*HEADER    SIGNALING PROTEIN                       27-OCT-00   1G4F              
*TITLE     NMR STRUCTURE OF THE FIFTH DOMAIN OF HUMAN BETA2-                     
*TITLE    2 GLYCOPROTEIN I                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BETA2-GLYCOPROTEIN I;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: PICHIA PASTORIS;                                  
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BUDDING YEAST                              
*KEYWDS    SHORT CONSENSUS REPEAT, SUSHI-DOMAIN                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.HOSHINO, Y.HAGIHARA, I.NISHII, T.YAMAZAKI, H.KATO, Y.GOTO           
*REVDAT   1   15-NOV-00 1G4F    0                                                

!----- constraint file for xplor 3.1 -----

!----- noe constraints from n15-noesy experiment -----
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assign (resid  57 and name HG2#)  (resid  58 and name HN) 5.0 3.2 1.0
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assign (resid  57 and name HN)  (resid  60 and name HG2#) 5.0 3.2 1.0
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assign (resid  61 and name HA)  (resid  62 and name HN) 3.0 1.2 0.0
assign (resid  61 and name HB)  (resid  62 and name HN) 4.0 2.2 0.0
assign (resid  61 and name HB)  (resid  61 and name HN) 4.0 2.2 0.0
assign (resid  61 and name HG1#)  (resid  62 and name HN) 3.0 1.2 0.9
assign (resid  61 and name HG1#)  (resid  61 and name HN) 5.0 3.2 0.9
assign (resid  61 and name HG2#)  (resid  62 and name HN) 5.0 3.2 1.0
assign (resid  61 and name HG2#)  (resid  61 and name HN) 4.0 2.2 1.0
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assign (resid  10 and name HB#)  (resid  10 and name HN) 5.0 3.2 0.9
assign (resid  10 and name HB#)  (resid  11 and name HN) 4.0 2.2 0.9
assign (resid  10 and name HN)  (resid  11 and name HN) 4.0 2.2 0.0
assign (resid  11 and name HA)  (resid  12 and name HN) 3.0 1.2 0.0
assign (resid  11 and name HA)  (resid  11 and name HN) 3.0 1.2 0.0
assign (resid  11 and name HA)  (resid  24 and name HN) 5.0 3.2 0.0
assign (resid  11 and name HB#)  (resid  12 and name HN) 4.0 2.2 0.9
assign (resid  11 and name HB#)  (resid  11 and name HN) 4.0 2.2 0.9
assign (resid  11 and name HG#)  (resid  12 and name HN) 5.0 3.2 0.9
assign (resid  11 and name HG#)  (resid  11 and name HN) 5.0 3.2 0.9
assign (resid  11 and name HN)  (resid  12 and name HN) 5.0 3.2 0.0
assign (resid   2 and name HA)  (resid   3 and name HN) 3.0 1.2 0.0
assign (resid   2 and name HA)  (resid   2 and name HN) 4.0 2.2 0.0
assign (resid   2 and name HB#)  (resid  33 and name HN) 5.0 3.2 0.9
assign (resid   2 and name HB#)  (resid   2 and name HN) 4.0 2.2 0.9
assign (resid   2 and name HG#)  (resid   3 and name HN) 5.0 3.2 0.9
assign (resid   2 and name HN)  (resid   3 and name HN) 5.0 3.2 0.0
assign (resid  22 and name HA)  (resid  25 and name HN) 5.0 3.2 0.0
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assign (resid  22 and name HA)  (resid  22 and name HN) 3.0 1.2 0.0
assign (resid  22 and name HA)  (resid  24 and name HN) 5.0 3.2 0.0
assign (resid  22 and name HB1)  (resid  24 and name HE2#) 3.0 1.2 0.9
assign (resid  22 and name HE#)  (resid  22 and name HN) 5.0 3.2 0.9
assign (resid  22 and name HN)  (resid  25 and name HN) 5.0 3.2 0.0
assign (resid  22 and name HN)  (resid  23 and name HN) 5.0 3.2 0.0
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assign (resid  26 and name HA)  (resid  27 and name HN) 4.0 2.2 0.0
assign (resid  26 and name HA)  (resid  26 and name HN) 3.0 1.2 0.0
assign (resid  26 and name HB1)  (resid  27 and name HN) 3.0 1.2 0.0
assign (resid  26 and name HB1)  (resid  26 and name HN) 3.0 1.2 0.0
assign (resid  26 and name HB2)  (resid  26 and name HN) 3.0 1.2 0.0
assign (resid  26 and name HG#)  (resid  27 and name HN) 5.0 3.2 0.9
assign (resid  26 and name HG#)  (resid  26 and name HN) 5.0 3.2 0.9
assign (resid  28 and name HA)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid  28 and name HA)  (resid  28 and name HN) 3.0 1.2 0.0
assign (resid  28 and name HB#)  (resid  28 and name HN) 3.0 1.2 0.9
assign (resid  28 and name HD#)  (resid  28 and name HN) 3.0 1.2 0.9
assign (resid  28 and name HD#)  (resid  29 and name HD2#) 5.0 3.2 1.8
assign (resid  28 and name HG#)  (resid  28 and name HN) 4.0 2.2 0.9
assign (resid  28 and name HG#)  (resid  29 and name HD2#) 5.0 3.2 1.8
assign (resid  28 and name HN)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid  28 and name HN)  (resid  29 and name HN) 5.0 3.2 0.0
assign (resid  36 and name HA)  (resid  37 and name HN) 3.0 1.2 0.0
assign (resid  36 and name HB#)  (resid  36 and name HN) 3.0 1.2 0.9
assign (resid  36 and name HB#)  (resid  37 and name HN) 3.0 1.2 0.9
assign (resid  36 and name HE#)  (resid  55 and name HE2#) 5.0 3.2 1.8
assign (resid  36 and name HG#)  (resid  54 and name HN) 5.0 3.2 0.9
assign (resid  36 and name HG#)  (resid  36 and name HN) 4.0 2.2 0.9
assign (resid  36 and name HG#)  (resid  37 and name HN) 4.0 2.2 0.9
assign (resid  36 and name HN)  (resid  37 and name HG##) 5.0 3.2 2.6
assign (resid  42 and name HA)  (resid  48 and name HN) 5.0 3.2 0.0
assign (resid  42 and name HA)  (resid  42 and name HN) 4.0 2.2 0.0
assign (resid  42 and name HA)  (resid  43 and name HN) 3.0 1.2 0.0
assign (resid  42 and name HA)  (resid  50 and name HN) 4.0 2.2 0.0
assign (resid  42 and name HB1)  (resid  42 and name HN) 3.0 1.2 0.0
assign (resid  42 and name HB1)  (resid  43 and name HN) 4.0 2.2 0.0
assign (resid  42 and name HB2)  (resid  42 and name HN) 4.0 2.2 0.0
assign (resid  42 and name HB2)  (resid  43 and name HN) 5.0 3.2 0.0
assign (resid  42 and name HG#)  (resid  42 and name HN) 4.0 2.2 0.9
assign (resid  42 and name HG#)  (resid  43 and name HN) 5.0 3.2 0.9
assign (resid  42 and name HN)  (resid  43 and name HN) 5.0 3.2 0.0
assign (resid  44 and name HA)  (resid  45 and name HN) 4.0 2.2 0.0
assign (resid  44 and name HA)  (resid  44 and name HN) 5.0 3.2 0.0
assign (resid  44 and name HA)  (resid  47 and name HN) 5.0 3.2 0.0
assign (resid  44 and name HB#)  (resid  45 and name HN) 5.0 3.2 0.9
assign (resid  44 and name HB#)  (resid  44 and name HN) 5.0 3.2 0.9
assign (resid  44 and name HD#)  (resid  45 and name HN) 5.0 3.2 0.9
assign (resid  44 and name HN)  (resid  45 and name HN) 5.0 3.2 0.0
assign (resid  46 and name HA)  (resid  46 and name HN) 3.0 1.2 0.0
assign (resid  46 and name HA)  (resid  47 and name HN) 4.0 2.2 0.0
assign (resid  46 and name HB1)  (resid  48 and name HN) 4.0 2.2 0.0
assign (resid  46 and name HB1)  (resid  46 and name HN) 4.0 2.2 0.0
assign (resid  46 and name HB2)  (resid  46 and name HN) 3.0 1.2 0.0
assign (resid  46 and name HE#)  (resid  46 and name HN) 5.0 3.2 0.9
assign (resid  46 and name HG#)  (resid  46 and name HN) 4.0 2.2 0.9
assign (resid  46 and name HG#)  (resid  47 and name HN) 5.0 3.2 0.9
assign (resid  46 and name HN)  (resid  47 and name HA) 5.0 3.2 0.0
assign (resid  46 and name HN)  (resid  47 and name HG#) 5.0 3.2 0.9
assign (resid  46 and name HN)  (resid  47 and name HN) 3.0 1.2 0.0
assign (resid  47 and name HA)  (resid  48 and name HN) 3.0 1.2 0.0
assign (resid  47 and name HA)  (resid  47 and name HN) 3.0 1.2 0.0
assign (resid  47 and name HB1)  (resid  48 and name HN) 5.0 3.2 0.0
assign (resid  47 and name HB1)  (resid  47 and name HN) 4.0 2.2 0.0
assign (resid  47 and name HB2)  (resid  48 and name HN) 4.0 2.2 0.0
assign (resid  47 and name HB2)  (resid  47 and name HN) 4.0 2.2 0.0
assign (resid  47 and name HG#)  (resid  48 and name HN) 5.0 3.2 0.9
assign (resid  47 and name HG#)  (resid  47 and name HN) 4.0 2.2 0.9
assign (resid   6 and name HA)  (resid   6 and name HN) 3.0 1.2 0.0
assign (resid   6 and name HA)  (resid   7 and name HN) 3.0 1.2 0.0
assign (resid   6 and name HA)  (resid  31 and name HN) 5.0 3.2 0.0
assign (resid   6 and name HG#)  (resid   6 and name HN) 4.0 2.2 0.9
assign (resid  65 and name HA)  (resid  66 and name HN) 5.0 3.2 0.0
assign (resid  65 and name HA)  (resid  67 and name HN) 5.0 3.2 0.0
assign (resid  65 and name HA)  (resid  65 and name HN) 3.0 1.2 0.0
assign (resid  65 and name HB#)  (resid  66 and name HN) 4.0 2.2 0.9
assign (resid  65 and name HB#)  (resid  65 and name HN) 3.0 1.2 0.9
assign (resid  65 and name HD#)  (resid  65 and name HN) 5.0 3.2 0.9
assign (resid  65 and name HG#)  (resid  65 and name HN) 4.0 2.2 0.9
assign (resid  65 and name HN)  (resid  66 and name HN) 5.0 3.2 0.0
assign (resid  68 and name HA)  (resid  69 and name HN) 3.0 1.2 0.0
assign (resid  68 and name HA)  (resid  68 and name HN) 3.0 1.2 0.0
assign (resid  68 and name HB#)  (resid  69 and name HN) 4.0 2.2 0.9
assign (resid  68 and name HB#)  (resid  68 and name HN) 3.0 1.2 0.9
assign (resid  68 and name HG#)  (resid  69 and name HN) 5.0 3.2 0.9
assign (resid  68 and name HG#)  (resid  68 and name HN) 4.0 2.2 0.9
assign (resid  68 and name HN)  (resid  69 and name HB#) 5.0 3.2 0.9
assign (resid  77 and name HA)  (resid  78 and name HN) 5.0 3.2 0.0
assign (resid  77 and name HB#)  (resid  77 and name HN) 4.0 2.2 0.9
assign (resid  77 and name HG#)  (resid  78 and name HN) 5.0 3.2 0.9
assign (resid  84 and name HA)  (resid  84 and name HN) 4.0 2.2 0.0
assign (resid  84 and name HB#)  (resid  84 and name HN) 3.0 1.2 0.9
assign (resid  84 and name HD#)  (resid  84 and name HN) 5.0 3.2 0.9
assign (resid  84 and name HG#)  (resid  84 and name HN) 5.0 3.2 0.9
assign (resid  84 and name HN)  (resid  85 and name HD#) 5.0 3.2 0.9
assign (resid  32 and name HA)  (resid  33 and name HN) 3.0 1.2 0.0
assign (resid  32 and name HA)  (resid  32 and name HN) 3.0 1.2 0.0
assign (resid  32 and name HB1)  (resid  33 and name HN) 3.0 1.2 0.0
assign (resid  32 and name HB1)  (resid  32 and name HN) 4.0 2.2 0.0
assign (resid  32 and name HB2)  (resid  35 and name HN) 5.0 3.2 0.0
assign (resid  32 and name HB2)  (resid  33 and name HN) 4.0 2.2 0.0
assign (resid  32 and name HB2)  (resid  32 and name HN) 3.0 1.2 0.0
assign (resid  32 and name HD##)  (resid  33 and name HN) 5.0 3.2 2.6
assign (resid  32 and name HD##)  (resid  32 and name HN) 5.0 3.2 2.6
assign (resid  32 and name HN)  (resid  35 and name HB#) 5.0 3.2 0.9
assign (resid   7 and name HA)  (resid   9 and name HN) 4.0 2.2 0.0
assign (resid   7 and name HD##)  (resid  25 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  27 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  30 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  28 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid   7 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  31 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  24 and name HN) 5.0 3.2 2.6
assign (resid   7 and name HG)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid   7 and name HN)  (resid  30 and name HA#) 5.0 3.2 0.9
assign (resid   7 and name HN)  (resid   8 and name HD#) 5.0 3.2 0.9
assign (resid  73 and name HA)  (resid  74 and name HN) 5.0 3.2 0.0
assign (resid  73 and name HA)  (resid  73 and name HN) 5.0 3.2 0.0
assign (resid  31 and name HA)  (resid  32 and name HN) 3.0 1.2 0.0
assign (resid  31 and name HB1)  (resid  32 and name HN) 3.0 1.2 0.0
assign (resid  31 and name HB2)  (resid  31 and name HN) 3.0 1.2 0.0
assign (resid  31 and name HG#)  (resid  31 and name HN) 3.0 1.2 0.9
assign (resid  29 and name HA)  (resid  30 and name HN) 3.0 1.2 0.0
assign (resid  29 and name HB1)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid  29 and name HB1)  (resid  29 and name HD2#) 4.0 2.2 0.9
assign (resid  29 and name HB1)  (resid  29 and name HN) 5.0 3.2 0.0
assign (resid  29 and name HB2)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid  29 and name HB2)  (resid  29 and name HD2#) 4.0 2.2 0.9
assign (resid  29 and name HB2)  (resid  29 and name HN) 5.0 3.2 0.0
assign (resid  29 and name HN)  (resid  30 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HA)  (resid  48 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HA)  (resid  45 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HA)  (resid  44 and name HN) 4.0 2.2 0.0
assign (resid  43 and name HA)  (resid  43 and name HN) 4.0 2.2 0.0
assign (resid  43 and name HB1)  (resid  48 and name HN) 3.0 1.2 0.0
assign (resid  43 and name HB1)  (resid  46 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HB1)  (resid  47 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HB1)  (resid  43 and name HD2#) 5.0 3.2 0.9
assign (resid  43 and name HB1)  (resid  43 and name HN) 3.0 1.2 0.0
assign (resid  43 and name HB2)  (resid  48 and name HN) 4.0 2.2 0.0
assign (resid  43 and name HB2)  (resid  46 and name HN) 5.0 3.2 0.0
assign (resid  43 and name HB2)  (resid  43 and name HD2#) 4.0 2.2 0.9
assign (resid  43 and name HB2)  (resid  43 and name HN) 4.0 2.2 0.0
assign (resid  43 and name HD2#)  (resid  46 and name HE#) 5.0 3.2 1.8
assign (resid  43 and name HN)  (resid  48 and name HN) 4.0 2.2 0.0
assign (resid  43 and name HN)  (resid  49 and name HA) 4.0 2.2 0.0
assign (resid  43 and name HN)  (resid  50 and name HD#) 5.0 3.2 2.0
assign (resid  43 and name HN)  (resid  50 and name HE#) 4.0 2.2 2.0
assign (resid  43 and name HN)  (resid  50 and name HN) 5.0 3.2 0.0
assign (resid  64 and name HA)  (resid  65 and name HN) 3.0 1.2 0.0
assign (resid  64 and name HB#)  (resid  66 and name HN) 5.0 3.2 0.9
assign (resid  64 and name HB#)  (resid  67 and name HN) 3.0 1.2 0.9
assign (resid  64 and name HB#)  (resid  65 and name HN) 4.0 2.2 0.9
assign (resid   8 and name HD#)  (resid   9 and name HN) 4.0 2.2 0.9
assign (resid   8 and name HG#)  (resid   9 and name HN) 4.0 2.2 0.9
assign (resid  85 and name HA)  (resid  86 and name HN) 3.0 1.2 0.0
assign (resid  85 and name HB#)  (resid  86 and name HN) 4.0 2.2 0.9
assign (resid  85 and name HD#)  (resid  86 and name HN) 5.0 3.2 0.9
assign (resid  17 and name HA)  (resid  18 and name HN) 3.0 1.2 0.0
assign (resid  17 and name HA)  (resid  17 and name HN) 3.0 1.2 0.0
assign (resid  17 and name HB1)  (resid  18 and name HN) 5.0 3.2 0.0
assign (resid  17 and name HB1)  (resid  17 and name HE2#) 5.0 3.2 0.9
assign (resid  17 and name HB1)  (resid  17 and name HN) 4.0 2.2 0.0
assign (resid  17 and name HB2)  (resid  19 and name HN) 5.0 3.2 0.0
assign (resid  17 and name HE2#)  (resid  17 and name HG#) 4.0 2.2 1.8
assign (resid  17 and name HG#)  (resid  18 and name HN) 5.0 3.2 0.9
assign (resid  17 and name HG#)  (resid  17 and name HN) 4.0 2.2 0.9
assign (resid  17 and name HN)  (resid  19 and name HN) 5.0 3.2 0.0
assign (resid  17 and name HN)  (resid  18 and name HA#) 5.0 3.2 0.9
assign (resid  17 and name HN)  (resid  18 and name HN) 4.0 2.2 0.0
assign (resid  24 and name HA)  (resid  25 and name HN) 4.0 2.2 0.0
assign (resid  24 and name HA)  (resid  27 and name HN) 5.0 3.2 0.0
assign (resid  24 and name HA)  (resid  24 and name HN) 3.0 1.2 0.0
assign (resid  24 and name HB1)  (resid  25 and name HN) 5.0 3.2 0.0
assign (resid  24 and name HB1)  (resid  24 and name HE2#) 5.0 3.2 0.9
assign (resid  24 and name HB1)  (resid  24 and name HN) 3.0 1.2 0.0
assign (resid  24 and name HB2)  (resid  24 and name HN) 4.0 2.2 0.0
