  531   3HG1  VAL  72          3HG1      VAL  72  -0.393  -2.695  -8.592
  532   1HG2  VAL  72          1HG2      VAL  72   1.430  -4.289  -8.283
  533   2HG2  VAL  72          2HG2      VAL  72   1.179  -6.006  -8.600
  534   3HG2  VAL  72          3HG2      VAL  72   0.738  -5.325  -7.035
  535    H    ASP  73           H        ASP  73  -3.891  -5.354  -7.161
  536    HA   ASP  73           HA       ASP  73  -5.426  -5.884  -9.572
  537   1HB   ASP  73          2HB       ASP  73  -6.026  -5.932  -6.861
  538   2HB   ASP  73          1HB       ASP  73  -6.818  -4.461  -7.422
  539    H    PHE  74           H        PHE  74  -7.082  -4.082 -10.224
  540    HA   PHE  74           HA       PHE  74  -5.617  -1.865 -11.145
  541   1HB   PHE  74          2HB       PHE  74  -7.811  -2.743 -12.096
  542   2HB   PHE  74          1HB       PHE  74  -8.617  -1.835 -10.815
  543    HD1  PHE  74           HD1      PHE  74  -5.581  -1.084 -12.866
  544    HD2  PHE  74           HD2      PHE  74  -9.580   0.064 -11.806
  545    HE1  PHE  74           HE1      PHE  74  -5.348   0.985 -14.214
  546    HE2  PHE  74           HE2      PHE  74  -9.345   2.135 -13.156
  547    HZ   PHE  74           HZ       PHE  74  -7.230   2.591 -14.358
  548    H    ASP  75           H        ASP  75  -7.617  -2.281  -8.253
  549    HA   ASP  75           HA       ASP  75  -7.653   0.462  -7.473
  550   1HB   ASP  75          2HB       ASP  75  -9.087  -1.504  -6.560
  551   2HB   ASP  75          1HB       ASP  75  -7.709  -1.824  -5.507
  552    H    GLU  76           H        GLU  76  -5.534  -2.283  -6.697
  553    HA   GLU  76           HA       GLU  76  -3.796  -0.833  -4.938
  554   1HB   GLU  76          2HB       GLU  76  -3.202  -3.353  -6.513
  555   2HB   GLU  76          1HB       GLU  76  -2.317  -2.762  -5.109
  556   1HG   GLU  76          2HG       GLU  76  -4.204  -3.132  -3.663
  557   2HG   GLU  76          1HG       GLU  76  -5.268  -3.443  -5.034
  558    H    PHE  77           H        PHE  77  -3.981  -1.314  -8.391
  559    HA   PHE  77           HA       PHE  77  -1.343  -0.619  -9.126
  560   1HB   PHE  77          2HB       PHE  77  -3.469  -1.582 -10.468
  561   2HB   PHE  77          1HB       PHE  77  -3.603   0.109 -10.919
  562    HD1  PHE  77           HD1      PHE  77  -3.240  -0.719 -13.245
  563    HD2  PHE  77           HD2      PHE  77  -0.201  -1.043 -10.215
  564    HE1  PHE  77           HE1      PHE  77  -1.522  -1.065 -14.989
  565    HE2  PHE  77           HE2      PHE  77   1.507  -1.376 -11.973
  566    HZ   PHE  77           HZ       PHE  77   0.844  -1.392 -14.361
  567    H    LEU  78           H        LEU  78  -4.340   1.330  -9.181
  568    HA   LEU  78           HA       LEU  78  -3.079   3.784  -9.832
  569   1HB   LEU  78          2HB       LEU  78  -5.654   3.491  -8.301
  570   2HB   LEU  78          1HB       LEU  78  -5.158   4.830  -9.321
  571    HG   LEU  78           HG       LEU  78  -6.128   2.096 -10.135
  572   1HD1  LEU  78          1HD1      LEU  78  -7.610   3.522 -11.574
  573   2HD1  LEU  78          2HD1      LEU  78  -6.903   4.945 -10.806
  574   3HD1  LEU  78          3HD1      LEU  78  -7.828   3.789  -9.844
  575   1HD2  LEU  78          1HD2      LEU  78  -5.581   3.091 -12.520
  576   2HD2  LEU  78          2HD2      LEU  78  -4.328   2.246 -11.611
  577   3HD2  LEU  78          3HD2      LEU  78  -4.363   4.010 -11.635
  578    H    VAL  79           H        VAL  79  -3.851   2.225  -6.755
  579    HA   VAL  79           HA       VAL  79  -3.309   4.424  -5.048
  580    HB   VAL  79           HB       VAL  79  -3.477   1.454  -4.703
  581   1HG1  VAL  79          1HG1      VAL  79  -2.336   3.358  -2.634
  582   2HG1  VAL  79          2HG1      VAL  79  -1.494   2.004  -3.394
  583   3HG1  VAL  79          3HG1      VAL  79  -2.852   1.702  -2.307
  584   1HG2  VAL  79          1HG2      VAL  79  -5.421   3.115  -4.602
  585   2HG2  VAL  79          2HG2      VAL  79  -4.708   3.707  -3.100
  586   3HG2  VAL  79          3HG2      VAL  79  -5.258   2.034  -3.217
  587    H    MET  80           H        MET  80  -1.268   1.708  -6.113
  588    HA   MET  80           HA       MET  80   1.095   2.197  -4.822
  589   1HB   MET  80          2HB       MET  80   0.323   0.605  -6.955
  590   2HB   MET  80          1HB       MET  80   1.569   1.640  -7.650
  591   1HG   MET  80          2HG       MET  80   2.957   1.075  -5.553
  592   2HG   MET  80          1HG       MET  80   1.789  -0.217  -5.282
  593   1HE   MET  80          1HE       MET  80   3.113  -3.011  -7.085
  594   2HE   MET  80          2HE       MET  80   1.486  -2.355  -6.927
  595   3HE   MET  80          3HE       MET  80   2.602  -2.258  -5.568
  596    H    MET  81           H        MET  81  -0.245   4.030  -7.535
  597    HA   MET  81           HA       MET  81   2.104   5.468  -8.225
  598   1HB   MET  81          2HB       MET  81  -0.133   5.292  -9.512
  599   2HB   MET  81          1HB       MET  81  -0.669   6.610  -8.472
  600   1HG   MET  81          2HG       MET  81   1.914   7.320  -9.389
  601   2HG   MET  81          1HG       MET  81   1.033   6.730 -10.797
  602   1HE   MET  81          1HE       MET  81  -2.323   8.727 -10.436
  603   2HE   MET  81          2HE       MET  81  -1.791   7.099 -10.021
  604   3HE   MET  81          3HE       MET  81  -1.387   7.778 -11.597
  605    H    VAL  82           H        VAL  82  -0.720   6.473  -6.267
  606    HA   VAL  82           HA       VAL  82   0.448   8.903  -5.366
  607    HB   VAL  82           HB       VAL  82  -1.331   8.844  -3.600
  608   1HG1  VAL  82          1HG1      VAL  82  -1.985   9.929  -5.574
  609   2HG1  VAL  82          2HG1      VAL  82  -3.242   8.708  -5.370
  610   3HG1  VAL  82          3HG1      VAL  82  -1.932   8.443  -6.521
  611   1HG2  VAL  82          1HG2      VAL  82  -2.212   6.298  -4.982
  612   2HG2  VAL  82          2HG2      VAL  82  -2.930   7.050  -3.557
  613   3HG2  VAL  82          3HG2      VAL  82  -1.331   6.309  -3.454
  614    H    ARG  83           H        ARG  83   0.666   5.602  -4.242
  615    HA   ARG  83           HA       ARG  83   1.594   6.065  -1.606
  616   1HB   ARG  83          2HB       ARG  83   2.033   3.777  -3.533
  617   2HB   ARG  83          1HB       ARG  83   2.657   3.770  -1.885
  618   1HG   ARG  83          2HG       ARG  83  -0.124   4.554  -1.870
  619   2HG   ARG  83          1HG       ARG  83   0.064   3.030  -2.738
  620   1HD   ARG  83          2HD       ARG  83   1.294   2.073  -0.849
  621   2HD   ARG  83          1HD       ARG  83   1.197   3.605   0.014
  622    HE   ARG  83           HE       ARG  83  -1.420   2.758  -0.636
  623   1HH1  ARG  83          2HH1      ARG  83   1.279   1.880   1.396
  624   2HH1  ARG  83          1HH1      ARG  83   0.288   1.166   2.620
  625   1HH2  ARG  83          1HH2      ARG  83  -2.703   1.821   0.982
  626   2HH2  ARG  83          2HH2      ARG  83  -1.962   1.132   2.388
  627    H    CYS  84           H        CYS  84   3.217   5.904  -4.738
  628    HA   CYS  84           HA       CYS  84   5.859   6.240  -3.528
  629   1HB   CYS  84          2HB       CYS  84   4.881   5.821  -6.344
  630   2HB   CYS  84          1HB       CYS  84   6.537   6.334  -6.023
  631    HG   CYS  84           HG       CYS  84   6.962   4.129  -4.740
  632    H    MET  85           H        MET  85   3.597   8.062  -5.583
  633    HA   MET  85           HA       MET  85   5.245  10.333  -5.987
  634   1HB   MET  85          2HB       MET  85   2.969   9.601  -7.117
  635   2HB   MET  85          1HB       MET  85   2.266  10.602  -5.846
  636   1HG   MET  85          2HG       MET  85   2.610  12.268  -7.378
  637   2HG   MET  85          1HG       MET  85   4.231  12.258  -6.684
  638   1HE   MET  85          1HE       MET  85   6.284  10.275  -8.145
  639   2HE   MET  85          2HE       MET  85   6.057  11.900  -7.506
  640   3HE   MET  85          3HE       MET  85   6.511  11.681  -9.194
  641    H    LYS  86           H        LYS  86   2.951   9.453  -3.452
  642    HA   LYS  86           HA       LYS  86   2.650  10.258  -1.328
  643   1HB   LYS  86          2HB       LYS  86   5.275  10.689  -1.658
  644   2HB   LYS  86          1HB       LYS  86   4.739  12.366  -1.571
  645   1HG   LYS  86          2HG       LYS  86   5.131  11.831   0.682
  646   2HG   LYS  86          1HG       LYS  86   3.392  11.579   0.520
  647   1HD   LYS  86          2HD       LYS  86   3.794   9.160   0.129
  648   2HD   LYS  86          1HD       LYS  86   5.523   9.427   0.352
  649   1HE   LYS  86          2HE       LYS  86   4.986   8.839   2.512
  650   2HE   LYS  86          1HE       LYS  86   4.654  10.567   2.618
  651   1HZ   LYS  86          1HZ       LYS  86   2.647   8.466   1.996
  652   2HZ   LYS  86          2HZ       LYS  86   2.337  10.131   2.130
  653   3HZ   LYS  86          3HZ       LYS  86   2.826   9.242   3.492
  654    H    ASP  87           H        ASP  87   0.717  11.196  -1.392
  655    HA   ASP  87           HA       ASP  87  -0.049  13.423  -2.909
  656   1HB   ASP  87          2HB       ASP  87  -1.966  13.608  -1.256
  657   2HB   ASP  87          1HB       ASP  87  -1.779  12.037  -2.032
  658    H    ASP  88           H        ASP  88   1.203  13.255   0.414
  659    HA   ASP  88           HA       ASP  88   1.949  14.872   1.865
  660   1HB   ASP  88          2HB       ASP  88   2.578  16.083  -0.819
  661   2HB   ASP  88          1HB       ASP  88   2.913  16.968   0.668
  662    H    SER  89           HN       SER  89  -0.885  14.837   1.271
  663    HA   SER  89           HA       SER  89  -1.582  17.437   2.332
  664   1HB   SER  89          2HB       SER  89  -2.118  16.736  -0.508
  665   2HB   SER  89          1HB       SER  89  -3.433  17.497   0.383
  666    HG   SER  89           HG       SER  89  -2.254  19.278   0.629
  Start of MODEL   37
    1   1H    MET   1          1H        MET   1  -1.802   3.303   8.811
    2   2H    MET   1          2H        MET   1  -2.043   2.594   7.284
    3   3H    MET   1          3H        MET   1  -2.375   1.710   8.696
    4    HA   MET   1           HA       MET   1  -4.402   2.531   7.600
    5   1HB   MET   1          2HB       MET   1  -4.002   2.246  10.182
    6   2HB   MET   1          1HB       MET   1  -4.076   4.007  10.205
    7   1HG   MET   1          2HG       MET   1  -6.316   3.376  10.559
    8   2HG   MET   1          1HG       MET   1  -6.265   3.710   8.829
    9   1HE   MET   1          1HE       MET   1  -8.513   0.860   8.188
   10   2HE   MET   1          2HE       MET   1  -7.695   2.219   7.423
   11   3HE   MET   1          3HE       MET   1  -8.540   2.456   8.951
   12    H    ASN   2           H        ASN   2  -3.327   3.936   5.877
   13    HA   ASN   2           HA       ASN   2  -3.604   6.810   6.530
   14   1HB   ASN   2          2HB       ASN   2  -1.926   5.348   4.508
   15   2HB   ASN   2          1HB       ASN   2  -2.331   7.050   4.288
   16   1HD2  ASN   2          1HD2      ASN   2  -1.246   8.599   5.607
   17   2HD2  ASN   2          2HD2      ASN   2  -0.075   8.174   6.760
   18    H    ASP   3           H        ASP   3  -5.599   7.452   6.057
   19    HA   ASP   3           HA       ASP   3  -7.128   6.287   3.885
   20   1HB   ASP   3          2HB       ASP   3  -8.924   7.788   4.609
   21   2HB   ASP   3          1HB       ASP   3  -8.240   6.933   5.989
   22    H    ILE   4           H        ILE   4  -4.970   8.948   4.235
   23    HA   ILE   4           HA       ILE   4  -6.013  10.801   2.410
   24    HB   ILE   4           HB       ILE   4  -3.670  11.592   2.129
   25   1HG1  ILE   4          2HG1      ILE   4  -2.169  10.249   3.961
   26   2HG1  ILE   4          1HG1      ILE   4  -3.138   8.922   3.324
   27   1HG2  ILE   4          1HG2      ILE   4  -4.922  12.429   4.009
   28   2HG2  ILE   4          2HG2      ILE   4  -3.299  12.050   4.586
   29   3HG2  ILE   4          3HG2      ILE   4  -4.635  10.950   4.929
   30   1HD1  ILE   4          1HD1      ILE   4  -0.871   9.613   2.142
   31   2HD1  ILE   4          2HD1      ILE   4  -1.890  10.841   1.392
   32   3HD1  ILE   4          3HD1      ILE   4  -2.270   9.132   1.182
   33    H    TYR   5           H        TYR   5  -4.254   7.813   1.852
   34    HA   TYR   5           HA       TYR   5  -3.646   8.274  -0.905
   35   1HB   TYR   5          2HB       TYR   5  -3.925   5.679   0.638
   36   2HB   TYR   5          1HB       TYR   5  -3.296   5.808  -1.005
   37    HD1  TYR   5           HD1      TYR   5  -1.219   7.188  -1.430
   38    HD2  TYR   5           HD2      TYR   5  -2.567   6.192   2.522
   39    HE1  TYR   5           HE1      TYR   5   1.018   7.754  -0.524
   40    HE2  TYR   5           HE2      TYR   5  -0.331   6.755   3.430
   41    HH   TYR   5           HH       TYR   5   2.298   6.833   1.926
   42    H    LYS   6           H        LYS   6  -6.338   6.775   0.822
   43    HA   LYS   6           HA       LYS   6  -7.710   5.825  -1.505
   44   1HB   LYS   6          2HB       LYS   6  -8.065   5.663   1.310
   45   2HB   LYS   6          1HB       LYS   6  -9.543   6.346   0.635
   46   1HG   LYS   6          2HG       LYS   6 -10.109   4.406  -0.392
   47   2HG   LYS   6          1HG       LYS   6  -8.461   4.114  -0.945
   48   1HD   LYS   6          2HD       LYS   6  -9.035   3.819   1.977
   49   2HD   LYS   6          1HD       LYS   6  -9.591   2.548   0.888
   50   1HE   LYS   6          2HE       LYS   6  -6.791   3.518   0.536
   51   2HE   LYS   6          1HE       LYS   6  -7.129   2.520   1.948
   52   1HZ   LYS   6          1HZ       LYS   6  -6.469   1.209   0.004
   53   2HZ   LYS   6          2HZ       LYS   6  -7.816   1.794  -0.850
   54   3HZ   LYS   6          3HZ       LYS   6  -8.035   0.821   0.526
   55    H    ALA   7           H        ALA   7  -7.575   8.892   0.168
   56    HA   ALA   7           HA       ALA   7  -9.998   9.993  -0.861
   57   1HB   ALA   7          1HB       ALA   7  -8.574  10.836   1.118
   58   2HB   ALA   7          2HB       ALA   7  -9.288  12.044   0.050
   59   3HB   ALA   7          3HB       ALA   7  -7.582  11.626  -0.107
   60    H    ALA   8           H        ALA   8  -6.664   9.855  -2.046
   61    HA   ALA   8           HA       ALA   8  -7.062  11.726  -4.191
   62   1HB   ALA   8          1HB       ALA   8  -4.871  11.154  -4.903
   63   2HB   ALA   8          2HB       ALA   8  -4.932   9.590  -4.088
   64   3HB   ALA   8          3HB       ALA   8  -4.824  11.076  -3.142
   65    H    VAL   9           H        VAL   9  -7.013   8.175  -3.955
   66    HA   VAL   9           HA       VAL   9  -7.430   7.708  -6.733
   67    HB   VAL   9           HB       VAL   9  -6.548   6.027  -5.067
   68   1HG1  VAL   9          1HG1      VAL   9  -8.230   4.704  -3.824
   69   2HG1  VAL   9          2HG1      VAL   9  -9.490   5.816  -4.358
   70   3HG1  VAL   9          3HG1      VAL   9  -8.204   6.384  -3.294
   71   1HG2  VAL   9          1HG2      VAL   9  -7.385   5.453  -7.371
   72   2HG2  VAL   9          2HG2      VAL   9  -8.959   5.102  -6.660
   73   3HG2  VAL   9          3HG2      VAL   9  -7.554   4.136  -6.211
   74    H    GLU  10           H        GLU  10  -9.545   8.636  -4.153
   75    HA   GLU  10           HA       GLU  10 -11.976   7.747  -5.454
   76   1HB   GLU  10          2HB       GLU  10 -11.301   9.182  -2.926
   77   2HB   GLU  10          1HB       GLU  10 -12.918   9.401  -3.596
   78   1HG   GLU  10          2HG       GLU  10 -12.892   6.789  -3.825
   79   2HG   GLU  10          1HG       GLU  10 -11.608   6.878  -2.620
   80    H    GLN  11           H        GLN  11  -9.912  10.525  -5.647
   81    HA   GLN  11           HA       GLN  11 -12.013  11.928  -7.189
   82   1HB   GLN  11          2HB       GLN  11 -11.192  14.072  -6.376
   83   2HB   GLN  11          1HB       GLN  11 -11.652  13.052  -5.013
   84   1HG   GLN  11          2HG       GLN  11  -9.177  12.340  -4.931
   85   2HG   GLN  11          1HG       GLN  11  -8.870  13.707  -6.002
   86   1HE2  GLN  11          1HE2      GLN  11 -10.698  13.076  -2.934
   87   2HE2  GLN  11          2HE2      GLN  11 -10.226  14.532  -2.199
   88    H    LEU  12           H        LEU  12  -9.759  10.138  -8.052
   89    HA   LEU  12           HA       LEU  12  -7.851  11.901  -9.344
   90   1HB   LEU  12          2HB       LEU  12  -7.305   9.688 -10.612
   91   2HB   LEU  12          1HB       LEU  12  -6.826   9.891  -8.944
   92    HG   LEU  12           HG       LEU  12  -8.642   8.476  -8.200
   93   1HD1  LEU  12          1HD1      LEU  12  -9.496   8.662 -11.085
   94   2HD1  LEU  12          2HD1      LEU  12 -10.452   8.956  -9.632
   95   3HD1  LEU  12          3HD1      LEU  12 -10.003   7.309 -10.074
   96   1HD2  LEU  12          1HD2      LEU  12  -7.942   6.374  -9.222
   97   2HD2  LEU  12          2HD2      LEU  12  -6.537   7.422  -9.031
   98   3HD2  LEU  12          3HD2      LEU  12  -7.289   7.237 -10.614
   99    H    THR  13           H        THR  13  -7.495  11.382 -11.833
  100    HA   THR  13           HA       THR  13 -10.034  12.092 -13.130
  101    HB   THR  13           HB       THR  13  -8.166  12.262 -15.111
  102    HG1  THR  13           HG1      THR  13  -6.402  11.841 -13.896
  103   1HG2  THR  13          1HG2      THR  13  -9.422  14.156 -14.895
  104   2HG2  THR  13          2HG2      THR  13  -7.976  14.738 -14.072
  105   3HG2  THR  13          3HG2      THR  13  -9.343  14.137 -13.134
  106    H    ASP  14           H        ASP  14 -10.366  11.229 -15.373
  107    HA   ASP  14           HA       ASP  14 -10.418   8.357 -15.302
  108   1HB   ASP  14          2HB       ASP  14 -12.057  10.028 -16.494
  109   2HB   ASP  14          1HB       ASP  14 -10.893   9.932 -17.815
  110    H    GLU  15           H        GLU  15  -8.403  10.823 -16.757
  111    HA   GLU  15           HA       GLU  15  -7.017   9.227 -18.637
  112   1HB   GLU  15          2HB       GLU  15  -5.384  11.005 -18.699
  113   2HB   GLU  15          1HB       GLU  15  -6.983  11.734 -18.547
  114   1HG   GLU  15          2HG       GLU  15  -6.458  11.581 -15.957
  115   2HG   GLU  15          1HG       GLU  15  -4.786  11.549 -16.516
  116    H    GLN  16           H        GLN  16  -6.571   9.790 -15.183
  117    HA   GLN  16           HA       GLN  16  -4.015   8.607 -14.884
  118   1HB   GLN  16          2HB       GLN  16  -5.599   9.972 -13.202
  119   2HB   GLN  16          1HB       GLN  16  -6.020   8.339 -12.692
  120   1HG   GLN  16          2HG       GLN  16  -3.176   8.471 -13.017
  121   2HG   GLN  16          1HG       GLN  16  -3.687   9.840 -12.031
  122   1HE2  GLN  16          1HE2      GLN  16  -4.756   6.384 -12.273
  123   2HE2  GLN  16          2HE2      GLN  16  -4.680   6.106 -10.601
  124    H    LYS  17           H        LYS  17  -7.311   7.332 -14.762
  125    HA   LYS  17           HA       LYS  17  -6.663   4.682 -13.982
  126   1HB   LYS  17          2HB       LYS  17  -9.027   5.554 -15.665
  127   2HB   LYS  17          1HB       LYS  17  -8.899   4.089 -14.694
  128   1HG   LYS  17          2HG       LYS  17  -8.738   6.881 -13.525
  129   2HG   LYS  17          1HG       LYS  17 -10.232   5.952 -13.618
  130   1HD   LYS  17          2HD       LYS  17  -8.215   4.260 -12.507
  131   2HD   LYS  17          1HD       LYS  17  -8.180   5.794 -11.638
  132   1HE   LYS  17          2HE       LYS  17 -10.791   5.529 -11.609
  133   2HE   LYS  17          1HE       LYS  17 -10.439   3.828 -11.913
  134   1HZ   LYS  17          1HZ       LYS  17 -10.299   3.761  -9.684
  135   2HZ   LYS  17          2HZ       LYS  17  -9.982   5.421  -9.529
  136   3HZ   LYS  17          3HZ       LYS  17  -8.730   4.349  -9.935
  137    H    ASN  18           H        ASN  18  -6.915   6.307 -17.117
  138    HA   ASN  18           HA       ASN  18  -6.696   3.963 -18.723
  139   1HB   ASN  18          2HB       ASN  18  -6.269   6.895 -19.261
  140   2HB   ASN  18          1HB       ASN  18  -5.912   5.683 -20.490
  141   1HD2  ASN  18          1HD2      ASN  18  -8.376   7.677 -19.386
  142   2HD2  ASN  18          2HD2      ASN  18  -9.706   6.807 -19.983
  143    H    GLU  19           H        GLU  19  -4.301   6.134 -17.282
  144    HA   GLU  19           HA       GLU  19  -2.027   5.337 -18.748
  145   1HB   GLU  19          2HB       GLU  19  -1.929   5.956 -15.795
  146   2HB   GLU  19          1HB       GLU  19  -0.691   6.248 -17.014
  147   1HG   GLU  19          2HG       GLU  19  -2.731   7.691 -18.062
  148   2HG   GLU  19          1HG       GLU  19  -3.102   7.830 -16.343
  149    H    PHE  20           H        PHE  20  -3.417   4.043 -15.754
  150    HA   PHE  20           HA       PHE  20  -1.478   1.894 -15.604
  151   1HB   PHE  20          2HB       PHE  20  -3.832   2.750 -13.955
  152   2HB   PHE  20          1HB       PHE  20  -3.111   1.160 -13.719
  153    HD1  PHE  20           HD1      PHE  20  -2.512   4.808 -13.555
  154    HD2  PHE  20           HD2      PHE  20  -0.895   0.905 -12.792
  155    HE1  PHE  20           HE1      PHE  20  -0.694   5.816 -12.210
  156    HE2  PHE  20           HE2      PHE  20   0.918   1.907 -11.444
  157    HZ   PHE  20           HZ       PHE  20   1.023   4.370 -11.153
  158    H    LYS  21           H        LYS  21  -4.972   2.175 -16.304
  159    HA   LYS  21           HA       LYS  21  -5.590  -0.531 -16.522
  160   1HB   LYS  21          2HB       LYS  21  -7.265   1.293 -16.597
  161   2HB   LYS  21          1HB       LYS  21  -6.726   1.697 -18.226
  162   1HG   LYS  21          2HG       LYS  21  -7.355  -1.158 -17.841
  163   2HG   LYS  21          1HG       LYS  21  -8.739  -0.083 -17.648
  164   1HD   LYS  21          2HD       LYS  21  -8.559   0.751 -19.838
  165   2HD   LYS  21          1HD       LYS  21  -6.881   0.232 -19.998
  166   1HE   LYS  21          2HE       LYS  21  -7.914  -1.436 -21.222
  167   2HE   LYS  21          1HE       LYS  21  -7.962  -2.175 -19.622
  168   1HZ   LYS  21          1HZ       LYS  21 -10.118  -2.277 -20.701
  169   2HZ   LYS  21          2HZ       LYS  21 -10.144  -0.586 -20.863
  170   3HZ   LYS  21          3HZ       LYS  21 -10.193  -1.295 -19.320
  171    H    ALA  22           H        ALA  22  -4.141   1.629 -18.942
  172    HA   ALA  22           HA       ALA  22  -4.248  -0.082 -21.171
  173   1HB   ALA  22          1HB       ALA  22  -3.585   2.284 -21.344
  174   2HB   ALA  22          2HB       ALA  22  -2.361   1.232 -22.054
  175   3HB   ALA  22          3HB       ALA  22  -2.103   1.933 -20.457
  176    H    ALA  23           H        ALA  23  -1.732   0.304 -18.692
  177    HA   ALA  23           HA       ALA  23  -0.064  -1.796 -19.727
  178   1HB   ALA  23          1HB       ALA  23   0.810   0.092 -18.349
  179   2HB   ALA  23          2HB       ALA  23   1.237  -1.490 -17.697
  180   3HB   ALA  23          3HB       ALA  23  -0.069  -0.557 -16.965
  181    H    PHE  24           H        PHE  24  -2.702  -1.536 -17.468
  182    HA   PHE  24           HA       PHE  24  -2.338  -3.963 -16.061
  183   1HB   PHE  24          2HB       PHE  24  -3.888  -1.978 -15.502
  184   2HB   PHE  24          1HB       PHE  24  -5.026  -2.724 -16.621
  185    HD1  PHE  24           HD1      PHE  24  -5.747  -5.133 -16.213
  186    HD2  PHE  24           HD2      PHE  24  -3.603  -2.821 -13.302
  187    HE1  PHE  24           HE1      PHE  24  -6.457  -6.705 -14.435
  188    HE2  PHE  24           HE2      PHE  24  -4.315  -4.387 -11.526
  189    HZ   PHE  24           HZ       PHE  24  -5.748  -6.323 -12.091
  190    H    ASP  25           H        ASP  25  -4.179  -3.166 -19.028
  191    HA   ASP  25           HA       ASP  25  -5.289  -5.800 -19.241
  192   1HB   ASP  25          2HB       ASP  25  -6.048  -5.133 -21.471
  193   2HB   ASP  25          1HB       ASP  25  -6.442  -3.920 -20.265
  194    H    ILE  26           H        ILE  26  -2.284  -4.387 -20.356
  195    HA   ILE  26           HA       ILE  26  -1.776  -6.501 -22.270
  196    HB   ILE  26           HB       ILE  26   0.521  -5.533 -22.404
  197   1HG1  ILE  26          2HG1      ILE  26  -0.565  -3.454 -20.481
  198   2HG1  ILE  26          1HG1      ILE  26   0.569  -4.720 -20.019
  199   1HG2  ILE  26          1HG2      ILE  26  -1.474  -3.287 -22.573
  200   2HG2  ILE  26          2HG2      ILE  26  -1.628  -4.689 -23.630
  201   3HG2  ILE  26          3HG2      ILE  26  -0.169  -3.700 -23.685
  202   1HD1  ILE  26          1HD1      ILE  26   1.676  -3.563 -22.324
  203   2HD1  ILE  26          2HD1      ILE  26   2.231  -3.350 -20.664
  204   3HD1  ILE  26          3HD1      ILE  26   1.087  -2.205 -21.364
  205    H    PHE  27           H        PHE  27  -0.826  -5.779 -18.929
  206    HA   PHE  27           HA       PHE  27   1.010  -7.987 -18.747
  207   1HB   PHE  27          2HB       PHE  27  -0.268  -6.254 -16.619
  208   2HB   PHE  27          1HB       PHE  27   0.914  -7.517 -16.274
  209    HD1  PHE  27           HD1      PHE  27   2.765  -7.276 -18.570
  210    HD2  PHE  27           HD2      PHE  27   0.873  -4.220 -16.215
  211    HE1  PHE  27           HE1      PHE  27   4.589  -5.704 -19.145
  212    HE2  PHE  27           HE2      PHE  27   2.703  -2.644 -16.800
  213    HZ   PHE  27           HZ       PHE  27   4.560  -3.389 -18.261
  214    H    ILE  28           H        ILE  28  -2.417  -7.497 -17.938