assign (resid  24 and name HE2#)  (resid  24 and name HG#) 4.0 2.2 1.8
assign (resid  24 and name HG#)  (resid  25 and name HN) 5.0 3.2 0.9
assign (resid  24 and name HG#)  (resid  24 and name HN) 4.0 2.2 0.9
assign (resid  24 and name HN)  (resid  25 and name HN) 3.0 1.2 0.0
assign (resid  24 and name HN)  (resid  26 and name HN) 5.0 3.2 0.0
assign (resid  55 and name HA)  (resid  56 and name HN) 3.0 1.2 0.0
assign (resid  55 and name HA)  (resid  55 and name HN) 4.0 2.2 0.0
assign (resid  55 and name HB2)  (resid  55 and name HE2#) 4.0 2.2 0.9
assign (resid  55 and name HB2)  (resid  55 and name HN) 3.0 1.2 0.0
assign (resid  55 and name HE2#)  (resid  57 and name HD1#) 5.0 3.2 1.9
assign (resid  55 and name HE2#)  (resid  55 and name HG#) 4.0 2.2 1.8
assign (resid  55 and name HG#)  (resid  56 and name HN) 3.0 1.2 0.9
assign (resid  55 and name HB1)  (resid  55 and name HN) 3.0 1.2 0.9
assign (resid  55 and name HN)  (resid  61 and name HG1#) 4.0 2.2 0.9
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assign (resid  20 and name HB1)  (resid  21 and name HN) 4.0 2.2 0.0
assign (resid  20 and name HB2)  (resid  20 and name HN) 3.0 1.2 0.0
assign (resid  20 and name HD#)  (resid  20 and name HN) 5.0 3.2 0.9
assign (resid  20 and name HG#)  (resid  20 and name HN) 4.0 2.2 0.9
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assign (resid  20 and name HN)  (resid  21 and name HG##) 5.0 3.2 2.6
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assign (resid   4 and name HA)  (resid   5 and name HN) 3.0 1.2 0.0
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assign (resid   4 and name HA)  (resid   4 and name HN) 3.0 1.2 0.0
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assign (resid   4 and name HB#)  (resid   4 and name HN) 3.0 1.2 0.9
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assign (resid  49 and name HB2)  (resid  49 and name HN) 5.0 3.2 0.0
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assign (resid  49 and name HN)  (resid  85 and name HB#) 5.0 3.2 0.9
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assign (resid  49 and name HN)  (resid  83 and name HG##) 5.0 3.2 2.6
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assign (resid  81 and name HN)  (resid  82 and name HN) 4.0 2.2 0.0
assign (resid  81 and name HN)  (resid  83 and name HN) 5.0 3.2 0.0
assign (resid   1 and name HB)  (resid   1 and name HN) 5.0 3.2 0.0
assign (resid   1 and name HN)  (resid  87 and name HA) 5.0 3.2 0.0
assign (resid  13 and name HA)  (resid  13 and name HN) 4.0 2.2 0.0
assign (resid  13 and name HA)  (resid  14 and name HN) 3.0 1.2 0.0
assign (resid  13 and name HA)  (resid  21 and name HN) 4.0 2.2 0.0
assign (resid  13 and name HB)  (resid  13 and name HN) 3.0 1.2 0.0
assign (resid  13 and name HB)  (resid  14 and name HN) 5.0 3.2 0.0
assign (resid  13 and name HG2#)  (resid  22 and name HN) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  13 and name HN) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  14 and name HN) 4.0 2.2 1.0
assign (resid  13 and name HG2#)  (resid  21 and name HN) 5.0 3.2 1.0
assign (resid  13 and name HN)  (resid  14 and name HN) 5.0 3.2 0.0
assign (resid  51 and name HA)  (resid  52 and name HN) 3.0 1.2 0.0
assign (resid  51 and name HA)  (resid  51 and name HN) 4.0 2.2 0.0
assign (resid  51 and name HB)  (resid  52 and name HN) 3.0 1.2 0.0
assign (resid  51 and name HB)  (resid  51 and name HN) 5.0 3.2 0.0
assign (resid  51 and name HG2#)  (resid  52 and name HN) 5.0 3.2 1.0
assign (resid  51 and name HG2#)  (resid  51 and name HN) 5.0 3.2 1.0
assign (resid  51 and name HN)  (resid  52 and name HN) 5.0 3.2 0.0
assign (resid  60 and name HA)  (resid  61 and name HN) 3.0 1.2 0.0
assign (resid  60 and name HA)  (resid  60 and name HN) 3.0 1.2 0.0
assign (resid  60 and name HB)  (resid  61 and name HN) 4.0 2.2 0.0
assign (resid  60 and name HB)  (resid  60 and name HN) 3.0 1.2 0.0
assign (resid  60 and name HG2#)  (resid  62 and name HN) 5.0 3.2 1.0
assign (resid  60 and name HG2#)  (resid  61 and name HN) 4.0 2.2 1.0
assign (resid  60 and name HG2#)  (resid  60 and name HN) 4.0 2.2 1.0
assign (resid  60 and name HN)  (resid  61 and name HB) 5.0 3.2 0.0
assign (resid  60 and name HN)  (resid  61 and name HN) 5.0 3.2 0.0
assign (resid  78 and name HA)  (resid  79 and name HN) 3.0 1.2 0.0
assign (resid  78 and name HB)  (resid  78 and name HN) 5.0 3.2 0.0
assign (resid  78 and name HG2#)  (resid  79 and name HN) 5.0 3.2 1.0
assign (resid  78 and name HG2#)  (resid  82 and name HN) 5.0 3.2 1.0
assign (resid  78 and name HG2#)  (resid  83 and name HN) 5.0 3.2 1.0
assign (resid  14 and name HA)  (resid  15 and name HN) 3.0 1.2 0.0
assign (resid  23 and name HB)  (resid  23 and name HN) 3.0 1.2 0.0
assign (resid  14 and name HB)  (resid  14 and name HN) 4.0 2.2 0.0
assign (resid  14 and name HG##)  (resid  40 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  23 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  38 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  14 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  15 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  21 and name HN) 5.0 3.2 2.6
assign (resid  14 and name HN)  (resid  15 and name HN) 5.0 3.2 0.0
assign (resid  14 and name HN)  (resid  21 and name HG##) 5.0 3.2 2.6
assign (resid  14 and name HN)  (resid  21 and name HN) 4.0 2.2 0.0
assign (resid  15 and name HB)  (resid  15 and name HN) 3.0 1.2 0.0
assign (resid  15 and name HG##)  (resid  38 and name HN) 5.0 3.2 2.6
assign (resid  15 and name HG##)  (resid  15 and name HN) 4.0 2.2 2.6
assign (resid  15 and name HG##)  (resid  21 and name HN) 5.0 3.2 2.6
assign (resid  15 and name HG##)  (resid  16 and name HN) 4.0 2.2 2.6
assign (resid  15 and name HN)  (resid  38 and name HB1) 5.0 3.2 0.0
assign (resid  15 and name HN)  (resid  38 and name HB2) 4.0 2.2 0.0
assign (resid  15 and name HN)  (resid  37 and name HA) 4.0 2.2 0.0
assign (resid  15 and name HN)  (resid  16 and name HN) 5.0 3.2 0.0
assign (resid  21 and name HB)  (resid  22 and name HN) 3.0 1.2 0.0
assign (resid  21 and name HB)  (resid  21 and name HN) 4.0 2.2 0.0
assign (resid  21 and name HG##)  (resid  23 and name HN) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  22 and name HN) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  26 and name HN) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  21 and name HN) 5.0 3.2 2.6
assign (resid  21 and name HN)  (resid  22 and name HN) 5.0 3.2 0.0
assign (resid  37 and name HA)  (resid  38 and name HN) 3.0 1.2 0.0
assign (resid  37 and name HG##)  (resid  54 and name HN) 5.0 3.2 2.6
assign (resid  37 and name HG##)  (resid  38 and name HN) 5.0 3.2 2.6
assign (resid  37 and name HG##)  (resid  37 and name HN) 5.0 3.2 2.6
assign (resid  37 and name HN)  (resid  54 and name HN) 4.0 2.2 0.0
assign (resid  37 and name HN)  (resid  55 and name HG#) 5.0 3.2 0.9
assign (resid  63 and name HA)  (resid  63 and name HN) 3.0 1.2 0.0
assign (resid  63 and name HB)  (resid  63 and name HN) 3.0 1.2 0.0
assign (resid  63 and name HG##)  (resid  67 and name HN) 5.0 3.2 2.6
assign (resid  63 and name HG##)  (resid  63 and name HN) 5.0 3.2 2.6
assign (resid  63 and name HN)  (resid  64 and name HD#) 5.0 3.2 0.9
assign (resid  83 and name HA)  (resid  84 and name HN) 3.0 1.2 0.0
assign (resid  83 and name HA)  (resid  83 and name HN) 3.0 1.2 0.0
assign (resid  83 and name HB)  (resid  84 and name HN) 4.0 2.2 0.0
assign (resid  83 and name HB)  (resid  83 and name HN) 3.0 1.2 0.0
assign (resid  83 and name HG##)  (resid  84 and name HN) 5.0 3.2 2.6
assign (resid  83 and name HG##)  (resid  83 and name HN) 5.0 3.2 2.6
assign (resid  83 and name HN)  (resid  84 and name HN) 5.0 3.2 0.0
assign (resid   9 and name HA)  (resid   9 and name HN) 3.0 1.2 0.0
assign (resid   9 and name HB)  (resid  10 and name HN) 4.0 2.2 0.0
assign (resid   9 and name HB)  (resid  11 and name HN) 3.0 1.2 0.0
assign (resid   9 and name HB)  (resid   9 and name HN) 3.0 1.2 0.0
assign (resid   9 and name HG##)  (resid  10 and name HN) 5.0 3.2 2.6
assign (resid   9 and name HG##)  (resid  11 and name HN) 5.0 3.2 2.6
assign (resid   9 and name HG##)  (resid   9 and name HN) 4.0 2.2 2.6
assign (resid  76 and name HA)  (resid  76 and name HN) 5.0 3.2 0.0
assign (resid  76 and name HB#)  (resid  76 and name HN) 4.0 2.2 0.9
assign (resid  76 and name HD1)  (resid  76 and name HE1) 3.0 1.2 0.0
assign (resid  76 and name HE1)  (resid  76 and name HZ2) 4.0 2.2 0.0
assign (resid  16 and name HA)  (resid  19 and name HN) 5.0 3.2 0.0
assign (resid  16 and name HA)  (resid  18 and name HN) 5.0 3.2 0.0
assign (resid  16 and name HA)  (resid  17 and name HN) 3.0 1.2 0.0
assign (resid  16 and name HA)  (resid  16 and name HN) 4.0 2.2 0.0
assign (resid  16 and name HB#)  (resid  19 and name HN) 5.0 3.2 0.9
assign (resid  16 and name HB#)  (resid  17 and name HN) 5.0 3.2 0.9
assign (resid  16 and name HB#)  (resid  21 and name HN) 5.0 3.2 0.9
assign (resid  16 and name HB#)  (resid  16 and name HN) 4.0 2.2 0.9
assign (resid  16 and name HD#)  (resid  36 and name HN) 5.0 3.2 2.0
assign (resid  16 and name HD#)  (resid  17 and name HN) 4.0 2.2 2.0
assign (resid  16 and name HD#)  (resid  38 and name HN) 5.0 3.2 2.0
assign (resid  16 and name HD#)  (resid  16 and name HN) 4.0 2.2 2.0
assign (resid  16 and name HE#)  (resid  35 and name HN) 5.0 3.2 2.0
assign (resid  16 and name HE#)  (resid  36 and name HN) 3.0 1.2 2.0
assign (resid  16 and name HE#)  (resid  17 and name HN) 5.0 3.2 2.0
assign (resid  16 and name HN)  (resid  19 and name HN) 4.0 2.2 0.0
assign (resid  16 and name HN)  (resid  18 and name HN) 5.0 3.2 0.0
assign (resid  16 and name HN)  (resid  20 and name HA) 4.0 2.2 0.0
assign (resid  16 and name HN)  (resid  21 and name HG##) 5.0 3.2 2.6
assign (resid  50 and name HA)  (resid  51 and name HN) 3.0 1.2 0.0
assign (resid  50 and name HA)  (resid  50 and name HN) 4.0 2.2 0.0
assign (resid  50 and name HB1)  (resid  51 and name HN) 4.0 2.2 0.0
assign (resid  50 and name HB1)  (resid  50 and name HN) 4.0 2.2 0.0
assign (resid  50 and name HB2)  (resid  51 and name HN) 3.0 1.2 0.0
assign (resid  50 and name HB2)  (resid  50 and name HN) 5.0 3.2 0.0
assign (resid  50 and name HD#)  (resid  51 and name HN) 3.0 1.2 2.0
assign (resid  50 and name HD#)  (resid  50 and name HN) 3.0 1.2 2.0
assign (resid  50 and name HE#)  (resid  51 and name HN) 5.0 3.2 2.0
assign (resid  50 and name HE#)  (resid  50 and name HN) 5.0 3.2 2.0
assign (resid  50 and name HN)  (resid  51 and name HN) 5.0 3.2 0.0
assign (resid  50 and name HN)  (resid  83 and name HB) 5.0 3.2 0.0

!----- noe constraints from c13-noesy experiment -----
assign (resid  12 and name HA)  (resid  12 and name HB#) 3.0 1.2 1.0
assign (resid  12 and name HA)  (resid  23 and name HG2#) 5.0 3.2 1.0
assign (resid  12 and name HB#)  (resid  39 and name HD#) 5.0 3.2 3.0
assign (resid  12 and name HB#)  (resid  39 and name HE#) 4.0 2.2 3.0
assign (resid  12 and name HB#)  (resid  39 and name HZ) 4.0 2.2 1.0
assign (resid  12 and name HB#)  (resid  67 and name HD#) 5.0 3.2 3.0
assign (resid  12 and name HB#)  (resid  67 and name HE#) 4.0 2.2 3.0
assign (resid  12 and name HB#)  (resid  67 and name HZ) 4.0 2.2 1.0
assign (resid  12 and name HB#)  (resid  23 and name HB) 5.0 3.2 1.0
assign (resid  12 and name HB#)  (resid  23 and name HD1#) 5.0 3.2 2.0
assign (resid  12 and name HB#)  (resid  23 and name HG2#) 4.0 2.2 2.0
assign (resid  12 and name HB#)  (resid  13 and name HA) 5.0 3.2 1.0
assign (resid  12 and name HB#)  (resid  14 and name HG##) 5.0 3.2 3.6
assign (resid   3 and name HA)  (resid   3 and name HB#) 3.0 1.2 1.0
assign (resid   3 and name HB#)  (resid  58 and name HA) 4.0 2.2 1.0
assign (resid   3 and name HB#)  (resid  59 and name HA#) 4.0 2.2 1.9
assign (resid  54 and name HA)  (resid  54 and name HB#) 3.0 1.2 1.0
assign (resid  54 and name HB#)  (resid  61 and name HD1#) 4.0 2.2 2.0
assign (resid  54 and name HB#)  (resid  61 and name HG1#) 5.0 3.2 1.9
assign (resid  54 and name HB#)  (resid  64 and name HD#) 5.0 3.2 1.9
assign (resid  54 and name HB#)  (resid  64 and name HG#) 5.0 3.2 1.9
assign (resid  54 and name HB#)  (resid  63 and name HA) 4.0 2.2 1.0
assign (resid  54 and name HB#)  (resid  63 and name HG##) 5.0 3.2 3.6
assign (resid  74 and name HA)  (resid  74 and name HB#) 3.0 1.2 1.0
assign (resid  80 and name HA)  (resid  80 and name HB#) 3.0 1.2 1.0
assign (resid  80 and name HA)  (resid  83 and name HB) 4.0 2.2 0.0
assign (resid  80 and name HA)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  80 and name HB#)  (resid  83 and name HB) 5.0 3.2 1.0
assign (resid  80 and name HB#)  (resid  83 and name HG##) 5.0 3.2 3.6
assign (resid  41 and name HA)  (resid  80 and name HB#) 4.0 2.2 1.0
assign (resid  41 and name HA)  (resid  41 and name HB1) 3.0 1.2 0.0
assign (resid  41 and name HA)  (resid  41 and name HB2) 3.0 1.2 0.0
assign (resid  41 and name HB1)  (resid  41 and name HB2) 3.0 1.2 0.0
assign (resid  41 and name HB1)  (resid  66 and name HB#) 4.0 2.2 0.9
assign (resid  41 and name HB1)  (resid  50 and name HE#) 4.0 2.2 2.0
assign (resid  41 and name HB2)  (resid  66 and name HB#) 4.0 2.2 0.9
assign (resid  41 and name HB2)  (resid  50 and name HE#) 3.0 1.2 2.0
assign (resid  48 and name HA)  (resid  48 and name HB1) 3.0 1.2 0.0
assign (resid  48 and name HA)  (resid  48 and name HB2) 3.0 1.2 0.0
assign (resid  48 and name HA)  (resid  86 and name HA) 4.0 2.2 0.0
assign (resid  48 and name HA)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  48 and name HB1)  (resid  48 and name HB2) 3.0 1.2 0.0
assign (resid  48 and name HB1)  (resid  86 and name HA) 3.0 1.2 0.0
assign (resid  48 and name HB1)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  48 and name HB2)  (resid  86 and name HA) 3.0 1.2 0.0
assign (resid  48 and name HB2)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid   5 and name HA)  (resid   5 and name HB1) 3.0 1.2 0.0
assign (resid   5 and name HA)  (resid   5 and name HB2) 3.0 1.2 0.0
assign (resid   5 and name HA)  (resid  59 and name HA#) 4.0 2.2 0.9
assign (resid   5 and name HB1)  (resid   5 and name HB2) 3.0 1.2 0.0
assign (resid   5 and name HB1)  (resid  61 and name HD1#) 5.0 3.2 1.0
assign (resid   5 and name HB1)  (resid  61 and name HG2#) 4.0 2.2 1.0
assign (resid   5 and name HB1)  (resid  31 and name HB1) 5.0 3.2 0.0
assign (resid   5 and name HB1)  (resid  31 and name HB2) 4.0 2.2 0.0
assign (resid   5 and name HB1)  (resid  31 and name HG#) 4.0 2.2 0.9
assign (resid   5 and name HB2)  (resid  61 and name HD1#) 5.0 3.2 1.0
assign (resid   5 and name HB2)  (resid  61 and name HG2#) 4.0 2.2 1.0
assign (resid   5 and name HB2)  (resid  31 and name HB1) 4.0 2.2 0.0
assign (resid   5 and name HB2)  (resid  31 and name HB2) 4.0 2.2 0.0
assign (resid  56 and name HA)  (resid  56 and name HB1) 3.0 1.2 0.0
assign (resid  56 and name HA)  (resid  56 and name HB2) 3.0 1.2 0.0
assign (resid  56 and name HA)  (resid  61 and name HB) 3.0 1.2 0.0
assign (resid  56 and name HA)  (resid  61 and name HD1#) 4.0 2.2 1.0
assign (resid  56 and name HA)  (resid  61 and name HG1#) 4.0 2.2 0.9