  215    HA   ILE  28           HA       ILE  28  -2.591 -10.255 -16.920
  216    HB   ILE  28           HB       ILE  28  -4.789  -9.730 -16.129
  217   1HG1  ILE  28          2HG1      ILE  28  -5.406  -7.121 -16.657
  218   2HG1  ILE  28          1HG1      ILE  28  -4.613  -7.583 -18.164
  219   1HG2  ILE  28          1HG2      ILE  28  -4.361  -7.788 -14.686
  220   2HG2  ILE  28          2HG2      ILE  28  -3.006  -7.315 -15.711
  221   3HG2  ILE  28          3HG2      ILE  28  -2.931  -8.816 -14.788
  222   1HD1  ILE  28          1HD1      ILE  28  -6.590  -9.509 -17.044
  223   2HD1  ILE  28          2HD1      ILE  28  -6.249  -9.093 -18.724
  224   3HD1  ILE  28          3HD1      ILE  28  -7.231  -8.015 -17.731
  225    H    GLN  29           H        GLN  29  -2.431  -9.114 -19.897
  226    HA   GLN  29           HA       GLN  29  -4.690  -9.698 -21.351
  227   1HB   GLN  29          2HB       GLN  29  -2.660  -8.797 -22.367
  228   2HB   GLN  29          1HB       GLN  29  -1.822 -10.325 -22.094
  229   1HG   GLN  29          2HG       GLN  29  -3.224 -11.484 -23.636
  230   2HG   GLN  29          1HG       GLN  29  -4.371 -10.146 -23.712
  231   1HE2  GLN  29          1HE2      GLN  29  -3.213  -7.957 -24.460
  232   2HE2  GLN  29          2HE2      GLN  29  -2.142  -8.125 -25.766
  233    H    ASP  30           H        ASP  30  -2.273 -11.994 -20.145
  234    HA   ASP  30           HA       ASP  30  -3.872 -14.244 -21.176
  235   1HB   ASP  30          2HB       ASP  30  -1.891 -15.629 -20.675
  236   2HB   ASP  30          1HB       ASP  30  -1.496 -14.291 -21.752
  237    H    ALA  31           H        ALA  31  -4.199 -12.498 -18.563
  238    HA   ALA  31           HA       ALA  31  -4.196 -14.678 -16.590
  239   1HB   ALA  31          1HB       ALA  31  -4.443 -12.985 -14.910
  240   2HB   ALA  31          2HB       ALA  31  -4.798 -11.753 -16.121
  241   3HB   ALA  31          3HB       ALA  31  -3.178 -12.441 -16.012
  242    H    GLU  32           H        GLU  32  -6.042 -15.171 -15.376
  243    HA   GLU  32           HA       GLU  32  -8.611 -14.254 -16.531
  244   1HB   GLU  32          2HB       GLU  32  -7.804 -17.056 -15.716
  245   2HB   GLU  32          1HB       GLU  32  -9.476 -16.573 -15.998
  246   1HG   GLU  32          2HG       GLU  32  -7.306 -16.138 -18.061
  247   2HG   GLU  32          1HG       GLU  32  -8.251 -17.624 -17.989
  248    H    ASP  33           H        ASP  33  -7.417 -13.005 -14.357
  249    HA   ASP  33           HA       ASP  33  -9.260 -13.763 -12.175
  250   1HB   ASP  33          2HB       ASP  33  -6.680 -14.353 -11.906
  251   2HB   ASP  33          1HB       ASP  33  -6.589 -12.651 -11.452
  252    H    GLY  34           H        GLY  34  -7.058 -11.230 -13.383
  253   1HA   GLY  34          2HA       GLY  34  -7.973  -9.028 -13.917
  254   2HA   GLY  34          1HA       GLY  34  -9.040  -9.200 -12.527
  255    H    CYS  35           H        CYS  35  -5.579  -9.931 -12.776
  256    HA   CYS  35           HA       CYS  35  -4.773  -7.584 -11.288
  257   1HB   CYS  35          2HB       CYS  35  -3.766  -8.923  -9.417
  258   2HB   CYS  35          1HB       CYS  35  -5.528  -8.886  -9.405
  259    HG   CYS  35           HG       CYS  35  -3.818 -11.353 -10.261
  260    H    ILE  36           H        ILE  36  -2.566  -7.201 -11.434
  261    HA   ILE  36           HA       ILE  36  -1.167  -8.859 -13.396
  262    HB   ILE  36           HB       ILE  36   0.407  -7.093 -13.627
  263   1HG1  ILE  36          2HG1      ILE  36  -0.251  -5.071 -11.830
  264   2HG1  ILE  36          1HG1      ILE  36  -0.337  -6.534 -10.849
  265   1HG2  ILE  36          1HG2      ILE  36  -2.424  -6.139 -13.255
  266   2HG2  ILE  36          2HG2      ILE  36  -1.529  -6.402 -14.751
  267   3HG2  ILE  36          3HG2      ILE  36  -1.154  -5.013 -13.732
  268   1HD1  ILE  36          1HD1      ILE  36   1.911  -6.776 -10.866
  269   2HD1  ILE  36          2HD1      ILE  36   1.993  -5.157 -11.565
  270   3HD1  ILE  36          3HD1      ILE  36   1.980  -6.572 -12.618
  271    H    SER  37           H        SER  37   1.293  -9.111 -12.943
  272    HA   SER  37           HA       SER  37   1.502 -10.523 -10.386
  273   1HB   SER  37          2HB       SER  37   2.321 -11.275 -12.841
  274   2HB   SER  37          1HB       SER  37   3.791 -10.490 -12.277
  275    HG   SER  37           HG       SER  37   2.591 -12.825 -11.459
  276    H    THR  38           H        THR  38   2.162  -9.390  -8.692
  277    HA   THR  38           HA       THR  38   3.430  -6.903  -8.679
  278    HB   THR  38           HB       THR  38   4.030  -7.387  -6.330
  279    HG1  THR  38           HG1      THR  38   4.545  -9.431  -6.115
  280   1HG2  THR  38          1HG2      THR  38   1.623  -8.211  -5.667
  281   2HG2  THR  38          2HG2      THR  38   1.307  -8.050  -7.394
  282   3HG2  THR  38          3HG2      THR  38   1.828  -6.650  -6.459
  283    H    LYS  39           H        LYS  39   4.821 -10.164  -8.601
  284    HA   LYS  39           HA       LYS  39   7.526  -9.377  -8.238
  285   1HB   LYS  39          2HB       LYS  39   8.022 -11.684  -9.179
  286   2HB   LYS  39          1HB       LYS  39   6.982 -11.642  -7.757
  287   1HG   LYS  39          2HG       LYS  39   5.394 -12.750  -8.899
  288   2HG   LYS  39          1HG       LYS  39   5.290 -11.405 -10.035
  289   1HD   LYS  39          2HD       LYS  39   5.885 -13.095 -11.485
  290   2HD   LYS  39          1HD       LYS  39   7.485 -12.514 -11.026
  291   1HE   LYS  39          2HE       LYS  39   7.797 -14.291  -9.468
  292   2HE   LYS  39          1HE       LYS  39   6.091 -14.734  -9.518
  293   1HZ   LYS  39          1HZ       LYS  39   7.420 -16.254 -10.831
  294   2HZ   LYS  39          2HZ       LYS  39   8.015 -14.969 -11.771
  295   3HZ   LYS  39          3HZ       LYS  39   6.367 -15.380 -11.834
  296    H    GLU  40           H        GLU  40   5.436  -9.475 -11.037
  297    HA   GLU  40           HA       GLU  40   7.731  -9.021 -12.837
  298   1HB   GLU  40          2HB       GLU  40   4.837  -9.627 -13.506
  299   2HB   GLU  40          1HB       GLU  40   6.143  -9.430 -14.673
  300   1HG   GLU  40          2HG       GLU  40   6.316 -11.468 -12.454
  301   2HG   GLU  40          1HG       GLU  40   5.526 -11.842 -13.984
  302    H    LEU  41           H        LEU  41   6.384  -7.053 -10.893
  303    HA   LEU  41           HA       LEU  41   5.048  -5.129 -12.546
  304   1HB   LEU  41          2HB       LEU  41   5.034  -5.485  -9.923
  305   2HB   LEU  41          1HB       LEU  41   6.344  -4.327  -9.990
  306    HG   LEU  41           HG       LEU  41   4.000  -3.498 -11.546
  307   1HD1  LEU  41          1HD1      LEU  41   3.284  -4.837  -9.291
  308   2HD1  LEU  41          2HD1      LEU  41   2.378  -3.471  -9.943
  309   3HD1  LEU  41          3HD1      LEU  41   3.534  -3.219  -8.636
  310   1HD2  LEU  41          1HD2      LEU  41   5.619  -1.846 -11.139
  311   2HD2  LEU  41          2HD2      LEU  41   5.858  -2.357  -9.469
  312   3HD2  LEU  41          3HD2      LEU  41   4.393  -1.488  -9.923
  313    H    GLY  42           H        GLY  42   8.315  -5.986 -12.294
  314   1HA   GLY  42          2HA       GLY  42   9.693  -3.553 -12.386
  315   2HA   GLY  42          1HA       GLY  42  10.230  -5.042 -13.158
  316    H    LYS  43           H        LYS  43   7.993  -5.344 -14.924
  317    HA   LYS  43           HA       LYS  43   8.824  -3.692 -17.113
  318   1HB   LYS  43          2HB       LYS  43   6.346  -5.426 -16.901
  319   2HB   LYS  43          1HB       LYS  43   7.076  -4.814 -18.385
  320   1HG   LYS  43          2HG       LYS  43   8.934  -6.299 -16.633
  321   2HG   LYS  43          1HG       LYS  43   7.620  -7.269 -17.296
  322   1HD   LYS  43          2HD       LYS  43   8.682  -5.539 -19.350
  323   2HD   LYS  43          1HD       LYS  43   9.990  -6.463 -18.614
  324   1HE   LYS  43          2HE       LYS  43   7.416  -7.803 -19.437
  325   2HE   LYS  43          1HE       LYS  43   8.718  -7.545 -20.596
  326   1HZ   LYS  43          1HZ       LYS  43   8.988  -8.974 -18.004
  327   2HZ   LYS  43          2HZ       LYS  43  10.216  -8.758 -19.160
  328   3HZ   LYS  43          3HZ       LYS  43   8.862  -9.717 -19.523
  329    H    VAL  44           H        VAL  44   6.452  -3.378 -14.622
  330    HA   VAL  44           HA       VAL  44   4.847  -1.392 -16.026
  331    HB   VAL  44           HB       VAL  44   4.676  -1.955 -13.073
  332   1HG1  VAL  44          1HG1      VAL  44   2.503  -1.130 -13.283
  333   2HG1  VAL  44          2HG1      VAL  44   2.418  -1.506 -15.003
  334   3HG1  VAL  44          3HG1      VAL  44   3.385  -0.141 -14.444
  335   1HG2  VAL  44          1HG2      VAL  44   3.764  -4.016 -13.340
  336   2HG2  VAL  44          2HG2      VAL  44   4.567  -4.018 -14.907
  337   3HG2  VAL  44          3HG2      VAL  44   2.875  -3.535 -14.782
  338    H    MET  45           H        MET  45   7.077  -1.592 -13.272
  339    HA   MET  45           HA       MET  45   7.056   1.062 -12.435
  340   1HB   MET  45          2HB       MET  45   9.331  -0.935 -12.463
  341   2HB   MET  45          1HB       MET  45   9.408   0.627 -11.647
  342   1HG   MET  45          2HG       MET  45   7.252  -0.076 -10.441
  343   2HG   MET  45          1HG       MET  45   7.578  -1.701 -11.044
  344   1HE   MET  45          1HE       MET  45  10.909  -2.701  -9.524
  345   2HE   MET  45          2HE       MET  45  10.489  -2.107 -11.128
  346   3HE   MET  45          3HE       MET  45   9.417  -3.238 -10.307
  347    H    ARG  46           H        ARG  46   9.036  -0.483 -14.969
  348    HA   ARG  46           HA       ARG  46  10.559   1.812 -15.640
  349   1HB   ARG  46          2HB       ARG  46  10.999   0.667 -17.796
  350   2HB   ARG  46          1HB       ARG  46  11.239  -0.398 -16.414
  351   1HG   ARG  46          2HG       ARG  46   9.131  -1.490 -16.780
  352   2HG   ARG  46          1HG       ARG  46   8.645  -0.286 -17.972
  353   1HD   ARG  46          2HD       ARG  46  10.977  -1.136 -19.072
  354   2HD   ARG  46          1HD       ARG  46  10.460  -2.610 -18.261
  355    HE   ARG  46           HE       ARG  46   8.718  -2.792 -19.791
  356   1HH1  ARG  46          2HH1      ARG  46  10.133   0.397 -19.945
  357   2HH1  ARG  46          1HH1      ARG  46   9.257   0.855 -21.363
  358   1HH2  ARG  46          1HH2      ARG  46   7.570  -2.165 -21.647
  359   2HH2  ARG  46          2HH2      ARG  46   7.806  -0.588 -22.323
  360    H    MET  47           H        MET  47   7.356   0.730 -16.608
  361    HA   MET  47           HA       MET  47   7.019   2.669 -18.711
  362   1HB   MET  47          2HB       MET  47   5.216   0.727 -17.292
  363   2HB   MET  47          1HB       MET  47   4.519   1.997 -18.299
  364   1HG   MET  47          2HG       MET  47   6.776   0.374 -19.415
  365   2HG   MET  47          1HG       MET  47   5.171  -0.353 -19.345
  366   1HE   MET  47          1HE       MET  47   7.550   1.952 -20.443
  367   2HE   MET  47          2HE       MET  47   6.770   3.303 -21.261
  368   3HE   MET  47          3HE       MET  47   7.197   1.858 -22.174
  369    H    LEU  48           H        LEU  48   6.358   2.516 -15.261
  370    HA   LEU  48           HA       LEU  48   4.716   4.892 -15.188
  371   1HB   LEU  48          2HB       LEU  48   5.858   2.994 -13.210
  372   2HB   LEU  48          1HB       LEU  48   5.499   4.608 -12.638
  373    HG   LEU  48           HG       LEU  48   3.164   4.347 -13.127
  374   1HD1  LEU  48          1HD1      LEU  48   2.766   3.209 -15.063
  375   2HD1  LEU  48          2HD1      LEU  48   2.661   1.809 -13.996
  376   3HD1  LEU  48          3HD1      LEU  48   4.164   2.158 -14.849
  377   1HD2  LEU  48          1HD2      LEU  48   3.421   1.625 -12.116
  378   2HD2  LEU  48          2HD2      LEU  48   2.838   3.071 -11.291
  379   3HD2  LEU  48          3HD2      LEU  48   4.564   2.714 -11.327
  380    H    GLY  49           H        GLY  49   8.114   4.109 -14.832
  381   1HA   GLY  49          2HA       GLY  49   9.684   5.928 -15.449
  382   2HA   GLY  49          1HA       GLY  49   8.722   6.985 -14.424
  383    H    GLN  50           H        GLN  50   9.544   3.668 -13.546
  384    HA   GLN  50           HA       GLN  50  11.510   4.661 -11.572
  385   1HB   GLN  50          2HB       GLN  50   9.468   2.515 -10.954
  386   2HB   GLN  50          1HB       GLN  50  10.587   3.289  -9.836
  387   1HG   GLN  50          2HG       GLN  50   8.393   4.770 -11.321
  388   2HG   GLN  50          1HG       GLN  50   8.220   4.146  -9.682
  389   1HE2  GLN  50          1HE2      GLN  50   8.491   7.023 -10.940
  390   2HE2  GLN  50          2HE2      GLN  50   9.640   7.761  -9.932
  391    H    ASN  51           H        ASN  51  13.093   3.104 -10.917
  392    HA   ASN  51           HA       ASN  51  13.156   0.538 -12.311
  393   1HB   ASN  51          2HB       ASN  51  15.558   1.060 -13.088
  394   2HB   ASN  51          1HB       ASN  51  14.230   1.741 -14.021
  395   1HD2  ASN  51          1HD2      ASN  51  15.430   3.603 -14.764
  396   2HD2  ASN  51          2HD2      ASN  51  15.928   4.836 -13.709
  397    HA   PRO  52           HA       PRO  52  15.236   0.551  -8.141
  398   1HB   PRO  52          2HB       PRO  52  13.372  -0.949  -6.810
  399   2HB   PRO  52          1HB       PRO  52  13.308   0.816  -6.929
  400   1HG   PRO  52          2HG       PRO  52  11.658  -1.220  -8.285
  401   2HG   PRO  52          1HG       PRO  52  11.279   0.466  -7.906
  402   1HD   PRO  52          2HD       PRO  52  12.077  -0.577 -10.438
  403   2HD   PRO  52          1HD       PRO  52  11.890   1.137  -9.999
  404    H    THR  53           H        THR  53  15.026  -1.803  -6.636
  405    HA   THR  53           HA       THR  53  16.236  -3.787  -8.455
  406    HB   THR  53           HB       THR  53  17.410  -4.626  -6.582
  407    HG1  THR  53           HG1      THR  53  16.734  -3.846  -4.425
  408   1HG2  THR  53          1HG2      THR  53  18.069  -2.286  -7.234
  409   2HG2  THR  53          2HG2      THR  53  18.477  -2.724  -5.575
  410   3HG2  THR  53          3HG2      THR  53  17.076  -1.703  -5.898
  411    HA   PRO  54           HA       PRO  54  12.902  -6.618  -7.804
  412   1HB   PRO  54          2HB       PRO  54  14.103  -9.009  -7.201
  413   2HB   PRO  54          1HB       PRO  54  14.078  -8.293  -8.820
  414   1HG   PRO  54          2HG       PRO  54  16.300  -8.437  -6.856
  415   2HG   PRO  54          1HG       PRO  54  16.356  -8.401  -8.626
  416   1HD   PRO  54          2HD       PRO  54  16.877  -6.228  -6.934
  417   2HD   PRO  54          1HD       PRO  54  16.525  -6.114  -8.674
  418    H    GLU  55           H        GLU  55  15.244  -6.484  -5.179
  419    HA   GLU  55           HA       GLU  55  13.441  -7.678  -3.238
  420   1HB   GLU  55          2HB       GLU  55  15.172  -7.093  -1.573
  421   2HB   GLU  55          1HB       GLU  55  15.850  -7.992  -2.927
  422   1HG   GLU  55          2HG       GLU  55  16.668  -5.913  -3.935
  423   2HG   GLU  55          1HG       GLU  55  15.928  -4.973  -2.639
  424    H    GLU  56           H        GLU  56  14.454  -4.448  -4.270
  425    HA   GLU  56           HA       GLU  56  13.057  -3.084  -2.137
  426   1HB   GLU  56          2HB       GLU  56  15.093  -2.292  -3.654
  427   2HB   GLU  56          1HB       GLU  56  13.786  -1.692  -4.676
  428   1HG   GLU  56          2HG       GLU  56  12.870  -0.784  -2.338
  429   2HG   GLU  56          1HG       GLU  56  14.583  -0.848  -1.921
  430    H    LEU  57           H        LEU  57  12.400  -4.031  -5.470
  431    HA   LEU  57           HA       LEU  57  10.106  -2.496  -5.964
  432   1HB   LEU  57          2HB       LEU  57  11.020  -3.576  -7.814
  433   2HB   LEU  57          1HB       LEU  57  11.197  -5.094  -6.973
  434    HG   LEU  57           HG       LEU  57   9.478  -4.966  -8.843
  435   1HD1  LEU  57          1HD1      LEU  57   9.604  -6.454  -6.535
  436   2HD1  LEU  57          2HD1      LEU  57   8.522  -6.777  -7.892
  437   3HD1  LEU  57          3HD1      LEU  57   7.945  -5.854  -6.505
  438   1HD2  LEU  57          1HD2      LEU  57   7.730  -3.546  -8.702
  439   2HD2  LEU  57          2HD2      LEU  57   8.572  -2.777  -7.356
  440   3HD2  LEU  57          3HD2      LEU  57   7.383  -4.041  -7.045
  441    H    GLN  58           H        GLN  58  10.506  -5.741  -4.549
  442    HA   GLN  58           HA       GLN  58   7.808  -6.372  -4.139
  443   1HB   GLN  58          2HB       GLN  58   9.820  -7.898  -3.807
  444   2HB   GLN  58          1HB       GLN  58  10.025  -7.131  -2.232
  445   1HG   GLN  58          2HG       GLN  58   8.703  -9.159  -1.955
  446   2HG   GLN  58          1HG       GLN  58   7.671  -7.760  -1.667
  447   1HE2  GLN  58          1HE2      GLN  58   5.792  -7.596  -2.939
  448   2HE2  GLN  58          2HE2      GLN  58   5.472  -8.564  -4.297
  449    H    GLU  59           H        GLU  59  10.056  -4.513  -2.100
  450    HA   GLU  59           HA       GLU  59   8.427  -4.211   0.173
  451   1HB   GLU  59          2HB       GLU  59  10.653  -2.589  -1.018
  452   2HB   GLU  59          1HB       GLU  59   9.727  -1.930   0.329
  453   1HG   GLU  59          2HG       GLU  59  10.430  -3.592   1.804
  454   2HG   GLU  59          1HG       GLU  59  10.777  -4.737   0.509
  455    H    MET  60           H        MET  60   8.640  -2.289  -2.806
  456    HA   MET  60           HA       MET  60   6.787  -0.268  -2.079
  457   1HB   MET  60          2HB       MET  60   7.354  -1.310  -4.866
  458   2HB   MET  60          1HB       MET  60   6.667   0.259  -4.447
  459   1HG   MET  60          2HG       MET  60   9.314  -0.493  -3.270
  460   2HG   MET  60          1HG       MET  60   9.258   0.006  -4.959
  461   1HE   MET  60          1HE       MET  60  10.983   2.344  -3.585
  462   2HE   MET  60          2HE       MET  60  10.032   3.383  -4.644
  463   3HE   MET  60          3HE       MET  60  10.393   1.730  -5.135
  464    H    ILE  61           H        ILE  61   6.444  -3.410  -3.627
  465    HA   ILE  61           HA       ILE  61   3.722  -3.256  -4.353
  466    HB   ILE  61           HB       ILE  61   5.318  -5.695  -3.522
  467   1HG1  ILE  61          2HG1      ILE  61   6.357  -4.594  -5.424
  468   2HG1  ILE  61          1HG1      ILE  61   5.516  -6.028  -6.002
  469   1HG2  ILE  61          1HG2      ILE  61   2.832  -5.594  -5.242
  470   2HG2  ILE  61          2HG2      ILE  61   2.773  -5.884  -3.504
  471   3HG2  ILE  61          3HG2      ILE  61   3.620  -7.015  -4.558
  472   1HD1  ILE  61          1HD1      ILE  61   4.553  -3.160  -6.171
  473   2HD1  ILE  61          2HD1      ILE  61   3.554  -4.555  -6.578
  474   3HD1  ILE  61          3HD1      ILE  61   5.009  -4.210  -7.513
  475    H    ASP  62           H        ASP  62   5.226  -4.694  -1.443
  476    HA   ASP  62           HA       ASP  62   2.881  -5.418  -0.107
  477   1HB   ASP  62          2HB       ASP  62   5.625  -4.668   0.878
  478   2HB   ASP  62          1HB       ASP  62   4.332  -5.080   2.003
  479    H    GLU  63           H        GLU  63   4.546  -2.297  -0.235
  480    HA   GLU  63           HA       GLU  63   3.158  -0.994   1.846
  481   1HB   GLU  63          2HB       GLU  63   4.567  -0.007  -0.622
  482   2HB   GLU  63          1HB       GLU  63   3.708   1.112   0.438
  483   1HG   GLU  63          2HG       GLU  63   5.079   0.531   2.315
  484   2HG   GLU  63          1HG       GLU  63   5.772  -0.850   1.463
  485    H    VAL  64           H        VAL  64   2.442  -1.179  -1.652
  486    HA   VAL  64           HA       VAL  64  -0.028   0.317  -1.316
  487    HB   VAL  64           HB       VAL  64   1.354   0.558  -3.367
  488   1HG1  VAL  64          1HG1      VAL  64   1.335  -1.236  -5.045
  489   2HG1  VAL  64          2HG1      VAL  64   0.428  -2.272  -3.942
  490   3HG1  VAL  64          3HG1      VAL  64   2.081  -1.799  -3.550
  491   1HG2  VAL  64          1HG2      VAL  64  -1.418   0.405  -3.140
  492   2HG2  VAL  64          2HG2      VAL  64  -1.062  -0.581  -4.559
  493   3HG2  VAL  64          3HG2      VAL  64  -0.529   1.099  -4.495
  494    H    ASP  65           H        ASP  65   0.940  -3.059  -1.548
  495    HA   ASP  65           HA       ASP  65  -1.676  -4.098  -2.104
  496   1HB   ASP  65          2HB       ASP  65   0.899  -5.169  -2.034
  497   2HB   ASP  65          1HB       ASP  65   0.077  -5.943  -0.684
  498    H    GLU  66           H        GLU  66  -3.266  -3.651  -0.719
  499    HA   GLU  66           HA       GLU  66  -2.948  -3.252   2.075
  500   1HB   GLU  66          2HB       GLU  66  -5.447  -3.434   2.153
  501   2HB   GLU  66          1HB       GLU  66  -4.846  -2.262   0.984
  502   1HG   GLU  66          2HG       GLU  66  -5.978  -3.326  -0.643
  503   2HG   GLU  66          1HG       GLU  66  -5.011  -4.770  -0.357
  504    H    ASP  67           H        ASP  67  -3.710  -6.090   0.142
  505    HA   ASP  67           HA       ASP  67  -4.099  -7.701   2.575
  506   1HB   ASP  67          2HB       ASP  67  -4.705  -9.517   0.866
  507   2HB   ASP  67          1HB       ASP  67  -5.828  -8.172   1.038
  508    H    GLY  68           H        GLY  68  -1.972  -7.347  -0.215
  509   1HA   GLY  68          2HA       GLY  68   0.216  -8.051  -0.505
  510   2HA   GLY  68          1HA       GLY  68   0.184  -8.689   1.135
  511    H    SER  69           H        SER  69  -1.836  -9.427  -1.702
  512    HA   SER  69           HA       SER  69  -1.617 -12.270  -1.215
  513   1HB   SER  69          2HB       SER  69  -3.055 -12.464  -3.246
  514   2HB   SER  69          1HB       SER  69  -3.737 -11.417  -2.005
  515    HG   SER  69           HG       SER  69  -3.758  -9.941  -3.495
  516    H    GLY  70           H        GLY  70  -0.062  -9.937  -3.290
  517   1HA   GLY  70          2HA       GLY  70   2.093 -10.481  -4.257
  518   2HA   GLY  70          1HA       GLY  70   1.505 -12.118  -4.530
  519    H    THR  71           H        THR  71  -0.867  -9.763  -5.193
  520    HA   THR  71           HA       THR  71  -0.123  -9.504  -8.022
  521    HB   THR  71           HB       THR  71  -2.318 -10.210  -8.789
  522    HG1  THR  71           HG1      THR  71  -3.792  -9.883  -7.313
  523   1HG2  THR  71          1HG2      THR  71  -1.275 -12.273  -6.833
  524   2HG2  THR  71          2HG2      THR  71  -0.538 -11.943  -8.401
  525   3HG2  THR  71          3HG2      THR  71  -2.180 -12.578  -8.316
  526    H    VAL  72           H        VAL  72  -0.617  -7.532  -8.834
  527    HA   VAL  72           HA       VAL  72  -1.933  -5.635  -7.023
  528    HB   VAL  72           HB       VAL  72  -0.722  -4.969  -9.701
  529   1HG1  VAL  72          1HG1      VAL  72  -2.228  -3.372  -8.341
  530   2HG1  VAL  72          2HG1      VAL  72  -0.667  -2.753  -8.878
  531   3HG1  VAL  72          3HG1      VAL  72  -0.879  -3.278  -7.208
  532   1HG2  VAL  72          1HG2      VAL  72   1.316  -4.322  -8.309
  533   2HG2  VAL  72          2HG2      VAL  72   1.070  -6.056  -8.535
  534   3HG2  VAL  72          3HG2      VAL  72   0.622  -5.290  -7.009
  535    H    ASP  73           H        ASP  73  -4.022  -5.296  -7.196
  536    HA   ASP  73           HA       ASP  73  -5.457  -5.993  -9.646
  537   1HB   ASP  73          2HB       ASP  73  -6.340  -5.079  -6.901
  538   2HB   ASP  73          1HB       ASP  73  -7.464  -5.227  -8.253
  539    H    PHE  74           H        PHE  74  -7.103  -4.328 -10.465
  540    HA   PHE  74           HA       PHE  74  -5.760  -2.024 -11.305
  541   1HB   PHE  74          2HB       PHE  74  -7.861  -3.036 -12.336
  542   2HB   PHE  74          1HB       PHE  74  -8.766  -2.167 -11.095
  543    HD1  PHE  74           HD1      PHE  74  -5.736  -1.311 -13.135
  544    HD2  PHE  74           HD2      PHE  74  -9.753  -0.268 -12.028
  545    HE1  PHE  74           HE1      PHE  74  -5.571   0.767 -14.478
  546    HE2  PHE  74           HE2      PHE  74  -9.584   1.810 -13.368
  547    HZ   PHE  74           HZ       PHE  74  -7.495   2.328 -14.595
  548    H    ASP  75           H        ASP  75  -7.886  -2.533  -8.517
  549    HA   ASP  75           HA       ASP  75  -8.145   0.181  -7.738
  550   1HB   ASP  75          2HB       ASP  75  -9.452  -1.835  -6.839
  551   2HB   ASP  75          1HB       ASP  75  -8.051  -2.148  -5.815
  552    H    GLU  76           H        GLU  76  -5.784  -2.341  -6.911
  553    HA   GLU  76           HA       GLU  76  -4.232  -0.646  -5.166
  554   1HB   GLU  76          2HB       GLU  76  -3.420  -3.264  -6.446
  555   2HB   GLU  76          1HB       GLU  76  -2.694  -2.504  -5.030
  556   1HG   GLU  76          2HG       GLU  76  -4.682  -2.845  -3.723
  557   2HG   GLU  76          1HG       GLU  76  -5.608  -3.327  -5.143
  558    H    PHE  77           H        PHE  77  -4.414  -1.116  -8.555
  559    HA   PHE  77           HA       PHE  77  -1.705  -0.508  -9.244
  560   1HB   PHE  77          2HB       PHE  77  -3.748  -1.633 -10.587
  561   2HB   PHE  77          1HB       PHE  77  -3.913   0.017 -11.164
  562    HD1  PHE  77           HD1      PHE  77  -3.404  -0.783 -13.421
  563    HD2  PHE  77           HD2      PHE  77  -0.541  -1.151 -10.231
  564    HE1  PHE  77           HE1      PHE  77  -1.607  -1.193 -15.069