assign (resid  56 and name HA)  (resid  61 and name HG2#) 5.0 3.2 1.0
assign (resid  56 and name HB1)  (resid  61 and name HD1#) 5.0 3.2 1.0
assign (resid  56 and name HB2)  (resid  61 and name HD1#) 5.0 3.2 1.0
assign (resid  66 and name HA)  (resid  66 and name HB#) 3.0 1.2 0.9
assign (resid  86 and name HA)  (resid  86 and name HB1) 3.0 1.2 0.0
assign (resid  86 and name HA)  (resid  86 and name HB2) 3.0 1.2 0.0
assign (resid  86 and name HB1)  (resid  86 and name HB2) 3.0 1.2 0.0
assign (resid  35 and name HA)  (resid  35 and name HB#) 4.0 2.2 0.9
assign (resid  53 and name HA)  (resid  53 and name HB1) 3.0 1.2 0.0
assign (resid  53 and name HA)  (resid  53 and name HB2) 3.0 1.2 0.0
assign (resid  53 and name HB1)  (resid  53 and name HB2) 3.0 1.2 0.0
assign (resid  58 and name HA)  (resid  58 and name HB1) 3.0 1.2 0.0
assign (resid  58 and name HA)  (resid  58 and name HB2) 3.0 1.2 0.0
assign (resid  58 and name HB1)  (resid  58 and name HB2) 3.0 1.2 0.0
assign (resid  79 and name HA)  (resid  79 and name HB#) 3.0 1.2 0.9
assign (resid  82 and name HA)  (resid  82 and name HB1) 3.0 1.2 0.0
assign (resid  82 and name HA)  (resid  82 and name HB2) 3.0 1.2 0.0
assign (resid  19 and name HA)  (resid  19 and name HB#) 3.0 1.2 0.9
assign (resid  19 and name HA)  (resid  19 and name HG#) 4.0 2.2 0.9
assign (resid  19 and name HB#)  (resid  19 and name HG#) 3.0 1.2 1.8
assign (resid  19 and name HB#)  (resid  21 and name HG##) 5.0 3.2 3.5
assign (resid  19 and name HG#)  (resid  21 and name HG##) 5.0 3.2 3.5
assign (resid  25 and name HA)  (resid  25 and name HB1) 3.0 1.2 0.0
assign (resid  25 and name HA)  (resid  25 and name HB2) 3.0 1.2 0.0
assign (resid  25 and name HA)  (resid  25 and name HG#) 4.0 2.2 0.9
assign (resid  45 and name HA)  (resid  45 and name HB#) 3.0 1.2 0.9
assign (resid  45 and name HA)  (resid  45 and name HG#) 4.0 2.2 0.9
assign (resid  45 and name HB#)  (resid  45 and name HG#) 3.0 1.2 1.8
assign (resid  52 and name HA)  (resid  52 and name HB#) 3.0 1.2 0.9
assign (resid  52 and name HA)  (resid  52 and name HG#) 3.0 1.2 0.9
assign (resid  52 and name HB#)  (resid  52 and name HG#) 3.0 1.2 1.8
assign (resid  52 and name HB#)  (resid  64 and name HB#) 4.0 2.2 1.8
assign (resid  62 and name HA)  (resid  62 and name HB#) 3.0 1.2 0.9
assign (resid  62 and name HA)  (resid  62 and name HG#) 3.0 1.2 0.9
assign (resid  62 and name HA)  (resid  63 and name HG##) 5.0 3.2 2.6
assign (resid  62 and name HB#)  (resid  62 and name HG#) 3.0 1.2 1.8
assign (resid  69 and name HA)  (resid  69 and name HB#) 3.0 1.2 0.9
assign (resid  69 and name HA)  (resid  69 and name HG#) 3.0 1.2 0.9
assign (resid  69 and name HB#)  (resid  69 and name HG#) 4.0 2.2 1.8
assign (resid  27 and name HA)  (resid  27 and name HB1) 3.0 1.2 0.0
assign (resid  27 and name HA)  (resid  27 and name HB2) 4.0 2.2 0.0
assign (resid  27 and name HA)  (resid  27 and name HD#) 3.0 1.2 2.0
assign (resid  27 and name HA)  (resid  31 and name HA) 4.0 2.2 0.0
assign (resid  27 and name HB1)  (resid  27 and name HB2) 3.0 1.2 0.0
assign (resid  27 and name HB1)  (resid  27 and name HD#) 3.0 1.2 2.0
assign (resid  27 and name HB2)  (resid  27 and name HD#) 3.0 1.2 2.0
assign (resid  27 and name HD#)  (resid  27 and name HE#) 3.0 1.2 4.0
assign (resid  27 and name HD#)  (resid  31 and name HA) 3.0 1.2 2.0
assign (resid  27 and name HD#)  (resid  31 and name HG#) 4.0 2.2 2.9
assign (resid  27 and name HD#)  (resid  37 and name HG##) 5.0 3.2 4.6
assign (resid  27 and name HE#)  (resid  37 and name HG##) 4.0 2.2 4.6
assign (resid  27 and name HZ)  (resid  37 and name HG##) 4.0 2.2 2.6
assign (resid  39 and name HA)  (resid  39 and name HB1) 3.0 1.2 0.0
assign (resid  39 and name HA)  (resid  39 and name HB2) 3.0 1.2 0.0
assign (resid  39 and name HA)  (resid  39 and name HD#) 3.0 1.2 2.0
assign (resid  39 and name HB1)  (resid  39 and name HB2) 3.0 1.2 0.0
assign (resid  39 and name HB1)  (resid  39 and name HD#) 3.0 1.2 2.0
assign (resid  39 and name HB2)  (resid  39 and name HD#) 3.0 1.2 2.0
assign (resid  39 and name HD#)  (resid  54 and name HB#) 4.0 2.2 3.0
assign (resid  39 and name HD#)  (resid  39 and name HE#) 3.0 1.2 4.0
assign (resid  39 and name HD#)  (resid  39 and name HZ) 4.0 2.2 2.0
assign (resid  39 and name HD#)  (resid  67 and name HD#) 4.0 2.2 4.0
assign (resid  39 and name HD#)  (resid  67 and name HE#) 4.0 2.2 4.0
assign (resid  39 and name HD#)  (resid  64 and name HG#) 4.0 2.2 2.9
assign (resid  39 and name HE#)  (resid  54 and name HB#) 4.0 2.2 3.0
assign (resid  39 and name HE#)  (resid  63 and name HA) 4.0 2.2 2.0
assign (resid  39 and name HZ)  (resid  54 and name HB#) 4.0 2.2 1.0
assign (resid  40 and name HA)  (resid  80 and name HB#) 5.0 3.2 1.0
assign (resid  40 and name HA)  (resid  40 and name HB1) 4.0 2.2 0.0
assign (resid  40 and name HA)  (resid  40 and name HB2) 4.0 2.2 0.0
assign (resid  40 and name HA)  (resid  40 and name HD#) 3.0 1.2 2.0
assign (resid  40 and name HA)  (resid  51 and name HA) 3.0 1.2 0.0
assign (resid  40 and name HA)  (resid  51 and name HG2#) 4.0 2.2 1.0
assign (resid  40 and name HB1)  (resid  80 and name HA) 4.0 2.2 0.0
assign (resid  40 and name HB1)  (resid  80 and name HB#) 4.0 2.2 1.0
assign (resid  40 and name HB1)  (resid  40 and name HB2) 3.0 1.2 0.0
assign (resid  40 and name HB1)  (resid  40 and name HD#) 3.0 1.2 2.0
assign (resid  40 and name HB2)  (resid  80 and name HB#) 4.0 2.2 1.0
assign (resid  40 and name HB2)  (resid  40 and name HD#) 3.0 1.2 2.0
assign (resid  40 and name HD#)  (resid  80 and name HB#) 5.0 3.2 3.0
assign (resid  40 and name HD#)  (resid  40 and name HE#) 3.0 1.2 4.0
assign (resid  40 and name HD#)  (resid  81 and name HA) 4.0 2.2 2.0
assign (resid  40 and name HD#)  (resid  81 and name HB#) 4.0 2.2 2.9
assign (resid  40 and name HE#)  (resid  51 and name HG2#) 4.0 2.2 3.0
assign (resid  67 and name HA)  (resid  67 and name HB#) 3.0 1.2 0.9
assign (resid  67 and name HA)  (resid  67 and name HD#) 3.0 1.2 2.0
assign (resid  67 and name HB#)  (resid  67 and name HD#) 3.0 1.2 2.9
assign (resid  67 and name HD#)  (resid  67 and name HE#) 3.0 1.2 4.0
assign (resid  67 and name HD#)  (resid  67 and name HZ) 3.0 1.2 2.0
assign (resid  67 and name HE#)  (resid  69 and name HA) 4.0 2.2 2.0
assign (resid  67 and name HZ)  (resid  69 and name HA) 4.0 2.2 0.0
assign (resid  75 and name HA)  (resid  75 and name HB#) 3.0 1.2 0.9
assign (resid  75 and name HA)  (resid  75 and name HD#) 4.0 2.2 2.0
assign (resid  75 and name HB#)  (resid  75 and name HD#) 3.0 1.2 2.9
assign (resid  75 and name HD#)  (resid  75 and name HE#) 3.0 1.2 4.0
assign (resid  75 and name HD#)  (resid  75 and name HZ) 3.0 1.2 2.0
assign (resid  33 and name HA)  (resid  33 and name HB1) 3.0 1.2 0.0
assign (resid  33 and name HA)  (resid  33 and name HB2) 3.0 1.2 0.0
assign (resid  33 and name HA)  (resid  57 and name HA) 4.0 2.2 0.0
assign (resid  33 and name HB1)  (resid  33 and name HB2) 3.0 1.2 0.0
assign (resid  33 and name HB1)  (resid  33 and name HD2) 4.0 2.2 0.0
assign (resid  33 and name HB2)  (resid  33 and name HD2) 4.0 2.2 0.0
assign (resid  33 and name HE1)  (resid  57 and name HA) 3.0 1.2 0.0
assign (resid  33 and name HE1)  (resid  57 and name HD1#) 5.0 3.2 1.0
assign (resid  33 and name HE1)  (resid  57 and name HG2#) 3.0 1.2 1.0
assign (resid  70 and name HA)  (resid  70 and name HB#) 3.0 1.2 0.9
assign (resid  70 and name HA)  (resid  70 and name HD2) 4.0 2.2 0.0
assign (resid  70 and name HB#)  (resid  70 and name HD2) 4.0 2.2 0.9
assign (resid  23 and name HA)  (resid  27 and name HD#) 3.0 1.2 2.0
assign (resid  23 and name HA)  (resid  27 and name HE#) 4.0 2.2 2.0
assign (resid  23 and name HA)  (resid  23 and name HB) 3.0 1.2 0.0
assign (resid  23 and name HA)  (resid  23 and name HD1#) 4.0 2.2 1.0
assign (resid  23 and name HA)  (resid  23 and name HG1#) 4.0 2.2 0.9
assign (resid  23 and name HA)  (resid  23 and name HG2#) 4.0 2.2 1.0
assign (resid  23 and name HB)  (resid  27 and name HD#) 4.0 2.2 2.0
assign (resid  23 and name HB)  (resid  23 and name HD1#) 4.0 2.2 1.0
assign (resid  23 and name HB)  (resid  23 and name HG2#) 4.0 2.2 1.0
assign (resid  23 and name HD1#)  (resid  27 and name HD#) 5.0 3.2 3.0
assign (resid  23 and name HD1#)  (resid  23 and name HG1#) 4.0 2.2 1.9
assign (resid  23 and name HD1#)  (resid  23 and name HG2#) 4.0 2.2 2.0
assign (resid  23 and name HD1#)  (resid  37 and name HG##) 5.0 3.2 3.6
assign (resid  23 and name HG2#)  (resid  27 and name HD#) 5.0 3.2 3.0
assign (resid  23 and name HG2#)  (resid  24 and name HA) 5.0 3.2 1.0
assign (resid  57 and name HA)  (resid  57 and name HB) 4.0 2.2 0.0
assign (resid  57 and name HA)  (resid  57 and name HD1#) 4.0 2.2 1.0
assign (resid  57 and name HA)  (resid  57 and name HG1#) 4.0 2.2 0.9
assign (resid  57 and name HA)  (resid  57 and name HG2#) 4.0 2.2 1.0
assign (resid  57 and name HB)  (resid  57 and name HD1#) 4.0 2.2 1.0
assign (resid  57 and name HB)  (resid  57 and name HG1#) 3.0 1.2 0.9
assign (resid  57 and name HB)  (resid  57 and name HG2#) 3.0 1.2 1.0
assign (resid  57 and name HD1#)  (resid  57 and name HG1#) 3.0 1.2 1.9
assign (resid  57 and name HD1#)  (resid  57 and name HG2#) 4.0 2.2 2.0
assign (resid  57 and name HG1#)  (resid  57 and name HG2#) 4.0 2.2 1.9
assign (resid  57 and name HG2#)  (resid  58 and name HB1) 5.0 3.2 1.0
assign (resid  57 and name HG2#)  (resid  58 and name HB2) 5.0 3.2 1.0
assign (resid  57 and name HG2#)  (resid  60 and name HB) 5.0 3.2 1.0
assign (resid  61 and name HA)  (resid  61 and name HB) 3.0 1.2 0.0
assign (resid  61 and name HA)  (resid  61 and name HD1#) 3.0 1.2 1.0
assign (resid  61 and name HA)  (resid  61 and name HG1#) 4.0 2.2 0.9
assign (resid  61 and name HA)  (resid  61 and name HG2#) 4.0 2.2 1.0
assign (resid  61 and name HB)  (resid  61 and name HD1#) 4.0 2.2 1.0
assign (resid  61 and name HB)  (resid  61 and name HG1#) 4.0 2.2 0.9
assign (resid  61 and name HB)  (resid  61 and name HG2#) 4.0 2.2 1.0
assign (resid  61 and name HD1#)  (resid  61 and name HG1#) 3.0 1.2 1.9
assign (resid  61 and name HD1#)  (resid  61 and name HG2#) 4.0 2.2 2.0
assign (resid  61 and name HG1#)  (resid  61 and name HG2#) 4.0 2.2 1.9
assign (resid  10 and name HA)  (resid  10 and name HB#) 3.0 1.2 0.9
assign (resid  10 and name HA)  (resid  10 and name HG#) 4.0 2.2 0.9
assign (resid  11 and name HA)  (resid  23 and name HG2#) 5.0 3.2 1.0
assign (resid  11 and name HA)  (resid  11 and name HB#) 3.0 1.2 0.9
assign (resid  11 and name HA)  (resid  11 and name HD#) 4.0 2.2 0.9
assign (resid  11 and name HA)  (resid  11 and name HG#) 4.0 2.2 0.9
assign (resid  11 and name HA)  (resid  24 and name HB1) 4.0 2.2 0.0
assign (resid  11 and name HD#)  (resid  11 and name HE#) 3.0 1.2 1.8
assign (resid   2 and name HA)  (resid   3 and name HB#) 5.0 3.2 1.0
assign (resid   2 and name HA)  (resid  58 and name HA) 4.0 2.2 0.0
assign (resid   2 and name HA)  (resid   2 and name HD#) 4.0 2.2 0.9
assign (resid   2 and name HA)  (resid   2 and name HG#) 3.0 1.2 0.9
assign (resid   2 and name HB#)  (resid  33 and name HB1) 5.0 3.2 0.9
assign (resid   2 and name HB#)  (resid  33 and name HB2) 5.0 3.2 0.9
assign (resid  22 and name HA)  (resid  22 and name HB1) 4.0 2.2 0.0
assign (resid  22 and name HA)  (resid  22 and name HB2) 4.0 2.2 0.0
assign (resid  22 and name HA)  (resid  22 and name HD#) 4.0 2.2 0.9
assign (resid  22 and name HA)  (resid  22 and name HG#) 3.0 1.2 0.9
assign (resid  26 and name HA)  (resid  26 and name HB1) 3.0 1.2 0.0
assign (resid  26 and name HA)  (resid  26 and name HB2) 3.0 1.2 0.0
assign (resid  26 and name HA)  (resid  26 and name HD#) 3.0 1.2 0.9
assign (resid  26 and name HA)  (resid  26 and name HG#) 4.0 2.2 0.9
assign (resid  26 and name HB1)  (resid  26 and name HB2) 3.0 1.2 0.0
assign (resid  26 and name HB1)  (resid  26 and name HD#) 4.0 2.2 0.9
assign (resid  26 and name HB1)  (resid  26 and name HG#) 4.0 2.2 0.9
assign (resid  26 and name HB2)  (resid  26 and name HG#) 4.0 2.2 0.9
assign (resid  26 and name HD#)  (resid  26 and name HE#) 4.0 2.2 1.8
assign (resid  26 and name HD#)  (resid  26 and name HG#) 4.0 2.2 1.8
assign (resid  26 and name HE#)  (resid  26 and name HG#) 4.0 2.2 1.8
assign (resid  28 and name HA)  (resid  28 and name HD#) 3.0 1.2 0.9
assign (resid  28 and name HA)  (resid  28 and name HG#) 4.0 2.2 0.9
assign (resid  28 and name HB#)  (resid  28 and name HG#) 4.0 2.2 1.8
assign (resid  28 and name HD#)  (resid  28 and name HG#) 3.0 1.2 1.8
assign (resid  28 and name HE#)  (resid  28 and name HG#) 4.0 2.2 1.8
assign (resid  36 and name HA)  (resid  36 and name HB#) 3.0 1.2 0.9
assign (resid  36 and name HA)  (resid  36 and name HD#) 4.0 2.2 0.9
assign (resid  36 and name HA)  (resid  36 and name HG#) 4.0 2.2 0.9
assign (resid  36 and name HA)  (resid  55 and name HG#) 4.0 2.2 0.9
assign (resid  36 and name HB#)  (resid  36 and name HE#) 4.0 2.2 1.8
assign (resid  36 and name HB#)  (resid  36 and name HG#) 3.0 1.2 1.8
assign (resid  36 and name HB#)  (resid  55 and name HA) 4.0 2.2 0.9
assign (resid  36 and name HD#)  (resid  53 and name HB1) 4.0 2.2 0.9
assign (resid  36 and name HD#)  (resid  53 and name HB2) 5.0 3.2 0.9
assign (resid  36 and name HD#)  (resid  55 and name HG#) 4.0 2.2 1.8
assign (resid  36 and name HG#)  (resid  55 and name HA) 4.0 2.2 0.9
assign (resid  36 and name HG#)  (resid  55 and name HG#) 5.0 3.2 1.8
assign (resid  42 and name HA)  (resid  80 and name HB#) 5.0 3.2 1.0
assign (resid  42 and name HA)  (resid  42 and name HB1) 4.0 2.2 0.0
assign (resid  42 and name HA)  (resid  42 and name HB2) 4.0 2.2 0.0
assign (resid  42 and name HA)  (resid  42 and name HG#) 4.0 2.2 0.9
assign (resid  42 and name HA)  (resid  49 and name HA) 3.0 1.2 0.0
assign (resid  42 and name HA)  (resid  49 and name HB1) 4.0 2.2 0.0
assign (resid  42 and name HA)  (resid  49 and name HB2) 4.0 2.2 0.0
assign (resid  42 and name HB1)  (resid  80 and name HB#) 4.0 2.2 1.0
assign (resid  42 and name HB1)  (resid  42 and name HB2) 3.0 1.2 0.0
assign (resid  42 and name HB1)  (resid  42 and name HE#) 5.0 3.2 0.9
assign (resid  42 and name HB1)  (resid  42 and name HG#) 4.0 2.2 0.9
assign (resid  42 and name HB2)  (resid  80 and name HB#) 5.0 3.2 1.0
assign (resid  42 and name HB2)  (resid  42 and name HE#) 5.0 3.2 0.9
assign (resid  42 and name HB2)  (resid  42 and name HG#) 4.0 2.2 0.9
assign (resid  42 and name HD#)  (resid  80 and name HB#) 4.0 2.2 1.9
assign (resid  42 and name HD#)  (resid  42 and name HE#) 4.0 2.2 1.8
assign (resid  42 and name HD#)  (resid  42 and name HG#) 4.0 2.2 1.8
assign (resid  42 and name HE#)  (resid  80 and name HA) 4.0 2.2 0.9
assign (resid  42 and name HE#)  (resid  42 and name HG#) 4.0 2.2 1.8
assign (resid  42 and name HE#)  (resid  83 and name HG##) 5.0 3.2 3.5
assign (resid  42 and name HG#)  (resid  80 and name HB#) 4.0 2.2 1.9
assign (resid  44 and name HA)  (resid  44 and name HB#) 3.0 1.2 0.9
assign (resid  44 and name HA)  (resid  44 and name HD#) 5.0 3.2 0.9
assign (resid  44 and name HA)  (resid  44 and name HG#) 4.0 2.2 0.9
assign (resid  44 and name HA)  (resid  47 and name HA) 4.0 2.2 0.0
assign (resid  46 and name HA)  (resid  46 and name HB1) 3.0 1.2 0.0
assign (resid  46 and name HA)  (resid  46 and name HB2) 3.0 1.2 0.0
assign (resid  46 and name HA)  (resid  46 and name HG#) 3.0 1.2 0.9
assign (resid  46 and name HB1)  (resid  46 and name HB2) 3.0 1.2 0.0
assign (resid  47 and name HA)  (resid  47 and name HB1) 3.0 1.2 0.0
assign (resid  47 and name HA)  (resid  47 and name HB2) 3.0 1.2 0.0
assign (resid  47 and name HA)  (resid  47 and name HD#) 4.0 2.2 0.9
assign (resid  47 and name HA)  (resid  47 and name HG#) 3.0 1.2 0.9
assign (resid  47 and name HB1)  (resid  47 and name HB2) 3.0 1.2 0.0
assign (resid  47 and name HB1)  (resid  47 and name HD#) 4.0 2.2 0.9
assign (resid  47 and name HB1)  (resid  47 and name HG#) 4.0 2.2 0.9
assign (resid  47 and name HB2)  (resid  47 and name HG#) 3.0 1.2 0.9
assign (resid  47 and name HE#)  (resid  47 and name HG#) 4.0 2.2 1.8
assign (resid   6 and name HA)  (resid  30 and name HA#) 4.0 2.2 0.9
assign (resid   6 and name HA)  (resid   6 and name HB#) 4.0 2.2 0.9
assign (resid   6 and name HA)  (resid   6 and name HG#) 4.0 2.2 0.9
assign (resid  65 and name HA)  (resid  65 and name HB#) 3.0 1.2 0.9
assign (resid  65 and name HA)  (resid  65 and name HD#) 4.0 2.2 0.9
assign (resid  65 and name HA)  (resid  65 and name HG#) 4.0 2.2 0.9
assign (resid  65 and name HB#)  (resid  65 and name HD#) 4.0 2.2 1.8
assign (resid  65 and name HB#)  (resid  65 and name HG#) 3.0 1.2 1.8
assign (resid  68 and name HA)  (resid  68 and name HB#) 4.0 2.2 0.9
assign (resid  68 and name HA)  (resid  68 and name HG#) 4.0 2.2 0.9
assign (resid  68 and name HB#)  (resid  69 and name HA) 5.0 3.2 0.9
assign (resid  77 and name HA)  (resid  77 and name HB#) 3.0 1.2 0.9
assign (resid  77 and name HA)  (resid  77 and name HD#) 4.0 2.2 0.9
assign (resid  77 and name HA)  (resid  77 and name HG#) 4.0 2.2 0.9
assign (resid  77 and name HB#)  (resid  77 and name HG#) 4.0 2.2 1.8
assign (resid  84 and name HA)  (resid  84 and name HB#) 3.0 1.2 0.9
assign (resid  84 and name HA)  (resid  84 and name HG#) 4.0 2.2 0.9
assign (resid  84 and name HA)  (resid  85 and name HD#) 3.0 1.2 0.9
assign (resid  84 and name HA)  (resid  85 and name HG#) 4.0 2.2 0.9
assign (resid  84 and name HB#)  (resid  84 and name HE#) 5.0 3.2 1.8
assign (resid  84 and name HB#)  (resid  84 and name HG#) 4.0 2.2 1.8
assign (resid  84 and name HB#)  (resid  85 and name HD#) 4.0 2.2 1.8
assign (resid  84 and name HD#)  (resid  84 and name HG#) 3.0 1.2 1.8
assign (resid  84 and name HE#)  (resid  84 and name HG#) 4.0 2.2 1.8
assign (resid  84 and name HG#)  (resid  85 and name HD#) 4.0 2.2 1.8
assign (resid  32 and name HA)  (resid  32 and name HB1) 3.0 1.2 0.0
assign (resid  32 and name HA)  (resid  32 and name HB2) 3.0 1.2 0.0
assign (resid  32 and name HA)  (resid  32 and name HD##) 4.0 2.2 2.6
assign (resid  32 and name HB1)  (resid  32 and name HB2) 3.0 1.2 0.0
assign (resid  32 and name HB1)  (resid  32 and name HD##) 4.0 2.2 2.6
assign (resid  32 and name HB2)  (resid  32 and name HD##) 4.0 2.2 2.6
assign (resid  32 and name HD##)  (resid  32 and name HG) 3.0 1.2 2.6
assign (resid   7 and name HA)  (resid  23 and name HD1#) 5.0 3.2 1.0
assign (resid   7 and name HA)  (resid   7 and name HB1) 3.0 1.2 0.0
assign (resid   7 and name HA)  (resid   7 and name HB2) 3.0 1.2 0.0
assign (resid   7 and name HA)  (resid   8 and name HD#) 3.0 1.2 0.9
assign (resid   7 and name HA)  (resid   8 and name HG#) 4.0 2.2 0.9
assign (resid   7 and name HB1)  (resid   7 and name HB2) 3.0 1.2 0.0
assign (resid   7 and name HB2)  (resid   8 and name HD#) 4.0 2.2 0.9
assign (resid   7 and name HD##)  (resid   8 and name HD#) 4.0 2.2 3.5
assign (resid   7 and name HD##)  (resid  24 and name HA) 4.0 2.2 2.6
assign (resid   7 and name HD##)  (resid  24 and name HB1) 5.0 3.2 2.6
assign (resid   7 and name HD##)  (resid  24 and name HB2) 5.0 3.2 2.6
assign (resid  73 and name HA)  (resid  73 and name HB1) 3.0 1.2 0.0
assign (resid  73 and name HA)  (resid  73 and name HB2) 3.0 1.2 0.0
assign (resid  73 and name HA)  (resid  73 and name HD##) 3.0 1.2 2.6
assign (resid  73 and name HA)  (resid  73 and name HG) 4.0 2.2 0.0
assign (resid  73 and name HB1)  (resid  73 and name HB2) 3.0 1.2 0.0
assign (resid  73 and name HB1)  (resid  73 and name HD##) 3.0 1.2 2.6
assign (resid  73 and name HB2)  (resid  73 and name HD##) 4.0 2.2 2.6
assign (resid  73 and name HD##)  (resid  73 and name HG) 4.0 2.2 2.6
assign (resid  31 and name HA)  (resid  31 and name HB1) 4.0 2.2 0.0
assign (resid  31 and name HA)  (resid  31 and name HB2) 4.0 2.2 0.0
assign (resid  31 and name HA)  (resid  31 and name HG#) 4.0 2.2 0.9
assign (resid  31 and name HB1)  (resid  35 and name HB#) 4.0 2.2 0.9
assign (resid  31 and name HB2)  (resid  61 and name HG2#) 5.0 3.2 1.0
assign (resid  31 and name HG#)  (resid  35 and name HB#) 4.0 2.2 1.8
assign (resid  29 and name HA)  (resid  29 and name HB1) 3.0 1.2 0.0
assign (resid  29 and name HA)  (resid  29 and name HB2) 3.0 1.2 0.0
assign (resid  29 and name HB1)  (resid  29 and name HB2) 3.0 1.2 0.0
assign (resid  43 and name HA)  (resid  43 and name HB1) 4.0 2.2 0.0
assign (resid  43 and name HA)  (resid  43 and name HB2) 4.0 2.2 0.0
assign (resid  43 and name HA)  (resid  50 and name HD#) 4.0 2.2 2.0
assign (resid  43 and name HA)  (resid  50 and name HE#) 3.0 1.2 2.0
assign (resid  43 and name HB1)  (resid  43 and name HB2) 3.0 1.2 0.0
assign (resid  43 and name HB1)  (resid  50 and name HD#) 4.0 2.2 2.0
assign (resid  43 and name HB1)  (resid  50 and name HE#) 4.0 2.2 2.0
assign (resid  43 and name HB2)  (resid  50 and name HD#) 4.0 2.2 2.0
assign (resid  43 and name HB2)  (resid  50 and name HE#) 4.0 2.2 2.0
assign (resid  64 and name HA)  (resid  64 and name HB1) 3.0 1.2 0.0
assign (resid  64 and name HA)  (resid  64 and name HB2) 3.0 1.2 0.0
assign (resid  64 and name HA)  (resid  64 and name HG#) 4.0 2.2 0.9
assign (resid  64 and name HB#)  (resid  64 and name HD#) 4.0 2.2 1.8
assign (resid  64 and name HB1)  (resid  64 and name HB2) 3.0 1.2 0.0
assign (resid  64 and name HB1)  (resid  64 and name HD#) 4.0 2.2 0.9
assign (resid  64 and name HB1)  (resid  64 and name HG#) 3.0 1.2 0.9
assign (resid  64 and name HD#)  (resid  64 and name HG#) 4.0 2.2 1.8
assign (resid   8 and name HA)  (resid   8 and name HB1) 3.0 1.2 0.0
assign (resid   8 and name HA)  (resid   8 and name HB2) 3.0 1.2 0.0
assign (resid   8 and name HA)  (resid   8 and name HD#) 4.0 2.2 0.9
assign (resid   8 and name HA)  (resid   8 and name HG#) 4.0 2.2 0.9
assign (resid   8 and name HB1)  (resid  61 and name HG2#) 5.0 3.2 1.0
assign (resid   8 and name HB1)  (resid   8 and name HB2) 3.0 1.2 0.0
assign (resid   8 and name HB1)  (resid   8 and name HD#) 4.0 2.2 0.9
assign (resid   8 and name HB1)  (resid   8 and name HG#) 4.0 2.2 0.9
assign (resid   8 and name HB1)  (resid  63 and name HG##) 5.0 3.2 2.6
assign (resid   8 and name HB2)  (resid  61 and name HG2#) 5.0 3.2 1.0
assign (resid   8 and name HB2)  (resid   8 and name HG#) 4.0 2.2 0.9
assign (resid   8 and name HB2)  (resid  63 and name HG##) 5.0 3.2 2.6
assign (resid   8 and name HD#)  (resid  23 and name HD1#) 5.0 3.2 1.9
assign (resid   8 and name HD#)  (resid  61 and name HD1#) 5.0 3.2 1.9
assign (resid   8 and name HD#)  (resid  61 and name HG2#) 5.0 3.2 1.9
assign (resid   8 and name HD#)  (resid   8 and name HG#) 4.0 2.2 1.8
assign (resid   8 and name HG#)  (resid  61 and name HD1#) 5.0 3.2 1.9
assign (resid   8 and name HG#)  (resid  61 and name HG2#) 4.0 2.2 1.9
assign (resid   8 and name HG#)  (resid  63 and name HG##) 5.0 3.2 3.5
assign (resid   8 and name HG#)  (resid   9 and name HG##) 5.0 3.2 3.5
assign (resid  85 and name HA)  (resid  85 and name HB1) 3.0 1.2 0.0
assign (resid  85 and name HA)  (resid  85 and name HB2) 3.0 1.2 0.0
assign (resid  85 and name HA)  (resid  85 and name HD#) 4.0 2.2 0.9
assign (resid  85 and name HA)  (resid  85 and name HG#) 4.0 2.2 0.9
assign (resid  85 and name HB1)  (resid  85 and name HB2) 3.0 1.2 0.0
assign (resid  85 and name HB1)  (resid  85 and name HD#) 4.0 2.2 0.9
assign (resid  85 and name HB1)  (resid  85 and name HG#) 3.0 1.2 0.9
assign (resid  85 and name HB2)  (resid  85 and name HD#) 4.0 2.2 0.9
assign (resid  85 and name HD#)  (resid  85 and name HG#) 3.0 1.2 1.8
assign (resid  17 and name HA)  (resid  17 and name HB1) 3.0 1.2 0.0
assign (resid  17 and name HA)  (resid  17 and name HB2) 3.0 1.2 0.0
assign (resid  17 and name HA)  (resid  17 and name HG#) 3.0 1.2 0.9
assign (resid  17 and name HB1)  (resid  17 and name HB2) 3.0 1.2 0.0
assign (resid  17 and name HB1)  (resid  17 and name HG#) 3.0 1.2 0.9
assign (resid  17 and name HB2)  (resid  17 and name HG#) 3.0 1.2 0.9
assign (resid  24 and name HA)  (resid  28 and name HA) 4.0 2.2 0.0
assign (resid  24 and name HA)  (resid  24 and name HB1) 3.0 1.2 0.0
assign (resid  24 and name HA)  (resid  24 and name HB2) 3.0 1.2 0.0
assign (resid  24 and name HA)  (resid  24 and name HG#) 4.0 2.2 0.9
assign (resid  24 and name HB1)  (resid  24 and name HB2) 3.0 1.2 0.0
assign (resid  24 and name HB1)  (resid  24 and name HG#) 3.0 1.2 0.9
assign (resid  24 and name HB2)  (resid  24 and name HG#) 3.0 1.2 0.9
assign (resid  55 and name HA)  (resid  61 and name HD1#) 5.0 3.2 1.0
assign (resid  55 and name HA)  (resid  55 and name HB2) 3.0 1.2 0.0
assign (resid  55 and name HA)  (resid  55 and name HG#) 3.0 1.2 0.9
assign (resid  55 and name HB2)  (resid  55 and name HG#) 3.0 1.2 0.9
assign (resid  55 and name HG#)  (resid  57 and name HD1#) 5.0 3.2 1.9
assign (resid  55 and name HG#)  (resid  57 and name HG1#) 4.0 2.2 1.8
assign (resid  20 and name HA)  (resid  20 and name HB1) 3.0 1.2 0.0
assign (resid  20 and name HA)  (resid  20 and name HB2) 3.0 1.2 0.0
assign (resid  20 and name HA)  (resid  20 and name HD#) 4.0 2.2 0.9
assign (resid  20 and name HA)  (resid  20 and name HG#) 4.0 2.2 0.9
assign (resid  20 and name HA)  (resid  21 and name HG##) 5.0 3.2 2.6
assign (resid  20 and name HB1)  (resid  20 and name HB2) 3.0 1.2 0.0
assign (resid  20 and name HB1)  (resid  20 and name HD#) 4.0 2.2 0.9
assign (resid  20 and name HB1)  (resid  20 and name HG#) 3.0 1.2 0.9
assign (resid  20 and name HB2)  (resid  20 and name HD#) 4.0 2.2 0.9
assign (resid  20 and name HB2)  (resid  20 and name HG#) 3.0 1.2 0.9
assign (resid  20 and name HD#)  (resid  20 and name HG#) 4.0 2.2 1.8
assign (resid  87 and name HA)  (resid  87 and name HB1) 3.0 1.2 0.0
assign (resid  87 and name HA)  (resid  87 and name HB2) 3.0 1.2 0.0
assign (resid  87 and name HA)  (resid  87 and name HG#) 4.0 2.2 0.9
assign (resid  87 and name HB1)  (resid  87 and name HD#) 4.0 2.2 0.9
assign (resid  87 and name HB1)  (resid  87 and name HG#) 3.0 1.2 0.9
assign (resid  87 and name HB2)  (resid  87 and name HD#) 4.0 2.2 0.9
assign (resid  87 and name HB2)  (resid  87 and name HG#) 3.0 1.2 0.9
assign (resid  87 and name HD#)  (resid  87 and name HG#) 4.0 2.2 1.8
assign (resid  38 and name HA)  (resid  53 and name HA) 3.0 1.2 0.0
assign (resid  38 and name HA)  (resid  53 and name HB1) 5.0 3.2 0.0
assign (resid  38 and name HA)  (resid  38 and name HB1) 3.0 1.2 0.0
assign (resid  38 and name HA)  (resid  38 and name HB2) 4.0 2.2 0.0
assign (resid  38 and name HA)  (resid  51 and name HB) 4.0 2.2 0.0
assign (resid  38 and name HB1)  (resid  53 and name HA) 4.0 2.2 0.0
assign (resid  38 and name HB1)  (resid  38 and name HB2) 3.0 1.2 0.0
assign (resid  38 and name HB1)  (resid  51 and name HA) 4.0 2.2 0.0
assign (resid  38 and name HB1)  (resid  51 and name HB) 3.0 1.2 0.0
assign (resid  38 and name HB1)  (resid  51 and name HG2#) 4.0 2.2 1.0
assign (resid  38 and name HB2)  (resid  53 and name HA) 4.0 2.2 0.0
assign (resid  38 and name HB2)  (resid  51 and name HA) 4.0 2.2 0.0
assign (resid  38 and name HB2)  (resid  51 and name HB) 3.0 1.2 0.0
assign (resid  38 and name HB2)  (resid  51 and name HG2#) 4.0 2.2 1.0
assign (resid   4 and name HA)  (resid  32 and name HA) 3.0 1.2 0.0
assign (resid   4 and name HA)  (resid  32 and name HD##) 5.0 3.2 2.6
assign (resid   4 and name HA)  (resid   4 and name HB#) 3.0 1.2 0.9
assign (resid   4 and name HB#)  (resid  32 and name HA) 4.0 2.2 0.9
assign (resid   4 and name HB#)  (resid  32 and name HD##) 5.0 3.2 3.5
assign (resid  49 and name HA)  (resid  49 and name HB1) 3.0 1.2 0.0
assign (resid  49 and name HA)  (resid  49 and name HB2) 3.0 1.2 0.0
assign (resid  49 and name HA)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  49 and name HA)  (resid  50 and name HD#) 4.0 2.2 2.0
assign (resid  49 and name HB1)  (resid  80 and name HB#) 5.0 3.2 1.0
assign (resid  49 and name HB1)  (resid  83 and name HB) 3.0 1.2 0.0
assign (resid  49 and name HB1)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  49 and name HB2)  (resid  80 and name HB#) 5.0 3.2 1.0
assign (resid  49 and name HB2)  (resid  83 and name HB) 4.0 2.2 0.0
assign (resid  49 and name HB2)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  71 and name HA)  (resid  71 and name HB1) 3.0 1.2 0.0
assign (resid  71 and name HA)  (resid  71 and name HB2) 3.0 1.2 0.0
assign (resid  71 and name HB1)  (resid  71 and name HB2) 3.0 1.2 0.0
assign (resid  72 and name HA)  (resid  72 and name HB#) 3.0 1.2 0.9
assign (resid  81 and name HA)  (resid  81 and name HB#) 3.0 1.2 0.9
assign (resid  13 and name HA)  (resid  13 and name HB) 3.0 1.2 0.0
assign (resid  13 and name HA)  (resid  13 and name HG2#) 3.0 1.2 1.0
assign (resid  13 and name HA)  (resid  14 and name HG##) 5.0 3.2 2.6
assign (resid  13 and name HA)  (resid  21 and name HG##) 5.0 3.2 2.6
assign (resid  13 and name HB)  (resid  81 and name HA) 4.0 2.2 0.0
assign (resid  13 and name HB)  (resid  81 and name HB#) 4.0 2.2 0.9
assign (resid  13 and name HB)  (resid  13 and name HG2#) 3.0 1.2 1.0
assign (resid  13 and name HG2#)  (resid  40 and name HD#) 5.0 3.2 3.0
assign (resid  13 and name HG2#)  (resid  40 and name HE#) 4.0 2.2 3.0
assign (resid  13 and name HG2#)  (resid  22 and name HA) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  20 and name HA) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  20 and name HB1) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  20 and name HB2) 5.0 3.2 1.0
assign (resid  13 and name HG2#)  (resid  20 and name HD#) 5.0 3.2 1.9
assign (resid  13 and name HG2#)  (resid  20 and name HG#) 5.0 3.2 1.9
assign (resid  13 and name HG2#)  (resid  81 and name HB#) 5.0 3.2 1.9
assign (resid  13 and name HG2#)  (resid  14 and name HA) 5.0 3.2 1.0
assign (resid  51 and name HA)  (resid  51 and name HB) 3.0 1.2 0.0
assign (resid  51 and name HA)  (resid  51 and name HG2#) 3.0 1.2 1.0
assign (resid  51 and name HB)  (resid  51 and name HG2#) 3.0 1.2 1.0
assign (resid  60 and name HA)  (resid  61 and name HG2#) 5.0 3.2 1.0
assign (resid  60 and name HA)  (resid  60 and name HB) 3.0 1.2 0.0
assign (resid  60 and name HA)  (resid  60 and name HG2#) 3.0 1.2 1.0
assign (resid  60 and name HB)  (resid  60 and name HG2#) 3.0 1.2 1.0
assign (resid  60 and name HG2#)  (resid  62 and name HA) 5.0 3.2 1.0
assign (resid  60 and name HG2#)  (resid  62 and name HG#) 5.0 3.2 1.9