  565    HE2  PHE  77           HE2      PHE  77   1.250  -1.550 -11.889
  566    HZ   PHE  77           HZ       PHE  77   0.717  -1.577 -14.311
  567    H    LEU  78           H        LEU  78  -4.735   1.356  -9.133
  568    HA   LEU  78           HA       LEU  78  -3.575   3.773 -10.133
  569   1HB   LEU  78          2HB       LEU  78  -6.159   3.162  -8.730
  570   2HB   LEU  78          1HB       LEU  78  -5.709   4.796  -9.174
  571    HG   LEU  78           HG       LEU  78  -6.709   4.433 -11.147
  572   1HD1  LEU  78          1HD1      LEU  78  -5.557   3.126 -12.847
  573   2HD1  LEU  78          2HD1      LEU  78  -4.670   2.234 -11.612
  574   3HD1  LEU  78          3HD1      LEU  78  -4.356   3.953 -11.854
  575   1HD2  LEU  78          1HD2      LEU  78  -8.101   2.653 -11.333
  576   2HD2  LEU  78          2HD2      LEU  78  -7.483   2.188  -9.748
  577   3HD2  LEU  78          3HD2      LEU  78  -6.778   1.494 -11.209
  578    H    VAL  79           H        VAL  79  -3.703   2.374  -6.942
  579    HA   VAL  79           HA       VAL  79  -3.365   4.848  -5.501
  580    HB   VAL  79           HB       VAL  79  -2.131   2.658  -4.081
  581   1HG1  VAL  79          1HG1      VAL  79  -3.940   3.218  -2.456
  582   2HG1  VAL  79          2HG1      VAL  79  -4.659   4.279  -3.668
  583   3HG1  VAL  79          3HG1      VAL  79  -3.056   4.641  -3.017
  584   1HG2  VAL  79          1HG2      VAL  79  -4.152   1.242  -3.842
  585   2HG2  VAL  79          2HG2      VAL  79  -3.497   1.207  -5.481
  586   3HG2  VAL  79          3HG2      VAL  79  -4.931   2.173  -5.124
  587    H    MET  80           H        MET  80  -1.240   2.277  -6.646
  588    HA   MET  80           HA       MET  80   1.220   2.933  -5.703
  589   1HB   MET  80          2HB       MET  80   0.286   1.408  -7.834
  590   2HB   MET  80          1HB       MET  80   1.389   2.559  -8.587
  591   1HG   MET  80          2HG       MET  80   3.004   1.945  -6.643
  592   2HG   MET  80          1HG       MET  80   1.965   0.535  -6.429
  593   1HE   MET  80          1HE       MET  80   1.677  -1.383  -8.039
  594   2HE   MET  80          2HE       MET  80   2.127  -1.340  -9.741
  595   3HE   MET  80          3HE       MET  80   0.921  -0.213  -9.129
  596    H    MET  81           H        MET  81  -0.525   4.692  -8.257
  597    HA   MET  81           HA       MET  81   1.643   6.452  -8.913
  598   1HB   MET  81          2HB       MET  81  -0.234   6.073 -10.463
  599   2HB   MET  81          1HB       MET  81  -1.333   6.849  -9.326
  600   1HG   MET  81          2HG       MET  81  -0.695   8.914  -9.984
  601   2HG   MET  81          1HG       MET  81   1.014   8.499  -9.865
  602   1HE   MET  81          1HE       MET  81   1.870   6.661 -11.188
  603   2HE   MET  81          2HE       MET  81   2.482   7.675 -12.492
  604   3HE   MET  81          3HE       MET  81   1.490   6.269 -12.871
  605    H    VAL  82           H        VAL  82  -1.424   7.095  -7.173
  606    HA   VAL  82           HA       VAL  82  -0.680   9.649  -6.235
  607    HB   VAL  82           HB       VAL  82  -2.530   9.387  -4.591
  608   1HG1  VAL  82          1HG1      VAL  82  -2.941   8.642  -7.487
  609   2HG1  VAL  82          2HG1      VAL  82  -3.189  10.206  -6.711
  610   3HG1  VAL  82          3HG1      VAL  82  -4.304   8.876  -6.392
  611   1HG2  VAL  82          1HG2      VAL  82  -2.914   6.647  -5.820
  612   2HG2  VAL  82          2HG2      VAL  82  -3.788   7.352  -4.460
  613   3HG2  VAL  82          3HG2      VAL  82  -2.095   6.893  -4.277
  614    H    ARG  83           H        ARG  83  -0.075   6.444  -4.928
  615    HA   ARG  83           HA       ARG  83   0.633   7.177  -2.290
  616   1HB   ARG  83          2HB       ARG  83   1.430   4.841  -4.030
  617   2HB   ARG  83          1HB       ARG  83   1.994   5.017  -2.369
  618   1HG   ARG  83          2HG       ARG  83  -0.828   5.484  -2.395
  619   2HG   ARG  83          1HG       ARG  83  -0.513   3.991  -3.278
  620   1HD   ARG  83          2HD       ARG  83   0.578   2.992  -1.431
  621   2HD   ARG  83          1HD       ARG  83   0.778   4.536  -0.609
  622    HE   ARG  83           HE       ARG  83  -1.993   3.880  -0.995
  623   1HH1  ARG  83          2HH1      ARG  83   0.817   3.246   0.980
  624   2HH1  ARG  83          1HH1      ARG  83  -0.108   2.828   2.382
  625   1HH2  ARG  83          1HH2      ARG  83  -3.184   3.331   0.855
  626   2HH2  ARG  83          2HH2      ARG  83  -2.366   2.875   2.313
  627    H    CYS  84           H        CYS  84   2.499   6.963  -5.285
  628    HA   CYS  84           HA       CYS  84   4.998   7.654  -3.975
  629   1HB   CYS  84          2HB       CYS  84   4.619   6.201  -6.132
  630   2HB   CYS  84          1HB       CYS  84   4.623   7.764  -6.947
  631    HG   CYS  84           HG       CYS  84   7.076   6.360  -5.971
  632    H    MET  85           H        MET  85   2.598   9.253  -6.051
  633    HA   MET  85           HA       MET  85   4.051  11.687  -6.376
  634   1HB   MET  85          2HB       MET  85   1.830  10.662  -7.552
  635   2HB   MET  85          1HB       MET  85   1.094  11.821  -6.445
  636   1HG   MET  85          2HG       MET  85   1.498  13.216  -8.241
  637   2HG   MET  85          1HG       MET  85   3.028  13.398  -7.384
  638   1HE   MET  85          1HE       MET  85   4.484  13.628 -10.666
  639   2HE   MET  85          2HE       MET  85   3.399  14.427  -9.531
  640   3HE   MET  85          3HE       MET  85   2.749  13.695 -10.996
  641    H    LYS  86           H        LYS  86   1.425  10.708  -4.174
  642    HA   LYS  86           HA       LYS  86   2.115  13.018  -2.454
  643   1HB   LYS  86          2HB       LYS  86  -0.103  13.271  -3.570
  644   2HB   LYS  86          1HB       LYS  86  -0.628  11.782  -2.787
  645   1HG   LYS  86          2HG       LYS  86   0.575  13.824  -0.999
  646   2HG   LYS  86          1HG       LYS  86  -0.991  14.239  -1.695
  647   1HD   LYS  86          2HD       LYS  86  -1.819  11.967  -0.930
  648   2HD   LYS  86          1HD       LYS  86  -0.308  11.798  -0.037
  649   1HE   LYS  86          2HE       LYS  86  -1.543  12.774   1.632
  650   2HE   LYS  86          1HE       LYS  86  -1.039  14.252   0.813
  651   1HZ   LYS  86          1HZ       LYS  86  -3.433  14.194   1.216
  652   2HZ   LYS  86          2HZ       LYS  86  -3.565  12.779   0.285
  653   3HZ   LYS  86          3HZ       LYS  86  -3.085  14.238  -0.444
  654    H    ASP  87           H        ASP  87   2.600  12.570  -0.398
  655    HA   ASP  87           HA       ASP  87   1.521  10.363   1.058
  656   1HB   ASP  87          2HB       ASP  87   3.819   9.253   1.419
  657   2HB   ASP  87          1HB       ASP  87   2.985   8.915  -0.096
  658    H    ASP  88           H        ASP  88   1.536  13.021   1.603
  659    HA   ASP  88           HA       ASP  88   1.988  14.555   3.245
  660   1HB   ASP  88          2HB       ASP  88   3.087  12.110   4.660
  661   2HB   ASP  88          1HB       ASP  88   2.820  13.677   5.422
  662    H    SER  89           HN       SER  89   3.472  15.609   1.834
  663    HA   SER  89           HA       SER  89   5.445  16.695   1.411
  664   1HB   SER  89          2HB       SER  89   5.499  16.452   4.058
  665   2HB   SER  89          1HB       SER  89   6.858  15.396   3.689
  666    HG   SER  89           HG       SER  89   7.972  17.065   2.992
  Start of MODEL   38
    1   1H    MET   1          1H        MET   1 -10.052  10.580   9.788
    2   2H    MET   1          2H        MET   1  -9.840   9.137   8.918
    3   3H    MET   1          3H        MET   1  -9.452  10.628   8.203
    4    HA   MET   1           HA       MET   1  -7.732  10.950   9.954
    5   1HB   MET   1          2HB       MET   1  -9.022   8.912  11.218
    6   2HB   MET   1          1HB       MET   1  -7.707   8.027  10.448
    7   1HG   MET   1          2HG       MET   1  -6.724   8.672  12.466
    8   2HG   MET   1          1HG       MET   1  -6.212   9.969  11.387
    9   1HE   MET   1          1HE       MET   1  -7.057  11.343  15.072
   10   2HE   MET   1          2HE       MET   1  -5.752  11.000  13.940
   11   3HE   MET   1          3HE       MET   1  -6.645   9.670  14.673
   12    H    ASN   2           H        ASN   2  -8.274   7.857   8.232
   13    HA   ASN   2           HA       ASN   2  -5.802   8.379   6.684
   14   1HB   ASN   2          2HB       ASN   2  -5.697   5.874   6.395
   15   2HB   ASN   2          1HB       ASN   2  -5.439   6.431   8.048
   16   1HD2  ASN   2          1HD2      ASN   2  -7.717   4.742   5.920
   17   2HD2  ASN   2          2HD2      ASN   2  -8.736   4.191   7.161
   18    H    ASP   3           H        ASP   3  -8.309   9.449   5.936
   19    HA   ASP   3           HA       ASP   3  -9.330   7.734   3.790
   20   1HB   ASP   3          2HB       ASP   3 -10.226  10.378   4.933
   21   2HB   ASP   3          1HB       ASP   3 -10.922   9.706   3.459
   22    H    ILE   4           H        ILE   4  -6.850   9.966   4.133
   23    HA   ILE   4           HA       ILE   4  -7.001  11.595   1.880
   24    HB   ILE   4           HB       ILE   4  -4.612  11.874   2.015
   25   1HG1  ILE   4          2HG1      ILE   4  -4.148   9.364   2.259
   26   2HG1  ILE   4          1HG1      ILE   4  -3.130  10.438   3.206
   27   1HG2  ILE   4          1HG2      ILE   4  -5.069  13.118   3.823
   28   2HG2  ILE   4          2HG2      ILE   4  -4.690  11.719   4.826
   29   3HG2  ILE   4          3HG2      ILE   4  -6.352  12.015   4.318
   30   1HD1  ILE   4          1HD1      ILE   4  -4.962  10.055   5.068
   31   2HD1  ILE   4          2HD1      ILE   4  -3.711   8.842   4.799
   32   3HD1  ILE   4          3HD1      ILE   4  -5.324   8.608   4.127
   33    H    TYR   5           H        TYR   5  -6.161   8.199   2.104
   34    HA   TYR   5           HA       TYR   5  -4.968   7.937  -0.478
   35   1HB   TYR   5          2HB       TYR   5  -6.380   5.835   1.191
   36   2HB   TYR   5          1HB       TYR   5  -5.338   5.522  -0.196
   37    HD1  TYR   5           HD1      TYR   5  -2.899   6.124  -0.088
   38    HD2  TYR   5           HD2      TYR   5  -5.471   6.331   3.348
   39    HE1  TYR   5           HE1      TYR   5  -0.915   6.179   1.393
   40    HE2  TYR   5           HE2      TYR   5  -3.485   6.387   4.831
   41    HH   TYR   5           HH       TYR   5  -0.664   5.419   4.167
   42    H    LYS   6           H        LYS   6  -8.255   7.447   0.771
   43    HA   LYS   6           HA       LYS   6  -9.373   6.645  -1.749
   44   1HB   LYS   6          2HB       LYS   6 -10.657   7.573   0.828
   45   2HB   LYS   6          1HB       LYS   6 -11.565   7.008  -0.575
   46   1HG   LYS   6          2HG       LYS   6 -11.371   4.996   0.516
   47   2HG   LYS   6          1HG       LYS   6  -9.835   4.959  -0.351
   48   1HD   LYS   6          2HD       LYS   6  -8.598   5.549   1.545
   49   2HD   LYS   6          1HD       LYS   6  -9.989   6.275   2.349
   50   1HE   LYS   6          2HE       LYS   6  -9.798   4.271   3.516
   51   2HE   LYS   6          1HE       LYS   6 -10.947   3.819   2.257
   52   1HZ   LYS   6          1HZ       LYS   6  -9.107   2.957   0.941
   53   2HZ   LYS   6          2HZ       LYS   6  -9.181   2.189   2.455
   54   3HZ   LYS   6          3HZ       LYS   6  -8.008   3.385   2.162
   55    H    ALA   7           H        ALA   7  -8.876   9.708  -0.118
   56    HA   ALA   7           HA       ALA   7 -10.761  11.282  -1.499
   57   1HB   ALA   7          1HB       ALA   7  -9.591  13.171  -0.686
   58   2HB   ALA   7          2HB       ALA   7  -8.065  12.291  -0.601
   59   3HB   ALA   7          3HB       ALA   7  -9.356  11.927   0.543
   60    H    ALA   8           H        ALA   8  -7.454  10.308  -2.352
   61    HA   ALA   8           HA       ALA   8  -7.273  12.022  -4.650
   62   1HB   ALA   8          1HB       ALA   8  -5.256  10.729  -5.194
   63   2HB   ALA   8          2HB       ALA   8  -5.669   9.552  -3.947
   64   3HB   ALA   8          3HB       ALA   8  -5.257  11.206  -3.496
   65    H    VAL   9           H        VAL   9  -7.978   8.563  -4.173
   66    HA   VAL   9           HA       VAL   9  -8.273   7.978  -6.948
   67    HB   VAL   9           HB       VAL   9  -7.848   6.289  -5.118
   68   1HG1  VAL   9          1HG1      VAL   9  -9.844   5.385  -3.961
   69   2HG1  VAL   9          2HG1      VAL   9 -10.818   6.683  -4.651
   70   3HG1  VAL   9          3HG1      VAL   9  -9.525   7.059  -3.514
   71   1HG2  VAL   9          1HG2      VAL   9 -10.298   5.612  -6.758
   72   2HG2  VAL   9          2HG2      VAL   9  -8.969   4.548  -6.295
   73   3HG2  VAL   9          3HG2      VAL   9  -8.709   5.813  -7.496
   74    H    GLU  10           H        GLU  10 -10.335   9.486  -4.616
   75    HA   GLU  10           HA       GLU  10 -12.806   8.971  -6.038
   76   1HB   GLU  10          2HB       GLU  10 -12.027  10.504  -3.591
   77   2HB   GLU  10          1HB       GLU  10 -13.552  10.895  -4.387
   78   1HG   GLU  10          2HG       GLU  10 -14.324   8.613  -4.179
   79   2HG   GLU  10          1HG       GLU  10 -12.750   8.085  -3.584
   80    H    GLN  11           H        GLN  11 -10.250  11.330  -6.181
   81    HA   GLN  11           HA       GLN  11 -11.914  12.960  -8.012
   82   1HB   GLN  11          2HB       GLN  11 -10.843  14.969  -7.240
   83   2HB   GLN  11          1HB       GLN  11 -11.448  14.105  -5.828
   84   1HG   GLN  11          2HG       GLN  11  -9.093  13.055  -5.684
   85   2HG   GLN  11          1HG       GLN  11  -8.597  14.319  -6.808
   86   1HE2  GLN  11          1HE2      GLN  11  -8.134  13.824  -3.743
   87   2HE2  GLN  11          2HE2      GLN  11  -8.483  15.339  -3.061
   88    H    LEU  12           H        LEU  12  -9.959  10.714  -8.532
   89    HA   LEU  12           HA       LEU  12  -7.676  12.004  -9.769
   90   1HB   LEU  12          2HB       LEU  12  -7.383   9.644 -10.788
   91   2HB   LEU  12          1HB       LEU  12  -7.078   9.891  -9.088
   92    HG   LEU  12           HG       LEU  12  -9.119   8.797  -8.483
   93   1HD1  LEU  12          1HD1      LEU  12 -10.680   9.627 -10.095
   94   2HD1  LEU  12          2HD1      LEU  12 -10.621   7.881 -10.328
   95   3HD1  LEU  12          3HD1      LEU  12  -9.757   8.946 -11.436
   96   1HD2  LEU  12          1HD2      LEU  12  -8.817   6.578  -9.606
   97   2HD2  LEU  12          2HD2      LEU  12  -7.302   7.282  -9.043
   98   3HD2  LEU  12          3HD2      LEU  12  -7.724   7.352 -10.754
   99    H    THR  13           H        THR  13  -7.170  11.370 -12.120
  100    HA   THR  13           HA       THR  13  -9.507  12.126 -13.753
  101    HB   THR  13           HB       THR  13  -7.377  12.229 -15.465
  102    HG1  THR  13           HG1      THR  13  -5.747  11.948 -14.103
  103   1HG2  THR  13          1HG2      THR  13  -9.209  13.959 -14.492
  104   2HG2  THR  13          2HG2      THR  13  -7.861  14.451 -15.516
  105   3HG2  THR  13          3HG2      THR  13  -7.748  14.625 -13.764
  106    H    ASP  14           H        ASP  14  -9.488  11.202 -16.016
  107    HA   ASP  14           HA       ASP  14  -9.577   8.334 -15.862
  108   1HB   ASP  14          2HB       ASP  14 -10.028  10.341 -18.061
  109   2HB   ASP  14          1HB       ASP  14  -9.941   8.618 -18.422
  110    H    GLU  15           H        GLU  15  -7.348  10.754 -17.096
  111    HA   GLU  15           HA       GLU  15  -5.691   9.022 -18.620
  112   1HB   GLU  15          2HB       GLU  15  -4.120  10.816 -18.688
  113   2HB   GLU  15          1HB       GLU  15  -5.719  11.550 -18.729
  114   1HG   GLU  15          2HG       GLU  15  -4.835  12.870 -17.082
  115   2HG   GLU  15          1HG       GLU  15  -5.320  11.526 -16.056
  116    H    GLN  16           H        GLN  16  -5.796   9.882 -15.208
  117    HA   GLN  16           HA       GLN  16  -3.292   8.825 -14.412
  118   1HB   GLN  16          2HB       GLN  16  -4.959  10.294 -13.071
  119   2HB   GLN  16          1HB       GLN  16  -5.746   8.768 -12.664
  120   1HG   GLN  16          2HG       GLN  16  -2.974   8.351 -12.277
  121   2HG   GLN  16          1HG       GLN  16  -3.342   9.917 -11.554
  122   1HE2  GLN  16          1HE2      GLN  16  -4.923   6.658 -11.718
  123   2HE2  GLN  16          2HE2      GLN  16  -5.355   6.638 -10.077
  124    H    LYS  17           H        LYS  17  -6.523   7.403 -14.688
  125    HA   LYS  17           HA       LYS  17  -5.827   4.837 -13.656
  126   1HB   LYS  17          2HB       LYS  17  -8.076   5.628 -15.529
  127   2HB   LYS  17          1HB       LYS  17  -7.944   4.086 -14.685
  128   1HG   LYS  17          2HG       LYS  17  -8.497   4.993 -12.648
  129   2HG   LYS  17          1HG       LYS  17  -7.742   6.544 -13.013
  130   1HD   LYS  17          2HD       LYS  17  -9.646   7.402 -13.918
  131   2HD   LYS  17          1HD       LYS  17 -10.071   5.881 -14.706
  132   1HE   LYS  17          2HE       LYS  17 -10.507   5.092 -12.212
  133   2HE   LYS  17          1HE       LYS  17 -10.703   6.820 -11.932
  134   1HZ   LYS  17          1HZ       LYS  17 -12.190   5.159 -13.892
  135   2HZ   LYS  17          2HZ       LYS  17 -12.314   6.851 -13.780
  136   3HZ   LYS  17          3HZ       LYS  17 -12.813   5.871 -12.485
  137    H    ASN  18           H        ASN  18  -5.852   6.284 -16.888
  138    HA   ASN  18           HA       ASN  18  -5.373   3.911 -18.368
  139   1HB   ASN  18          2HB       ASN  18  -4.909   6.830 -18.955
  140   2HB   ASN  18          1HB       ASN  18  -4.433   5.572 -20.096
  141   1HD2  ASN  18          1HD2      ASN  18  -6.888   7.675 -19.644
  142   2HD2  ASN  18          2HD2      ASN  18  -8.194   6.749 -20.205
  143    H    GLU  19           H        GLU  19  -3.211   6.118 -16.662
  144    HA   GLU  19           HA       GLU  19  -0.752   5.444 -17.821
  145   1HB   GLU  19          2HB       GLU  19  -1.015   5.833 -14.842
  146   2HB   GLU  19          1HB       GLU  19   0.316   6.297 -15.898
  147   1HG   GLU  19          2HG       GLU  19  -1.582   7.762 -17.051
  148   2HG   GLU  19          1HG       GLU  19  -2.311   7.636 -15.450
  149    H    PHE  20           H        PHE  20  -2.501   3.905 -15.150
  150    HA   PHE  20           HA       PHE  20  -0.545   1.747 -14.968
  151   1HB   PHE  20          2HB       PHE  20  -3.011   2.508 -13.428
  152   2HB   PHE  20          1HB       PHE  20  -2.261   0.930 -13.220
  153    HD1  PHE  20           HD1      PHE  20  -1.927   4.539 -12.660
  154    HD2  PHE  20           HD2      PHE  20   0.045   0.727 -12.352
  155    HE1  PHE  20           HE1      PHE  20  -0.241   5.526 -11.130
  156    HE2  PHE  20           HE2      PHE  20   1.720   1.715 -10.819
  157    HZ   PHE  20           HZ       PHE  20   1.581   4.117 -10.211
  158    H    LYS  21           H        LYS  21  -3.989   2.148 -15.793
  159    HA   LYS  21           HA       LYS  21  -4.704  -0.488 -16.233
  160   1HB   LYS  21          2HB       LYS  21  -6.279   1.418 -16.293
  161   2HB   LYS  21          1HB       LYS  21  -5.625   1.891 -17.860
  162   1HG   LYS  21          2HG       LYS  21  -6.436  -0.945 -17.672
  163   2HG   LYS  21          1HG       LYS  21  -7.761   0.209 -17.520
  164   1HD   LYS  21          2HD       LYS  21  -6.472   1.324 -19.604
  165   2HD   LYS  21          1HD       LYS  21  -6.000  -0.356 -19.854
  166   1HE   LYS  21          2HE       LYS  21  -8.002  -0.335 -21.015
  167   2HE   LYS  21          1HE       LYS  21  -8.588  -0.787 -19.415
  168   1HZ   LYS  21          1HZ       LYS  21  -8.489   1.980 -20.493
  169   2HZ   LYS  21          2HZ       LYS  21  -9.081   1.527 -18.966
  170   3HZ   LYS  21          3HZ       LYS  21  -9.883   1.021 -20.376
  171    H    ALA  22           H        ALA  22  -2.835   1.641 -18.354
  172    HA   ALA  22           HA       ALA  22  -2.992   0.125 -20.727
  173   1HB   ALA  22          1HB       ALA  22  -0.698   1.811 -19.687
  174   2HB   ALA  22          2HB       ALA  22  -2.023   2.374 -20.706
  175   3HB   ALA  22          3HB       ALA  22  -0.852   1.219 -21.341
  176    H    ALA  23           H        ALA  23  -0.448   0.122 -18.223
  177    HA   ALA  23           HA       ALA  23   0.932  -2.151 -19.236
  178   1HB   ALA  23          1HB       ALA  23   2.057  -2.167 -17.021
  179   2HB   ALA  23          2HB       ALA  23   0.910  -0.955 -16.445
  180   3HB   ALA  23          3HB       ALA  23   2.042  -0.556 -17.740
  181    H    PHE  24           H        PHE  24  -1.617  -1.672 -16.862
  182    HA   PHE  24           HA       PHE  24  -1.686  -4.255 -15.742
  183   1HB   PHE  24          2HB       PHE  24  -2.890  -2.086 -14.997
  184   2HB   PHE  24          1HB       PHE  24  -4.141  -2.554 -16.147
  185    HD1  PHE  24           HD1      PHE  24  -5.235  -4.833 -15.909
  186    HD2  PHE  24           HD2      PHE  24  -2.722  -3.132 -12.874
  187    HE1  PHE  24           HE1      PHE  24  -6.176  -6.407 -14.244
  188    HE2  PHE  24           HE2      PHE  24  -3.665  -4.703 -11.210
  189    HZ   PHE  24           HZ       PHE  24  -5.396  -6.337 -11.895
  190    H    ASP  25           H        ASP  25  -3.444  -2.873 -18.527
  191    HA   ASP  25           HA       ASP  25  -5.026  -5.167 -19.068
  192   1HB   ASP  25          2HB       ASP  25  -4.872  -2.583 -20.069
  193   2HB   ASP  25          1HB       ASP  25  -4.408  -3.589 -21.438
  194    H    ILE  26           H        ILE  26  -1.814  -4.203 -20.240
  195    HA   ILE  26           HA       ILE  26  -1.698  -6.262 -22.246
  196    HB   ILE  26           HB       ILE  26   0.718  -5.678 -22.402
  197   1HG1  ILE  26          2HG1      ILE  26   0.081  -3.608 -20.278
  198   2HG1  ILE  26          1HG1      ILE  26   0.942  -5.107 -19.939
  199   1HG2  ILE  26          1HG2      ILE  26  -1.192  -3.322 -22.323
  200   2HG2  ILE  26          2HG2      ILE  26  -0.992  -4.435 -23.677
  201   3HG2  ILE  26          3HG2      ILE  26   0.336  -3.376 -23.203
  202   1HD1  ILE  26          1HD1      ILE  26   2.046  -2.683 -20.861
  203   2HD1  ILE  26          2HD1      ILE  26   2.111  -3.790 -22.233
  204   3HD1  ILE  26          3HD1      ILE  26   2.867  -4.236 -20.703
  205    H    PHE  27           H        PHE  27  -0.615  -6.013 -18.885
  206    HA   PHE  27           HA       PHE  27   0.840  -8.508 -18.988
  207   1HB   PHE  27          2HB       PHE  27   0.022  -6.779 -16.641
  208   2HB   PHE  27          1HB       PHE  27   1.038  -8.216 -16.518
  209    HD1  PHE  27           HD1      PHE  27   2.719  -8.055 -18.918
  210    HD2  PHE  27           HD2      PHE  27   1.445  -4.930 -16.255
  211    HE1  PHE  27           HE1      PHE  27   4.689  -6.700 -19.567
  212    HE2  PHE  27           HE2      PHE  27   3.419  -3.575 -16.915
  213    HZ   PHE  27           HZ       PHE  27   5.037  -4.463 -18.566
  214    H    ILE  28           H        ILE  28  -2.402  -7.492 -17.979
  215    HA   ILE  28           HA       ILE  28  -2.993 -10.239 -17.098
  216    HB   ILE  28           HB       ILE  28  -5.005  -9.417 -16.122
  217   1HG1  ILE  28          2HG1      ILE  28  -5.214  -6.708 -16.510
  218   2HG1  ILE  28          1HG1      ILE  28  -4.645  -7.241 -18.090
  219   1HG2  ILE  28          1HG2      ILE  28  -2.944  -8.873 -14.880
  220   2HG2  ILE  28          2HG2      ILE  28  -4.186  -7.647 -14.627
  221   3HG2  ILE  28          3HG2      ILE  28  -2.844  -7.328 -15.725
  222   1HD1  ILE  28          1HD1      ILE  28  -6.856  -8.765 -16.756
  223   2HD1  ILE  28          2HD1      ILE  28  -6.523  -8.555 -18.476
  224   3HD1  ILE  28          3HD1      ILE  28  -7.229  -7.232 -17.548
  225    H    GLN  29           H        GLN  29  -2.852  -8.808 -19.992
  226    HA   GLN  29           HA       GLN  29  -5.266  -9.013 -21.308
  227   1HB   GLN  29          2HB       GLN  29  -3.253  -8.196 -22.413
  228   2HB   GLN  29          1HB       GLN  29  -2.518  -9.796 -22.316
  229   1HG   GLN  29          2HG       GLN  29  -4.124 -10.723 -23.831
  230   2HG   GLN  29          1HG       GLN  29  -5.131  -9.277 -23.752
  231   1HE2  GLN  29          1HE2      GLN  29  -4.019  -7.199 -24.588
  232   2HE2  GLN  29          2HE2      GLN  29  -2.946  -7.364 -25.892
  233    H    ASP  30           H        ASP  30  -3.008 -11.609 -20.487
  234    HA   ASP  30           HA       ASP  30  -4.939 -13.603 -21.503
  235   1HB   ASP  30          2HB       ASP  30  -3.031 -15.195 -21.443
  236   2HB   ASP  30          1HB       ASP  30  -2.736 -13.822 -22.509
  237    H    ALA  31           H        ALA  31  -4.861 -12.131 -18.797
  238    HA   ALA  31           HA       ALA  31  -4.554 -14.428 -16.990
  239   1HB   ALA  31          1HB       ALA  31  -3.495 -12.247 -16.369
  240   2HB   ALA  31          2HB       ALA  31  -4.654 -12.842 -15.177
  241   3HB   ALA  31          3HB       ALA  31  -5.109 -11.543 -16.279
  242    H    GLU  32           H        GLU  32  -6.196 -15.090 -15.626
  243    HA   GLU  32           HA       GLU  32  -8.925 -14.238 -16.405
  244   1HB   GLU  32          2HB       GLU  32  -7.990 -16.977 -15.499
  245   2HB   GLU  32          1HB       GLU  32  -9.660 -16.534 -15.853
  246   1HG   GLU  32          2HG       GLU  32  -8.871 -15.861 -18.176
  247   2HG   GLU  32          1HG       GLU  32  -7.330 -16.626 -17.786
  248    H    ASP  33           H        ASP  33  -7.569 -12.844 -14.455