assign (resid  60 and name HG2#)  (resid  61 and name HA) 4.0 2.2 1.0
assign (resid  78 and name HA)  (resid  78 and name HB) 3.0 1.2 0.0
assign (resid  78 and name HA)  (resid  78 and name HG2#) 3.0 1.2 1.0
assign (resid  78 and name HB)  (resid  78 and name HG2#) 3.0 1.2 1.0
assign (resid  78 and name HB)  (resid  83 and name HG##) 5.0 3.2 2.6
assign (resid  78 and name HG2#)  (resid  82 and name HB1) 4.0 2.2 1.0
assign (resid  78 and name HG2#)  (resid  82 and name HB2) 4.0 2.2 1.0
assign (resid  78 and name HG2#)  (resid  83 and name HG##) 5.0 3.2 3.6
assign (resid  14 and name HA)  (resid  39 and name HA) 4.0 2.2 0.0
assign (resid  14 and name HA)  (resid  40 and name HD#) 4.0 2.2 2.0
assign (resid  14 and name HA)  (resid  40 and name HE#) 4.0 2.2 2.0
assign (resid  14 and name HA)  (resid  14 and name HB) 3.0 1.2 0.0
assign (resid  14 and name HA)  (resid  14 and name HG##) 4.0 2.2 2.6
assign (resid  14 and name HA)  (resid  15 and name HG##) 5.0 3.2 2.6
assign (resid  14 and name HB)  (resid  14 and name HG##) 4.0 2.2 2.6
assign (resid  14 and name HB)  (resid  37 and name HG##) 4.0 2.2 2.6
assign (resid  14 and name HG##)  (resid  27 and name HD#) 5.0 3.2 4.6
assign (resid  14 and name HG##)  (resid  27 and name HE#) 5.0 3.2 4.6
assign (resid  14 and name HG##)  (resid  39 and name HA) 4.0 2.2 2.6
assign (resid  14 and name HG##)  (resid  23 and name HA) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  23 and name HB) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  23 and name HD1#) 5.0 3.2 3.6
assign (resid  14 and name HG##)  (resid  23 and name HG1#) 5.0 3.2 3.5
assign (resid  14 and name HG##)  (resid  23 and name HG2#) 5.0 3.2 3.6
assign (resid  14 and name HG##)  (resid  21 and name HG##) 5.0 3.2 5.2
assign (resid  14 and name HG##)  (resid  37 and name HA) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  37 and name HB) 4.0 2.2 2.6
assign (resid  14 and name HG##)  (resid  37 and name HG##) 5.0 3.2 5.2
assign (resid  14 and name HG##)  (resid  63 and name HG##) 5.0 3.2 5.2
assign (resid  14 and name HG##)  (resid  16 and name HA) 5.0 3.2 2.6
assign (resid  14 and name HG##)  (resid  16 and name HB#) 5.0 3.2 3.5
assign (resid  15 and name HA)  (resid  15 and name HB) 4.0 2.2 0.0
assign (resid  15 and name HA)  (resid  15 and name HG##) 4.0 2.2 2.6
assign (resid  15 and name HB)  (resid  38 and name HB1) 4.0 2.2 0.0
assign (resid  15 and name HB)  (resid  38 and name HB2) 3.0 1.2 0.0
assign (resid  15 and name HB)  (resid  51 and name HB) 4.0 2.2 0.0
assign (resid  15 and name HB)  (resid  15 and name HG##) 4.0 2.2 2.6
assign (resid  15 and name HG##)  (resid  40 and name HD#) 5.0 3.2 4.6
assign (resid  15 and name HG##)  (resid  40 and name HE#) 4.0 2.2 4.6
assign (resid  15 and name HG##)  (resid  40 and name HZ) 4.0 2.2 2.6
assign (resid  15 and name HG##)  (resid  18 and name HA#) 4.0 2.2 3.5
assign (resid  15 and name HG##)  (resid  20 and name HA) 5.0 3.2 2.6
assign (resid  15 and name HG##)  (resid  20 and name HD#) 5.0 3.2 3.5
assign (resid  15 and name HG##)  (resid  20 and name HG#) 5.0 3.2 3.5
assign (resid  15 and name HG##)  (resid  38 and name HB1) 5.0 3.2 2.6
assign (resid  15 and name HG##)  (resid  38 and name HB2) 4.0 2.2 2.6
assign (resid  15 and name HG##)  (resid  51 and name HB) 5.0 3.2 2.6
assign (resid  15 and name HG##)  (resid  51 and name HG2#) 5.0 3.2 3.6
assign (resid  15 and name HG##)  (resid  16 and name HA) 5.0 3.2 2.6
assign (resid  21 and name HA)  (resid  21 and name HB) 3.0 1.2 0.0
assign (resid  21 and name HA)  (resid  21 and name HG##) 4.0 2.2 2.6
assign (resid  21 and name HB)  (resid  26 and name HB1) 4.0 2.2 0.0
assign (resid  21 and name HB)  (resid  26 and name HB2) 4.0 2.2 0.0
assign (resid  21 and name HB)  (resid  26 and name HD#) 4.0 2.2 0.9
assign (resid  21 and name HB)  (resid  21 and name HG##) 4.0 2.2 2.6
assign (resid  21 and name HG##)  (resid  23 and name HA) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  26 and name HB1) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  26 and name HB2) 5.0 3.2 2.6
assign (resid  21 and name HG##)  (resid  26 and name HD#) 5.0 3.2 3.5
assign (resid  21 and name HG##)  (resid  26 and name HE#) 5.0 3.2 3.5
assign (resid  21 and name HG##)  (resid  26 and name HG#) 5.0 3.2 3.5
assign (resid  37 and name HA)  (resid  37 and name HB) 3.0 1.2 0.0
assign (resid  37 and name HA)  (resid  37 and name HG##) 4.0 2.2 2.6
assign (resid  37 and name HB)  (resid  37 and name HG##) 4.0 2.2 2.6
assign (resid  37 and name HG##)  (resid  54 and name HB#) 5.0 3.2 3.6
assign (resid  37 and name HG##)  (resid  61 and name HD1#) 5.0 3.2 3.6
assign (resid  63 and name HA)  (resid  64 and name HD#) 3.0 1.2 0.9
assign (resid  63 and name HA)  (resid  64 and name HG#) 4.0 2.2 0.9
assign (resid  63 and name HA)  (resid  63 and name HB) 3.0 1.2 0.0
assign (resid  63 and name HA)  (resid  63 and name HG##) 4.0 2.2 2.6
assign (resid  63 and name HB)  (resid  64 and name HD#) 4.0 2.2 0.9
assign (resid  63 and name HB)  (resid  63 and name HG##) 4.0 2.2 2.6
assign (resid  63 and name HG##)  (resid  67 and name HA) 5.0 3.2 2.6
assign (resid  63 and name HG##)  (resid  67 and name HB#) 5.0 3.2 3.5
assign (resid  63 and name HG##)  (resid  67 and name HD#) 5.0 3.2 4.6
assign (resid  63 and name HG##)  (resid  64 and name HD#) 5.0 3.2 3.5
assign (resid  83 and name HA)  (resid  83 and name HB) 3.0 1.2 0.0
assign (resid  83 and name HA)  (resid  83 and name HG##) 4.0 2.2 2.6
assign (resid  83 and name HB)  (resid  83 and name HG##) 4.0 2.2 2.6
assign (resid   9 and name HA)  (resid   9 and name HB) 3.0 1.2 0.0
assign (resid   9 and name HA)  (resid   9 and name HG##) 4.0 2.2 2.6
assign (resid   9 and name HB)  (resid  12 and name HB#) 5.0 3.2 1.0
assign (resid   9 and name HB)  (resid  23 and name HD1#) 5.0 3.2 1.0
assign (resid   9 and name HB)  (resid   9 and name HG##) 4.0 2.2 2.6
assign (resid   9 and name HG##)  (resid  12 and name HA) 5.0 3.2 2.6
assign (resid   9 and name HG##)  (resid  12 and name HB#) 5.0 3.2 3.6
assign (resid   9 and name HG##)  (resid  39 and name HE#) 4.0 2.2 4.6
assign (resid   9 and name HG##)  (resid  67 and name HD#) 5.0 3.2 4.6
assign (resid   9 and name HG##)  (resid  67 and name HE#) 4.0 2.2 4.6
assign (resid   9 and name HG##)  (resid  67 and name HZ) 5.0 3.2 2.6
assign (resid   9 and name HG##)  (resid  23 and name HG2#) 5.0 3.2 3.6
assign (resid   9 and name HG##)  (resid  14 and name HG##) 5.0 3.2 5.2
assign (resid   9 and name HG##)  (resid  63 and name HG##) 5.0 3.2 5.2
assign (resid  76 and name HA)  (resid  76 and name HB#) 3.0 1.2 0.9
assign (resid  76 and name HA)  (resid  76 and name HD1) 3.0 1.2 0.0
assign (resid  76 and name HA)  (resid  76 and name HE3) 4.0 2.2 0.0
assign (resid  76 and name HB#)  (resid  76 and name HD1) 4.0 2.2 0.9
assign (resid  76 and name HB#)  (resid  76 and name HE3) 4.0 2.2 0.9
assign (resid  76 and name HE3)  (resid  76 and name HZ3) 3.0 1.2 0.0
assign (resid  76 and name HH2)  (resid  76 and name HZ2) 3.0 1.2 0.0
assign (resid  76 and name HH2)  (resid  76 and name HZ3) 3.0 1.2 0.0
assign (resid  16 and name HA)  (resid  37 and name HA) 3.0 1.2 0.0
assign (resid  16 and name HA)  (resid  37 and name HG##) 4.0 2.2 2.6
assign (resid  16 and name HA)  (resid  16 and name HB#) 4.0 2.2 0.9
assign (resid  16 and name HA)  (resid  16 and name HD#) 3.0 1.2 2.0
assign (resid  16 and name HA)  (resid  16 and name HE#) 4.0 2.2 2.0
assign (resid  16 and name HB#)  (resid  27 and name HZ) 5.0 3.2 0.9
assign (resid  16 and name HB#)  (resid  21 and name HG##) 4.0 2.2 3.5
assign (resid  16 and name HB#)  (resid  37 and name HA) 5.0 3.2 0.9
assign (resid  16 and name HB#)  (resid  37 and name HG##) 5.0 3.2 3.5
assign (resid  16 and name HB#)  (resid  16 and name HD#) 3.0 1.2 2.9
assign (resid  16 and name HD#)  (resid  27 and name HE#) 4.0 2.2 4.0
assign (resid  16 and name HD#)  (resid  27 and name HZ) 4.0 2.2 2.0
assign (resid  16 and name HD#)  (resid  26 and name HE#) 4.0 2.2 2.9
assign (resid  16 and name HD#)  (resid  17 and name HG#) 4.0 2.2 2.9
assign (resid  16 and name HD#)  (resid  37 and name HA) 4.0 2.2 2.0
assign (resid  16 and name HD#)  (resid  37 and name HG##) 4.0 2.2 4.6
assign (resid  16 and name HD#)  (resid  16 and name HE#) 3.0 1.2 4.0
assign (resid  16 and name HE#)  (resid  35 and name HA) 4.0 2.2 2.0
assign (resid  16 and name HE#)  (resid  35 and name HB#) 4.0 2.2 2.9
assign (resid  16 and name HE#)  (resid  27 and name HZ) 4.0 2.2 2.0
assign (resid  16 and name HE#)  (resid  26 and name HE#) 4.0 2.2 2.9
assign (resid  16 and name HE#)  (resid  37 and name HG##) 5.0 3.2 4.6
assign (resid  50 and name HA)  (resid  51 and name HG2#) 5.0 3.2 1.0
assign (resid  50 and name HA)  (resid  50 and name HB1) 3.0 1.2 0.0
assign (resid  50 and name HA)  (resid  50 and name HB2) 3.0 1.2 0.0
assign (resid  50 and name HA)  (resid  50 and name HD#) 3.0 1.2 2.0
assign (resid  50 and name HB1)  (resid  50 and name HB2) 3.0 1.2 0.0
assign (resid  50 and name HB1)  (resid  50 and name HD#) 3.0 1.2 2.0
assign (resid  50 and name HB2)  (resid  50 and name HD#) 3.0 1.2 2.0
assign (resid  50 and name HD#)  (resid  52 and name HG#) 4.0 2.2 2.9
assign (resid  50 and name HD#)  (resid  50 and name HE#) 3.0 1.2 4.0
assign (resid  50 and name HE#)  (resid  52 and name HG#) 3.0 1.2 2.9

!----- H-bond constraints from hnco-trosy experiment -----
assign (resid 12 and name O) (resid 23 and name HN) 2.15 0.35 0.15
assign (resid 12 and name O) (resid 23 and name N) 2.90 0.1 0.4
assign (resid 14 and name O) (resid 21 and name HN) 2.15 0.35 0.15
assign (resid 14 and name O) (resid 21 and name N) 2.90 0.1 0.4
assign (resid 19 and name O) (resid 16 and name HN) 2.15 0.35 0.15
assign (resid 19 and name O) (resid 16 and name N) 2.90 0.1 0.4
assign (resid 21 and name O) (resid 14 and name HN) 2.15 0.35 0.15
assign (resid 21 and name O) (resid 14 and name N) 2.90 0.1 0.4
assign (resid 22 and name O) (resid 26 and name HN) 2.15 0.35 0.15
assign (resid 22 and name O) (resid 26 and name N) 2.90 0.1 0.4
assign (resid 35 and name O) (resid 56 and name HN) 2.15 0.35 0.15
assign (resid 35 and name O) (resid 56 and name N) 2.90 0.1 0.4
assign (resid 38 and name O) (resid 15 and name HN) 2.15 0.35 0.15
assign (resid 38 and name O) (resid 15 and name N) 2.90 0.1 0.4
assign (resid 39 and name O) (resid 52 and name HN) 2.15 0.35 0.15
assign (resid 39 and name O) (resid 52 and name N) 2.90 0.1 0.4
assign (resid 49 and name O) (resid 86 and name HN) 2.15 0.35 0.15
assign (resid 49 and name O) (resid 86 and name N) 2.90 0.1 0.4
assign (resid 50 and name O) (resid 41 and name HN) 2.15 0.35 0.15
assign (resid 50 and name O) (resid 41 and name N) 2.90 0.1 0.4
assign (resid 52 and name O) (resid 39 and name HN) 2.15 0.35 0.15
assign (resid 52 and name O) (resid 39 and name N) 2.90 0.1 0.4
assign (resid 54 and name O) (resid 37 and name HN) 2.15 0.35 0.15
assign (resid 54 and name O) (resid 37 and name N) 2.90 0.1 0.4
assign (resid 60 and name O) (resid 57 and name HN) 2.15 0.35 0.15
assign (resid 60 and name O) (resid 57 and name N) 2.90 0.1 0.4

!----- phi-angle constraints from hmqc-j experiment -----
assign (resid   2 and name c) (resid   3 and name n)
  (resid   3 and name ca) (resid   3 and name c) 1.0 -60.0  30.0 2
assign (resid   4 and name c) (resid   5 and name n)
  (resid   5 and name ca) (resid   5 and name c) 1.0 -120.0  20.0 2
assign (resid   6 and name c) (resid   7 and name n)
  (resid   7 and name ca) (resid   7 and name c) 1.0 -60.0  30.0 2
assign (resid   8 and name c) (resid   9 and name n)
  (resid   9 and name ca) (resid   9 and name c) 1.0 -120.0  20.0 2
assign (resid   10 and name c) (resid   11 and name n)
  (resid   11 and name ca) (resid   11 and name c) 1.0 -120.0  40.0 2
assign (resid   11 and name c) (resid   12 and name n)
  (resid   12 and name ca) (resid   12 and name c) 1.0 -60.0  30.0 2
assign (resid   12 and name c) (resid   13 and name n)
  (resid   13 and name ca) (resid   13 and name c) 1.0 -120.0  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 -120.0  20.0 2
assign (resid   14 and name c) (resid   15 and name n)
  (resid   15 and name ca) (resid   15 and name c) 1.0 -120.0  20.0 2
assign (resid   15 and name c) (resid   16 and name n)
  (resid   16 and name ca) (resid   16 and name c) 1.0 -120.0  40.0 2
assign (resid   18 and name c) (resid   19 and name n)
  (resid   19 and name ca) (resid   19 and name c) 1.0 -120.0  20.0 2
assign (resid   20 and name c) (resid   21 and name n)
  (resid   21 and name ca) (resid   21 and name c) 1.0 -120.0  40.0 2
assign (resid   21 and name c) (resid   22 and name n)
  (resid   22 and name ca) (resid   22 and name c) 1.0 -120.0  40.0 2
assign (resid   22 and name c) (resid   23 and name n)
  (resid   23 and name ca) (resid   23 and name c) 1.0 -60.0  30.0 2
assign (resid   23 and name c) (resid   24 and name n)
  (resid   24 and name ca) (resid   24 and name c) 1.0 -60.0  30.0 2
assign (resid   24 and name c) (resid   25 and name n)
  (resid   25 and name ca) (resid   25 and name c) 1.0 -120.0  20.0 2
assign (resid   25 and name c) (resid   26 and name n)
  (resid   26 and name ca) (resid   26 and name c) 1.0 -60.0  30.0 2
assign (resid   26 and name c) (resid   27 and name n)
  (resid   27 and name ca) (resid   27 and name c) 1.0 -120.0  20.0 2
assign (resid   27 and name c) (resid   28 and name n)
  (resid   28 and name ca) (resid   28 and name c) 1.0 -60.0  30.0 2
assign (resid   28 and name c) (resid   29 and name n)
  (resid   29 and name ca) (resid   29 and name c) 1.0 -120.0  20.0 2
assign (resid   30 and name c) (resid   31 and name n)
  (resid   31 and name ca) (resid   31 and name c) 1.0 -120.0  20.0 2
assign (resid   32 and name c) (resid   33 and name n)
  (resid   33 and name ca) (resid   33 and name c) 1.0 -60.0  30.0 2
assign (resid   34 and name c) (resid   35 and name n)
  (resid   35 and name ca) (resid   35 and name c) 1.0 -60.0  30.0 2
assign (resid   35 and name c) (resid   36 and name n)
  (resid   36 and name ca) (resid   36 and name c) 1.0 -120.0  20.0 2
assign (resid   36 and name c) (resid   37 and name n)
  (resid   37 and name ca) (resid   37 and name c) 1.0 -120.0  20.0 2
assign (resid   37 and name c) (resid   38 and name n)
  (resid   38 and name ca) (resid   38 and name c) 1.0 -120.0  20.0 2
assign (resid   38 and name c) (resid   39 and name n)
  (resid   39 and name ca) (resid   39 and name c) 1.0 -120.0  20.0 2
assign (resid   39 and name c) (resid   40 and name n)
  (resid   40 and name ca) (resid   40 and name c) 1.0 -120.0  40.0 2
assign (resid   40 and name c) (resid   41 and name n)
  (resid   41 and name ca) (resid   41 and name c) 1.0 -120.0  20.0 2
assign (resid   41 and name c) (resid   42 and name n)
  (resid   42 and name ca) (resid   42 and name c) 1.0 -120.0  40.0 2
assign (resid   43 and name c) (resid   44 and name n)
  (resid   44 and name ca) (resid   44 and name c) 1.0 -60.0  30.0 2
assign (resid   44 and name c) (resid   45 and name n)
  (resid   45 and name ca) (resid   45 and name c) 1.0 -60.0  30.0 2
assign (resid   45 and name c) (resid   46 and name n)
  (resid   46 and name ca) (resid   46 and name c) 1.0 -120.0  40.0 2
assign (resid   47 and name c) (resid   48 and name n)
  (resid   48 and name ca) (resid   48 and name c) 1.0 -120.0  40.0 2
assign (resid   48 and name c) (resid   49 and name n)
  (resid   49 and name ca) (resid   49 and name c) 1.0 -120.0  40.0 2
assign (resid   49 and name c) (resid   50 and name n)
  (resid   50 and name ca) (resid   50 and name c) 1.0 -120.0  40.0 2
assign (resid   50 and name c) (resid   51 and name n)
  (resid   51 and name ca) (resid   51 and name c) 1.0 -120.0  20.0 2
assign (resid   51 and name c) (resid   52 and name n)
  (resid   52 and name ca) (resid   52 and name c) 1.0 -120.0  40.0 2
assign (resid   53 and name c) (resid   54 and name n)
  (resid   54 and name ca) (resid   54 and name c) 1.0 -120.0  40.0 2
assign (resid   54 and name c) (resid   55 and name n)
  (resid   55 and name ca) (resid   55 and name c) 1.0 -120.0  20.0 2
assign (resid   56 and name c) (resid   57 and name n)
  (resid   57 and name ca) (resid   57 and name c) 1.0 -120.0  20.0 2
assign (resid   57 and name c) (resid   58 and name n)
  (resid   58 and name ca) (resid   58 and name c) 1.0 -60.0  30.0 2
assign (resid   59 and name c) (resid   60 and name n)
  (resid   60 and name ca) (resid   60 and name c) 1.0 -120.0  20.0 2
assign (resid   60 and name c) (resid   61 and name n)
  (resid   61 and name ca) (resid   61 and name c) 1.0 -120.0  40.0 2
assign (resid   61 and name c) (resid   62 and name n)
  (resid   62 and name ca) (resid   62 and name c) 1.0 -120.0  40.0 2
assign (resid   64 and name c) (resid   65 and name n)
  (resid   65 and name ca) (resid   65 and name c) 1.0 -60.0  30.0 2
assign (resid   65 and name c) (resid   66 and name n)
  (resid   66 and name ca) (resid   66 and name c) 1.0 -60.0  30.0 2
assign (resid   68 and name c) (resid   69 and name n)
  (resid   69 and name ca) (resid   69 and name c) 1.0 -60.0  30.0 2
assign (resid   69 and name c) (resid   70 and name n)
  (resid   70 and name ca) (resid   70 and name c) 1.0 -120.0  40.0 2
assign (resid   73 and name c) (resid   74 and name n)
  (resid   74 and name ca) (resid   74 and name c) 1.0 -60.0  30.0 2
assign (resid   78 and name c) (resid   79 and name n)
  (resid   79 and name ca) (resid   79 and name c) 1.0 -60.0  30.0 2
assign (resid   79 and name c) (resid   80 and name n)
  (resid   80 and name ca) (resid   80 and name c) 1.0 -60.0  30.0 2
assign (resid   80 and name c) (resid   81 and name n)
  (resid   81 and name ca) (resid   81 and name c) 1.0 -60.0  30.0 2
assign (resid   81 and name c) (resid   82 and name n)
  (resid   82 and name ca) (resid   82 and name c) 1.0 -120.0  40.0 2
assign (resid   82 and name c) (resid   83 and name n)
  (resid   83 and name ca) (resid   83 and name c) 1.0 -120.0  20.0 2
assign (resid   83 and name c) (resid   84 and name n)
  (resid   84 and name ca) (resid   84 and name c) 1.0 -60.0  30.0 2
assign (resid   85 and name c) (resid   86 and name n)
  (resid   86 and name ca) (resid   86 and name c) 1.0 -60.0  30.0 2

!----- chi1-angle constraints from hnhb, hn(co)hb, n15-tocsy experiments -----
assign (resid 5 and name n)    (resid 5 and name ca)
   (resid 5 and name cb)   (resid 5 and name og1) 1.0 -60.0 20.0 2
assign (resid 7 and name n)    (resid 7 and name ca)
   (resid 7 and name cb)   (resid 7 and name cg) 1.0 60.0 25.0 2
assign (resid 17 and name n)    (resid 17 and name ca)
   (resid 17 and name cb)   (resid 17 and name cg) 1.0 -60.0 25.0 2
assign (resid 20 and name n)    (resid 20 and name ca)
   (resid 20 and name cb)   (resid 20 and name cg) 1.0 -60.0 30.0 2
assign (resid 22 and name n)    (resid 22 and name ca)
   (resid 22 and name cb)   (resid 22 and name cg1) 1.0 -60.0 30.0 2
assign (resid 24 and name n)    (resid 24 and name ca)
   (resid 24 and name cb)   (resid 24 and name cg) 1.0 60.0 20.0 2
assign (resid 25 and name n)    (resid 25 and name ca)
   (resid 25 and name cb)   (resid 25 and name cg) 1.0 -60.0 20.0 2
assign (resid 26 and name n)    (resid 26 and name ca)
   (resid 26 and name cb)   (resid 26 and name cg) 1.0 180.0 30.0 2
assign (resid 27 and name n)    (resid 27 and name ca)
   (resid 27 and name cb)   (resid 27 and name cg) 1.0 -60.0 20.0 2
assign (resid 29 and name n)    (resid 29 and name ca)
   (resid 29 and name cb)   (resid 29 and name cg) 1.0 -60.0 30.0 2
assign (resid 31 and name n)    (resid 31 and name ca)
   (resid 31 and name cb)   (resid 31 and name cg) 1.0 -60.0 20.0 2
assign (resid 32 and name n)    (resid 32 and name ca)
   (resid 32 and name cb)   (resid 32 and name cg) 1.0 -60.0 20.0 2
assign (resid 33 and name n)    (resid 33 and name ca)
   (resid 33 and name cb)   (resid 33 and name cg) 1.0 180.0 30.0 2
assign (resid 38 and name n)    (resid 38 and name ca)
   (resid 38 and name cb)   (resid 38 and name cg) 1.0 -60.0 20.0 2
assign (resid 39 and name n)    (resid 39 and name ca)
   (resid 39 and name cb)   (resid 39 and name cg) 1.0 -60.0 20.0 2
assign (resid 40 and name n)    (resid 40 and name ca)
   (resid 40 and name cb)   (resid 40 and name cg) 1.0 -60.0 30.0 2
assign (resid 41 and name n)    (resid 41 and name ca)
   (resid 41 and name cb)   (resid 41 and name cg) 1.0 -60.0 20.0 2
assign (resid 42 and name n)    (resid 42 and name ca)
   (resid 42 and name cb)   (resid 42 and name cg) 1.0 60.0 30.0 2
assign (resid 43 and name n)    (resid 43 and name ca)
   (resid 43 and name cb)   (resid 43 and name cg) 1.0 180.0 30.0 2
assign (resid 46 and name n)    (resid 46 and name ca)
   (resid 46 and name cb)   (resid 46 and name cg) 1.0 -60.0 20.0 2
assign (resid 47 and name n)    (resid 47 and name ca)
   (resid 47 and name cb)   (resid 47 and name cg) 1.0 -60.0 20.0 2
assign (resid 48 and name n)    (resid 48 and name ca)
   (resid 48 and name cb)   (resid 48 and name cg) 1.0 60.0 20.0 2
assign (resid 49 and name n)    (resid 49 and name ca)
   (resid 49 and name cb)   (resid 49 and name cg) 1.0 60.0 25.0 2
assign (resid 50 and name n)    (resid 50 and name ca)
   (resid 50 and name cb)   (resid 50 and name cg) 1.0 60.0 20.0 2
assign (resid 53 and name n)    (resid 53 and name ca)
   (resid 53 and name cb)   (resid 53 and name cg) 1.0 -60.0 30.0 2
assign (resid 55 and name n)    (resid 55 and name ca)
   (resid 55 and name cb)   (resid 55 and name cg) 1.0 180.0 25.0 2
assign (resid 56 and name n)    (resid 56 and name ca)
   (resid 56 and name cb)   (resid 56 and name cg) 1.0 180.0 30.0 2
assign (resid 58 and name n)    (resid 58 and name ca)
   (resid 58 and name cb)   (resid 58 and name cg) 1.0 180.0 30.0 2
assign (resid 73 and name n)    (resid 73 and name ca)
   (resid 73 and name cb)   (resid 73 and name cg) 1.0 -60.0 30.0 2
assign (resid 82 and name n)    (resid 82 and name ca)
   (resid 82 and name cb)   (resid 82 and name cg) 1.0 -60.0 20.0 2
assign (resid 86 and name n)    (resid 86 and name ca)
   (resid 86 and name cb)   (resid 86 and name cg) 1.0 -60.0 30.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR   1          HT1       THR   1  24.939  -7.805  -6.753
    2   2H    THR   1          HT2       THR   1  23.309  -8.212  -6.502
    3   3H    THR   1          HT3       THR   1  24.042  -7.003  -5.560
    4    HA   THR   1           HA       THR   1  24.218  -5.534  -7.426
    5    HB   THR   1           HB       THR   1  22.826  -7.189  -9.352
    6    HG1  THR   1           HG1      THR   1  23.765  -8.912  -8.243
    7   1HG2  THR   1          HG21      THR   1  24.231  -6.073 -10.718
    8   2HG2  THR   1          HG22      THR   1  25.650  -6.654  -9.845
    9   3HG2  THR   1          HG23      THR   1  24.793  -5.221  -9.279
   10    H    LYS   2           HN       LYS   2  22.159  -6.631  -5.402
   11    HA   LYS   2           HA       LYS   2  19.605  -5.920  -6.752
   12   1HB   LYS   2          HB2       LYS   2  20.228  -6.879  -3.938
   13   2HB   LYS   2          HB1       LYS   2  18.634  -6.821  -4.688
   14   1HG   LYS   2          HG2       LYS   2  19.497  -8.381  -6.468
   15   2HG   LYS   2          HG1       LYS   2  20.978  -8.547  -5.525
   16   1HD   LYS   2          HD2       LYS   2  19.754  -9.462  -3.646
   17   2HD   LYS   2          HD1       LYS   2  18.212  -9.133  -4.435
   18   1HE   LYS   2          HE2       LYS   2  19.437 -10.636  -6.358
   19   2HE   LYS   2          HE1       LYS   2  20.107 -11.362  -4.884
   20   1HZ   LYS   2          HZ1       LYS   2  17.594 -11.002  -4.132
   21   2HZ   LYS   2          HZ2       LYS   2  18.128 -12.433  -4.879
   22   3HZ   LYS   2          HZ3       LYS   2  17.340 -11.236  -5.792
   23    H    ALA   3           HN       ALA   3  19.075  -3.776  -6.737
   24    HA   ALA   3           HA       ALA   3  20.229  -1.949  -4.725
   25   1HB   ALA   3          HB1       ALA   3  19.815  -1.671  -7.316
   26   2HB   ALA   3          HB2       ALA   3  19.571  -0.292  -6.243
   27   3HB   ALA   3          HB3       ALA   3  18.185  -1.226  -6.808
   28    H    SER   4           HN       SER   4  18.092  -0.125  -4.519
   29    HA   SER   4           HA       SER   4  16.001  -1.701  -3.053
   30   1HB   SER   4          HB2       SER   4  17.248   0.957  -2.286
   31   2HB   SER   4          HB1       SER   4  16.112   0.016  -1.322
   32    HG   SER   4           HG       SER   4  18.653  -0.907  -2.194
   33    H    CYS   5           HN       CYS   5  13.953  -0.381  -2.766
   34    HA   CYS   5           HA       CYS   5  13.390   1.160  -5.255
   35   1HB   CYS   5          HB2       CYS   5  11.716  -0.203  -3.136
   36   2HB   CYS   5          HB1       CYS   5  11.009   0.732  -4.452
   37    H    LYS   6           HN       LYS   6  11.219   2.664  -4.378
   38    HA   LYS   6           HA       LYS   6  12.252   4.347  -2.134
   39   1HB   LYS   6          HB2       LYS   6  12.463   4.892  -4.901
   40   2HB   LYS   6          HB1       LYS   6  11.185   5.946  -4.294
   41   1HG   LYS   6          HG2       LYS   6  12.610   7.008  -2.763
   42   2HG   LYS   6          HG1       LYS   6  13.775   5.683  -2.784
   43   1HD   LYS   6          HD2       LYS   6  14.943   6.763  -4.372
   44   2HD   LYS   6          HD1       LYS   6  13.556   6.633  -5.453
   45   1HE   LYS   6          HE2       LYS   6  12.614   8.709  -4.285
   46   2HE   LYS   6          HE1       LYS   6  14.221   8.900  -3.555
   47   1HZ   LYS   6          HZ1       LYS   6  13.638   9.881  -5.938
   48   2HZ   LYS   6          HZ2       LYS   6  14.119   8.321  -6.412
   49   3HZ   LYS   6          HZ3       LYS   6  15.189   9.317  -5.546
   50    H    LEU   7           HN       LEU   7  10.562   4.450  -0.708
   51    HA   LEU   7           HA       LEU   7   7.939   3.673  -0.953
   52   1HB   LEU   7          HB2       LEU   7   7.503   5.449   0.802
   53   2HB   LEU   7          HB1       LEU   7   8.909   4.429   1.126
   54    HG   LEU   7           HG       LEU   7   9.896   6.525  -0.453
   55   1HD1  LEU   7          HD11      LEU   7   8.984   8.243   1.557
   56   2HD1  LEU   7          HD12      LEU   7   7.544   7.363   1.048
   57   3HD1  LEU   7          HD13      LEU   7   8.491   8.265  -0.136
   58   1HD2  LEU   7          HD21      LEU   7  11.391   6.039   1.183
   59   2HD2  LEU   7          HD22      LEU   7  10.129   5.475   2.278
   60   3HD2  LEU   7          HD23      LEU   7  10.497   7.197   2.167
   61    HA   PRO   8           HA       PRO   8   6.827   6.541  -4.332
   62   1HB   PRO   8          HB2       PRO   8   4.399   5.017  -4.576
   63   2HB   PRO   8          HB1       PRO   8   5.793   5.032  -5.667
   64   1HG   PRO   8          HG2       PRO   8   4.976   2.928  -3.910
   65   2HG   PRO   8          HG1       PRO   8   6.398   2.971  -4.955
   66   1HD   PRO   8          HD2       PRO   8   6.292   3.185  -2.065
   67   2HD   PRO   8          HD1       PRO   8   7.729   3.151  -3.115
   68    H    VAL   9           HN       VAL   9   5.413   5.828  -1.294
   69    HA   VAL   9           HA       VAL   9   3.626   8.219  -1.562
   70    HB   VAL   9           HB       VAL   9   2.924   5.722  -0.014
   71   1HG1  VAL   9          HG11      VAL   9   0.859   6.692   0.250
   72   2HG1  VAL   9          HG12      VAL   9   0.926   7.501  -1.316
   73   3HG1  VAL   9          HG13      VAL   9   1.802   8.170   0.061
   74   1HG2  VAL   9          HG21      VAL   9   1.562   5.049  -1.980
   75   2HG2  VAL   9          HG22      VAL   9   3.284   5.061  -2.357
   76   3HG2  VAL   9          HG23      VAL   9   2.253   6.384  -2.901
   77    H    LYS  10           HN       LYS  10   3.233   9.315   0.488
   78    HA   LYS  10           HA       LYS  10   5.461   8.944   2.431
   79   1HB   LYS  10          HB2       LYS  10   3.868  11.124   1.317
   80   2HB   LYS  10          HB1       LYS  10   3.952  11.210   3.077
   81   1HG   LYS  10          HG2       LYS  10   6.022  12.073   2.882
   82   2HG   LYS  10          HG1       LYS  10   6.552  10.532   2.208
   83   1HD   LYS  10          HD2       LYS  10   5.185  11.876   0.127
   84   2HD   LYS  10          HD1       LYS  10   6.246  13.069   0.874
   85   1HE   LYS  10          HE2       LYS  10   7.749  12.101  -0.614
   86   2HE   LYS  10          HE1       LYS  10   7.977  11.012   0.770
   87   1HZ   LYS  10          HZ1       LYS  10   6.054  10.618  -1.463
   88   2HZ   LYS  10          HZ2       LYS  10   6.207   9.602  -0.111
   89   3HZ   LYS  10          HZ3       LYS  10   7.484   9.740  -1.222
   90    H    LYS  11           HN       LYS  11   2.370   7.829   2.067
   91    HA   LYS  11           HA       LYS  11   2.084   7.294   4.954
   92   1HB   LYS  11          HB2       LYS  11  -0.283   8.285   4.831
   93   2HB   LYS  11          HB1       LYS  11   1.044   9.447   4.836
   94   1HG   LYS  11          HG2       LYS  11   0.376   8.531   2.139
   95   2HG   LYS  11          HG1       LYS  11  -0.985   9.315   2.941
   96   1HD   LYS  11          HD2       LYS  11   0.464  11.249   3.488
   97   2HD   LYS  11          HD1       LYS  11   1.802  10.472   2.641
   98   1HE   LYS  11          HE2       LYS  11   0.885  11.932   1.009
   99   2HE   LYS  11          HE1       LYS  11   0.144  10.368   0.616
  100   1HZ   LYS  11          HZ1       LYS  11  -1.639  11.872   0.776
  101   2HZ   LYS  11          HZ2       LYS  11  -1.021  12.597   2.182
  102   3HZ   LYS  11          HZ3       LYS  11  -1.655  11.022   2.243
  103    H    ALA  12           HN       ALA  12   2.515   5.583   2.687
  104    HA   ALA  12           HA       ALA  12  -0.102   4.391   1.997
  105   1HB   ALA  12          HB1       ALA  12   1.309   4.316   0.171
  106   2HB   ALA  12          HB2       ALA  12   1.749   2.772   0.899
  107   3HB   ALA  12          HB3       ALA  12   2.757   4.194   1.168
  108    H    THR  13           HN       THR  13  -0.875   2.482   2.893
  109    HA   THR  13           HA       THR  13   0.790   1.226   5.049
  110    HB   THR  13           HB       THR  13  -2.199   0.986   4.720
  111    HG1  THR  13           HG1      THR  13  -2.419   2.892   5.846