  249    HA   ASP  33           HA       ASP  33  -9.118 -13.542 -12.051
  250   1HB   ASP  33          2HB       ASP  33  -6.146 -12.986 -12.111
  251   2HB   ASP  33          1HB       ASP  33  -7.118 -12.943 -10.640
  252    H    GLY  34           H        GLY  34  -6.857 -11.135 -13.411
  253   1HA   GLY  34          2HA       GLY  34  -7.593  -8.875 -13.902
  254   2HA   GLY  34          1HA       GLY  34  -8.712  -8.995 -12.545
  255    H    CYS  35           H        CYS  35  -5.280  -9.873 -12.785
  256    HA   CYS  35           HA       CYS  35  -4.403  -7.634 -11.169
  257   1HB   CYS  35          2HB       CYS  35  -3.460  -9.091  -9.364
  258   2HB   CYS  35          1HB       CYS  35  -5.221  -9.023  -9.371
  259    HG   CYS  35           HG       CYS  35  -3.637 -11.446 -10.570
  260    H    ILE  36           H        ILE  36  -2.161  -7.357 -11.209
  261    HA   ILE  36           HA       ILE  36  -0.788  -8.997 -13.229
  262    HB   ILE  36           HB       ILE  36   0.799  -7.225 -13.447
  263   1HG1  ILE  36          2HG1      ILE  36   0.044  -5.176 -11.710
  264   2HG1  ILE  36          1HG1      ILE  36  -0.036  -6.625 -10.706
  265   1HG2  ILE  36          1HG2      ILE  36  -2.002  -6.137 -13.073
  266   2HG2  ILE  36          2HG2      ILE  36  -1.274  -6.718 -14.569
  267   3HG2  ILE  36          3HG2      ILE  36  -0.693  -5.228 -13.826
  268   1HD1  ILE  36          1HD1      ILE  36   2.283  -5.203 -11.406
  269   2HD1  ILE  36          2HD1      ILE  36   2.331  -6.663 -12.395
  270   3HD1  ILE  36          3HD1      ILE  36   2.216  -6.791 -10.639
  271    H    SER  37           H        SER  37   1.686  -9.193 -12.749
  272    HA   SER  37           HA       SER  37   1.891 -10.618 -10.204
  273   1HB   SER  37          2HB       SER  37   2.857 -11.210 -12.687
  274   2HB   SER  37          1HB       SER  37   4.270 -10.465 -11.947
  275    HG   SER  37           HG       SER  37   3.969 -11.919 -10.182
  276    H    THR  38           H        THR  38   2.399  -9.417  -8.479
  277    HA   THR  38           HA       THR  38   3.593  -6.886  -8.507
  278    HB   THR  38           HB       THR  38   2.382  -7.650  -6.545
  279    HG1  THR  38           HG1      THR  38   5.136  -7.277  -5.982
  280   1HG2  THR  38          1HG2      THR  38   3.492 -10.064  -6.868
  281   2HG2  THR  38          2HG2      THR  38   2.886  -9.518  -5.305
  282   3HG2  THR  38          3HG2      THR  38   4.610  -9.425  -5.663
  283    H    LYS  39           H        LYS  39   5.082 -10.099  -8.157
  284    HA   LYS  39           HA       LYS  39   7.715  -9.163  -7.651
  285   1HB   LYS  39          2HB       LYS  39   8.433 -11.449  -8.394
  286   2HB   LYS  39          1HB       LYS  39   7.199 -11.456  -7.136
  287   1HG   LYS  39          2HG       LYS  39   5.960 -11.403  -9.756
  288   2HG   LYS  39          1HG       LYS  39   7.077 -12.761  -9.628
  289   1HD   LYS  39          2HD       LYS  39   5.911 -13.036  -7.247
  290   2HD   LYS  39          1HD       LYS  39   4.592 -12.196  -8.062
  291   1HE   LYS  39          2HE       LYS  39   4.000 -14.108  -9.086
  292   2HE   LYS  39          1HE       LYS  39   5.589 -14.195  -9.846
  293   1HZ   LYS  39          1HZ       LYS  39   6.446 -15.314  -7.910
  294   2HZ   LYS  39          2HZ       LYS  39   5.087 -16.152  -8.488
  295   3HZ   LYS  39          3HZ       LYS  39   4.958 -15.167  -7.110
  296    H    GLU  40           H        GLU  40   5.816  -9.410 -10.554
  297    HA   GLU  40           HA       GLU  40   8.204  -8.822 -12.201
  298   1HB   GLU  40          2HB       GLU  40   5.476  -9.727 -13.161
  299   2HB   GLU  40          1HB       GLU  40   6.946  -9.583 -14.122
  300   1HG   GLU  40          2HG       GLU  40   6.589 -11.471 -11.772
  301   2HG   GLU  40          1HG       GLU  40   6.483 -11.939 -13.468
  302    H    LEU  41           H        LEU  41   6.694  -6.916 -10.473
  303    HA   LEU  41           HA       LEU  41   5.058  -5.265 -12.124
  304   1HB   LEU  41          2HB       LEU  41   5.218  -5.361  -9.543
  305   2HB   LEU  41          1HB       LEU  41   6.557  -4.250  -9.737
  306    HG   LEU  41           HG       LEU  41   4.148  -3.438 -11.203
  307   1HD1  LEU  41          1HD1      LEU  41   2.818  -4.232  -9.463
  308   2HD1  LEU  41          2HD1      LEU  41   3.195  -2.605  -8.898
  309   3HD1  LEU  41          3HD1      LEU  41   4.076  -3.989  -8.253
  310   1HD2  LEU  41          1HD2      LEU  41   6.142  -2.215  -9.292
  311   2HD2  LEU  41          2HD2      LEU  41   4.711  -1.327  -9.816
  312   3HD2  LEU  41          3HD2      LEU  41   5.899  -1.861 -11.004
  313    H    GLY  42           H        GLY  42   8.479  -5.649 -11.890
  314   1HA   GLY  42          2HA       GLY  42   9.436  -3.092 -12.501
  315   2HA   GLY  42          1HA       GLY  42  10.210  -4.598 -12.989
  316    H    LYS  43           H        LYS  43   7.833  -5.489 -14.505
  317    HA   LYS  43           HA       LYS  43   8.481  -4.373 -17.050
  318   1HB   LYS  43          2HB       LYS  43   6.102  -6.080 -16.276
  319   2HB   LYS  43          1HB       LYS  43   6.687  -5.790 -17.914
  320   1HG   LYS  43          2HG       LYS  43   8.849  -6.847 -17.320
  321   2HG   LYS  43          1HG       LYS  43   8.236  -7.167 -15.697
  322   1HD   LYS  43          2HD       LYS  43   7.651  -9.174 -16.639
  323   2HD   LYS  43          1HD       LYS  43   6.232  -8.257 -17.145
  324   1HE   LYS  43          2HE       LYS  43   6.890  -9.134 -19.186
  325   2HE   LYS  43          1HE       LYS  43   7.793  -7.620 -19.199
  326   1HZ   LYS  43          1HZ       LYS  43   8.824 -10.277 -18.359
  327   2HZ   LYS  43          2HZ       LYS  43   9.699  -8.822 -18.268
  328   3HZ   LYS  43          3HZ       LYS  43   9.232  -9.443 -19.779
  329    H    VAL  44           H        VAL  44   6.163  -3.527 -14.594
  330    HA   VAL  44           HA       VAL  44   4.591  -1.904 -16.461
  331    HB   VAL  44           HB       VAL  44   2.904  -1.815 -14.920
  332   1HG1  VAL  44          1HG1      VAL  44   2.579  -4.010 -14.633
  333   2HG1  VAL  44          2HG1      VAL  44   3.656  -3.989 -13.237
  334   3HG1  VAL  44          3HG1      VAL  44   4.302  -4.309 -14.845
  335   1HG2  VAL  44          1HG2      VAL  44   3.417  -2.049 -12.380
  336   2HG2  VAL  44          2HG2      VAL  44   3.826  -0.535 -13.183
  337   3HG2  VAL  44          3HG2      VAL  44   5.085  -1.721 -12.845
  338    H    MET  45           H        MET  45   6.932  -1.619 -13.848
  339    HA   MET  45           HA       MET  45   6.753   1.141 -13.354
  340   1HB   MET  45          2HB       MET  45   9.011  -0.842 -13.138
  341   2HB   MET  45          1HB       MET  45   9.277   0.870 -12.813
  342   1HG   MET  45          2HG       MET  45   6.976  -0.552 -11.505
  343   2HG   MET  45          1HG       MET  45   8.600  -0.717 -10.839
  344   1HE   MET  45          1HE       MET  45   8.338   0.946  -8.381
  345   2HE   MET  45          2HE       MET  45   7.055  -0.080  -9.018
  346   3HE   MET  45          3HE       MET  45   6.687   1.567  -8.509
  347    H    ARG  46           H        ARG  46   8.587  -0.705 -15.775
  348    HA   ARG  46           HA       ARG  46   9.963   1.506 -16.914
  349   1HB   ARG  46          2HB       ARG  46  10.290   0.026 -18.886
  350   2HB   ARG  46          1HB       ARG  46  10.710  -0.760 -17.366
  351   1HG   ARG  46          2HG       ARG  46   8.756  -2.085 -17.368
  352   2HG   ARG  46          1HG       ARG  46   7.953  -1.056 -18.551
  353   1HD   ARG  46          2HD       ARG  46   8.594  -2.794 -19.922
  354   2HD   ARG  46          1HD       ARG  46  10.008  -1.758 -20.069
  355    HE   ARG  46           HE       ARG  46  10.639  -3.366 -17.959
  356   1HH1  ARG  46          2HH1      ARG  46   9.491  -3.958 -21.205
  357   2HH1  ARG  46          1HH1      ARG  46  10.272  -5.497 -21.335
  358   1HH2  ARG  46          1HH2      ARG  46  11.654  -5.389 -18.153
  359   2HH2  ARG  46          2HH2      ARG  46  11.493  -6.305 -19.614
  360    H    MET  47           H        MET  47   6.756   0.158 -17.427
  361    HA   MET  47           HA       MET  47   6.146   1.649 -19.806
  362   1HB   MET  47          2HB       MET  47   4.722  -0.165 -17.968
  363   2HB   MET  47          1HB       MET  47   3.711   1.096 -18.668
  364   1HG   MET  47          2HG       MET  47   3.706  -0.896 -20.103
  365   2HG   MET  47          1HG       MET  47   4.488   0.451 -20.931
  366   1HE   MET  47          1HE       MET  47   6.598   0.776 -21.484
  367   2HE   MET  47          2HE       MET  47   6.426  -0.593 -22.580
  368   3HE   MET  47          3HE       MET  47   7.893  -0.421 -21.621
  369    H    LEU  48           H        LEU  48   5.813   2.169 -16.343
  370    HA   LEU  48           HA       LEU  48   4.158   4.518 -16.544
  371   1HB   LEU  48          2HB       LEU  48   5.611   3.083 -14.375
  372   2HB   LEU  48          1HB       LEU  48   5.168   4.751 -14.098
  373    HG   LEU  48           HG       LEU  48   2.875   4.267 -14.090
  374   1HD1  LEU  48          1HD1      LEU  48   2.419   3.071 -16.041
  375   2HD1  LEU  48          2HD1      LEU  48   2.161   1.833 -14.811
  376   3HD1  LEU  48          3HD1      LEU  48   3.671   1.872 -15.720
  377   1HD2  LEU  48          1HD2      LEU  48   2.926   1.810 -12.892
  378   2HD2  LEU  48          2HD2      LEU  48   3.358   3.312 -12.076
  379   3HD2  LEU  48          3HD2      LEU  48   4.619   2.284 -12.754
  380    H    GLY  49           H        GLY  49   7.598   3.837 -16.450
  381   1HA   GLY  49          2HA       GLY  49   9.036   5.522 -17.563
  382   2HA   GLY  49          1HA       GLY  49   8.170   6.741 -16.636
  383    H    GLN  50           H        GLN  50   9.125   3.644 -15.264
  384    HA   GLN  50           HA       GLN  50  11.312   4.940 -13.756
  385   1HB   GLN  50          2HB       GLN  50   9.375   2.993 -12.490
  386   2HB   GLN  50          1HB       GLN  50  10.592   3.983 -11.690
  387   1HG   GLN  50          2HG       GLN  50   8.236   5.146 -13.203
  388   2HG   GLN  50          1HG       GLN  50   8.218   4.838 -11.468
  389   1HE2  GLN  50          1HE2      GLN  50   8.349   7.426 -13.273
  390   2HE2  GLN  50          2HE2      GLN  50   9.567   8.337 -12.519
  391    H    ASN  51           H        ASN  51  12.726   3.269 -12.665
  392    HA   ASN  51           HA       ASN  51  12.666   0.605 -13.854
  393   1HB   ASN  51          2HB       ASN  51  13.973   2.347 -15.359
  394   2HB   ASN  51          1HB       ASN  51  15.251   2.078 -14.174
  395   1HD2  ASN  51          1HD2      ASN  51  14.738   1.123 -17.131
  396   2HD2  ASN  51          2HD2      ASN  51  15.090  -0.535 -17.051
  397    HA   PRO  52           HA       PRO  52  14.581   0.794  -9.629
  398   1HB   PRO  52          2HB       PRO  52  12.562  -0.432  -8.251
  399   2HB   PRO  52          1HB       PRO  52  12.631   1.314  -8.531
  400   1HG   PRO  52          2HG       PRO  52  10.871  -0.713  -9.750
  401   2HG   PRO  52          1HG       PRO  52  10.624   1.031  -9.569
  402   1HD   PRO  52          2HD       PRO  52  11.451  -0.361 -11.933
  403   2HD   PRO  52          1HD       PRO  52  11.333   1.400 -11.706
  404    H    THR  53           H        THR  53  14.149  -1.411  -7.956
  405    HA   THR  53           HA       THR  53  15.073  -3.666  -9.639
  406    HB   THR  53           HB       THR  53  16.449  -4.370  -7.877
  407    HG1  THR  53           HG1      THR  53  16.099  -3.396  -5.724
  408   1HG2  THR  53          1HG2      THR  53  16.300  -1.366  -7.543
  409   2HG2  THR  53          2HG2      THR  53  17.244  -2.216  -8.770
  410   3HG2  THR  53          3HG2      THR  53  17.653  -2.391  -7.063
  411    HA   PRO  54           HA       PRO  54  11.639  -6.065  -8.268
  412   1HB   PRO  54          2HB       PRO  54  12.719  -8.491  -7.587
  413   2HB   PRO  54          1HB       PRO  54  12.515  -7.928  -9.254
  414   1HG   PRO  54          2HG       PRO  54  14.983  -8.091  -7.607
  415   2HG   PRO  54          1HG       PRO  54  14.783  -8.236  -9.360
  416   1HD   PRO  54          2HD       PRO  54  15.721  -5.962  -8.021
  417   2HD   PRO  54          1HD       PRO  54  15.104  -5.987  -9.689
  418    H    GLU  55           H        GLU  55  14.347  -5.944  -6.017
  419    HA   GLU  55           HA       GLU  55  12.737  -6.749  -3.735
  420   1HB   GLU  55          2HB       GLU  55  14.746  -6.246  -2.397
  421   2HB   GLU  55          1HB       GLU  55  15.120  -7.320  -3.741
  422   1HG   GLU  55          2HG       GLU  55  16.016  -5.462  -5.038
  423   2HG   GLU  55          1HG       GLU  55  15.529  -4.314  -3.790
  424    H    GLU  56           H        GLU  56  13.768  -3.778  -5.305
  425    HA   GLU  56           HA       GLU  56  13.120  -2.011  -3.144
  426   1HB   GLU  56          2HB       GLU  56  14.583  -1.586  -5.285
  427   2HB   GLU  56          1HB       GLU  56  13.040  -1.150  -6.019
  428   1HG   GLU  56          2HG       GLU  56  13.692   0.909  -5.171
  429   2HG   GLU  56          1HG       GLU  56  12.763   0.285  -3.807
  430    H    LEU  57           H        LEU  57  11.462  -2.816  -6.214
  431    HA   LEU  57           HA       LEU  57   9.116  -1.340  -5.706
  432   1HB   LEU  57          2HB       LEU  57   8.127  -2.547  -7.503
  433   2HB   LEU  57          1HB       LEU  57   9.795  -2.242  -7.920
  434    HG   LEU  57           HG       LEU  57  10.131  -4.689  -6.940
  435   1HD1  LEU  57          1HD1      LEU  57   8.130  -5.573  -6.311
  436   2HD1  LEU  57          2HD1      LEU  57   7.858  -5.786  -8.039
  437   3HD1  LEU  57          3HD1      LEU  57   7.214  -4.368  -7.215
  438   1HD2  LEU  57          1HD2      LEU  57   9.845  -5.538  -9.241
  439   2HD2  LEU  57          2HD2      LEU  57  10.612  -3.950  -9.252
  440   3HD2  LEU  57          3HD2      LEU  57   8.902  -4.105  -9.655
  441    H    GLN  58           H        GLN  58  10.096  -4.597  -4.755
  442    HA   GLN  58           HA       GLN  58   7.596  -5.620  -3.987
  443   1HB   GLN  58          2HB       GLN  58  10.419  -6.256  -3.372
  444   2HB   GLN  58          1HB       GLN  58   9.240  -6.798  -2.178
  445   1HG   GLN  58          2HG       GLN  58   8.797  -7.296  -5.119
  446   2HG   GLN  58          1HG       GLN  58   9.790  -8.389  -4.157
  447   1HE2  GLN  58          1HE2      GLN  58   6.486  -7.097  -4.509
  448   2HE2  GLN  58          2HE2      GLN  58   5.739  -8.307  -3.585
  449    H    GLU  59           H        GLU  59   9.895  -3.586  -2.207
  450    HA   GLU  59           HA       GLU  59   8.567  -3.711   0.306
  451   1HB   GLU  59          2HB       GLU  59  10.390  -1.580  -0.839
  452   2HB   GLU  59          1HB       GLU  59   9.861  -1.647   0.841
  453   1HG   GLU  59          2HG       GLU  59  11.253  -3.976  -0.495
  454   2HG   GLU  59          1HG       GLU  59  12.148  -2.693   0.320
  455    H    MET  60           H        MET  60   8.189  -1.620  -2.516
  456    HA   MET  60           HA       MET  60   6.388   0.215  -1.224
  457   1HB   MET  60          2HB       MET  60   6.744  -0.240  -4.193
  458   2HB   MET  60          1HB       MET  60   6.056   1.183  -3.412
  459   1HG   MET  60          2HG       MET  60   8.901   0.227  -2.984
  460   2HG   MET  60          1HG       MET  60   8.447   1.482  -4.135
  461   1HE   MET  60          1HE       MET  60  10.231   0.978  -1.634
  462   2HE   MET  60          2HE       MET  60   9.284   0.965  -0.149
  463   3HE   MET  60          3HE       MET  60  10.215   2.397  -0.579
  464    H    ILE  61           H        ILE  61   6.040  -2.570  -3.378
  465    HA   ILE  61           HA       ILE  61   3.208  -2.376  -3.653
  466    HB   ILE  61           HB       ILE  61   5.034  -4.762  -4.017
  467   1HG1  ILE  61          2HG1      ILE  61   5.539  -2.973  -5.594
  468   2HG1  ILE  61          1HG1      ILE  61   4.661  -4.240  -6.446
  469   1HG2  ILE  61          1HG2      ILE  61   3.052  -5.880  -3.934
  470   2HG2  ILE  61          2HG2      ILE  61   2.827  -5.224  -5.556
  471   3HG2  ILE  61          3HG2      ILE  61   2.099  -4.416  -4.168
  472   1HD1  ILE  61          1HD1      ILE  61   3.719  -2.104  -7.093
  473   2HD1  ILE  61          2HD1      ILE  61   3.529  -1.627  -5.407
  474   3HD1  ILE  61          3HD1      ILE  61   2.545  -2.931  -6.071
  475    H    ASP  62           H        ASP  62   5.283  -4.406  -1.569
  476    HA   ASP  62           HA       ASP  62   3.318  -5.868  -0.258
  477   1HB   ASP  62          2HB       ASP  62   5.977  -5.792  -0.004
  478   2HB   ASP  62          1HB       ASP  62   5.561  -4.821   1.407
  479    H    GLU  63           H        GLU  63   4.368  -2.539   0.298
  480    HA   GLU  63           HA       GLU  63   2.923  -2.122   2.727
  481   1HB   GLU  63          2HB       GLU  63   4.253  -0.360   0.709
  482   2HB   GLU  63          1HB       GLU  63   3.125   0.371   1.850
  483   1HG   GLU  63          2HG       GLU  63   4.394  -0.660   3.725
  484   2HG   GLU  63          1HG       GLU  63   5.553  -1.303   2.562
  485    H    VAL  64           H        VAL  64   2.202  -1.351  -0.689
  486    HA   VAL  64           HA       VAL  64  -0.384  -0.252  -0.081
  487    HB   VAL  64           HB       VAL  64   0.849   0.517  -2.046
  488   1HG1  VAL  64          1HG1      VAL  64   0.960  -1.019  -4.046
  489   2HG1  VAL  64          2HG1      VAL  64   0.505  -2.345  -2.974
  490   3HG1  VAL  64          3HG1      VAL  64   2.017  -1.478  -2.711
  491   1HG2  VAL  64          1HG2      VAL  64  -0.989   0.612  -3.532
  492   2HG2  VAL  64          2HG2      VAL  64  -1.728   0.379  -1.948
  493   3HG2  VAL  64          3HG2      VAL  64  -1.569  -0.984  -3.055
  494    H    ASP  65           H        ASP  65   0.793  -3.449  -0.948
  495    HA   ASP  65           HA       ASP  65  -1.765  -4.525  -1.665
  496   1HB   ASP  65          2HB       ASP  65   0.885  -5.414  -1.803
  497   2HB   ASP  65          1HB       ASP  65   0.116  -6.500  -0.654
  498    H    GLU  66           H        GLU  66  -3.299  -4.259  -0.144
  499    HA   GLU  66           HA       GLU  66  -2.939  -4.446   2.652
  500   1HB   GLU  66          2HB       GLU  66  -5.466  -4.763   2.687
  501   2HB   GLU  66          1HB       GLU  66  -4.876  -3.300   1.905
  502   1HG   GLU  66          2HG       GLU  66  -5.637  -3.942  -0.139
  503   2HG   GLU  66          1HG       GLU  66  -5.123  -5.611   0.090
  504    H    ASP  67           H        ASP  67  -3.745  -6.874   0.233
  505    HA   ASP  67           HA       ASP  67  -4.146  -8.913   2.300
  506   1HB   ASP  67          2HB       ASP  67  -4.559 -10.396   0.230
  507   2HB   ASP  67          1HB       ASP  67  -5.759  -9.162   0.610
  508    H    GLY  68           H        GLY  68  -1.897  -8.071  -0.296
  509   1HA   GLY  68          2HA       GLY  68   0.289  -8.722  -0.663
  510   2HA   GLY  68          1HA       GLY  68   0.273  -9.465   0.936
  511    H    SER  69           H        SER  69  -1.632 -10.036  -2.021
  512    HA   SER  69           HA       SER  69  -1.339 -12.912  -1.686
  513   1HB   SER  69          2HB       SER  69  -2.911 -13.032  -3.616
  514   2HB   SER  69          1HB       SER  69  -3.535 -12.079  -2.274
  515    HG   SER  69           HG       SER  69  -2.619 -11.276  -4.797
  516    H    GLY  70           H        GLY  70   0.790 -10.812  -2.894
  517   1HA   GLY  70          2HA       GLY  70   2.617 -11.109  -4.279
  518   2HA   GLY  70          1HA       GLY  70   2.037 -12.736  -4.622
  519    H    THR  71           H        THR  71  -0.093 -10.025  -5.050
  520    HA   THR  71           HA       THR  71   0.428  -9.766  -7.907
  521    HB   THR  71           HB       THR  71  -1.788 -10.380  -8.618
  522    HG1  THR  71           HG1      THR  71  -3.392 -10.461  -7.269
  523   1HG2  THR  71          1HG2      THR  71  -0.197 -12.253  -8.325
  524   2HG2  THR  71          2HG2      THR  71  -1.860 -12.764  -8.039
  525   3HG2  THR  71          3HG2      THR  71  -0.779 -12.474  -6.674
  526    H    VAL  72           H        VAL  72  -0.466  -7.875  -8.795
  527    HA   VAL  72           HA       VAL  72  -1.549  -5.989  -6.785
  528    HB   VAL  72           HB       VAL  72  -0.215  -5.236  -9.387
  529   1HG1  VAL  72          1HG1      VAL  72  -0.105  -3.035  -8.408
  530   2HG1  VAL  72          2HG1      VAL  72  -0.647  -3.645  -6.844
  531   3HG1  VAL  72          3HG1      VAL  72  -1.761  -3.610  -8.212
  532   1HG2  VAL  72          1HG2      VAL  72   1.573  -6.239  -8.248
  533   2HG2  VAL  72          2HG2      VAL  72   0.935  -5.802  -6.663
  534   3HG2  VAL  72          3HG2      VAL  72   1.673  -4.570  -7.688
  535    H    ASP  73           H        ASP  73  -3.603  -5.508  -6.993
  536    HA   ASP  73           HA       ASP  73  -5.045  -6.098  -9.469
  537   1HB   ASP  73          2HB       ASP  73  -5.978  -5.065  -6.772
  538   2HB   ASP  73          1HB       ASP  73  -7.047  -5.385  -8.138
  539    H    PHE  74           H        PHE  74  -6.594  -4.360 -10.290
  540    HA   PHE  74           HA       PHE  74  -5.139  -2.084 -11.044
  541   1HB   PHE  74          2HB       PHE  74  -7.232  -3.037 -12.167
  542   2HB   PHE  74          1HB       PHE  74  -8.152  -2.122 -10.972
  543    HD1  PHE  74           HD1      PHE  74  -4.965  -1.337 -12.769
  544    HD2  PHE  74           HD2      PHE  74  -9.065  -0.267 -12.081
  545    HE1  PHE  74           HE1      PHE  74  -4.658   0.708 -14.121
  546    HE2  PHE  74           HE2      PHE  74  -8.757   1.784 -13.436
  547    HZ   PHE  74           HZ       PHE  74  -6.555   2.272 -14.461
  548    H    ASP  75           H        ASP  75  -7.236  -2.641  -8.274
  549    HA   ASP  75           HA       ASP  75  -7.498   0.097  -7.490
  550   1HB   ASP  75          2HB       ASP  75  -8.857  -1.983  -6.687
  551   2HB   ASP  75          1HB       ASP  75  -7.544  -2.182  -5.526
  552    H    GLU  76           H        GLU  76  -5.285  -2.539  -6.584
  553    HA   GLU  76           HA       GLU  76  -3.750  -0.966  -4.734
  554   1HB   GLU  76          2HB       GLU  76  -2.937  -3.521  -6.151
  555   2HB   GLU  76          1HB       GLU  76  -2.212  -2.849  -4.691
  556   1HG   GLU  76          2HG       GLU  76  -4.282  -3.178  -3.449
  557   2HG   GLU  76          1HG       GLU  76  -5.117  -3.703  -4.908
  558    H    PHE  77           H        PHE  77  -3.742  -1.444  -8.169
  559    HA   PHE  77           HA       PHE  77  -1.059  -0.674  -8.736
  560   1HB   PHE  77          2HB       PHE  77  -3.073  -1.789 -10.182
  561   2HB   PHE  77          1HB       PHE  77  -3.180  -0.126 -10.737
  562    HD1  PHE  77           HD1      PHE  77  -2.598  -0.984 -12.984
  563    HD2  PHE  77           HD2      PHE  77   0.140  -1.294  -9.676
  564    HE1  PHE  77           HE1      PHE  77  -0.733  -1.399 -14.555
  565    HE2  PHE  77           HE2      PHE  77   1.996  -1.700 -11.258
  566    HZ   PHE  77           HZ       PHE  77   1.562  -1.758 -13.698
  567    H    LEU  78           H        LEU  78  -4.163   1.068  -9.010
  568    HA   LEU  78           HA       LEU  78  -2.980   3.586  -9.654
  569   1HB   LEU  78          2HB       LEU  78  -5.702   2.638  -8.902
  570   2HB   LEU  78          1HB       LEU  78  -5.361   4.353  -8.755
  571    HG   LEU  78           HG       LEU  78  -4.979   4.566 -11.100
  572   1HD1  LEU  78          1HD1      LEU  78  -5.170   1.550 -11.311
  573   2HD1  LEU  78          2HD1      LEU  78  -3.655   2.452 -11.323
  574   3HD1  LEU  78          3HD1      LEU  78  -4.825   2.681 -12.619
  575   1HD2  LEU  78          1HD2      LEU  78  -7.338   4.450 -10.545
  576   2HD2  LEU  78          2HD2      LEU  78  -7.295   2.686 -10.558
  577   3HD2  LEU  78          3HD2      LEU  78  -7.084   3.586 -12.061
  578    H    VAL  79           H        VAL  79  -3.894   2.022  -6.635
  579    HA   VAL  79           HA       VAL  79  -3.798   4.286  -4.942
  580    HB   VAL  79           HB       VAL  79  -3.577   1.326  -4.547
  581   1HG1  VAL  79          1HG1      VAL  79  -3.212   1.664  -2.128
  582   2HG1  VAL  79          2HG1      VAL  79  -2.990   3.393  -2.406
  583   3HG1  VAL  79          3HG1      VAL  79  -1.837   2.234  -3.077
  584   1HG2  VAL  79          1HG2      VAL  79  -5.286   3.370  -3.117
  585   2HG2  VAL  79          2HG2      VAL  79  -5.574   1.638  -3.291
  586   3HG2  VAL  79          3HG2      VAL  79  -5.739   2.704  -4.686
  587    H    MET  80           H        MET  80  -1.326   1.863  -5.764
  588    HA   MET  80           HA       MET  80   0.826   2.664  -4.284
  589   1HB   MET  80          2HB       MET  80   0.454   0.985  -6.464
  590   2HB   MET  80          1HB       MET  80   1.637   2.158  -7.037
  591   1HG   MET  80          2HG       MET  80   2.132   1.217  -4.292
  592   2HG   MET  80          1HG       MET  80   2.235  -0.052  -5.512
  593   1HE   MET  80          1HE       MET  80   3.119   0.167  -7.576
  594   2HE   MET  80          2HE       MET  80   4.842  -0.049  -7.279
  595   3HE   MET  80          3HE       MET  80   4.284   1.345  -8.198
  596    H    MET  81           H        MET  81  -0.545   4.368  -7.057
  597    HA   MET  81           HA       MET  81   1.663   6.056  -7.629
  598   1HB   MET  81          2HB       MET  81  -0.187   5.865  -9.204
  599   2HB   MET  81          1HB       MET  81  -1.305   6.530  -8.017
  600   1HG   MET  81          2HG       MET  81  -0.471   8.185  -9.756
  601   2HG   MET  81          1HG       MET  81  -0.235   8.678  -8.081
  602   1HE   MET  81          1HE       MET  81   1.135   7.206 -11.239
  603   2HE   MET  81          2HE       MET  81   1.844   5.968 -10.204
  604   3HE   MET  81          3HE       MET  81   2.891   7.109 -11.044
  605    H    VAL  82           H        VAL  82  -1.306   6.710  -5.740
  606    HA   VAL  82           HA       VAL  82  -0.377   9.193  -4.691
  607    HB   VAL  82           HB       VAL  82  -2.244   9.010  -3.096
  608   1HG1  VAL  82          1HG1      VAL  82  -2.805   9.849  -5.278
  609   2HG1  VAL  82          2HG1      VAL  82  -4.075   8.711  -4.825
  610   3HG1  VAL  82          3HG1      VAL  82  -2.819   8.223  -5.963
  611   1HG2  VAL  82          1HG2      VAL  82  -1.960   6.500  -2.788
  612   2HG2  VAL  82          2HG2      VAL  82  -2.799   6.301  -4.328
  613   3HG2  VAL  82          3HG2      VAL  82  -3.625   7.054  -2.963
  614    H    ARG  83           H        ARG  83  -0.059   5.853  -3.690
  615    HA   ARG  83           HA       ARG  83   0.724   6.177  -1.013
  616   1HB   ARG  83          2HB       ARG  83   1.407   4.103  -3.098
  617   2HB   ARG  83          1HB       ARG  83   2.063   4.021  -1.464
  618   1HG   ARG  83          2HG       ARG  83  -0.892   4.401  -1.838
  619   2HG   ARG  83          1HG       ARG  83  -0.200   2.792  -2.030
  620   1HD   ARG  83          2HD       ARG  83   1.016   3.637   0.275
  621   2HD   ARG  83          1HD       ARG  83  -0.558   4.408   0.413
  622    HE   ARG  83           HE       ARG  83   0.008   1.579   0.602
  623   1HH1  ARG  83          2HH1      ARG  83  -2.407   3.975  -0.182
  624   2HH1  ARG  83          1HH1      ARG  83  -3.739   2.946   0.213
  625   1HH2  ARG  83          1HH2      ARG  83  -1.761   0.248   1.120
  626   2HH2  ARG  83          2HH2      ARG  83  -3.376   0.842   0.942
  627    H    CYS  84           H        CYS  84   2.570   6.355  -4.039
  628    HA   CYS  84           HA       CYS  84   5.164   6.564  -2.955
  629   1HB   CYS  84          2HB       CYS  84   4.398   6.344  -5.445
  630   2HB   CYS  84          1HB       CYS  84   4.351   8.106  -5.405
  631    HG   CYS  84           HG       CYS  84   6.799   6.908  -6.023
  632    H    MET  85           H        MET  85   2.679   8.998  -3.623
  633    HA   MET  85           HA       MET  85   4.231  11.283  -2.927
  634   1HB   MET  85          2HB       MET  85   1.293  10.727  -3.213
  635   2HB   MET  85          1HB       MET  85   1.836  12.254  -2.518
  636   1HG   MET  85          2HG       MET  85   2.843  12.953  -4.494
  637   2HG   MET  85          1HG       MET  85   3.075  11.306  -5.079
  638   1HE   MET  85          1HE       MET  85   1.004  14.461  -5.778
  639   2HE   MET  85          2HE       MET  85   0.631  13.657  -7.300
  640   3HE   MET  85          3HE       MET  85   2.276  13.617  -6.671
  641    H    LYS  86           H        LYS  86   1.788   9.384  -1.136
  642    HA   LYS  86           HA       LYS  86   3.173   9.915   1.371
  643   1HB   LYS  86          2HB       LYS  86   1.477  11.836   0.884
  644   2HB   LYS  86          1HB       LYS  86   0.255  10.631   1.294
  645   1HG   LYS  86          2HG       LYS  86   2.515  10.727   3.182
  646   2HG   LYS  86          1HG       LYS  86   1.567  12.214   3.125
  647   1HD   LYS  86          2HD       LYS  86  -0.083   9.780   3.137
  648   2HD   LYS  86          1HD       LYS  86   0.904   9.964   4.586
  649   1HE   LYS  86          2HE       LYS  86  -1.187  11.096   4.994
  650   2HE   LYS  86          1HE       LYS  86   0.046  12.334   4.766
  651   1HZ   LYS  86          1HZ       LYS  86  -1.523  11.375   2.462
  652   2HZ   LYS  86          2HZ       LYS  86  -0.746  12.869   2.685
  653   3HZ   LYS  86          3HZ       LYS  86  -2.188  12.525   3.515
  654    H    ASP  87           H        ASP  87   3.122   8.130   2.564
  655    HA   ASP  87           HA       ASP  87   0.771   6.449   2.725
  656   1HB   ASP  87          2HB       ASP  87   1.738   4.428   1.861
  657   2HB   ASP  87          1HB       ASP  87   1.917   5.667   0.623
  658    H    ASP  88           H        ASP  88   2.239   7.989   4.613
  659    HA   ASP  88           HA       ASP  88   3.054   5.840   6.453
  660   1HB   ASP  88          2HB       ASP  88   4.897   7.391   7.301
  661   2HB   ASP  88          1HB       ASP  88   5.184   6.610   5.750
  662    H    SER  89           HN       SER  89   2.303   9.316   6.133
  663    HA   SER  89           HA       SER  89   1.131  10.767   7.443
  664   1HB   SER  89          2HB       SER  89  -0.856  10.024   8.335
  665   2HB   SER  89          1HB       SER  89  -0.481   8.678   7.266
  666    HG   SER  89           HG       SER  89  -0.176   7.444   8.955
  Start of MODEL   39
    1   1H    MET   1          1H        MET   1  -8.064   0.272   8.210
    2   2H    MET   1          2H        MET   1  -8.221   1.269   6.843
    3   3H    MET   1          3H        MET   1  -7.087   1.649   8.051
    4    HA   MET   1           HA       MET   1  -5.865  -0.397   7.553
    5   1HB   MET   1          2HB       MET   1  -8.216  -0.735   5.771
    6   2HB   MET   1          1HB       MET   1  -6.657  -1.189   5.080
    7   1HG   MET   1          2HG       MET   1  -6.284  -2.467   7.312
    8   2HG   MET   1          1HG       MET   1  -8.028  -2.307   7.521
    9   1HE   MET   1          1HE       MET   1  -5.664  -4.874   4.614
   10   2HE   MET   1          2HE       MET   1  -5.136  -4.005   6.053
   11   3HE   MET   1          3HE       MET   1  -5.455  -3.118   4.563
   12    H    ASN   2           H        ASN   2  -7.329   1.429   4.831
   13    HA   ASN   2           HA       ASN   2  -5.023   3.116   4.524
   14   1HB   ASN   2          2HB       ASN   2  -4.718   2.217   2.059
   15   2HB   ASN   2          1HB       ASN   2  -3.864   1.456   3.398
   16   1HD2  ASN   2          1HD2      ASN   2  -6.928   1.140   1.513
   17   2HD2  ASN   2          2HD2      ASN   2  -7.019  -0.547   1.675
   18    H    ASP   3           H        ASP   3  -7.158   4.301   4.898
   19    HA   ASP   3           HA       ASP   3  -8.791   4.609   2.491
   20   1HB   ASP   3          2HB       ASP   3  -9.020   5.619   5.314
   21   2HB   ASP   3          1HB       ASP   3  -9.992   6.318   4.019
   22    H    ILE   4           H        ILE   4  -6.276   6.302   4.243
   23    HA   ILE   4           HA       ILE   4  -6.648   8.880   3.150
   24    HB   ILE   4           HB       ILE   4  -4.289   9.303   3.740
   25   1HG1  ILE   4          2HG1      ILE   4  -3.417   7.083   5.097
   26   2HG1  ILE   4          1HG1      ILE   4  -4.222   6.346   3.713
   27   1HG2  ILE   4          1HG2      ILE   4  -6.220   9.214   5.432
   28   2HG2  ILE   4          2HG2      ILE   4  -4.585   9.106   6.086
   29   3HG2  ILE   4          3HG2      ILE   4  -5.566   7.650   5.921
   30   1HD1  ILE   4          1HD1      ILE   4  -2.799   7.364   2.170
   31   2HD1  ILE   4          2HD1      ILE   4  -1.700   7.049   3.513
   32   3HD1  ILE   4          3HD1      ILE   4  -2.364   8.665   3.279
   33    H    TYR   5           H        TYR   5  -5.058   6.007   1.897
   34    HA   TYR   5           HA       TYR   5  -3.808   7.323  -0.342
   35   1HB   TYR   5          2HB       TYR   5  -4.473   4.390   0.053
   36   2HB   TYR   5          1HB       TYR   5  -3.425   5.048  -1.201
   37    HD1  TYR   5           HD1      TYR   5  -1.317   6.324  -0.492
   38    HD2  TYR   5           HD2      TYR   5  -3.648   3.940   2.220
   39    HE1  TYR   5           HE1      TYR   5   0.595   6.231   1.071
   40    HE2  TYR   5           HE2      TYR   5  -1.731   3.849   3.787
   41    HH   TYR   5           HH       TYR   5   1.240   4.319   3.080
   42    H    LYS   6           H        LYS   6  -6.862   5.703   0.305
   43    HA   LYS   6           HA       LYS   6  -7.801   5.477  -2.361
   44   1HB   LYS   6          2HB       LYS   6  -8.729   4.454  -0.132
   45   2HB   LYS   6          1HB       LYS   6  -9.672   5.943  -0.064
   46   1HG   LYS   6          2HG       LYS   6 -10.476   5.473  -2.394
   47   2HG   LYS   6          1HG       LYS   6  -9.647   3.918  -2.321
   48   1HD   LYS   6          2HD       LYS   6 -11.699   4.774  -0.269
   49   2HD   LYS   6          1HD       LYS   6 -12.123   3.866  -1.721
   50   1HE   LYS   6          2HE       LYS   6 -10.565   2.072  -1.062
   51   2HE   LYS   6          1HE       LYS   6 -10.125   2.978   0.384
   52   1HZ   LYS   6          1HZ       LYS   6 -12.847   1.987  -0.278
   53   2HZ   LYS   6          2HZ       LYS   6 -12.426   2.865   1.115
   54   3HZ   LYS   6          3HZ       LYS   6 -11.797   1.306   0.867
   55    H    ALA   7           H        ALA   7  -7.621   8.171  -0.149
   56    HA   ALA   7           HA       ALA   7  -9.622   9.867  -1.074
   57   1HB   ALA   7          1HB       ALA   7  -8.458  11.624  -0.051
   58   2HB   ALA   7          2HB       ALA   7  -6.883  10.918  -0.410
   59   3HB   ALA   7          3HB       ALA   7  -7.902  10.209   0.843
   60    H    ALA   8           H        ALA   8  -6.482   9.114  -2.497
   61    HA   ALA   8           HA       ALA   8  -6.638  11.174  -4.522
   62   1HB   ALA   8          1HB       ALA   8  -4.475  10.231  -3.649
   63   2HB   ALA   8          2HB       ALA   8  -4.616  10.203  -5.407
   64   3HB   ALA   8          3HB       ALA   8  -4.865   8.723  -4.479
   65    H    VAL   9           H        VAL   9  -7.175   7.670  -4.360
   66    HA   VAL   9           HA       VAL   9  -7.672   7.229  -7.111
   67    HB   VAL   9           HB       VAL   9  -8.717   5.716  -4.700
   68   1HG1  VAL   9          1HG1      VAL   9  -8.660   5.057  -7.657
   69   2HG1  VAL   9          2HG1      VAL   9 -10.070   5.130  -6.600
   70   3HG1  VAL   9          3HG1      VAL   9  -8.888   3.837  -6.402
   71   1HG2  VAL   9          1HG2      VAL   9  -6.164   5.978  -5.142
   72   2HG2  VAL   9          2HG2      VAL   9  -6.448   4.916  -6.521
   73   3HG2  VAL   9          3HG2      VAL   9  -6.800   4.353  -4.888
   74    H    GLU  10           H        GLU  10  -9.730   8.425  -4.525
   75    HA   GLU  10           HA       GLU  10 -12.172   8.124  -6.042
   76   1HB   GLU  10          2HB       GLU  10 -13.255   9.208  -4.168
   77   2HB   GLU  10          1HB       GLU  10 -12.125   7.999  -3.562
   78   1HG   GLU  10          2HG       GLU  10 -10.576   9.612  -2.852
   79   2HG   GLU  10          1HG       GLU  10 -11.252  10.862  -3.894
   80    H    GLN  11           H        GLN  11  -9.647  10.462  -5.926
   81    HA   GLN  11           HA       GLN  11 -11.402  12.411  -7.295
   82   1HB   GLN  11          2HB       GLN  11 -10.114  14.226  -6.351
   83   2HB   GLN  11          1HB       GLN  11 -10.676  13.186  -5.044
   84   1HG   GLN  11          2HG       GLN  11  -8.387  11.979  -5.315
   85   2HG   GLN  11          1HG       GLN  11  -7.898  13.424  -6.195
   86   1HE2  GLN  11          1HE2      GLN  11  -6.354  13.463  -4.171
   87   2HE2  GLN  11          2HE2      GLN  11  -6.925  14.314  -2.817
   88    H    LEU  12           H        LEU  12  -9.413  10.204  -8.251
   89    HA   LEU  12           HA       LEU  12  -7.367  11.730  -9.628
   90   1HB   LEU  12          2HB       LEU  12  -7.076   9.477 -10.870
   91   2HB   LEU  12          1HB       LEU  12  -6.595   9.602  -9.196
   92    HG   LEU  12           HG       LEU  12  -8.578   8.413  -8.486
   93   1HD1  LEU  12          1HD1      LEU  12  -9.350   8.552 -11.412
   94   2HD1  LEU  12          2HD1      LEU  12 -10.233   9.222 -10.040
   95   3HD1  LEU  12          3HD1      LEU  12 -10.129   7.476 -10.251
   96   1HD2  LEU  12          1HD2      LEU  12  -7.148   7.145 -10.833
   97   2HD2  LEU  12          2HD2      LEU  12  -8.214   6.252  -9.748
   98   3HD2  LEU  12          3HD2      LEU  12  -6.740   6.992  -9.124
   99    H    THR  13           H        THR  13  -7.129  11.227 -12.094
  100    HA   THR  13           HA       THR  13  -9.658  12.053 -13.360
  101    HB   THR  13           HB       THR  13  -7.783  12.256 -15.334
  102    HG1  THR  13           HG1      THR  13  -5.934  12.066 -14.381
  103   1HG2  THR  13          1HG2      THR  13  -8.999  14.089 -13.355
  104   2HG2  THR  13          2HG2      THR  13  -9.000  14.162 -15.117
  105   3HG2  THR  13          3HG2      THR  13  -7.589  14.711 -14.213
  106    H    ASP  14           H        ASP  14  -9.970  11.263 -15.631
  107    HA   ASP  14           HA       ASP  14 -10.067   8.399 -15.649
  108   1HB   ASP  14          2HB       ASP  14 -11.687  10.057 -16.805
  109   2HB   ASP  14          1HB       ASP  14 -10.477  10.125 -18.086
  110    H    GLU  15           H        GLU  15  -7.959  10.851 -17.039
  111    HA   GLU  15           HA       GLU  15  -6.566   9.106 -18.838
  112   1HB   GLU  15          2HB       GLU  15  -6.170  11.876 -17.806
  113   2HB   GLU  15          1HB       GLU  15  -4.764  11.045 -18.471
  114   1HG   GLU  15          2HG       GLU  15  -7.371  11.049 -19.978
  115   2HG   GLU  15          1HG       GLU  15  -6.282  12.432 -20.085
  116    H    GLN  16           H        GLN  16  -6.202  10.000 -15.458
  117    HA   GLN  16           HA       GLN  16  -3.579   8.995 -15.048
  118   1HB   GLN  16          2HB       GLN  16  -5.049  10.492 -13.502
  119   2HB   GLN  16          1HB       GLN  16  -5.711   8.966 -12.923
  120   1HG   GLN  16          2HG       GLN  16  -2.954   8.536 -12.948
  121   2HG   GLN  16          1HG       GLN  16  -3.124  10.190 -12.359
  122   1HE2  GLN  16          1HE2      GLN  16  -4.806   7.026 -11.865
  123   2HE2  GLN  16          2HE2      GLN  16  -4.935   7.202 -10.181
  124    H    LYS  17           H        LYS  17  -6.818   7.575 -14.799
  125    HA   LYS  17           HA       LYS  17  -5.988   5.031 -13.812
  126   1HB   LYS  17          2HB       LYS  17  -8.474   5.799 -15.372
  127   2HB   LYS  17          1HB       LYS  17  -8.228   4.260 -14.548
  128   1HG   LYS  17          2HG       LYS  17  -8.343   5.223 -12.424
  129   2HG   LYS  17          1HG       LYS  17  -7.903   6.825 -13.015
  130   1HD   LYS  17          2HD       LYS  17 -10.060   7.373 -13.360
  131   2HD   LYS  17          1HD       LYS  17 -10.351   5.892 -14.271
  132   1HE   LYS  17          2HE       LYS  17 -10.158   5.851 -11.260
  133   2HE   LYS  17          1HE       LYS  17 -11.678   6.230 -12.069
  134   1HZ   LYS  17          1HZ       LYS  17 -10.072   3.750 -12.372
  135   2HZ   LYS  17          2HZ       LYS  17 -11.442   4.123 -13.306
  136   3HZ   LYS  17          3HZ       LYS  17 -11.589   3.894 -11.629
  137    H    ASN  18           H        ASN  18  -6.564   6.355 -17.057
  138    HA   ASN  18           HA       ASN  18  -6.243   3.957 -18.521
  139   1HB   ASN  18          2HB       ASN  18  -5.950   6.866 -19.212
  140   2HB   ASN  18          1HB       ASN  18  -5.483   5.629 -20.378
  141   1HD2  ASN  18          1HD2      ASN  18  -8.023   7.575 -19.740
  142   2HD2  ASN  18          2HD2      ASN  18  -9.309   6.565 -20.194
  143    H    GLU  19           H        GLU  19  -3.899   6.270 -17.252
  144    HA   GLU  19           HA       GLU  19  -1.611   5.536 -18.670
  145   1HB   GLU  19          2HB       GLU  19  -1.829   7.426 -16.991
  146   2HB   GLU  19          1HB       GLU  19  -1.638   6.214 -15.722
  147   1HG   GLU  19          2HG       GLU  19   0.575   6.830 -16.012
  148   2HG   GLU  19          1HG       GLU  19   0.470   5.516 -17.183
  149    H    PHE  20           H        PHE  20  -2.813   4.221 -15.579
  150    HA   PHE  20           HA       PHE  20  -0.831   2.114 -15.540
  151   1HB   PHE  20          2HB       PHE  20  -3.135   2.898 -13.790
  152   2HB   PHE  20          1HB       PHE  20  -2.425   1.294 -13.627
  153    HD1  PHE  20           HD1      PHE  20  -1.816   4.919 -13.317
  154    HD2  PHE  20           HD2      PHE  20  -0.154   0.995 -12.796
  155    HE1  PHE  20           HE1      PHE  20   0.037   5.879 -11.980
  156    HE2  PHE  20           HE2      PHE  20   1.689   1.946 -11.449
  157    HZ   PHE  20           HZ       PHE  20   1.791   4.393 -11.045
  158    H    LYS  21           H        LYS  21  -4.335   2.341 -16.142
  159    HA   LYS  21           HA       LYS  21  -4.953  -0.357 -16.363
  160   1HB   LYS  21          2HB       LYS  21  -6.556   1.614 -16.447
  161   2HB   LYS  21          1HB       LYS  21  -6.151   1.751 -18.155
  162   1HG   LYS  21          2HG       LYS  21  -8.163   0.390 -17.922
  163   2HG   LYS  21          1HG       LYS  21  -6.835  -0.635 -18.466
  164   1HD   LYS  21          2HD       LYS  21  -6.539  -1.582 -16.303
  165   2HD   LYS  21          1HD       LYS  21  -7.517  -0.331 -15.538
  166   1HE   LYS  21          2HE       LYS  21  -9.495  -1.175 -16.846
  167   2HE   LYS  21          1HE       LYS  21  -8.490  -2.515 -17.398
  168   1HZ   LYS  21          1HZ       LYS  21  -9.764  -3.162 -15.472
  169   2HZ   LYS  21          2HZ       LYS  21  -9.145  -1.859 -14.574
  170   3HZ   LYS  21          3HZ       LYS  21  -8.117  -3.119 -15.071
  171    H    ALA  22           H        ALA  22  -3.474   1.776 -18.781
  172    HA   ALA  22           HA       ALA  22  -3.687   0.138 -21.045
  173   1HB   ALA  22          1HB       ALA  22  -1.357   1.922 -20.292
  174   2HB   ALA  22          2HB       ALA  22  -2.822   2.460 -21.116
  175   3HB   ALA  22          3HB       ALA  22  -1.728   1.327 -21.911
  176    H    ALA  23           H        ALA  23  -1.134   0.265 -18.580
  177    HA   ALA  23           HA       ALA  23   0.340  -1.957 -19.652
  178   1HB   ALA  23          1HB       ALA  23   1.738  -1.736 -17.729
  179   2HB   ALA  23          2HB       ALA  23   0.482  -0.881 -16.831
  180   3HB   ALA  23          3HB       ALA  23   1.286  -0.095 -18.190
  181    H    PHE  24           H        PHE  24  -2.216  -1.471 -17.321
  182    HA   PHE  24           HA       PHE  24  -2.077  -3.939 -15.960
  183   1HB   PHE  24          2HB       PHE  24  -3.427  -1.820 -15.362
  184   2HB   PHE  24          1HB       PHE  24  -4.649  -2.453 -16.464
  185    HD1  PHE  24           HD1      PHE  24  -5.604  -4.767 -16.052
  186    HD2  PHE  24           HD2      PHE  24  -3.142  -2.729 -13.186
  187    HE1  PHE  24           HE1      PHE  24  -6.406  -6.296 -14.272
  188    HE2  PHE  24           HE2      PHE  24  -3.946  -4.253 -11.408
  189    HZ   PHE  24           HZ       PHE  24  -5.581  -6.032 -11.952
  190    H    ASP  25           H        ASP  25  -3.900  -2.955 -18.894
  191    HA   ASP  25           HA       ASP  25  -5.256  -5.475 -19.084
  192   1HB   ASP  25          2HB       ASP  25  -6.012  -4.734 -21.286
  193   2HB   ASP  25          1HB       ASP  25  -6.244  -3.480 -20.078
  194    H    ILE  26           H        ILE  26  -2.169  -4.332 -20.289
  195    HA   ILE  26           HA       ILE  26  -1.896  -6.480 -22.213
  196    HB   ILE  26           HB       ILE  26   0.475  -5.719 -22.393
  197   1HG1  ILE  26          2HG1      ILE  26  -0.386  -3.592 -20.406
  198   2HG1  ILE  26          1HG1      ILE  26   0.669  -4.946 -20.011
  199   1HG2  ILE  26          1HG2      ILE  26  -1.388  -3.347 -22.493
  200   2HG2  ILE  26          2HG2      ILE  26  -1.551  -4.696 -23.617
  201   3HG2  ILE  26          3HG2      ILE  26  -0.064  -3.748 -23.587
  202   1HD1  ILE  26          1HD1      ILE  26   1.869  -2.788 -20.565
  203   2HD1  ILE  26          2HD1      ILE  26   1.273  -2.963 -22.216
  204   3HD1  ILE  26          3HD1      ILE  26   2.358  -4.176 -21.536
  205    H    PHE  27           H        PHE  27  -0.869  -5.878 -18.886
  206    HA   PHE  27           HA       PHE  27   0.803  -8.222 -18.753
  207   1HB   PHE  27          2HB       PHE  27  -0.282  -6.431 -16.567
  208   2HB   PHE  27          1HB       PHE  27   0.872  -7.739 -16.308
  209    HD1  PHE  27           HD1      PHE  27   2.462  -7.435 -18.883
  210    HD2  PHE  27           HD2      PHE  27   1.087  -4.538 -16.020
  211    HE1  PHE  27           HE1      PHE  27   4.300  -5.915 -19.541
  212    HE2  PHE  27           HE2      PHE  27   2.930  -3.017 -16.691
  213    HZ   PHE  27           HZ       PHE  27   4.534  -3.706 -18.446
  214    H    ILE  28           H        ILE  28  -2.522  -7.428 -17.755
  215    HA   ILE  28           HA       ILE  28  -2.890 -10.158 -16.740
  216    HB   ILE  28           HB       ILE  28  -5.009  -9.450 -15.886
  217   1HG1  ILE  28          2HG1      ILE  28  -5.412  -6.797 -16.461
  218   2HG1  ILE  28          1HG1      ILE  28  -4.746  -7.385 -17.984
  219   1HG2  ILE  28          1HG2      ILE  28  -4.380  -7.526 -14.491
  220   2HG2  ILE  28          2HG2      ILE  28  -3.028  -7.179 -15.568
  221   3HG2  ILE  28          3HG2      ILE  28  -3.041  -8.667 -14.623
  222   1HD1  ILE  28          1HD1      ILE  28  -7.362  -7.555 -17.428
  223   2HD1  ILE  28          2HD1      ILE  28  -6.836  -9.062 -16.678
  224   3HD1  ILE  28          3HD1      ILE  28  -6.531  -8.777 -18.391
  225    H    GLN  29           H        GLN  29  -2.724  -9.071 -19.733
  226    HA   GLN  29           HA       GLN  29  -5.055  -9.486 -21.128
  227   1HB   GLN  29          2HB       GLN  29  -2.976  -8.790 -22.209
  228   2HB   GLN  29          1HB       GLN  29  -2.267 -10.378 -21.910
  229   1HG   GLN  29          2HG       GLN  29  -3.842 -11.449 -23.373
  230   2HG   GLN  29          1HG       GLN  29  -4.804  -9.975 -23.512
  231   1HE2  GLN  29          1HE2      GLN  29  -3.461  -8.008 -24.426
  232   2HE2  GLN  29          2HE2      GLN  29  -2.388  -8.368 -25.691
  233    H    ASP  30           H        ASP  30  -2.818 -11.948 -19.910
  234    HA   ASP  30           HA       ASP  30  -4.721 -14.058 -20.736
  235   1HB   ASP  30          2HB       ASP  30  -2.805 -15.623 -20.478
  236   2HB   ASP  30          1HB       ASP  30  -2.508 -14.377 -21.686
  237    H    ALA  31           H        ALA  31  -4.867 -12.327 -18.284
  238    HA   ALA  31           HA       ALA  31  -4.471 -14.310 -16.147
  239   1HB   ALA  31          1HB       ALA  31  -3.627 -11.950 -15.855
  240   2HB   ALA  31          2HB       ALA  31  -4.731 -12.500 -14.594
  241   3HB   ALA  31          3HB       ALA  31  -5.309 -11.419 -15.863
  242    H    GLU  32           H        GLU  32  -6.149 -14.850 -14.725
  243    HA   GLU  32           HA       GLU  32  -8.883 -14.287 -15.717
  244   1HB   GLU  32          2HB       GLU  32  -7.806 -16.892 -14.601
  245   2HB   GLU  32          1HB       GLU  32  -9.506 -16.576 -14.947
  246   1HG   GLU  32          2HG       GLU  32  -8.773 -15.998 -17.327
  247   2HG   GLU  32          1HG       GLU  32  -7.207 -16.694 -16.910
  248    H    ASP  33           H        ASP  33  -7.666 -12.677 -13.832
  249    HA   ASP  33           HA       ASP  33  -9.325 -13.224 -11.468
  250   1HB   ASP  33          2HB       ASP  33  -6.846 -13.988 -11.180
  251   2HB   ASP  33          1HB       ASP  33  -6.514 -12.261 -11.049
  252    H    GLY  34           H        GLY  34  -7.072 -10.920 -12.990
  253   1HA   GLY  34          2HA       GLY  34  -7.855  -8.713 -13.649
  254   2HA   GLY  34          1HA       GLY  34  -8.911  -8.724 -12.239
  255    H    CYS  35           H        CYS  35  -5.492  -9.632 -12.530
  256    HA   CYS  35           HA       CYS  35  -4.545  -7.262 -11.166
  257   1HB   CYS  35          2HB       CYS  35  -3.552  -8.595  -9.266
  258   2HB   CYS  35          1HB       CYS  35  -5.303  -8.412  -9.205
  259    HG   CYS  35           HG       CYS  35  -3.850 -11.047 -10.054
  260    H    ILE  36           H        ILE  36  -2.334  -6.983 -11.369
  261    HA   ILE  36           HA       ILE  36  -1.013  -8.792 -13.259
  262    HB   ILE  36           HB       ILE  36   0.704  -7.087 -13.457
  263   1HG1  ILE  36          2HG1      ILE  36  -0.078  -4.890 -11.997
  264   2HG1  ILE  36          1HG1      ILE  36  -0.438  -6.206 -10.879
  265   1HG2  ILE  36          1HG2      ILE  36  -1.249  -6.652 -14.793
  266   2HG2  ILE  36          2HG2      ILE  36  -0.737  -5.113 -14.103
  267   3HG2  ILE  36          3HG2      ILE  36  -2.112  -5.973 -13.414
  268   1HD1  ILE  36          1HD1      ILE  36   1.763  -6.740 -10.590
  269   2HD1  ILE  36          2HD1      ILE  36   2.029  -5.082 -11.132
  270   3HD1  ILE  36          3HD1      ILE  36   2.164  -6.416 -12.279
  271    H    SER  37           H        SER  37   1.522  -8.975 -12.722
  272    HA   SER  37           HA       SER  37   1.606 -10.333 -10.127
  273   1HB   SER  37          2HB       SER  37   2.594 -11.082 -12.551
  274   2HB   SER  37          1HB       SER  37   4.022 -10.350 -11.826
  275    HG   SER  37           HG       SER  37   2.482 -12.544 -10.973
  276    H    THR  38           H        THR  38   2.362  -9.321  -8.390
  277    HA   THR  38           HA       THR  38   3.454  -6.757  -8.302
  278    HB   THR  38           HB       THR  38   4.265  -7.335  -6.027
  279    HG1  THR  38           HG1      THR  38   4.437  -9.353  -5.422
  280   1HG2  THR  38          1HG2      THR  38   2.027  -6.705  -5.971
  281   2HG2  THR  38          2HG2      THR  38   1.950  -8.318  -5.262
  282   3HG2  THR  38          3HG2      THR  38   1.514  -8.077  -6.953