  112   1HG2  THR  13          HG21      THR  13  -0.196   0.269   6.682
  113   2HG2  THR  13          HG22      THR  13  -1.903  -0.170   6.626
  114   3HG2  THR  13          HG23      THR  13  -1.404   1.336   7.397
  115    H    VAL  14           HN       VAL  14   1.600  -0.740   4.450
  116    HA   VAL  14           HA       VAL  14  -0.024  -2.428   2.571
  117    HB   VAL  14           HB       VAL  14   2.331  -3.290   1.946
  118   1HG1  VAL  14          HG11      VAL  14   2.030  -0.378   1.284
  119   2HG1  VAL  14          HG12      VAL  14   0.789  -1.513   0.756
  120   3HG1  VAL  14          HG13      VAL  14   2.458  -1.724   0.228
  121   1HG2  VAL  14          HG21      VAL  14   3.114  -1.824   4.105
  122   2HG2  VAL  14          HG22      VAL  14   3.402  -0.664   2.808
  123   3HG2  VAL  14          HG23      VAL  14   4.189  -2.242   2.771
  124    H    VAL  15           HN       VAL  15   0.942  -4.829   2.777
  125    HA   VAL  15           HA       VAL  15   1.073  -5.458   5.709
  126    HB   VAL  15           HB       VAL  15  -0.276  -6.734   3.331
  127   1HG1  VAL  15          HG11      VAL  15   0.857  -8.051   5.722
  128   2HG1  VAL  15          HG12      VAL  15   0.403  -8.743   4.165
  129   3HG1  VAL  15          HG13      VAL  15  -0.830  -8.444   5.390
  130   1HG2  VAL  15          HG21      VAL  15  -1.048  -5.229   5.689
  131   2HG2  VAL  15          HG22      VAL  15  -1.860  -6.794   5.657
  132   3HG2  VAL  15          HG23      VAL  15  -2.027  -5.686   4.295
  133    H    TYR  16           HN       TYR  16   3.461  -5.370   5.576
  134    HA   TYR  16           HA       TYR  16   4.831  -7.247   3.768
  135   1HB   TYR  16          HB2       TYR  16   5.672  -4.972   4.412
  136   2HB   TYR  16          HB1       TYR  16   5.859  -5.553   6.068
  137    HD1  TYR  16           HD1      TYR  16   8.221  -5.525   6.346
  138    HD2  TYR  16           HD2      TYR  16   6.483  -7.449   2.921
  139    HE1  TYR  16           HE1      TYR  16  10.431  -6.487   5.763
  140    HE2  TYR  16           HE2      TYR  16   8.694  -8.410   2.339
  141    HH   TYR  16           HH       TYR  16  10.805  -8.671   2.973
  142    H    GLN  17           HN       GLN  17   5.081  -9.372   4.306
  143    HA   GLN  17           HA       GLN  17   5.349 -11.319   5.617
  144   1HB   GLN  17          HB2       GLN  17   6.237  -9.319   7.711
  145   2HB   GLN  17          HB1       GLN  17   6.735 -11.008   7.568
  146   1HG   GLN  17          HG2       GLN  17   7.259  -9.750   5.065
  147   2HG   GLN  17          HG1       GLN  17   7.904  -8.702   6.328
  148   1HE2  GLN  17          HE21      GLN  17   8.816 -10.443   8.256
  149   2HE2  GLN  17          HE22      GLN  17   9.988 -11.492   7.617
  150    H    GLY  18           HN       GLY  18   2.745 -10.010   5.626
  151   1HA   GLY  18          HA2       GLY  18   0.704 -10.299   6.755
  152   2HA   GLY  18          HA1       GLY  18   1.554 -11.364   7.876
  153    H    GLU  19           HN       GLU  19   2.709  -8.110   7.363
  154    HA   GLU  19           HA       GLU  19   1.592  -7.338  10.040
  155   1HB   GLU  19          HB2       GLU  19   4.295  -7.687   9.104
  156   2HB   GLU  19          HB1       GLU  19   4.042  -5.998   9.543
  157   1HG   GLU  19          HG2       GLU  19   4.673  -6.971  11.586
  158   2HG   GLU  19          HG1       GLU  19   2.912  -6.967  11.682
  159    H    ARG  20           HN       ARG  20   0.636  -5.325  10.088
  160    HA   ARG  20           HA       ARG  20   0.453  -3.815   7.551
  161   1HB   ARG  20          HB2       ARG  20  -0.837  -3.275  10.237
  162   2HB   ARG  20          HB1       ARG  20  -1.406  -2.755   8.647
  163   1HG   ARG  20          HG2       ARG  20  -1.813  -5.085   8.003
  164   2HG   ARG  20          HG1       ARG  20  -1.185  -5.641   9.555
  165   1HD   ARG  20          HD2       ARG  20  -3.197  -3.661  10.073
  166   2HD   ARG  20          HD1       ARG  20  -3.862  -4.865   8.951
  167    HE   ARG  20           HE       ARG  20  -2.322  -5.953  11.220
  168   1HH1  ARG  20          HH21      ARG  20  -5.328  -4.506  10.718
  169   2HH1  ARG  20          HH22      ARG  20  -6.257  -5.825  11.346
  170   1HH2  ARG  20          HH11      ARG  20  -3.530  -7.944  11.656
  171   2HH2  ARG  20          HH12      ARG  20  -5.239  -7.773  11.877
  172    H    VAL  21           HN       VAL  21   1.743  -2.058   7.172
  173    HA   VAL  21           HA       VAL  21   2.588  -0.322   9.416
  174    HB   VAL  21           HB       VAL  21   5.007  -0.598   8.495
  175   1HG1  VAL  21          HG11      VAL  21   4.026  -3.114   9.797
  176   2HG1  VAL  21          HG12      VAL  21   3.836  -1.585  10.653
  177   3HG1  VAL  21          HG13      VAL  21   5.443  -2.137  10.180
  178   1HG2  VAL  21          HG21      VAL  21   5.511  -2.558   7.276
  179   2HG2  VAL  21          HG22      VAL  21   4.042  -1.960   6.504
  180   3HG2  VAL  21          HG23      VAL  21   3.954  -3.298   7.650
  181    H    LYS  22           HN       LYS  22   4.262   1.380   8.244
  182    HA   LYS  22           HA       LYS  22   2.796   2.298   5.800
  183   1HB   LYS  22          HB2       LYS  22   3.060   3.537   8.161
  184   2HB   LYS  22          HB1       LYS  22   4.568   4.074   7.419
  185   1HG   LYS  22          HG2       LYS  22   2.913   5.715   6.850
  186   2HG   LYS  22          HG1       LYS  22   3.195   4.761   5.393
  187   1HD   LYS  22          HD2       LYS  22   0.863   4.807   5.484
  188   2HD   LYS  22          HD1       LYS  22   1.225   3.289   6.308
  189   1HE   LYS  22          HE2       LYS  22   1.221   4.651   8.493
  190   2HE   LYS  22          HE1       LYS  22   0.454   5.941   7.545
  191   1HZ   LYS  22          HZ1       LYS  22  -0.536   3.179   7.328
  192   2HZ   LYS  22          HZ2       LYS  22  -1.361   4.639   7.055
  193   3HZ   LYS  22          HZ3       LYS  22  -1.023   4.133   8.642
  194    H    ILE  23           HN       ILE  23   3.974   1.742   3.998
  195    HA   ILE  23           HA       ILE  23   6.692   1.069   3.829
  196    HB   ILE  23           HB       ILE  23   4.934   0.761   2.096
  197   1HG1  ILE  23          HG12      ILE  23   7.162   2.435   0.930
  198   2HG1  ILE  23          HG11      ILE  23   7.470   0.837   1.611
  199   1HG2  ILE  23          HG21      ILE  23   5.315   3.742   1.678
  200   2HG2  ILE  23          HG22      ILE  23   3.867   2.971   2.324
  201   3HG2  ILE  23          HG23      ILE  23   4.349   2.682   0.653
  202   1HD1  ILE  23          HD11      ILE  23   5.933   1.589  -0.840
  203   2HD1  ILE  23          HD12      ILE  23   5.405   0.172   0.067
  204   3HD1  ILE  23          HD13      ILE  23   7.043   0.243  -0.582
  205    H    GLN  24           HN       GLN  24   5.214   4.245   4.045
  206    HA   GLN  24           HA       GLN  24   7.504   5.756   3.096
  207   1HB   GLN  24          HB2       GLN  24   6.216   7.643   4.011
  208   2HB   GLN  24          HB1       GLN  24   5.140   6.542   3.143
  209   1HG   GLN  24          HG2       GLN  24   3.894   6.446   5.018
  210   2HG   GLN  24          HG1       GLN  24   5.214   5.538   5.755
  211   1HE2  GLN  24          HE21      GLN  24   4.110   6.853   7.703
  212   2HE2  GLN  24          HE22      GLN  24   4.836   8.346   8.054
  213    H    GLU  25           HN       GLU  25   6.809   4.087   6.017
  214    HA   GLU  25           HA       GLU  25   8.881   5.668   7.497
  215   1HB   GLU  25          HB2       GLU  25   6.493   4.002   8.293
  216   2HB   GLU  25          HB1       GLU  25   7.736   4.437   9.465
  217   1HG   GLU  25          HG2       GLU  25   6.852   6.709   7.836
  218   2HG   GLU  25          HG1       GLU  25   5.553   6.003   8.798
  219    H    LYS  26           HN       LYS  26   7.650   2.298   7.592
  220    HA   LYS  26           HA       LYS  26   9.910   1.016   8.590
  221   1HB   LYS  26          HB2       LYS  26   7.850  -0.160   8.210
  222   2HB   LYS  26          HB1       LYS  26   7.889   0.212   6.484
  223   1HG   LYS  26          HG2       LYS  26   9.037  -1.683   6.104
  224   2HG   LYS  26          HG1       LYS  26  10.338  -1.097   7.142
  225   1HD   LYS  26          HD2       LYS  26   8.364  -1.882   8.942
  226   2HD   LYS  26          HD1       LYS  26   8.305  -3.123   7.689
  227   1HE   LYS  26          HE2       LYS  26  10.602  -3.693   7.995
  228   2HE   LYS  26          HE1       LYS  26  10.918  -2.221   8.933
  229   1HZ   LYS  26          HZ1       LYS  26   9.511  -4.661   9.728
  230   2HZ   LYS  26          HZ2       LYS  26   8.940  -3.188  10.351
  231   3HZ   LYS  26          HZ3       LYS  26  10.545  -3.670  10.635
  232    H    PHE  27           HN       PHE  27   9.250   1.893   5.199
  233    HA   PHE  27           HA       PHE  27  12.078   1.183   4.515
  234   1HB   PHE  27          HB2       PHE  27   9.462   1.319   3.020
  235   2HB   PHE  27          HB1       PHE  27  10.996   1.356   2.143
  236    HD1  PHE  27           HD1      PHE  27   8.574  -0.827   2.622
  237    HD2  PHE  27           HD2      PHE  27  12.691  -0.417   3.777
  238    HE1  PHE  27           HE1      PHE  27   8.759  -3.291   2.844
  239    HE2  PHE  27           HE2      PHE  27  12.876  -2.878   3.998
  240    HZ   PHE  27           HZ       PHE  27  10.910  -4.316   3.532
  241    H    LYS  28           HN       LYS  28  11.604   3.632   5.877
  242    HA   LYS  28           HA       LYS  28  11.138   5.902   4.245
  243   1HB   LYS  28          HB2       LYS  28  11.213   6.369   6.506
  244   2HB   LYS  28          HB1       LYS  28  12.516   5.221   6.802
  245   1HG   LYS  28          HG2       LYS  28  13.030   7.731   5.221
  246   2HG   LYS  28          HG1       LYS  28  13.040   7.764   6.985
  247   1HD   LYS  28          HD2       LYS  28  14.547   5.552   6.532
  248   2HD   LYS  28          HD1       LYS  28  14.960   6.514   5.112
  249   1HE   LYS  28          HE2       LYS  28  16.533   7.260   6.715
  250   2HE   LYS  28          HE1       LYS  28  15.243   8.469   6.858
  251   1HZ   LYS  28          HZ1       LYS  28  15.216   7.834   9.002
  252   2HZ   LYS  28          HZ2       LYS  28  16.001   6.360   8.695
  253   3HZ   LYS  28          HZ3       LYS  28  14.329   6.505   8.437
  254    H    ASN  29           HN       ASN  29  13.865   3.742   4.441
  255    HA   ASN  29           HA       ASN  29  15.554   5.589   2.810
  256   1HB   ASN  29          HB2       ASN  29  16.011   3.109   4.476
  257   2HB   ASN  29          HB1       ASN  29  17.248   3.703   3.363
  258   1HD2  ASN  29          HD21      ASN  29  16.192   3.956   6.550
  259   2HD2  ASN  29          HD22      ASN  29  16.903   5.446   6.941
  260    H    GLY  30           HN       GLY  30  13.254   4.350   1.588
  261   1HA   GLY  30          HA2       GLY  30  12.848   3.340  -0.513
  262   2HA   GLY  30          HA1       GLY  30  14.571   2.970  -0.626
  263    H    MET  31           HN       MET  31  12.583   1.052  -1.289
  264    HA   MET  31           HA       MET  31  12.525  -0.795   1.052
  265   1HB   MET  31          HB2       MET  31  11.259  -1.156  -1.675
  266   2HB   MET  31          HB1       MET  31  10.777  -1.889  -0.149
  267   1HG   MET  31          HG2       MET  31   9.365  -0.175   0.205
  268   2HG   MET  31          HG1       MET  31  10.744   0.924   0.244
  269   1HE   MET  31          HE1       MET  31   7.620  -0.165  -2.453
  270   2HE   MET  31          HE2       MET  31   8.775  -1.309  -1.777
  271   3HE   MET  31          HE3       MET  31   8.946  -0.781  -3.449
  272    H    LEU  32           HN       LEU  32  13.437  -2.923   0.866
  273    HA   LEU  32           HA       LEU  32  15.855  -3.112  -0.696
  274   1HB   LEU  32          HB2       LEU  32  14.209  -5.124   0.859
  275   2HB   LEU  32          HB1       LEU  32  15.830  -5.448   0.236
  276    HG   LEU  32           HG       LEU  32  15.553  -2.942   1.789
  277   1HD1  LEU  32          HD11      LEU  32  14.099  -4.666   2.994
  278   2HD1  LEU  32          HD12      LEU  32  15.422  -3.981   3.938
  279   3HD1  LEU  32          HD13      LEU  32  15.578  -5.595   3.245
  280   1HD2  LEU  32          HD21      LEU  32  17.545  -4.953   2.559
  281   2HD2  LEU  32          HD22      LEU  32  17.780  -3.283   2.038
  282   3HD2  LEU  32          HD23      LEU  32  17.593  -4.564   0.840
  283    H    HIS  33           HN       HIS  33  16.274  -4.385  -2.540
  284    HA   HIS  33           HA       HIS  33  14.268  -4.614  -4.535
  285   1HB   HIS  33          HB2       HIS  33  16.574  -4.548  -5.135
  286   2HB   HIS  33          HB1       HIS  33  16.964  -5.900  -4.068
  287    HD1  HIS  33           HD1      HIS  33  14.005  -5.916  -6.406
  288    HD2  HIS  33           HD2      HIS  33  17.779  -7.658  -6.128
  289    HE1  HIS  33           HE1      HIS  33  14.102  -7.700  -8.200
  290    H    GLY  34           HN       GLY  34  12.811  -6.237  -5.026
  291   1HA   GLY  34          HA2       GLY  34  11.910  -8.446  -5.031
  292   2HA   GLY  34          HA1       GLY  34  13.143  -8.926  -3.864
  293    H    ASP  35           HN       ASP  35  12.365  -6.409  -2.263
  294    HA   ASP  35           HA       ASP  35  10.861  -7.497  -0.218
  295   1HB   ASP  35          HB2       ASP  35  11.880  -5.286  -0.148
  296   2HB   ASP  35          HB1       ASP  35  10.777  -4.701  -1.394
  297    H    LYS  36           HN       LYS  36   8.811  -8.343  -0.112
  298    HA   LYS  36           HA       LYS  36   6.877  -7.612  -2.277
  299   1HB   LYS  36          HB2       LYS  36   7.504 -10.035  -0.653
  300   2HB   LYS  36          HB1       LYS  36   5.831  -9.810  -1.162
  301   1HG   LYS  36          HG2       LYS  36   7.187  -9.227  -3.473
  302   2HG   LYS  36          HG1       LYS  36   8.207 -10.484  -2.772
  303   1HD   LYS  36          HD2       LYS  36   5.265 -10.949  -2.721
  304   2HD   LYS  36          HD1       LYS  36   6.067 -11.069  -4.287
  305   1HE   LYS  36          HE2       LYS  36   7.481 -12.429  -2.065
  306   2HE   LYS  36          HE1       LYS  36   5.924 -13.147  -2.528
  307   1HZ   LYS  36          HZ1       LYS  36   7.512 -14.061  -3.993
  308   2HZ   LYS  36          HZ2       LYS  36   8.244 -12.554  -4.277
  309   3HZ   LYS  36          HZ3       LYS  36   6.694 -12.878  -4.893
  310    H    VAL  37           HN       VAL  37   5.227  -6.304  -1.658
  311    HA   VAL  37           HA       VAL  37   4.163  -6.523   1.127
  312    HB   VAL  37           HB       VAL  37   4.220  -4.063   1.290
  313   1HG1  VAL  37          HG11      VAL  37   6.254  -5.607   1.812
  314   2HG1  VAL  37          HG12      VAL  37   6.525  -3.866   1.718
  315   3HG1  VAL  37          HG13      VAL  37   6.959  -4.902   0.357
  316   1HG2  VAL  37          HG21      VAL  37   4.956  -4.365  -1.567
  317   2HG2  VAL  37          HG22      VAL  37   5.848  -3.128  -0.680
  318   3HG2  VAL  37          HG23      VAL  37   4.088  -3.058  -0.762