  283    H    LYS  39           H        LYS  39   5.027  -9.890  -8.652
  284    HA   LYS  39           HA       LYS  39   7.716  -9.011  -8.359
  285   1HB   LYS  39          2HB       LYS  39   8.284 -11.130  -9.579
  286   2HB   LYS  39          1HB       LYS  39   7.227 -11.372  -8.189
  287   1HG   LYS  39          2HG       LYS  39   5.285 -11.573  -9.600
  288   2HG   LYS  39          1HG       LYS  39   6.192 -11.059 -11.021
  289   1HD   LYS  39          2HD       LYS  39   7.194 -13.437  -9.525
  290   2HD   LYS  39          1HD       LYS  39   5.744 -13.638 -10.506
  291   1HE   LYS  39          2HE       LYS  39   7.455 -12.172 -12.147
  292   2HE   LYS  39          1HE       LYS  39   8.522 -13.330 -11.356
  293   1HZ   LYS  39          1HZ       LYS  39   7.589 -14.251 -13.375
  294   2HZ   LYS  39          2HZ       LYS  39   6.012 -13.984 -12.806
  295   3HZ   LYS  39          3HZ       LYS  39   7.021 -15.108 -12.026
  296    H    GLU  40           H        GLU  40   5.472  -9.044 -11.070
  297    HA   GLU  40           HA       GLU  40   7.536  -8.355 -13.003
  298   1HB   GLU  40          2HB       GLU  40   5.938  -8.689 -14.664
  299   2HB   GLU  40          1HB       GLU  40   5.416  -9.818 -13.421
  300   1HG   GLU  40          2HG       GLU  40   3.458  -8.735 -13.129
  301   2HG   GLU  40          1HG       GLU  40   4.246  -7.164 -13.043
  302    H    LEU  41           H        LEU  41   6.475  -6.528 -10.648
  303    HA   LEU  41           HA       LEU  41   5.211  -4.276 -11.689
  304   1HB   LEU  41          2HB       LEU  41   6.362  -4.962  -9.257
  305   2HB   LEU  41          1HB       LEU  41   7.303  -3.587  -9.786
  306    HG   LEU  41           HG       LEU  41   5.413  -2.949  -8.321
  307   1HD1  LEU  41          1HD1      LEU  41   4.358  -1.302 -10.013
  308   2HD1  LEU  41          2HD1      LEU  41   5.444  -2.030 -11.195
  309   3HD1  LEU  41          3HD1      LEU  41   6.104  -1.220  -9.775
  310   1HD2  LEU  41          1HD2      LEU  41   3.637  -3.843 -10.611
  311   2HD2  LEU  41          2HD2      LEU  41   3.126  -3.223  -9.041
  312   3HD2  LEU  41          3HD2      LEU  41   3.896  -4.806  -9.156
  313    H    GLY  42           H        GLY  42   8.599  -5.252 -11.891
  314   1HA   GLY  42          2HA       GLY  42   9.752  -2.829 -12.724
  315   2HA   GLY  42          1HA       GLY  42  10.357  -4.431 -13.135
  316    H    LYS  43           H        LYS  43   7.900  -5.252 -14.497
  317    HA   LYS  43           HA       LYS  43   8.489  -4.267 -17.122
  318   1HB   LYS  43          2HB       LYS  43   6.154  -5.947 -16.172
  319   2HB   LYS  43          1HB       LYS  43   6.610  -5.682 -17.854
  320   1HG   LYS  43          2HG       LYS  43   8.433  -6.928 -15.774
  321   2HG   LYS  43          1HG       LYS  43   7.462  -7.851 -16.921
  322   1HD   LYS  43          2HD       LYS  43   8.607  -6.631 -18.788
  323   2HD   LYS  43          1HD       LYS  43   9.656  -5.870 -17.594
  324   1HE   LYS  43          2HE       LYS  43   9.372  -8.870 -17.728
  325   2HE   LYS  43          1HE       LYS  43  10.521  -8.018 -18.757
  326   1HZ   LYS  43          1HZ       LYS  43  10.421  -7.984 -15.789
  327   2HZ   LYS  43          2HZ       LYS  43  11.444  -6.995 -16.719
  328   3HZ   LYS  43          3HZ       LYS  43  11.621  -8.685 -16.761
  329    H    VAL  44           H        VAL  44   6.133  -3.437 -14.661
  330    HA   VAL  44           HA       VAL  44   4.586  -1.807 -16.532
  331    HB   VAL  44           HB       VAL  44   2.878  -1.855 -15.045
  332   1HG1  VAL  44          1HG1      VAL  44   4.353  -3.824 -13.339
  333   2HG1  VAL  44          2HG1      VAL  44   4.051  -4.221 -15.029
  334   3HG1  VAL  44          3HG1      VAL  44   2.699  -3.885 -13.949
  335   1HG2  VAL  44          1HG2      VAL  44   3.576  -0.319 -13.422
  336   2HG2  VAL  44          2HG2      VAL  44   4.984  -1.283 -12.971
  337   3HG2  VAL  44          3HG2      VAL  44   3.374  -1.790 -12.474
  338    H    MET  45           H        MET  45   6.869  -1.456 -13.874
  339    HA   MET  45           HA       MET  45   6.666   1.354 -13.565
  340   1HB   MET  45          2HB       MET  45   8.016  -0.622 -12.238
  341   2HB   MET  45          1HB       MET  45   9.329   0.181 -13.099
  342   1HG   MET  45          2HG       MET  45   9.212   1.470 -11.164
  343   2HG   MET  45          1HG       MET  45   8.149   2.377 -12.238
  344   1HE   MET  45          1HE       MET  45   8.183   0.749  -8.586
  345   2HE   MET  45          2HE       MET  45   7.115   2.133  -8.371
  346   3HE   MET  45          3HE       MET  45   8.603   2.314  -9.297
  347    H    ARG  46           H        ARG  46   8.712  -0.713 -15.616
  348    HA   ARG  46           HA       ARG  46  10.351   1.340 -16.667
  349   1HB   ARG  46          2HB       ARG  46  10.902  -0.201 -18.465
  350   2HB   ARG  46          1HB       ARG  46  10.841  -1.085 -16.941
  351   1HG   ARG  46          2HG       ARG  46   8.494  -1.765 -17.486
  352   2HG   ARG  46          1HG       ARG  46   8.674  -0.993 -19.060
  353   1HD   ARG  46          2HD       ARG  46  10.446  -3.221 -18.021
  354   2HD   ARG  46          1HD       ARG  46   9.108  -3.447 -19.135
  355    HE   ARG  46           HE       ARG  46  10.362  -2.350 -20.827
  356   1HH1  ARG  46          2HH1      ARG  46  12.092  -2.580 -17.791
  357   2HH1  ARG  46          1HH1      ARG  46  13.624  -2.210 -18.499
  358   1HH2  ARG  46          1HH2      ARG  46  12.386  -1.865 -21.721
  359   2HH2  ARG  46          2HH2      ARG  46  13.793  -1.806 -20.712
  360    H    MET  47           H        MET  47   7.141   0.182 -17.554
  361    HA   MET  47           HA       MET  47   6.942   1.735 -19.970
  362   1HB   MET  47          2HB       MET  47   4.869   0.338 -18.261
  363   2HB   MET  47          1HB       MET  47   4.479   1.200 -19.749
  364   1HG   MET  47          2HG       MET  47   6.532  -1.024 -19.605
  365   2HG   MET  47          1HG       MET  47   4.843  -1.290 -20.037
  366   1HE   MET  47          1HE       MET  47   7.859  -1.589 -21.560
  367   2HE   MET  47          2HE       MET  47   8.281   0.024 -20.990
  368   3HE   MET  47          3HE       MET  47   8.187  -0.294 -22.719
  369    H    LEU  48           H        LEU  48   6.200   2.202 -16.570
  370    HA   LEU  48           HA       LEU  48   4.622   4.577 -16.859
  371   1HB   LEU  48          2HB       LEU  48   5.928   3.106 -14.633
  372   2HB   LEU  48          1HB       LEU  48   5.591   4.801 -14.366
  373    HG   LEU  48           HG       LEU  48   3.262   4.473 -14.469
  374   1HD1  LEU  48          1HD1      LEU  48   2.780   1.782 -15.080
  375   2HD1  LEU  48          2HD1      LEU  48   3.986   2.291 -16.261
  376   3HD1  LEU  48          3HD1      LEU  48   2.462   3.164 -16.127
  377   1HD2  LEU  48          1HD2      LEU  48   3.158   2.047 -13.179
  378   2HD2  LEU  48          2HD2      LEU  48   3.578   3.576 -12.404
  379   3HD2  LEU  48          3HD2      LEU  48   4.852   2.494 -12.966
  380    H    GLY  49           H        GLY  49   8.049   3.871 -16.606
  381   1HA   GLY  49          2HA       GLY  49   9.530   5.548 -17.681
  382   2HA   GLY  49          1HA       GLY  49   8.646   6.769 -16.777
  383    H    GLN  50           H        GLN  50   9.295   3.798 -15.096
  384    HA   GLN  50           HA       GLN  50  11.662   4.984 -13.776
  385   1HB   GLN  50          2HB       GLN  50   9.621   3.463 -12.174
  386   2HB   GLN  50          1HB       GLN  50  10.855   4.587 -11.613
  387   1HG   GLN  50          2HG       GLN  50   8.504   5.439 -13.327
  388   2HG   GLN  50          1HG       GLN  50   8.477   5.480 -11.565
  389   1HE2  GLN  50          1HE2      GLN  50   8.583   7.692 -13.773
  390   2HE2  GLN  50          2HE2      GLN  50   9.832   8.709 -13.236
  391    H    ASN  51           H        ASN  51  12.802   3.291 -12.380
  392    HA   ASN  51           HA       ASN  51  12.396   0.521 -13.144
  393   1HB   ASN  51          2HB       ASN  51  13.752   1.663 -15.022
  394   2HB   ASN  51          1HB       ASN  51  15.072   1.710 -13.855
  395   1HD2  ASN  51          1HD2      ASN  51  16.427  -0.070 -14.081
  396   2HD2  ASN  51          2HD2      ASN  51  15.925  -1.626 -14.537
  397    HA   PRO  52           HA       PRO  52  14.385   1.045  -9.022
  398   1HB   PRO  52          2HB       PRO  52  12.442  -0.257  -7.608
  399   2HB   PRO  52          1HB       PRO  52  12.373   1.466  -8.005
  400   1HG   PRO  52          2HG       PRO  52  10.834  -0.785  -9.136
  401   2HG   PRO  52          1HG       PRO  52  10.419   0.933  -9.048
  402   1HD   PRO  52          2HD       PRO  52  11.404  -0.474 -11.329
  403   2HD   PRO  52          1HD       PRO  52  11.167   1.283 -11.177
  404    H    THR  53           H        THR  53  14.089  -1.056  -7.201
  405    HA   THR  53           HA       THR  53  15.283  -3.337  -8.663
  406    HB   THR  53           HB       THR  53  16.649  -3.760  -6.811
  407    HG1  THR  53           HG1      THR  53  16.039  -3.421  -4.798
  408   1HG2  THR  53          1HG2      THR  53  17.240  -1.583  -7.815
  409   2HG2  THR  53          2HG2      THR  53  17.615  -1.629  -6.092
  410   3HG2  THR  53          3HG2      THR  53  16.180  -0.775  -6.660
  411    HA   PRO  54           HA       PRO  54  12.053  -5.984  -7.221
  412   1HB   PRO  54          2HB       PRO  54  13.335  -8.195  -6.229
  413   2HB   PRO  54          1HB       PRO  54  13.191  -7.824  -7.954
  414   1HG   PRO  54          2HG       PRO  54  15.540  -7.545  -6.157
  415   2HG   PRO  54          1HG       PRO  54  15.480  -7.882  -7.893
  416   1HD   PRO  54          2HD       PRO  54  16.074  -5.401  -6.742
  417   2HD   PRO  54          1HD       PRO  54  15.589  -5.656  -8.434
  418    H    GLU  55           H        GLU  55  14.551  -5.289  -4.854
  419    HA   GLU  55           HA       GLU  55  12.952  -6.094  -2.568
  420   1HB   GLU  55          2HB       GLU  55  15.544  -4.529  -2.744
  421   2HB   GLU  55          1HB       GLU  55  14.792  -5.074  -1.244
  422   1HG   GLU  55          2HG       GLU  55  14.828  -7.425  -2.512
  423   2HG   GLU  55          1HG       GLU  55  16.174  -6.668  -3.361
  424    H    GLU  56           H        GLU  56  13.740  -3.150  -4.344
  425    HA   GLU  56           HA       GLU  56  12.622  -1.310  -2.460
  426   1HB   GLU  56          2HB       GLU  56  14.285  -0.803  -4.355
  427   2HB   GLU  56          1HB       GLU  56  12.885  -0.814  -5.425
  428   1HG   GLU  56          2HG       GLU  56  12.035   0.767  -3.313
  429   2HG   GLU  56          1HG       GLU  56  13.731   1.216  -3.486
  430    H    LEU  57           H        LEU  57  11.411  -2.732  -5.518
  431    HA   LEU  57           HA       LEU  57   8.881  -1.463  -5.438
  432   1HB   LEU  57          2HB       LEU  57   8.224  -2.932  -7.170
  433   2HB   LEU  57          1HB       LEU  57   9.898  -2.528  -7.450
  434    HG   LEU  57           HG       LEU  57  10.316  -4.816  -6.171
  435   1HD1  LEU  57          1HD1      LEU  57   8.283  -5.709  -5.600
  436   2HD1  LEU  57          2HD1      LEU  57   8.312  -6.281  -7.269
  437   3HD1  LEU  57          3HD1      LEU  57   7.423  -4.815  -6.855
  438   1HD2  LEU  57          1HD2      LEU  57   9.316  -4.661  -9.034
  439   2HD2  LEU  57          2HD2      LEU  57  10.354  -5.922  -8.369
  440   3HD2  LEU  57          3HD2      LEU  57  10.953  -4.269  -8.508
  441    H    GLN  58           H        GLN  58  10.095  -4.428  -3.959
  442    HA   GLN  58           HA       GLN  58   7.613  -5.610  -3.316
  443   1HB   GLN  58          2HB       GLN  58   9.919  -6.678  -3.129
  444   2HB   GLN  58          1HB       GLN  58  10.092  -5.811  -1.603
  445   1HG   GLN  58          2HG       GLN  58   9.240  -8.038  -1.130
  446   2HG   GLN  58          1HG       GLN  58   7.956  -6.872  -0.823
  447   1HE2  GLN  58          1HE2      GLN  58   6.016  -7.100  -2.026
  448   2HE2  GLN  58          2HE2      GLN  58   5.812  -8.229  -3.278
  449    H    GLU  59           H        GLU  59   9.414  -2.993  -1.800
  450    HA   GLU  59           HA       GLU  59   8.051  -2.997   0.699
  451   1HB   GLU  59          2HB       GLU  59   9.754  -1.039  -0.783
  452   2HB   GLU  59          1HB       GLU  59   8.765  -0.441   0.549
  453   1HG   GLU  59          2HG       GLU  59  10.566  -2.856   0.829
  454   2HG   GLU  59          1HG       GLU  59  11.122  -1.218   1.169
  455    H    MET  60           H        MET  60   7.557  -1.032  -2.263
  456    HA   MET  60           HA       MET  60   5.274   0.321  -1.264
  457   1HB   MET  60          2HB       MET  60   4.787   0.877  -3.641
  458   2HB   MET  60          1HB       MET  60   6.447   1.238  -3.177
  459   1HG   MET  60          2HG       MET  60   7.228  -0.821  -4.231
  460   2HG   MET  60          1HG       MET  60   5.570  -1.284  -4.615
  461   1HE   MET  60          1HE       MET  60   8.083   1.411  -4.646
  462   2HE   MET  60          2HE       MET  60   7.976   2.244  -6.194
  463   3HE   MET  60          3HE       MET  60   8.726   0.652  -6.109
  464    H    ILE  61           H        ILE  61   5.705  -2.748  -2.914
  465    HA   ILE  61           HA       ILE  61   2.958  -3.263  -3.470
  466    HB   ILE  61           HB       ILE  61   5.317  -5.123  -3.084
  467   1HG1  ILE  61          2HG1      ILE  61   5.432  -3.638  -5.050
  468   2HG1  ILE  61          1HG1      ILE  61   5.182  -5.310  -5.546
  469   1HG2  ILE  61          1HG2      ILE  61   3.328  -6.391  -2.565
  470   2HG2  ILE  61          2HG2      ILE  61   3.825  -6.823  -4.200
  471   3HG2  ILE  61          3HG2      ILE  61   2.475  -5.717  -3.952
  472   1HD1  ILE  61          1HD1      ILE  61   3.654  -4.031  -6.852
  473   2HD1  ILE  61          2HD1      ILE  61   3.156  -3.069  -5.461
  474   3HD1  ILE  61          3HD1      ILE  61   2.675  -4.760  -5.579
  475    H    ASP  62           H        ASP  62   5.101  -4.062  -0.750
  476    HA   ASP  62           HA       ASP  62   3.298  -5.609   0.756
  477   1HB   ASP  62          2HB       ASP  62   5.841  -5.132   1.129
  478   2HB   ASP  62          1HB       ASP  62   5.266  -3.762   2.081
  479    H    GLU  63           H        GLU  63   3.768  -2.092   0.571
  480    HA   GLU  63           HA       GLU  63   1.901  -1.527   2.710
  481   1HB   GLU  63          2HB       GLU  63   3.614   0.042   0.876
  482   2HB   GLU  63          1HB       GLU  63   2.124   0.833   1.387
  483   1HG   GLU  63          2HG       GLU  63   2.821   0.027   3.780
  484   2HG   GLU  63          1HG       GLU  63   4.429  -0.117   3.069
  485    H    VAL  64           H        VAL  64   1.891  -1.017  -0.815
  486    HA   VAL  64           HA       VAL  64  -0.738  -0.077  -1.072
  487    HB   VAL  64           HB       VAL  64   1.000  -1.590  -3.035
  488   1HG1  VAL  64          1HG1      VAL  64  -1.744  -0.545  -3.212
  489   2HG1  VAL  64          2HG1      VAL  64  -0.910  -1.708  -4.241
  490   3HG1  VAL  64          3HG1      VAL  64  -0.678   0.023  -4.499
  491   1HG2  VAL  64          1HG2      VAL  64   0.432   1.372  -2.956
  492   2HG2  VAL  64          2HG2      VAL  64   1.759   0.525  -3.752
  493   3HG2  VAL  64          3HG2      VAL  64   1.732   0.664  -1.993
  494    H    ASP  65           H        ASP  65   0.490  -3.327  -1.851
  495    HA   ASP  65           HA       ASP  65  -2.047  -4.535  -2.189
  496   1HB   ASP  65          2HB       ASP  65   0.541  -5.347  -2.591
  497   2HB   ASP  65          1HB       ASP  65   0.090  -6.304  -1.183
  498    H    GLU  66           H        GLU  66  -3.455  -4.119  -0.529
  499    HA   GLU  66           HA       GLU  66  -2.830  -4.288   2.230
  500   1HB   GLU  66          2HB       GLU  66  -5.280  -4.302   2.593
  501   2HB   GLU  66          1HB       GLU  66  -4.778  -3.037   1.476
  502   1HG   GLU  66          2HG       GLU  66  -5.352  -4.592  -0.424
  503   2HG   GLU  66          1HG       GLU  66  -6.028  -5.706   0.765
  504    H    ASP  67           H        ASP  67  -4.131  -6.665  -0.055
  505    HA   ASP  67           HA       ASP  67  -4.464  -8.666   2.021
  506   1HB   ASP  67          2HB       ASP  67  -4.948 -10.194   0.036
  507   2HB   ASP  67          1HB       ASP  67  -6.063  -8.854   0.286
  508    H    GLY  68           H        GLY  68  -2.164  -7.937  -0.556
  509   1HA   GLY  68          2HA       GLY  68   0.040  -8.572  -0.798
  510   2HA   GLY  68          1HA       GLY  68  -0.065  -9.369   0.769
  511    H    SER  69           H        SER  69  -1.853  -9.849  -2.271
  512    HA   SER  69           HA       SER  69  -1.483 -12.732  -2.051
  513   1HB   SER  69          2HB       SER  69  -2.994 -12.835  -4.012
  514   2HB   SER  69          1HB       SER  69  -3.688 -11.915  -2.681
  515    HG   SER  69           HG       SER  69  -2.736 -11.065  -5.167
  516    H    GLY  70           H        GLY  70   0.501 -10.388  -3.190
  517   1HA   GLY  70          2HA       GLY  70   2.397 -10.530  -4.505
  518   2HA   GLY  70          1HA       GLY  70   1.958 -12.191  -4.895
  519    H    THR  71           H        THR  71  -0.476  -9.774  -5.328
  520    HA   THR  71           HA       THR  71   0.127  -9.425  -8.171
  521    HB   THR  71           HB       THR  71  -2.062 -10.161  -8.895
  522    HG1  THR  71           HG1      THR  71  -3.446  -9.779  -7.305
  523   1HG2  THR  71          1HG2      THR  71  -0.836 -12.198  -7.012
  524   2HG2  THR  71          2HG2      THR  71  -0.317 -11.896  -8.671
  525   3HG2  THR  71          3HG2      THR  71  -1.921 -12.561  -8.356
  526    H    VAL  72           H        VAL  72  -0.262  -7.392  -8.783
  527    HA   VAL  72           HA       VAL  72  -1.621  -5.594  -6.922
  528    HB   VAL  72           HB       VAL  72  -0.423  -4.824  -9.578
  529   1HG1  VAL  72          1HG1      VAL  72  -1.866  -3.184  -8.395
  530   2HG1  VAL  72          2HG1      VAL  72  -0.191  -2.643  -8.483
  531   3HG1  VAL  72          3HG1      VAL  72  -0.823  -3.313  -6.979
  532   1HG2  VAL  72          1HG2      VAL  72   0.935  -5.202  -6.895
  533   2HG2  VAL  72          2HG2      VAL  72   1.622  -4.230  -8.198
  534   3HG2  VAL  72          3HG2      VAL  72   1.363  -5.961  -8.430
  535    H    ASP  73           H        ASP  73  -3.714  -5.245  -7.072
  536    HA   ASP  73           HA       ASP  73  -5.209  -5.877  -9.488
  537   1HB   ASP  73          2HB       ASP  73  -6.054  -4.729  -6.809
  538   2HB   ASP  73          1HB       ASP  73  -7.169  -5.068  -8.132
  539    H    PHE  74           H        PHE  74  -6.771  -4.152 -10.360
  540    HA   PHE  74           HA       PHE  74  -5.308  -1.946 -11.269
  541   1HB   PHE  74          2HB       PHE  74  -7.424  -2.863 -12.315
  542   2HB   PHE  74          1HB       PHE  74  -8.321  -1.972 -11.084
  543    HD1  PHE  74           HD1      PHE  74  -5.226  -1.163 -13.036
  544    HD2  PHE  74           HD2      PHE  74  -9.270  -0.079 -12.080
  545    HE1  PHE  74           HE1      PHE  74  -4.987   0.906 -14.371
  546    HE2  PHE  74           HE2      PHE  74  -9.030   1.994 -13.417
  547    HZ   PHE  74           HZ       PHE  74  -6.888   2.489 -14.562
  548    H    ASP  75           H        ASP  75  -7.478  -2.244  -8.482
  549    HA   ASP  75           HA       ASP  75  -7.556   0.524  -7.816
  550   1HB   ASP  75          2HB       ASP  75  -9.103  -1.244  -6.884
  551   2HB   ASP  75          1HB       ASP  75  -7.762  -1.801  -5.884
  552    H    GLU  76           H        GLU  76  -5.447  -2.162  -6.851
  553    HA   GLU  76           HA       GLU  76  -3.817  -0.625  -5.062
  554   1HB   GLU  76          2HB       GLU  76  -3.145  -3.216  -6.483
  555   2HB   GLU  76          1HB       GLU  76  -2.333  -2.559  -5.063
  556   1HG   GLU  76          2HG       GLU  76  -4.304  -2.850  -3.705
  557   2HG   GLU  76          1HG       GLU  76  -5.285  -3.246  -5.113
  558    H    PHE  77           H        PHE  77  -3.874  -1.172  -8.496
  559    HA   PHE  77           HA       PHE  77  -1.178  -0.543  -9.117
  560   1HB   PHE  77          2HB       PHE  77  -3.210  -1.561 -10.541
  561   2HB   PHE  77          1HB       PHE  77  -3.358   0.115 -11.043
  562    HD1  PHE  77           HD1      PHE  77  -2.858  -0.755 -13.336
  563    HD2  PHE  77           HD2      PHE  77   0.024  -0.950 -10.141
  564    HE1  PHE  77           HE1      PHE  77  -1.036  -1.108 -14.979
  565    HE2  PHE  77           HE2      PHE  77   1.828  -1.288 -11.791
  566    HZ   PHE  77           HZ       PHE  77   1.304  -1.372 -14.212
  567    H    LEU  78           H        LEU  78  -4.163   1.406  -9.310
  568    HA   LEU  78           HA       LEU  78  -2.874   3.841 -10.006
  569   1HB   LEU  78          2HB       LEU  78  -5.503   3.597  -8.563
  570   2HB   LEU  78          1HB       LEU  78  -4.972   4.896  -9.616
  571    HG   LEU  78           HG       LEU  78  -5.909   2.128 -10.355
  572   1HD1  LEU  78          1HD1      LEU  78  -7.355   3.470 -11.888
  573   2HD1  LEU  78          2HD1      LEU  78  -6.659   4.939 -11.200
  574   3HD1  LEU  78          3HD1      LEU  78  -7.612   3.854 -10.186
  575   1HD2  LEU  78          1HD2      LEU  78  -4.074   3.973 -11.846
  576   2HD2  LEU  78          2HD2      LEU  78  -5.280   3.062 -12.756
  577   3HD2  LEU  78          3HD2      LEU  78  -4.078   2.210 -11.785
  578    H    VAL  79           H        VAL  79  -3.811   2.394  -6.914
  579    HA   VAL  79           HA       VAL  79  -3.249   4.671  -5.305
  580    HB   VAL  79           HB       VAL  79  -4.393   2.212  -4.851
  581   1HG1  VAL  79          1HG1      VAL  79  -2.262   1.074  -4.579
  582   2HG1  VAL  79          2HG1      VAL  79  -3.076   1.179  -3.020
  583   3HG1  VAL  79          3HG1      VAL  79  -1.742   2.270  -3.394
  584   1HG2  VAL  79          1HG2      VAL  79  -4.475   3.003  -2.452
  585   2HG2  VAL  79          2HG2      VAL  79  -4.969   4.212  -3.637
  586   3HG2  VAL  79          3HG2      VAL  79  -3.364   4.294  -2.909
  587    H    MET  80           H        MET  80  -1.354   1.854  -6.297
  588    HA   MET  80           HA       MET  80   0.976   2.106  -4.870
  589   1HB   MET  80          2HB       MET  80   0.198   0.695  -7.129
  590   2HB   MET  80          1HB       MET  80   1.529   1.691  -7.711
  591   1HG   MET  80          2HG       MET  80   2.795   0.901  -5.605
  592   2HG   MET  80          1HG       MET  80   1.545  -0.336  -5.477
  593   1HE   MET  80          1HE       MET  80   3.195   1.059  -9.048
  594   2HE   MET  80          2HE       MET  80   4.740   0.336  -8.606
  595   3HE   MET  80          3HE       MET  80   3.968   1.483  -7.515
  596    H    MET  81           H        MET  81  -0.088   4.078  -7.610
  597    HA   MET  81           HA       MET  81   2.378   5.440  -8.034
  598   1HB   MET  81          2HB       MET  81   0.319   5.296  -9.583
  599   2HB   MET  81          1HB       MET  81  -0.329   6.622  -8.619
  600   1HG   MET  81          2HG       MET  81   2.378   7.263  -9.251
  601   2HG   MET  81          1HG       MET  81   1.593   6.745 -10.741
  602   1HE   MET  81          1HE       MET  81  -0.901   7.039 -10.721
  603   2HE   MET  81          2HE       MET  81  -1.230   8.618 -11.427
  604   3HE   MET  81          3HE       MET  81  -1.783   8.260  -9.794
  605    H    VAL  82           H        VAL  82  -0.640   6.550  -6.460
  606    HA   VAL  82           HA       VAL  82   0.473   8.951  -5.443
  607    HB   VAL  82           HB       VAL  82  -1.511   9.000  -3.935
  608   1HG1  VAL  82          1HG1      VAL  82  -3.188   8.747  -5.958
  609   2HG1  VAL  82          2HG1      VAL  82  -1.708   8.522  -6.890
  610   3HG1  VAL  82          3HG1      VAL  82  -1.960  10.012  -5.981
  611   1HG2  VAL  82          1HG2      VAL  82  -1.620   6.497  -3.634
  612   2HG2  VAL  82          2HG2      VAL  82  -2.239   6.381  -5.281
  613   3HG2  VAL  82          3HG2      VAL  82  -3.167   7.236  -4.049
  614    H    ARG  83           H        ARG  83   0.440   5.672  -4.206
  615    HA   ARG  83           HA       ARG  83   1.055   6.218  -1.497
  616   1HB   ARG  83          2HB       ARG  83   1.683   3.832  -3.245
  617   2HB   ARG  83          1HB       ARG  83   2.029   3.886  -1.516
  618   1HG   ARG  83          2HG       ARG  83  -0.641   4.775  -1.813
  619   2HG   ARG  83          1HG       ARG  83  -0.477   3.353  -2.839
  620   1HD   ARG  83          2HD       ARG  83   0.638   2.211  -0.848
  621   2HD   ARG  83          1HD       ARG  83   0.083   3.571   0.121
  622    HE   ARG  83           HE       ARG  83  -2.082   2.458  -1.363
  623   1HH1  ARG  83          2HH1      ARG  83  -0.037   1.919   1.412
  624   2HH1  ARG  83          1HH1      ARG  83  -1.191   0.917   2.223
  625   1HH2  ARG  83          1HH2      ARG  83  -3.577   1.140  -0.287
  626   2HH2  ARG  83          2HH2      ARG  83  -3.186   0.471   1.261
  627    H    CYS  84           H        CYS  84   3.033   6.091  -4.402
  628    HA   CYS  84           HA       CYS  84   5.560   6.049  -3.027
  629   1HB   CYS  84          2HB       CYS  84   4.738   6.542  -5.881
  630   2HB   CYS  84          1HB       CYS  84   6.401   6.799  -5.353
  631    HG   CYS  84           HG       CYS  84   6.410   4.331  -5.981
  632    H    MET  85           H        MET  85   3.492   8.578  -4.441
  633    HA   MET  85           HA       MET  85   5.442  10.648  -3.736
  634   1HB   MET  85          2HB       MET  85   3.751  10.503  -5.833
  635   2HB   MET  85          1HB       MET  85   2.743  11.416  -4.711
  636   1HG   MET  85          2HG       MET  85   5.605  12.238  -5.025
  637   2HG   MET  85          1HG       MET  85   4.472  12.649  -6.312
  638   1HE   MET  85          1HE       MET  85   4.391  15.980  -5.114
  639   2HE   MET  85          2HE       MET  85   3.054  15.222  -5.974
  640   3HE   MET  85          3HE       MET  85   4.710  14.736  -6.329
  641    H    LYS  86           H        LYS  86   1.921  10.306  -3.191
  642    HA   LYS  86           HA       LYS  86   2.076  11.947  -0.799
  643   1HB   LYS  86          2HB       LYS  86   0.148  12.067  -2.399
  644   2HB   LYS  86          1HB       LYS  86  -0.305  10.437  -1.904
  645   1HG   LYS  86          2HG       LYS  86   0.163  12.307   0.334
  646   2HG   LYS  86          1HG       LYS  86  -1.209  12.724  -0.692
  647   1HD   LYS  86          2HD       LYS  86  -1.656  10.077  -0.446
  648   2HD   LYS  86          1HD       LYS  86  -0.814  10.361   1.078
  649   1HE   LYS  86          2HE       LYS  86  -2.980  10.844   1.736
  650   2HE   LYS  86          1HE       LYS  86  -2.470  12.444   1.200
  651   1HZ   LYS  86          1HZ       LYS  86  -3.421  11.932  -0.993
  652   2HZ   LYS  86          2HZ       LYS  86  -4.590  11.905   0.240
  653   3HZ   LYS  86          3HZ       LYS  86  -3.987  10.449  -0.396
  654    H    ASP  87           H        ASP  87   3.070  10.942   0.851
  655    HA   ASP  87           HA       ASP  87   1.717   8.862   2.266
  656   1HB   ASP  87          2HB       ASP  87   3.048   7.702   0.321
  657   2HB   ASP  87          1HB       ASP  87   4.450   8.007   1.344
  658    H    ASP  88           H        ASP  88   2.347  11.346   3.065
  659    HA   ASP  88           HA       ASP  88   3.957  10.917   5.385
  660   1HB   ASP  88          2HB       ASP  88   5.719  11.276   3.590
  661   2HB   ASP  88          1HB       ASP  88   5.094  12.916   3.419
  662    H    SER  89           HN       SER  89   3.095  13.644   3.222
  663    HA   SER  89           HA       SER  89   2.210  15.217   5.511
  664   1HB   SER  89          2HB       SER  89   3.435  16.016   3.291
  665   2HB   SER  89          1HB       SER  89   1.779  16.133   2.701
  666    HG   SER  89           HG       SER  89   1.376  17.694   4.108
  Start of MODEL   40
    1   1H    MET   1          1H        MET   1  -6.529   5.901   8.382
    2   2H    MET   1          2H        MET   1  -6.416   5.957  10.076
    3   3H    MET   1          3H        MET   1  -5.856   4.595   9.231
    4    HA   MET   1           HA       MET   1  -4.688   7.312   9.339
    5   1HB   MET   1          2HB       MET   1  -2.678   6.121  10.053
    6   2HB   MET   1          1HB       MET   1  -4.032   5.674  11.086
    7   1HG   MET   1          2HG       MET   1  -4.315   3.572   9.927
    8   2HG   MET   1          1HG       MET   1  -3.145   4.037   8.692
    9   1HE   MET   1          1HE       MET   1  -3.257   1.456  11.333
   10   2HE   MET   1          2HE       MET   1  -4.028   2.890  12.009
   11   3HE   MET   1          3HE       MET   1  -2.570   2.247  12.759
   12    H    ASN   2           H        ASN   2  -4.916   4.330   7.446
   13    HA   ASN   2           HA       ASN   2  -3.198   5.555   5.373
   14   1HB   ASN   2          2HB       ASN   2  -2.997   3.230   4.466
   15   2HB   ASN   2          1HB       ASN   2  -2.323   3.415   6.084
   16   1HD2  ASN   2          1HD2      ASN   2  -4.915   1.905   4.224
   17   2HD2  ASN   2          2HD2      ASN   2  -5.533   0.973   5.501
   18    H    ASP   3           H        ASP   3  -5.964   6.292   5.773
   19    HA   ASP   3           HA       ASP   3  -7.274   5.116   3.398
   20   1HB   ASP   3          2HB       ASP   3  -8.476   6.738   5.659
   21   2HB   ASP   3          1HB       ASP   3  -9.365   6.020   4.316
   22    H    ILE   4           H        ILE   4  -5.147   7.255   3.461
   23    HA   ILE   4           HA       ILE   4  -6.613   9.597   2.506
   24    HB   ILE   4           HB       ILE   4  -4.524  10.777   2.490
   25   1HG1  ILE   4          2HG1      ILE   4  -3.210   8.696   1.659
   26   2HG1  ILE   4          1HG1      ILE   4  -2.385   9.817   2.733
   27   1HG2  ILE   4          1HG2      ILE   4  -5.578  10.610   4.653
   28   2HG2  ILE   4          2HG2      ILE   4  -3.832  10.490   4.874
   29   3HG2  ILE   4          3HG2      ILE   4  -4.833   9.040   4.947
   30   1HD1  ILE   4          1HD1      ILE   4  -1.862   7.899   3.860
   31   2HD1  ILE   4          2HD1      ILE   4  -3.248   7.019   3.218
   32   3HD1  ILE   4          3HD1      ILE   4  -3.459   8.131   4.569
   33    H    TYR   5           H        TYR   5  -4.691   6.940   1.296
   34    HA   TYR   5           HA       TYR   5  -4.195   8.009  -1.311
   35   1HB   TYR   5          2HB       TYR   5  -4.455   5.056  -0.785
   36   2HB   TYR   5          1HB       TYR   5  -3.382   5.891  -1.907
   37    HD1  TYR   5           HD1      TYR   5  -1.815   7.742  -0.628
   38    HD2  TYR   5           HD2      TYR   5  -3.458   4.169   1.101
   39    HE1  TYR   5           HE1      TYR   5  -0.071   7.780   1.109
   40    HE2  TYR   5           HE2      TYR   5  -1.699   4.204   2.841
   41    HH   TYR   5           HH       TYR   5   0.971   5.532   2.738
   42    H    LYS   6           H        LYS   6  -6.777   6.109   0.165
   43    HA   LYS   6           HA       LYS   6  -8.190   5.442  -2.205
   44   1HB   LYS   6          2HB       LYS   6  -8.721   5.364   0.699
   45   2HB   LYS   6          1HB       LYS   6 -10.153   5.530  -0.316
   46   1HG   LYS   6          2HG       LYS   6  -9.927   3.219  -0.283
   47   2HG   LYS   6          1HG       LYS   6  -8.992   3.614  -1.725
   48   1HD   LYS   6          2HD       LYS   6  -7.087   3.879   0.222
   49   2HD   LYS   6          1HD       LYS   6  -8.075   2.579   0.888
   50   1HE   LYS   6          2HE       LYS   6  -7.869   1.329  -1.229
   51   2HE   LYS   6          1HE       LYS   6  -6.885   2.629  -1.901
   52   1HZ   LYS   6          1HZ       LYS   6  -5.237   2.252  -0.207
   53   2HZ   LYS   6          2HZ       LYS   6  -5.546   0.793  -1.023
   54   3HZ   LYS   6          3HZ       LYS   6  -6.197   1.058   0.525
   55    H    ALA   7           H        ALA   7  -8.208   8.282  -0.117
   56    HA   ALA   7           HA       ALA   7 -10.581   9.478  -1.132
   57   1HB   ALA   7          1HB       ALA   7  -8.227  11.036  -0.080
   58   2HB   ALA   7          2HB       ALA   7  -9.260  10.093   0.994
   59   3HB   ALA   7          3HB       ALA   7  -9.944  11.415   0.048
   60    H    ALA   8           H        ALA   8  -7.294   9.325  -2.314
   61    HA   ALA   8           HA       ALA   8  -7.660  11.486  -4.228
   62   1HB   ALA   8          1HB       ALA   8  -5.391  11.004  -4.921
   63   2HB   ALA   8          2HB       ALA   8  -5.403   9.481  -4.029
   64   3HB   ALA   8          3HB       ALA   8  -5.449  11.015  -3.158
   65    H    VAL   9           H        VAL   9  -7.412   7.938  -4.277
   66    HA   VAL   9           HA       VAL   9  -7.566   7.659  -7.098
   67    HB   VAL   9           HB       VAL   9  -6.776   5.885  -5.493
   68   1HG1  VAL   9          1HG1      VAL   9  -8.584   6.055  -3.851
   69   2HG1  VAL   9          2HG1      VAL   9  -8.515   4.420  -4.507
   70   3HG1  VAL   9          3HG1      VAL   9  -9.759   5.541  -5.061
   71   1HG2  VAL   9          1HG2      VAL   9  -7.476   5.519  -7.924
   72   2HG2  VAL   9          2HG2      VAL   9  -9.011   4.921  -7.293
   73   3HG2  VAL   9          3HG2      VAL   9  -7.509   4.089  -6.892
   74    H    GLU  10           H        GLU  10  -9.989   8.308  -4.691
   75    HA   GLU  10           HA       GLU  10 -12.204   7.408  -6.322
   76   1HB   GLU  10          2HB       GLU  10 -13.625   8.235  -4.564
   77   2HB   GLU  10          1HB       GLU  10 -12.266   7.397  -3.818
   78   1HG   GLU  10          2HG       GLU  10 -11.311   9.349  -3.028
   79   2HG   GLU  10          1HG       GLU  10 -12.013  10.341  -4.305
   80    H    GLN  11           H        GLN  11 -10.280  10.272  -6.098
   81    HA   GLN  11           HA       GLN  11 -12.232  11.674  -7.825
   82   1HB   GLN  11          2HB       GLN  11 -11.634  13.800  -6.769
   83   2HB   GLN  11          1HB       GLN  11 -12.273  12.673  -5.574
   84   1HG   GLN  11          2HG       GLN  11  -9.886  12.035  -5.029
   85   2HG   GLN  11          1HG       GLN  11  -9.365  13.365  -6.063
   86   1HE2  GLN  11          1HE2      GLN  11 -11.655  12.807  -3.317
   87   2HE2  GLN  11          2HE2      GLN  11 -11.328  14.294  -2.565
   88    H    LEU  12           H        LEU  12  -9.829  10.060  -8.497
   89    HA   LEU  12           HA       LEU  12  -7.823  11.980  -9.360
   90   1HB   LEU  12          2HB       LEU  12  -6.979   9.879 -10.652
   91   2HB   LEU  12          1HB       LEU  12  -6.774   9.990  -8.920
   92    HG   LEU  12           HG       LEU  12  -8.595   8.450  -8.551
   93   1HD1  LEU  12          1HD1      LEU  12 -10.190   9.005 -10.224
   94   2HD1  LEU  12          2HD1      LEU  12  -9.660   7.371 -10.625
   95   3HD1  LEU  12          3HD1      LEU  12  -9.027   8.749 -11.525
   96   1HD2  LEU  12          1HD2      LEU  12  -7.694   6.452  -9.713
   97   2HD2  LEU  12          2HD2      LEU  12  -6.406   7.467  -9.066
   98   3HD2  LEU  12          3HD2      LEU  12  -6.779   7.508 -10.788
   99    H    THR  13           H        THR  13  -7.060  11.610 -11.782
  100    HA   THR  13           HA       THR  13  -9.355  12.375 -13.431
  101    HB   THR  13           HB       THR  13  -7.207  12.525 -15.110
  102    HG1  THR  13           HG1      THR  13  -5.589  12.115 -13.776
  103   1HG2  THR  13          1HG2      THR  13  -8.458  14.442 -15.014
  104   2HG2  THR  13          2HG2      THR  13  -7.088  14.971 -14.037
  105   3HG2  THR  13          3HG2      THR  13  -8.566  14.413 -13.254
  106    H    ASP  14           H        ASP  14  -9.368  11.573 -15.717
  107    HA   ASP  14           HA       ASP  14  -9.522   8.706 -15.740
  108   1HB   ASP  14          2HB       ASP  14  -9.822  10.784 -17.919
  109   2HB   ASP  14          1HB       ASP  14 -10.027   9.053 -18.197
  110    H    GLU  15           H        GLU  15  -7.214  11.121 -16.804
  111    HA   GLU  15           HA       GLU  15  -5.630   9.453 -18.483
  112   1HB   GLU  15          2HB       GLU  15  -4.028  11.206 -18.465
  113   2HB   GLU  15          1HB       GLU  15  -5.596  12.001 -18.362
  114   1HG   GLU  15          2HG       GLU  15  -5.229  11.870 -15.781
  115   2HG   GLU  15          1HG       GLU  15  -3.535  11.618 -16.201
  116    H    GLN  16           H        GLN  16  -5.708  10.041 -15.021
  117    HA   GLN  16           HA       GLN  16  -3.220   8.819 -14.363
  118   1HB   GLN  16          2HB       GLN  16  -4.962  10.309 -12.944
  119   2HB   GLN  16          1HB       GLN  16  -5.468   8.706 -12.412
  120   1HG   GLN  16          2HG       GLN  16  -2.596   8.808 -12.430
  121   2HG   GLN  16          1HG       GLN  16  -3.210  10.201 -11.539
  122   1HE2  GLN  16          1HE2      GLN  16  -4.203   6.725 -11.822
  123   2HE2  GLN  16          2HE2      GLN  16  -4.339   6.489 -10.146
  124    H    LYS  17           H        LYS  17  -6.566   7.683 -14.592
  125    HA   LYS  17           HA       LYS  17  -6.076   5.028 -13.675
  126   1HB   LYS  17          2HB       LYS  17  -8.298   6.134 -15.415
  127   2HB   LYS  17          1HB       LYS  17  -8.283   4.518 -14.712
  128   1HG   LYS  17          2HG       LYS  17  -8.623   5.297 -12.558
  129   2HG   LYS  17          1HG       LYS  17  -7.844   6.846 -12.883
  130   1HD   LYS  17          2HD       LYS  17 -10.144   7.383 -12.719
  131   2HD   LYS  17          1HD       LYS  17  -9.843   7.307 -14.454
  132   1HE   LYS  17          2HE       LYS  17 -10.643   4.936 -14.442
  133   2HE   LYS  17          1HE       LYS  17 -11.054   5.120 -12.737
  134   1HZ   LYS  17          1HZ       LYS  17 -12.978   5.512 -14.124
  135   2HZ   LYS  17          2HZ       LYS  17 -12.154   6.724 -14.984
  136   3HZ   LYS  17          3HZ       LYS  17 -12.531   6.949 -13.342
  137    H    ASN  18           H        ASN  18  -6.223   6.532 -16.895
  138    HA   ASN  18           HA       ASN  18  -5.942   4.157 -18.414
  139   1HB   ASN  18          2HB       ASN  18  -5.494   7.066 -18.965
  140   2HB   ASN  18          1HB       ASN  18  -4.916   5.872 -20.127
  141   1HD2  ASN  18          1HD2      ASN  18  -7.646   7.680 -19.238
  142   2HD2  ASN  18          2HD2      ASN  18  -8.821   6.767 -20.056
  143    H    GLU  19           H        GLU  19  -3.559   6.327 -16.966
  144    HA   GLU  19           HA       GLU  19  -1.222   5.513 -18.217
  145   1HB   GLU  19          2HB       GLU  19  -1.452   7.342 -16.484
  146   2HB   GLU  19          1HB       GLU  19  -1.449   6.079 -15.252
  147   1HG   GLU  19          2HG       GLU  19   0.814   6.523 -15.320
  148   2HG   GLU  19          1HG       GLU  19   0.727   5.298 -16.586
  149    H    PHE  20           H        PHE  20  -2.746   4.108 -15.321
  150    HA   PHE  20           HA       PHE  20  -0.857   1.907 -15.237
  151   1HB   PHE  20          2HB       PHE  20  -3.244   2.714 -13.604
  152   2HB   PHE  20          1HB       PHE  20  -2.536   1.114 -13.426
  153    HD1  PHE  20           HD1      PHE  20  -2.162   4.661 -12.751
  154    HD2  PHE  20           HD2      PHE  20  -0.121   0.883 -12.737
  155    HE1  PHE  20           HE1      PHE  20  -0.412   5.607 -11.286
  156    HE2  PHE  20           HE2      PHE  20   1.623   1.826 -11.260
  157    HZ   PHE  20           HZ       PHE  20   1.482   4.196 -10.534
  158    H    LYS  21           H        LYS  21  -4.313   2.341 -15.986
  159    HA   LYS  21           HA       LYS  21  -5.093  -0.292 -16.329
  160   1HB   LYS  21          2HB       LYS  21  -6.638   1.629 -16.418
  161   2HB   LYS  21          1HB       LYS  21  -5.988   2.070 -17.996
  162   1HG   LYS  21          2HG       LYS  21  -6.787  -0.744 -17.862
  163   2HG   LYS  21          1HG       LYS  21  -8.129   0.354 -17.541
  164   1HD   LYS  21          2HD       LYS  21  -7.805   1.500 -19.623
  165   2HD   LYS  21          1HD       LYS  21  -6.263   0.692 -19.901
  166   1HE   LYS  21          2HE       LYS  21  -7.270  -1.337 -20.452
  167   2HE   LYS  21          1HE       LYS  21  -8.744  -0.963 -19.561
  168   1HZ   LYS  21          1HZ       LYS  21  -7.863   0.298 -22.102
  169   2HZ   LYS  21          2HZ       LYS  21  -9.252   0.736 -21.227
  170   3HZ   LYS  21          3HZ       LYS  21  -9.134  -0.810 -21.921
  171    H    ALA  22           H        ALA  22  -3.283   1.752 -18.577
  172    HA   ALA  22           HA       ALA  22  -3.512   0.155 -20.885
  173   1HB   ALA  22          1HB       ALA  22  -1.505   1.296 -21.676
  174   2HB   ALA  22          2HB       ALA  22  -1.135   1.827 -20.035
  175   3HB   ALA  22          3HB       ALA  22  -2.559   2.454 -20.864
  176    H    ALA  23           H        ALA  23  -0.861   0.253 -18.496
  177    HA   ALA  23           HA       ALA  23   0.488  -2.041 -19.512
  178   1HB   ALA  23          1HB       ALA  23   0.733  -1.232 -16.635
  179   2HB   ALA  23          2HB       ALA  23   1.308  -0.126 -17.884
  180   3HB   ALA  23          3HB       ALA  23   1.984  -1.750 -17.765
  181    H    PHE  24           H        PHE  24  -1.964  -1.519 -17.042
  182    HA   PHE  24           HA       PHE  24  -1.939  -4.052 -15.811
  183   1HB   PHE  24          2HB       PHE  24  -3.205  -1.894 -15.132
  184   2HB   PHE  24          1HB       PHE  24  -4.457  -2.456 -16.235
  185    HD1  PHE  24           HD1      PHE  24  -5.472  -4.761 -15.874
  186    HD2  PHE  24           HD2      PHE  24  -2.955  -2.847 -12.973
  187    HE1  PHE  24           HE1      PHE  24  -6.327  -6.289 -14.118
  188    HE2  PHE  24           HE2      PHE  24  -3.807  -4.367 -11.220
  189    HZ   PHE  24           HZ       PHE  24  -5.498  -6.083 -11.787
  190    H    ASP  25           H        ASP  25  -3.788  -2.830 -18.608
  191    HA   ASP  25           HA       ASP  25  -5.341  -5.159 -19.014
  192   1HB   ASP  25          2HB       ASP  25  -5.390  -2.688 -20.088
  193   2HB   ASP  25          1HB       ASP  25  -4.614  -3.570 -21.405
  194    H    ILE  26           H        ILE  26  -2.188  -4.205 -20.352
  195    HA   ILE  26           HA       ILE  26  -2.036  -6.449 -22.139
  196    HB   ILE  26           HB       ILE  26   0.329  -5.775 -22.461
  197   1HG1  ILE  26          2HG1      ILE  26  -0.327  -3.659 -20.381
  198   2HG1  ILE  26          1HG1      ILE  26   0.758  -5.025 -20.127
  199   1HG2  ILE  26          1HG2      ILE  26  -1.584  -4.681 -23.670
  200   2HG2  ILE  26          2HG2      ILE  26  -0.170  -3.640 -23.499
  201   3HG2  ILE  26          3HG2      ILE  26  -1.569  -3.410 -22.448
  202   1HD1  ILE  26          1HD1      ILE  26   1.185  -2.528 -21.669
  203   2HD1  ILE  26          2HD1      ILE  26   1.831  -4.002 -22.391
  204   3HD1  ILE  26          3HD1      ILE  26   2.342  -3.512 -20.776
  205    H    PHE  27           H        PHE  27  -0.862  -5.804 -18.865
  206    HA   PHE  27           HA       PHE  27   0.745  -8.185 -18.736
  207   1HB   PHE  27          2HB       PHE  27  -0.253  -6.332 -16.561
  208   2HB   PHE  27          1HB       PHE  27   0.847  -7.683 -16.282
  209    HD1  PHE  27           HD1      PHE  27   2.400  -7.478 -18.916
  210    HD2  PHE  27           HD2      PHE  27   1.235  -4.509 -16.032
  211    HE1  PHE  27           HE1      PHE  27   4.302  -6.054 -19.613
  212    HE2  PHE  27           HE2      PHE  27   3.139  -3.086 -16.742
  213    HZ   PHE  27           HZ       PHE  27   4.670  -3.859 -18.526
  214    H    ILE  28           H        ILE  28  -2.588  -7.377 -17.831
  215    HA   ILE  28           HA       ILE  28  -2.951 -10.081 -16.720
  216    HB   ILE  28           HB       ILE  28  -5.095  -9.361 -15.913
  217   1HG1  ILE  28          2HG1      ILE  28  -5.507  -6.730 -16.445
  218   2HG1  ILE  28          1HG1      ILE  28  -4.735  -7.227 -17.953
  219   1HG2  ILE  28          1HG2      ILE  28  -2.926  -8.530 -14.801
  220   2HG2  ILE  28          2HG2      ILE  28  -4.424  -7.709 -14.363
  221   3HG2  ILE  28          3HG2      ILE  28  -3.310  -6.963 -15.509
  222   1HD1  ILE  28          1HD1      ILE  28  -6.443  -8.686 -18.512
  223   2HD1  ILE  28          2HD1      ILE  28  -7.359  -7.459 -17.635
  224   3HD1  ILE  28          3HD1      ILE  28  -6.901  -8.961 -16.830
  225    H    GLN  29           H        GLN  29  -2.867  -8.907 -19.733
  226    HA   GLN  29           HA       GLN  29  -5.224  -9.508 -21.054
  227   1HB   GLN  29          2HB       GLN  29  -3.337  -8.479 -22.187
  228   2HB   GLN  29          1HB       GLN  29  -2.373  -9.938 -21.976
  229   1HG   GLN  29          2HG       GLN  29  -3.874 -11.204 -23.407
  230   2HG   GLN  29          1HG       GLN  29  -4.978  -9.832 -23.525
  231   1HE2  GLN  29          1HE2      GLN  29  -3.784  -7.715 -24.372
  232   2HE2  GLN  29          2HE2      GLN  29  -2.714  -7.959 -25.667
  233    H    ASP  30           H        ASP  30  -2.646 -11.722 -20.041
  234    HA   ASP  30           HA       ASP  30  -4.102 -14.013 -21.158
  235   1HB   ASP  30          2HB       ASP  30  -1.341 -13.694 -19.986
  236   2HB   ASP  30          1HB       ASP  30  -2.038 -15.276 -20.335
  237    H    ALA  31           H        ALA  31  -4.230 -12.334 -18.297
  238    HA   ALA  31           HA       ALA  31  -4.584 -14.722 -16.617
  239   1HB   ALA  31          1HB       ALA  31  -3.212 -12.964 -15.630
  240   2HB   ALA  31          2HB       ALA  31  -4.728 -13.113 -14.740
  241   3HB   ALA  31          3HB       ALA  31  -4.501 -11.786 -15.881
  242    H    GLU  32           H        GLU  32  -6.486 -15.095 -15.480
  243    HA   GLU  32           HA       GLU  32  -8.871 -13.664 -16.505
  244   1HB   GLU  32          2HB       GLU  32  -8.450 -16.596 -15.919
  245   2HB   GLU  32          1HB       GLU  32 -10.063 -15.885 -15.983
  246   1HG   GLU  32          2HG       GLU  32  -9.678 -15.118 -18.269
  247   2HG   GLU  32          1HG       GLU  32  -8.016 -15.704 -18.215
  248    H    ASP  33           H        ASP  33  -7.527 -12.688 -14.320
  249    HA   ASP  33           HA       ASP  33  -9.395 -13.309 -12.112
  250   1HB   ASP  33          2HB       ASP  33  -6.405 -12.921 -11.963
  251   2HB   ASP  33          1HB       ASP  33  -7.456 -12.769 -10.555
  252    H    GLY  34           H        GLY  34  -7.052 -10.945 -13.386
  253   1HA   GLY  34          2HA       GLY  34  -7.761  -8.668 -13.848
  254   2HA   GLY  34          1HA       GLY  34  -8.844  -8.777 -12.462
  255    H    CYS  35           H        CYS  35  -5.442  -9.758 -12.744
  256    HA   CYS  35           HA       CYS  35  -4.520  -7.528 -11.111
  257   1HB   CYS  35          2HB       CYS  35  -4.826 -10.294 -10.048
  258   2HB   CYS  35          1HB       CYS  35  -3.363  -9.416  -9.622
  259    HG   CYS  35           HG       CYS  35  -6.247  -8.506  -8.863
  260    H    ILE  36           H        ILE  36  -2.269  -7.301 -11.111
  261    HA   ILE  36           HA       ILE  36  -0.919  -8.785 -13.264
  262    HB   ILE  36           HB       ILE  36   0.688  -7.015 -13.358
  263   1HG1  ILE  36          2HG1      ILE  36  -0.026  -5.059 -11.532
  264   2HG1  ILE  36          1HG1      ILE  36  -0.204  -6.544 -10.596
  265   1HG2  ILE  36          1HG2      ILE  36  -1.441  -6.476 -14.423
  266   2HG2  ILE  36          2HG2      ILE  36  -0.756  -5.019 -13.703
  267   3HG2  ILE  36          3HG2      ILE  36  -2.079  -5.863 -12.897
  268   1HD1  ILE  36          1HD1      ILE  36   2.261  -5.881 -12.234
  269   2HD1  ILE  36          2HD1      ILE  36   2.070  -7.207 -11.088
  270   3HD1  ILE  36          3HD1      ILE  36   2.113  -5.545 -10.510
  271    H    SER  37           H        SER  37   1.539  -9.081 -12.819
  272    HA   SER  37           HA       SER  37   1.741 -10.624 -10.337
  273   1HB   SER  37          2HB       SER  37   2.573 -11.208 -12.859
  274   2HB   SER  37          1HB       SER  37   4.053 -10.543 -12.177
  275    HG   SER  37           HG       SER  37   3.467 -12.911 -11.880
  276    H    THR  38           H        THR  38   2.404  -9.566  -8.588
  277    HA   THR  38           HA       THR  38   3.716  -7.110  -8.456
  278    HB   THR  38           HB       THR  38   4.350  -7.741  -6.140
  279    HG1  THR  38           HG1      THR  38   4.726  -9.790  -5.921
  280   1HG2  THR  38          1HG2      THR  38   1.567  -8.445  -7.082
  281   2HG2  THR  38          2HG2      THR  38   2.128  -6.896  -6.454
  282   3HG2  THR  38          3HG2      THR  38   1.999  -8.288  -5.380
  283    H    LYS  39           H        LYS  39   5.049 -10.381  -8.633
  284    HA   LYS  39           HA       LYS  39   7.765  -9.712  -8.185
  285   1HB   LYS  39          2HB       LYS  39   8.304 -11.873  -9.183
  286   2HB   LYS  39          1HB       LYS  39   6.920 -12.040  -8.107
  287   1HG   LYS  39          2HG       LYS  39   5.641 -11.482 -10.438
  288   2HG   LYS  39          1HG       LYS  39   7.066 -12.316 -11.057
  289   1HD   LYS  39          2HD       LYS  39   5.458 -13.455  -8.772
  290   2HD   LYS  39          1HD       LYS  39   5.011 -13.764 -10.450
  291   1HE   LYS  39          2HE       LYS  39   6.742 -15.195 -10.772
  292   2HE   LYS  39          1HE       LYS  39   7.876 -14.164  -9.900
  293   1HZ   LYS  39          1HZ       LYS  39   5.837 -15.916  -8.635
  294   2HZ   LYS  39          2HZ       LYS  39   6.984 -14.962  -7.820
  295   3HZ   LYS  39          3HZ       LYS  39   7.487 -16.279  -8.768
  296    H    GLU  40           H        GLU  40   5.713  -9.460 -11.008
  297    HA   GLU  40           HA       GLU  40   8.022  -8.751 -12.698
  298   1HB   GLU  40          2HB       GLU  40   5.163  -9.466 -13.371
  299   2HB   GLU  40          1HB       GLU  40   6.303  -8.831 -14.558
  300   1HG   GLU  40          2HG       GLU  40   6.843 -11.289 -12.868
  301   2HG   GLU  40          1HG       GLU  40   6.174 -11.352 -14.498
  302    H    LEU  41           H        LEU  41   6.645  -7.031 -10.553
  303    HA   LEU  41           HA       LEU  41   5.158  -4.953 -11.668
  304   1HB   LEU  41          2HB       LEU  41   6.083  -5.474  -9.198
  305   2HB   LEU  41          1HB       LEU  41   7.208  -4.220  -9.658
  306    HG   LEU  41           HG       LEU  41   5.236  -3.403  -8.368
  307   1HD1  LEU  41          1HD1      LEU  41   6.533  -2.013 -10.058
  308   2HD1  LEU  41          2HD1      LEU  41   4.900  -1.450  -9.707
  309   3HD1  LEU  41          3HD1      LEU  41   5.227  -2.336 -11.195
  310   1HD2  LEU  41          1HD2      LEU  41   3.049  -3.302  -9.486
  311   2HD2  LEU  41          2HD2      LEU  41   3.572  -4.980  -9.332
  312   3HD2  LEU  41          3HD2      LEU  41   3.708  -4.153 -10.884
  313    H    GLY  42           H        GLY  42   8.618  -5.581 -11.824
  314   1HA   GLY  42          2HA       GLY  42   9.604  -3.076 -12.576
  315   2HA   GLY  42          1HA       GLY  42  10.300  -4.616 -13.065
  316    H    LYS  43           H        LYS  43   7.950  -5.549 -14.495
  317    HA   LYS  43           HA       LYS  43   8.465  -4.460 -17.067
  318   1HB   LYS  43          2HB       LYS  43   6.145  -6.154 -16.105
  319   2HB   LYS  43          1HB       LYS  43   6.505  -5.806 -17.794
  320   1HG   LYS  43          2HG       LYS  43   8.678  -6.940 -16.067
  321   2HG   LYS  43          1HG       LYS  43   7.414  -8.020 -16.657
  322   1HD   LYS  43          2HD       LYS  43   7.975  -6.715 -18.953
  323   2HD   LYS  43          1HD       LYS  43   9.550  -6.599 -18.166
  324   1HE   LYS  43          2HE       LYS  43   8.160  -9.248 -18.135
  325   2HE   LYS  43          1HE       LYS  43   8.901  -8.720 -19.645
  326   1HZ   LYS  43          1HZ       LYS  43  10.982  -8.373 -18.449
  327   2HZ   LYS  43          2HZ       LYS  43  10.459  -9.984 -18.318
  328   3HZ   LYS  43          3HZ       LYS  43  10.263  -8.916 -17.011
  329    H    VAL  44           H        VAL  44   6.164  -3.645 -14.561
  330    HA   VAL  44           HA       VAL  44   4.653  -1.907 -16.375
  331    HB   VAL  44           HB       VAL  44   2.906  -2.054 -14.948
  332   1HG1  VAL  44          1HG1      VAL  44   2.729  -4.097 -13.822
  333   2HG1  VAL  44          2HG1      VAL  44   4.416  -4.068 -13.302
  334   3HG1  VAL  44          3HG1      VAL  44   4.017  -4.415 -14.984
  335   1HG2  VAL  44          1HG2      VAL  44   3.345  -2.065 -12.358
  336   2HG2  VAL  44          2HG2      VAL  44   3.527  -0.564 -13.263
  337   3HG2  VAL  44          3HG2      VAL  44   4.952  -1.504 -12.816
  338    H    MET  45           H        MET  45   6.993  -1.790 -13.767
  339    HA   MET  45           HA       MET  45   6.847   0.949 -13.120
  340   1HB   MET  45          2HB       MET  45   9.027  -1.115 -12.948
  341   2HB   MET  45          1HB       MET  45   9.377   0.575 -12.588
  342   1HG   MET  45          2HG       MET  45   6.947  -0.597 -11.325
  343   2HG   MET  45          1HG       MET  45   8.506  -1.136 -10.706
  344   1HE   MET  45          1HE       MET  45   5.958   2.044 -10.744
  345   2HE   MET  45          2HE       MET  45   6.288   1.969  -9.015
  346   3HE   MET  45          3HE       MET  45   5.904   0.493  -9.897
  347    H    ARG  46           H        ARG  46   8.639  -0.820 -15.626
  348    HA   ARG  46           HA       ARG  46  10.103   1.404 -16.620
  349   1HB   ARG  46          2HB       ARG  46  10.409   0.041 -18.670
  350   2HB   ARG  46          1HB       ARG  46  10.776  -0.858 -17.199
  351   1HG   ARG  46          2HG       ARG  46   8.854  -2.172 -17.357
  352   2HG   ARG  46          1HG       ARG  46   8.002  -0.989 -18.346
  353   1HD   ARG  46          2HD       ARG  46   8.588  -2.767 -19.821
  354   2HD   ARG  46          1HD       ARG  46   9.708  -1.455 -20.171
  355    HE   ARG  46           HE       ARG  46  11.042  -2.959 -18.314
  356   1HH1  ARG  46          2HH1      ARG  46   9.470  -3.663 -21.353
  357   2HH1  ARG  46          1HH1      ARG  46  10.532  -4.972 -21.741
  358   1HH2  ARG  46          1HH2      ARG  46  12.423  -4.679 -18.847
  359   2HH2  ARG  46          2HH2      ARG  46  12.198  -5.547 -20.328
  360    H    MET  47           H        MET  47   6.857   0.192 -17.238
  361    HA   MET  47           HA       MET  47   6.307   1.827 -19.525
  362   1HB   MET  47          2HB       MET  47   4.806   0.003 -17.770
  363   2HB   MET  47          1HB       MET  47   3.853   1.358 -18.373
  364   1HG   MET  47          2HG       MET  47   3.660  -0.437 -19.975
  365   2HG   MET  47          1HG       MET  47   4.685   0.808 -20.690
  366   1HE   MET  47          1HE       MET  47   6.353   0.277 -21.989
  367   2HE   MET  47          2HE       MET  47   7.698  -0.825 -21.707
  368   3HE   MET  47          3HE       MET  47   7.498   0.591 -20.678
  369    H    LEU  48           H        LEU  48   6.029   2.215 -16.037
  370    HA   LEU  48           HA       LEU  48   4.537   4.684 -16.136
  371   1HB   LEU  48          2HB       LEU  48   5.858   3.036 -14.041
  372   2HB   LEU  48          1HB       LEU  48   5.605   4.729 -13.687
  373    HG   LEU  48           HG       LEU  48   3.233   4.493 -13.801
  374   1HD1  LEU  48          1HD1      LEU  48   3.915   2.084 -15.381
  375   2HD1  LEU  48          2HD1      LEU  48   2.528   3.163 -15.518
  376   3HD1  LEU  48          3HD1      LEU  48   2.542   1.894 -14.291
  377   1HD2  LEU  48          1HD2      LEU  48   3.267   2.012 -12.462
  378   2HD2  LEU  48          2HD2      LEU  48   3.391   3.614 -11.729
  379   3HD2  LEU  48          3HD2      LEU  48   4.852   2.727 -12.163
  380    H    GLY  49           H        GLY  49   7.918   3.733 -16.049
  381   1HA   GLY  49          2HA       GLY  49   9.506   5.312 -17.092
  382   2HA   GLY  49          1HA       GLY  49   8.710   6.587 -16.176
  383    H    GLN  50           H        GLN  50   9.408   3.416 -14.810
  384    HA   GLN  50           HA       GLN  50  11.622   4.569 -13.219
  385   1HB   GLN  50          2HB       GLN  50   9.532   2.711 -12.067
  386   2HB   GLN  50          1HB       GLN  50  10.787   3.591 -11.199
  387   1HG   GLN  50          2HG       GLN  50   8.572   4.955 -12.755
  388   2HG   GLN  50          1HG       GLN  50   8.476   4.610 -11.030
  389   1HE2  GLN  50          1HE2      GLN  50   8.912   7.201 -12.833
  390   2HE2  GLN  50          2HE2      GLN  50  10.145   8.010 -11.994
  391    H    ASN  51           H        ASN  51  13.116   3.000 -12.365
  392    HA   ASN  51           HA       ASN  51  12.924   0.268 -13.416
  393   1HB   ASN  51          2HB       ASN  51  14.179   1.867 -15.056
  394   2HB   ASN  51          1HB       ASN  51  15.488   1.768 -13.879
  395   1HD2  ASN  51          1HD2      ASN  51  16.788  -0.105 -13.926
  396   2HD2  ASN  51          2HD2      ASN  51  16.446  -1.472 -14.872
  397    HA   PRO  52           HA       PRO  52  14.882   0.535  -9.222
  398   1HB   PRO  52          2HB       PRO  52  12.927  -0.806  -7.863
  399   2HB   PRO  52          1HB       PRO  52  12.894   0.939  -8.154
  400   1HG   PRO  52          2HG       PRO  52  11.282  -1.199  -9.391
  401   2HG   PRO  52          1HG       PRO  52  10.917   0.521  -9.204
  402   1HD   PRO  52          2HD       PRO  52  11.847  -0.792 -11.566
  403   2HD   PRO  52          1HD       PRO  52  11.634   0.957 -11.325
  404    H    THR  53           H        THR  53  14.567  -1.654  -7.526
  405    HA   THR  53           HA       THR  53  15.698  -3.876  -9.122
  406    HB   THR  53           HB       THR  53  17.053  -4.436  -7.297
  407    HG1  THR  53           HG1      THR  53  16.364  -4.325  -5.314
  408   1HG2  THR  53          1HG2      THR  53  18.060  -2.374  -6.445
  409   2HG2  THR  53          2HG2      THR  53  16.650  -1.455  -6.966
  410   3HG2  THR  53          3HG2      THR  53  17.695  -2.218  -8.164
  411    HA   PRO  54           HA       PRO  54  12.398  -6.527  -7.866
  412   1HB   PRO  54          2HB       PRO  54  13.604  -8.806  -6.930
  413   2HB   PRO  54          1HB       PRO  54  13.504  -8.366  -8.643
  414   1HG   PRO  54          2HG       PRO  54  15.818  -8.189  -6.782
  415   2HG   PRO  54          1HG       PRO  54  15.790  -8.499  -8.525
  416   1HD   PRO  54          2HD       PRO  54  16.433  -6.056  -7.347
  417   2HD   PRO  54          1HD       PRO  54  15.918  -6.260  -9.037
  418    H    GLU  55           H        GLU  55  14.863  -6.021  -5.408
  419    HA   GLU  55           HA       GLU  55  13.168  -6.850  -3.197
  420   1HB   GLU  55          2HB       GLU  55  15.862  -5.473  -3.306
  421   2HB   GLU  55          1HB       GLU  55  15.034  -5.881  -1.804
  422   1HG   GLU  55          2HG       GLU  55  15.671  -8.039  -1.950
  423   2HG   GLU  55          1HG       GLU  55  15.090  -8.157  -3.611
  424    H    GLU  56           H        GLU  56  14.203  -3.856  -4.761
  425    HA   GLU  56           HA       GLU  56  13.097  -2.069  -2.828
  426   1HB   GLU  56          2HB       GLU  56  14.883  -1.570  -4.615
  427   2HB   GLU  56          1HB       GLU  56  13.531  -1.406  -5.735
  428   1HG   GLU  56          2HG       GLU  56  12.545   0.347  -4.369
  429   2HG   GLU  56          1HG       GLU  56  13.780   0.124  -3.130
  430    H    LEU  57           H        LEU  57  11.948  -3.265  -5.993
  431    HA   LEU  57           HA       LEU  57   9.529  -1.798  -6.003
  432   1HB   LEU  57          2HB       LEU  57   8.877  -3.108  -7.839
  433   2HB   LEU  57          1HB       LEU  57  10.608  -2.919  -7.976
  434    HG   LEU  57           HG       LEU  57  10.640  -5.277  -6.771
  435   1HD1  LEU  57          1HD1      LEU  57   8.543  -6.061  -6.402
  436   2HD1  LEU  57          2HD1      LEU  57   8.472  -6.335  -8.142
  437   3HD1  LEU  57          3HD1      LEU  57   7.817  -4.848  -7.458
  438   1HD2  LEU  57          1HD2      LEU  57  10.011  -4.672  -9.668
  439   2HD2  LEU  57          2HD2      LEU  57  10.401  -6.301  -9.116
  440   3HD2  LEU  57          3HD2      LEU  57  11.584  -5.006  -8.945
  441    H    GLN  58           H        GLN  58  10.378  -4.965  -4.658
  442    HA   GLN  58           HA       GLN  58   7.730  -5.832  -4.133
  443   1HB   GLN  58          2HB       GLN  58   9.898  -7.216  -4.077
  444   2HB   GLN  58          1HB       GLN  58  10.103  -6.592  -2.440
  445   1HG   GLN  58          2HG       GLN  58   8.938  -8.729  -2.329
  446   2HG   GLN  58          1HG       GLN  58   7.820  -7.443  -1.878
  447   1HE2  GLN  58          1HE2      GLN  58   5.874  -7.345  -3.048
  448   2HE2  GLN  58          2HE2      GLN  58   5.584  -8.180  -4.497
  449    H    GLU  59           H        GLU  59   9.881  -3.652  -2.413
  450    HA   GLU  59           HA       GLU  59   8.591  -3.719   0.118
  451   1HB   GLU  59          2HB       GLU  59  10.431  -1.798  -1.260
  452   2HB   GLU  59          1HB       GLU  59   9.605  -1.288   0.211
  453   1HG   GLU  59          2HG       GLU  59  10.602  -3.002   1.505
  454   2HG   GLU  59          1HG       GLU  59  11.093  -3.911   0.075
  455    H    MET  60           H        MET  60   8.281  -1.405  -2.602
  456    HA   MET  60           HA       MET  60   6.191   0.101  -1.423
  457   1HB   MET  60          2HB       MET  60   5.764   0.947  -3.730
  458   2HB   MET  60          1HB       MET  60   7.459   1.051  -3.257
  459   1HG   MET  60          2HG       MET  60   8.038  -0.870  -4.564
  460   2HG   MET  60          1HG       MET  60   6.345  -1.289  -4.820
  461   1HE   MET  60          1HE       MET  60   5.896  -0.811  -7.827
  462   2HE   MET  60          2HE       MET  60   7.066  -1.744  -6.899
  463   3HE   MET  60          3HE       MET  60   7.623  -0.666  -8.176
  464    H    ILE  61           H        ILE  61   6.213  -2.808  -3.388
  465    HA   ILE  61           HA       ILE  61   3.424  -2.882  -3.960
  466    HB   ILE  61           HB       ILE  61   5.513  -5.071  -3.866
  467   1HG1  ILE  61          2HG1      ILE  61   5.837  -3.388  -5.621
  468   2HG1  ILE  61          1HG1      ILE  61   5.304  -4.907  -6.338
  469   1HG2  ILE  61          1HG2      ILE  61   3.457  -6.208  -3.519
  470   2HG2  ILE  61          2HG2      ILE  61   3.735  -6.305  -5.257
  471   3HG2  ILE  61          3HG2      ILE  61   2.586  -5.134  -4.614
  472   1HD1  ILE  61          1HD1      ILE  61   4.026  -2.305  -6.405
  473   2HD1  ILE  61          2HD1      ILE  61   2.939  -3.511  -5.716
  474   3HD1  ILE  61          3HD1      ILE  61   3.629  -3.759  -7.319
  475    H    ASP  62           H        ASP  62   5.429  -4.323  -1.401
  476    HA   ASP  62           HA       ASP  62   3.390  -5.774  -0.101
  477   1HB   ASP  62          2HB       ASP  62   5.937  -5.844   0.318
  478   2HB   ASP  62          1HB       ASP  62   5.666  -4.456   1.372
  479    H    GLU  63           H        GLU  63   4.443  -2.406   0.189
  480    HA   GLU  63           HA       GLU  63   2.812  -1.761   2.442
  481   1HB   GLU  63          2HB       GLU  63   4.149  -0.046   0.344
  482   2HB   GLU  63          1HB       GLU  63   3.232   0.623   1.694
  483   1HG   GLU  63          2HG       GLU  63   4.728  -0.294   3.302
  484   2HG   GLU  63          1HG       GLU  63   5.485  -1.349   2.109
  485    H    VAL  64           H        VAL  64   2.388  -1.285  -1.081
  486    HA   VAL  64           HA       VAL  64  -0.156   0.000  -0.806
  487    HB   VAL  64           HB       VAL  64   1.291   0.319  -2.789
  488   1HG1  VAL  64          1HG1      VAL  64   1.469  -1.419  -4.478
  489   2HG1  VAL  64          2HG1      VAL  64   0.451  -2.500  -3.525
  490   3HG1  VAL  64          3HG1      VAL  64   2.054  -2.053  -2.941
  491   1HG2  VAL  64          1HG2      VAL  64  -1.231  -0.962  -3.799
  492   2HG2  VAL  64          2HG2      VAL  64  -0.493   0.571  -4.265
  493   3HG2  VAL  64          3HG2      VAL  64  -1.346   0.435  -2.729
  494    H    ASP  65           H        ASP  65   0.860  -3.360  -1.237
  495    HA   ASP  65           HA       ASP  65  -1.777  -4.365  -1.792
  496   1HB   ASP  65          2HB       ASP  65   0.725  -5.436  -2.044
  497   2HB   ASP  65          1HB       ASP  65   0.167  -6.231  -0.575
  498    H    GLU  66           H        GLU  66  -3.336  -4.132  -0.329
  499    HA   GLU  66           HA       GLU  66  -2.893  -3.936   2.490
  500   1HB   GLU  66          2HB       GLU  66  -5.501  -4.573   1.086
  501   2HB   GLU  66          1HB       GLU  66  -5.302  -3.903   2.705
  502   1HG   GLU  66          2HG       GLU  66  -4.155  -1.918   1.668
  503   2HG   GLU  66          1HG       GLU  66  -4.575  -2.570   0.084
  504    H    ASP  67           H        ASP  67  -4.102  -6.499   0.364
  505    HA   ASP  67           HA       ASP  67  -4.363  -8.392   2.550
  506   1HB   ASP  67          2HB       ASP  67  -4.838 -10.032   0.659
  507   2HB   ASP  67          1HB       ASP  67  -5.971  -8.694   0.831
  508    H    GLY  68           H        GLY  68  -2.086  -7.777  -0.089
  509   1HA   GLY  68          2HA       GLY  68   0.132  -8.402  -0.301
  510   2HA   GLY  68          1HA       GLY  68   0.032  -9.152   1.289
  511    H    SER  69           H        SER  69  -1.782  -9.720  -1.716
  512    HA   SER  69           HA       SER  69  -1.468 -12.599  -1.416
  513   1HB   SER  69          2HB       SER  69  -2.945 -12.697  -3.421
  514   2HB   SER  69          1HB       SER  69  -3.642 -11.773  -2.094
  515    HG   SER  69           HG       SER  69  -3.588 -10.062  -3.317
  516    H    GLY  70           H        GLY  70   0.260 -10.119  -3.002
  517   1HA   GLY  70          2HA       GLY  70   2.250 -10.395  -4.216
  518   2HA   GLY  70          1HA       GLY  70   1.833 -12.084  -4.488
  519    H    THR  71           H        THR  71  -0.643  -9.739  -5.034
  520    HA   THR  71           HA       THR  71  -0.109  -9.588  -7.916
  521    HB   THR  71           HB       THR  71  -2.371 -10.290  -8.488
  522    HG1  THR  71           HG1      THR  71  -3.804 -10.124  -6.982
  523   1HG2  THR  71          1HG2      THR  71  -2.232 -12.663  -7.869
  524   2HG2  THR  71          2HG2      THR  71  -1.070 -12.271  -6.600
  525   3HG2  THR  71          3HG2      THR  71  -0.637 -12.041  -8.294
  526    H    VAL  72           H        VAL  72  -0.579  -7.608  -8.710
  527    HA   VAL  72           HA       VAL  72  -1.797  -5.682  -6.857
  528    HB   VAL  72           HB       VAL  72  -0.605  -4.974  -9.531
  529   1HG1  VAL  72          1HG1      VAL  72  -1.935  -3.316  -8.170
  530   2HG1  VAL  72          2HG1      VAL  72  -0.271  -2.823  -8.482
  531   3HG1  VAL  72          3HG1      VAL  72  -0.718  -3.469  -6.902
  532   1HG2  VAL  72          1HG2      VAL  72   1.118  -6.287  -8.397
  533   2HG2  VAL  72          2HG2      VAL  72   0.848  -5.394  -6.898
  534   3HG2  VAL  72          3HG2      VAL  72   1.538  -4.574  -8.300
  535    H    ASP  73           H        ASP  73  -3.850  -5.159  -7.023
  536    HA   ASP  73           HA       ASP  73  -5.386  -5.832  -9.414
  537   1HB   ASP  73          2HB       ASP  73  -6.147  -5.973  -6.878
  538   2HB   ASP  73          1HB       ASP  73  -6.524  -4.270  -7.122
  539    H    PHE  74           H        PHE  74  -6.892  -4.074 -10.284
  540    HA   PHE  74           HA       PHE  74  -5.357  -1.915 -11.224
  541   1HB   PHE  74          2HB       PHE  74  -7.455  -2.846 -12.300
  542   2HB   PHE  74          1HB       PHE  74  -8.375  -1.924 -11.109
  543    HD1  PHE  74           HD1      PHE  74  -5.191  -1.084 -12.868
  544    HD2  PHE  74           HD2      PHE  74  -9.343  -0.154 -12.310
  545    HE1  PHE  74           HE1      PHE  74  -4.919   0.956 -14.243
  546    HE2  PHE  74           HE2      PHE  74  -9.074   1.888 -13.688
  547    HZ   PHE  74           HZ       PHE  74  -6.863   2.444 -14.656
  548    H    ASP  75           H        ASP  75  -7.344  -2.267  -8.361
  549    HA   ASP  75           HA       ASP  75  -7.557   0.525  -7.736
  550   1HB   ASP  75          2HB       ASP  75  -7.761  -1.900  -5.927
  551   2HB   ASP  75          1HB       ASP  75  -8.228  -0.256  -5.491
  552    H    GLU  76           H        GLU  76  -5.427  -2.130  -6.670
  553    HA   GLU  76           HA       GLU  76  -3.801  -0.569  -4.926
  554   1HB   GLU  76          2HB       GLU  76  -3.068  -3.107  -6.419
  555   2HB   GLU  76          1HB       GLU  76  -2.228  -2.446  -5.018
  556   1HG   GLU  76          2HG       GLU  76  -4.106  -2.849  -3.587
  557   2HG   GLU  76          1HG       GLU  76  -5.161  -3.195  -4.956
  558    H    PHE  77           H        PHE  77  -3.768  -1.255  -8.359
  559    HA   PHE  77           HA       PHE  77  -1.168  -0.379  -9.011
  560   1HB   PHE  77          2HB       PHE  77  -3.209  -1.547 -10.373
  561   2HB   PHE  77          1HB       PHE  77  -3.343   0.097 -10.969
  562    HD1  PHE  77           HD1      PHE  77  -2.810  -0.748 -13.205
  563    HD2  PHE  77           HD2      PHE  77   0.001  -1.092  -9.960
  564    HE1  PHE  77           HE1      PHE  77  -0.982  -1.187 -14.817
  565    HE2  PHE  77           HE2      PHE  77   1.818  -1.514 -11.582
  566    HZ   PHE  77           HZ       PHE  77   1.330  -1.571 -14.012
  567    H    LEU  78           H        LEU  78  -4.302   1.324  -9.128
  568    HA   LEU  78           HA       LEU  78  -3.158   3.843  -9.883
  569   1HB   LEU  78          2HB       LEU  78  -5.853   2.891  -9.037
  570   2HB   LEU  78          1HB       LEU  78  -5.516   4.610  -8.942
  571    HG   LEU  78           HG       LEU  78  -5.223   4.779 -11.297
  572   1HD1  LEU  78          1HD1      LEU  78  -5.070   2.878 -12.787
  573   2HD1  LEU  78          2HD1      LEU  78  -5.365   1.757 -11.459
  574   3HD1  LEU  78          3HD1      LEU  78  -3.864   2.680 -11.517
  575   1HD2  LEU  78          1HD2      LEU  78  -7.560   4.621 -10.668
  576   2HD2  LEU  78          2HD2      LEU  78  -7.477   2.859 -10.649
  577   3HD2  LEU  78          3HD2      LEU  78  -7.334   3.733 -12.175
  578    H    VAL  79           H        VAL  79  -3.918   2.286  -6.826
  579    HA   VAL  79           HA       VAL  79  -3.831   4.557  -5.144
  580    HB   VAL  79           HB       VAL  79  -3.568   1.606  -4.767
  581   1HG1  VAL  79          1HG1      VAL  79  -3.078   1.951  -2.341
  582   2HG1  VAL  79          2HG1      VAL  79  -2.743   3.648  -2.683
  583   3HG1  VAL  79          3HG1      VAL  79  -1.725   2.388  -3.385
  584   1HG2  VAL  79          1HG2      VAL  79  -5.483   1.902  -3.419
  585   2HG2  VAL  79          2HG2      VAL  79  -5.704   3.074  -4.719
  586   3HG2  VAL  79          3HG2      VAL  79  -5.131   3.608  -3.138
  587    H    MET  80           H        MET  80  -1.314   2.217  -6.071
  588    HA   MET  80           HA       MET  80   0.874   3.099  -4.687
  589   1HB   MET  80          2HB       MET  80   0.451   1.425  -6.878
  590   2HB   MET  80          1HB       MET  80   1.594   2.631  -7.467
  591   1HG   MET  80          2HG       MET  80   2.934   2.220  -5.339
  592   2HG   MET  80          1HG       MET  80   1.890   0.827  -5.055
  593   1HE   MET  80          1HE       MET  80   1.316  -0.165  -8.104
  594   2HE   MET  80          2HE       MET  80   1.505  -1.040  -6.587
  595   3HE   MET  80          3HE       MET  80   2.468  -1.502  -7.987
  596    H    MET  81           H        MET  81  -0.612   4.652  -7.504
  597    HA   MET  81           HA       MET  81   1.481   6.503  -8.046
  598   1HB   MET  81          2HB       MET  81  -0.355   6.019  -9.642
  599   2HB   MET  81          1HB       MET  81  -1.489   6.822  -8.561
  600   1HG   MET  81          2HG       MET  81  -0.853   8.871  -9.268
  601   2HG   MET  81          1HG       MET  81   0.856   8.477  -9.093
  602   1HE   MET  81          1HE       MET  81   2.452   7.913 -11.150
  603   2HE   MET  81          2HE       MET  81   1.834   6.715 -12.284
  604   3HE   MET  81          3HE       MET  81   1.708   6.424 -10.552
  605    H    VAL  82           H        VAL  82  -1.643   6.974  -6.367
  606    HA   VAL  82           HA       VAL  82  -1.034   9.571  -5.403
  607    HB   VAL  82           HB       VAL  82  -2.952   9.245  -3.871
  608   1HG1  VAL  82          1HG1      VAL  82  -3.499   9.971  -6.086
  609   2HG1  VAL  82          2HG1      VAL  82  -4.635   8.679  -5.701
  610   3HG1  VAL  82          3HG1      VAL  82  -3.254   8.355  -6.749
  611   1HG2  VAL  82          1HG2      VAL  82  -3.174   6.467  -5.052
  612   2HG2  VAL  82          2HG2      VAL  82  -4.119   7.162  -3.737
  613   3HG2  VAL  82          3HG2      VAL  82  -2.418   6.775  -3.489
  614    H    ARG  83           H        ARG  83  -0.373   6.361  -4.163
  615    HA   ARG  83           HA       ARG  83   0.168   6.867  -1.476
  616   1HB   ARG  83          2HB       ARG  83   1.345   4.918  -3.448
  617   2HB   ARG  83          1HB       ARG  83   1.936   4.996  -1.789
  618   1HG   ARG  83          2HG       ARG  83  -0.571   4.820  -1.120
  619   2HG   ARG  83          1HG       ARG  83  -0.816   4.255  -2.773
  620   1HD   ARG  83          2HD       ARG  83  -0.479   2.323  -1.357
  621   2HD   ARG  83          1HD       ARG  83   0.934   2.512  -2.382
  622    HE   ARG  83           HE       ARG  83   0.808   3.215   0.495
  623   1HH1  ARG  83          2HH1      ARG  83   2.648   2.452  -2.393
  624   2HH1  ARG  83          1HH1      ARG  83   4.149   2.341  -1.546
  625   1HH2  ARG  83          1HH2      ARG  83   2.798   3.070   1.561
  626   2HH2  ARG  83          2HH2      ARG  83   4.238   2.691   0.676
  627    H    CYS  84           H        CYS  84   2.165   7.422  -4.339
  628    HA   CYS  84           HA       CYS  84   4.469   8.260  -2.785
  629   1HB   CYS  84          2HB       CYS  84   4.475   7.138  -5.133
  630   2HB   CYS  84          1HB       CYS  84   4.140   8.761  -5.732
  631    HG   CYS  84           HG       CYS  84   6.832   7.974  -5.242
  632    H    MET  85           H        MET  85   2.032   9.819  -4.877
  633    HA   MET  85           HA       MET  85   3.015  12.455  -4.698
  634   1HB   MET  85          2HB       MET  85   1.201  11.587  -6.265
  635   2HB   MET  85          1HB       MET  85   0.085  11.738  -4.909
  636   1HG   MET  85          2HG       MET  85   0.553  14.116  -4.722
  637   2HG   MET  85          1HG       MET  85   1.801  14.004  -5.962
  638   1HE   MET  85          1HE       MET  85   0.290  16.134  -6.595
  639   2HE   MET  85          2HE       MET  85  -1.170  15.767  -5.681
  640   3HE   MET  85          3HE       MET  85  -1.271  16.030  -7.420
  641    H    LYS  86           H        LYS  86   0.205  11.091  -2.949
  642    HA   LYS  86           HA       LYS  86   0.737  13.017  -0.768
  643   1HB   LYS  86          2HB       LYS  86  -1.505  13.116  -1.972
  644   2HB   LYS  86          1HB       LYS  86  -1.854  11.547  -1.246
  645   1HG   LYS  86          2HG       LYS  86  -0.815  13.374   0.751
  646   2HG   LYS  86          1HG       LYS  86  -2.215  14.078  -0.059
  647   1HD   LYS  86          2HD       LYS  86  -2.404  11.206   0.732
  648   2HD   LYS  86          1HD       LYS  86  -2.472  12.404   2.026
  649   1HE   LYS  86          2HE       LYS  86  -4.732  12.167   1.395
  650   2HE   LYS  86          1HE       LYS  86  -4.218  13.613   0.529
  651   1HZ   LYS  86          1HZ       LYS  86  -4.082  12.468  -1.468
  652   2HZ   LYS  86          2HZ       LYS  86  -5.476  11.812  -0.754
  653   3HZ   LYS  86          3HZ       LYS  86  -4.017  10.944  -0.724
  654    H    ASP  87           H        ASP  87   1.108  12.303   1.235
  655    HA   ASP  87           HA       ASP  87   0.372   9.714   2.205
  656   1HB   ASP  87          2HB       ASP  87   2.401   9.344   0.597
  657   2HB   ASP  87          1HB       ASP  87   3.350  10.027   1.915
  658    H    ASP  88           H        ASP  88   2.689  12.397   2.492
  659    HA   ASP  88           HA       ASP  88   2.440  12.277   5.435
  660   1HB   ASP  88          2HB       ASP  88   4.501  13.556   3.630
  661   2HB   ASP  88          1HB       ASP  88   4.412  13.877   5.362
  662    H    SER  89           HN       SER  89   2.504  14.617   2.731
  663    HA   SER  89           HA       SER  89   0.624  16.308   4.265
  664   1HB   SER  89          2HB       SER  89   3.136  17.139   2.824
  665   2HB   SER  89          1HB       SER  89   1.806  18.272   3.054
  666    HG   SER  89           HG       SER  89   2.684  18.543   4.949