  319    H    SER  38           HN       SER  38   1.920  -6.319   1.197
  320    HA   SER  38           HA       SER  38   0.537  -5.973  -1.421
  321   1HB   SER  38          HB2       SER  38  -0.826  -6.817   1.102
  322   2HB   SER  38          HB1       SER  38  -1.039  -7.421  -0.542
  323    HG   SER  38           HG       SER  38   0.156  -8.761   1.101
  324    H    PHE  39           HN       PHE  39  -1.094  -4.407  -1.683
  325    HA   PHE  39           HA       PHE  39  -1.161  -2.251   0.383
  326   1HB   PHE  39          HB2       PHE  39  -1.711  -2.457  -2.580
  327   2HB   PHE  39          HB1       PHE  39  -2.228  -1.044  -1.652
  328    HD1  PHE  39           HD1      PHE  39  -0.539   0.353  -0.454
  329    HD2  PHE  39           HD2      PHE  39   0.602  -2.824  -3.111
  330    HE1  PHE  39           HE1      PHE  39   1.760   1.276  -0.569
  331    HE2  PHE  39           HE2      PHE  39   2.902  -1.900  -3.227
  332    HZ   PHE  39           HZ       PHE  39   3.480   0.148  -1.956
  333    H    PHE  40           HN       PHE  40  -3.239  -1.449   1.101
  334    HA   PHE  40           HA       PHE  40  -5.347  -3.500   1.099
  335   1HB   PHE  40          HB2       PHE  40  -4.884  -0.821   2.424
  336   2HB   PHE  40          HB1       PHE  40  -6.409  -1.693   2.612
  337    HD1  PHE  40           HD1      PHE  40  -3.081  -1.321   3.833
  338    HD2  PHE  40           HD2      PHE  40  -6.236  -4.195   3.346
  339    HE1  PHE  40           HE1      PHE  40  -2.052  -2.747   5.581
  340    HE2  PHE  40           HE2      PHE  40  -5.208  -5.620   5.095
  341    HZ   PHE  40           HZ       PHE  40  -3.116  -4.897   6.212
  342    H    CYS  41           HN       CYS  41  -7.169  -3.437  -0.150
  343    HA   CYS  41           HA       CYS  41  -7.959  -0.869  -1.454
  344   1HB   CYS  41          HB2       CYS  41  -6.510  -2.806  -2.741
  345   2HB   CYS  41          HB1       CYS  41  -8.160  -3.328  -3.098
  346    H    LYS  42           HN       LYS  42 -10.221  -1.337  -2.603
  347    HA   LYS  42           HA       LYS  42 -11.810  -3.142  -0.807
  348   1HB   LYS  42          HB2       LYS  42 -13.544  -1.418  -0.840
  349   2HB   LYS  42          HB1       LYS  42 -12.017  -0.708  -0.312
  350   1HG   LYS  42          HG2       LYS  42 -11.712  -0.244  -2.903
  351   2HG   LYS  42          HG1       LYS  42 -13.473  -0.359  -2.906
  352   1HD   LYS  42          HD2       LYS  42 -13.508   1.793  -2.232
  353   2HD   LYS  42          HD1       LYS  42 -12.895   1.223  -0.679
  354   1HE   LYS  42          HE2       LYS  42 -11.357   2.924  -1.418
  355   2HE   LYS  42          HE1       LYS  42 -10.546   1.375  -1.726
  356   1HZ   LYS  42          HZ1       LYS  42 -11.811   1.502  -3.961
  357   2HZ   LYS  42          HZ2       LYS  42 -10.387   2.409  -3.769
  358   3HZ   LYS  42          HZ3       LYS  42 -11.903   3.164  -3.635
  359    H    ASN  43           HN       ASN  43 -13.672  -4.107  -1.785
  360    HA   ASN  43           HA       ASN  43 -13.598  -4.134  -4.786
  361   1HB   ASN  43          HB2       ASN  43 -12.974  -6.180  -3.265
  362   2HB   ASN  43          HB1       ASN  43 -14.721  -6.320  -3.043
  363   1HD2  ASN  43          HD21      ASN  43 -13.878  -8.474  -4.312
  364   2HD2  ASN  43          HD22      ASN  43 -14.078  -8.394  -5.996
  365    H    LYS  44           HN       LYS  44 -15.296  -2.841  -5.447
  366    HA   LYS  44           HA       LYS  44 -17.697  -2.394  -3.914
  367   1HB   LYS  44          HB2       LYS  44 -16.502  -1.687  -6.511
  368   2HB   LYS  44          HB1       LYS  44 -18.264  -1.747  -6.535
  369   1HG   LYS  44          HG2       LYS  44 -18.321   0.259  -5.522
  370   2HG   LYS  44          HG1       LYS  44 -17.518  -0.451  -4.122
  371   1HD   LYS  44          HD2       LYS  44 -15.410  -0.161  -5.834
  372   2HD   LYS  44          HD1       LYS  44 -16.401   1.230  -6.279
  373   1HE   LYS  44          HE2       LYS  44 -16.544   1.345  -3.544
  374   2HE   LYS  44          HE1       LYS  44 -14.897   0.727  -3.785
  375   1HZ   LYS  44          HZ1       LYS  44 -14.317   2.519  -5.100
  376   2HZ   LYS  44          HZ2       LYS  44 -15.302   3.260  -3.931
  377   3HZ   LYS  44          HZ3       LYS  44 -15.924   2.914  -5.473
  378    H    GLU  45           HN       GLU  45 -16.691  -4.979  -5.950
  379    HA   GLU  45           HA       GLU  45 -19.416  -5.801  -6.724
  380   1HB   GLU  45          HB2       GLU  45 -16.778  -6.167  -7.628
  381   2HB   GLU  45          HB1       GLU  45 -17.297  -7.758  -7.072
  382   1HG   GLU  45          HG2       GLU  45 -18.160  -7.841  -9.205
  383   2HG   GLU  45          HG1       GLU  45 -19.519  -7.062  -8.396
  384    H    LYS  46           HN       LYS  46 -16.879  -6.803  -4.439
  385    HA   LYS  46           HA       LYS  46 -18.668  -8.932  -3.363
  386   1HB   LYS  46          HB2       LYS  46 -15.756  -8.197  -2.941
  387   2HB   LYS  46          HB1       LYS  46 -16.554  -9.565  -2.161
  388   1HG   LYS  46          HG2       LYS  46 -16.893  -9.410  -5.098
  389   2HG   LYS  46          HG1       LYS  46 -15.253  -9.749  -4.541
  390   1HD   LYS  46          HD2       LYS  46 -15.809 -11.809  -3.750
  391   2HD   LYS  46          HD1       LYS  46 -17.371 -11.260  -3.141
  392   1HE   LYS  46          HE2       LYS  46 -18.376 -11.412  -5.322
  393   2HE   LYS  46          HE1       LYS  46 -16.797 -11.664  -6.095
  394   1HZ   LYS  46          HZ1       LYS  46 -16.515 -13.679  -4.799
  395   2HZ   LYS  46          HZ2       LYS  46 -17.941 -13.774  -5.718
  396   3HZ   LYS  46          HZ3       LYS  46 -18.019 -13.445  -4.052
  397    H    LYS  47           HN       LYS  47 -17.739  -5.711  -2.769
  398    HA   LYS  47           HA       LYS  47 -18.297  -4.241  -1.014
  399   1HB   LYS  47          HB2       LYS  47 -19.712  -6.626   0.192
  400   2HB   LYS  47          HB1       LYS  47 -20.094  -4.920   0.409
  401   1HG   LYS  47          HG2       LYS  47 -21.299  -4.824  -1.506
  402   2HG   LYS  47          HG1       LYS  47 -20.116  -5.770  -2.407
  403   1HD   LYS  47          HD2       LYS  47 -21.011  -7.832  -1.625
  404   2HD   LYS  47          HD1       LYS  47 -21.954  -7.031  -0.368
  405   1HE   LYS  47          HE2       LYS  47 -22.475  -6.249  -3.216
  406   2HE   LYS  47          HE1       LYS  47 -23.125  -7.793  -2.632
  407   1HZ   LYS  47          HZ1       LYS  47 -23.482  -5.133  -1.352
  408   2HZ   LYS  47          HZ2       LYS  47 -24.007  -6.606  -0.686
  409   3HZ   LYS  47          HZ3       LYS  47 -24.683  -6.037  -2.137
  410    H    CYS  48           HN       CYS  48 -15.884  -6.037  -0.928
  411    HA   CYS  48           HA       CYS  48 -15.372  -5.751   1.997
  412   1HB   CYS  48          HB2       CYS  48 -14.008  -8.083   1.121
  413   2HB   CYS  48          HB1       CYS  48 -15.318  -7.975   2.290
  414    H    SER  49           HN       SER  49 -12.933  -6.032   2.407
  415    HA   SER  49           HA       SER  49 -11.462  -4.682   0.178
  416   1HB   SER  49          HB2       SER  49  -9.928  -4.305   2.353
  417   2HB   SER  49          HB1       SER  49 -11.298  -3.263   1.981
  418    HG   SER  49           HG       SER  49 -11.164  -5.461   3.763
  419    H    TYR  50           HN       TYR  50  -9.123  -5.256   0.041
  420    HA   TYR  50           HA       TYR  50  -8.339  -7.900   1.115
  421   1HB   TYR  50          HB2       TYR  50  -7.835  -8.607  -1.314
  422   2HB   TYR  50          HB1       TYR  50  -9.535  -8.588  -0.831
  423    HD1  TYR  50           HD1      TYR  50  -6.986  -7.078  -2.952
  424    HD2  TYR  50           HD2      TYR  50 -11.010  -6.681  -1.501
  425    HE1  TYR  50           HE1      TYR  50  -7.477  -5.458  -4.762
  426    HE2  TYR  50           HE2      TYR  50 -11.498  -5.059  -3.313
  427    HH   TYR  50           HH       TYR  50  -9.471  -4.622  -5.987
  428    H    THR  51           HN       THR  51  -6.055  -8.363  -0.298
  429    HA   THR  51           HA       THR  51  -4.525  -5.792  -0.040
  430    HB   THR  51           HB       THR  51  -2.640  -7.413   0.609
  431    HG1  THR  51           HG1      THR  51  -3.559  -9.405   1.478
  432   1HG2  THR  51          HG21      THR  51  -3.502  -7.630   2.932
  433   2HG2  THR  51          HG22      THR  51  -5.110  -7.192   2.354
  434   3HG2  THR  51          HG23      THR  51  -3.792  -6.025   2.261
  435    H    GLU  52           HN       GLU  52  -2.976  -5.369  -1.611
  436    HA   GLU  52           HA       GLU  52  -2.951  -7.209  -3.983
  437   1HB   GLU  52          HB2       GLU  52  -2.878  -4.226  -3.583
  438   2HB   GLU  52          HB1       GLU  52  -2.192  -4.921  -5.052
  439   1HG   GLU  52          HG2       GLU  52  -4.994  -5.527  -4.074
  440   2HG   GLU  52          HG1       GLU  52  -4.626  -4.265  -5.249
  441    H    ASP  53           HN       ASP  53  -1.137  -8.451  -3.242
  442    HA   ASP  53           HA       ASP  53   1.234  -7.563  -2.062
  443   1HB   ASP  53          HB2       ASP  53   0.798  -9.691  -4.169
  444   2HB   ASP  53          HB1       ASP  53   2.208  -9.591  -3.109
  445    H    ALA  54           HN       ALA  54   3.156  -6.720  -2.808
  446    HA   ALA  54           HA       ALA  54   3.326  -5.941  -5.701
  447   1HB   ALA  54          HB1       ALA  54   4.453  -3.839  -4.727
  448   2HB   ALA  54          HB2       ALA  54   3.811  -4.354  -3.168
  449   3HB   ALA  54          HB3       ALA  54   2.710  -3.970  -4.491
  450    H    GLN  55           HN       GLN  55   5.741  -5.349  -6.214
  451    HA   GLN  55           HA       GLN  55   7.621  -6.933  -4.511
  452   1HB   GLN  55          HB2       GLN  55   6.518  -8.126  -6.575
  453   2HB   GLN  55          HB1       GLN  55   7.663  -7.161  -7.509
  454   1HG   GLN  55          HG2       GLN  55   9.509  -8.047  -6.072
  455   2HG   GLN  55          HG1       GLN  55   8.337  -9.101  -5.282
  456   1HE2  GLN  55          HE21      GLN  55   8.644 -11.175  -6.111
  457   2HE2  GLN  55          HE22      GLN  55   8.836 -11.545  -7.757
  458    H    CYS  56           HN       CYS  56   9.279  -5.563  -4.026
  459    HA   CYS  56           HA       CYS  56   9.837  -3.152  -5.549
  460   1HB   CYS  56          HB2       CYS  56  10.237  -3.142  -3.201
  461   2HB   CYS  56          HB1       CYS  56  11.121  -4.664  -3.270
  462    H    ILE  57           HN       ILE  57  11.386  -2.885  -7.158
  463    HA   ILE  57           HA       ILE  57  13.031  -5.295  -7.853
  464    HB   ILE  57           HB       ILE  57  12.119  -3.120  -9.743
  465   1HG1  ILE  57          HG12      ILE  57  10.143  -4.113  -8.580
  466   2HG1  ILE  57          HG11      ILE  57  10.188  -4.524 -10.294
  467   1HG2  ILE  57          HG21      ILE  57  12.206  -5.571 -11.033
  468   2HG2  ILE  57          HG22      ILE  57  13.564  -5.661  -9.911
  469   3HG2  ILE  57          HG23      ILE  57  13.472  -4.343 -11.079
  470   1HD1  ILE  57          HD11      ILE  57   9.787  -6.391  -8.429
  471   2HD1  ILE  57          HD12      ILE  57  11.550  -6.376  -8.387
  472   3HD1  ILE  57          HD13      ILE  57  10.708  -6.738  -9.894
  473    H    ASP  58           HN       ASP  58  14.970  -4.563  -9.275
  474    HA   ASP  58           HA       ASP  58  16.856  -3.152  -7.787
  475   1HB   ASP  58          HB2       ASP  58  16.855  -4.606 -10.013
  476   2HB   ASP  58          HB1       ASP  58  16.907  -3.012 -10.774
  477    H    GLY  59           HN       GLY  59  15.813  -1.159  -6.995
  478   1HA   GLY  59          HA2       GLY  59  15.718   1.189  -7.063
  479   2HA   GLY  59          HA1       GLY  59  16.419   1.119  -8.673
  480    H    THR  60           HN       THR  60  13.732  -0.854  -8.787
  481    HA   THR  60           HA       THR  60  11.910   1.444  -9.409
  482    HB   THR  60           HB       THR  60  12.540  -0.939 -11.167
  483    HG1  THR  60           HG1      THR  60  14.146   0.683 -11.131
  484   1HG2  THR  60          HG21      THR  60  10.385  -0.502 -11.814
  485   2HG2  THR  60          HG22      THR  60  11.183   0.762 -12.749
  486   3HG2  THR  60          HG23      THR  60  10.429   1.152 -11.203
  487    H    ILE  61           HN       ILE  61   9.708   1.002  -9.073
  488    HA   ILE  61           HA       ILE  61   8.911  -1.776  -8.361
  489    HB   ILE  61           HB       ILE  61   9.536  -0.843  -6.245
  490   1HG1  ILE  61          HG12      ILE  61   7.254  -0.494  -5.144
  491   2HG1  ILE  61          HG11      ILE  61   6.558  -0.642  -6.757
  492   1HG2  ILE  61          HG21      ILE  61   9.733   1.404  -6.165
  493   2HG2  ILE  61          HG22      ILE  61   7.998   1.442  -5.846
  494   3HG2  ILE  61          HG23      ILE  61   8.596   1.622  -7.496
  495   1HD1  ILE  61          HD11      ILE  61   8.326  -2.791  -6.579
  496   2HD1  ILE  61          HD12      ILE  61   6.570  -2.874  -6.436
  497   3HD1  ILE  61          HD13      ILE  61   7.568  -2.726  -4.989
  498    H    GLU  62           HN       GLU  62   6.668  -2.152  -8.721
  499    HA   GLU  62           HA       GLU  62   5.225   0.091 -10.098
  500   1HB   GLU  62          HB2       GLU  62   4.897  -2.900 -10.465
  501   2HB   GLU  62          HB1       GLU  62   4.278  -1.622 -11.511
  502   1HG   GLU  62          HG2       GLU  62   6.729  -0.914 -11.822
  503   2HG   GLU  62          HG1       GLU  62   7.147  -2.472 -11.107
  504    H    VAL  63           HN       VAL  63   4.177   0.790  -8.111
  505    HA   VAL  63           HA       VAL  63   2.780  -0.917  -6.304
  506    HB   VAL  63           HB       VAL  63   3.450   1.526  -6.078
  507   1HG1  VAL  63          HG11      VAL  63   1.998   3.213  -7.008
  508   2HG1  VAL  63          HG12      VAL  63   0.876   1.991  -7.608
  509   3HG1  VAL  63          HG13      VAL  63   2.478   2.148  -8.329
  510   1HG2  VAL  63          HG21      VAL  63   1.904   0.402  -4.491
  511   2HG2  VAL  63          HG22      VAL  63   0.543   0.854  -5.518
  512   3HG2  VAL  63          HG23      VAL  63   1.490   2.103  -4.709
  513    HA   PRO  64           HA       PRO  64  -0.675  -2.239  -8.739
  514   1HB   PRO  64          HB2       PRO  64  -2.417  -2.237  -6.447
  515   2HB   PRO  64          HB1       PRO  64  -1.613  -3.619  -7.205
  516   1HG   PRO  64          HG2       PRO  64  -1.008  -2.406  -4.678
  517   2HG   PRO  64          HG1       PRO  64  -0.193  -3.769  -5.448
  518   1HD   PRO  64          HD2       PRO  64   0.792  -1.075  -5.105
  519   2HD   PRO  64          HD1       PRO  64   1.622  -2.456  -5.864
  520    H    LYS  65           HN       LYS  65  -1.998  -0.940  -9.970
  521    HA   LYS  65           HA       LYS  65  -2.508   1.782  -9.548
  522   1HB   LYS  65          HB2       LYS  65  -4.068  -0.391 -10.975
  523   2HB   LYS  65          HB1       LYS  65  -4.440   1.326 -11.146
  524   1HG   LYS  65          HG2       LYS  65  -1.742   1.337 -11.563
  525   2HG   LYS  65          HG1       LYS  65  -2.181  -0.227 -12.247
  526   1HD   LYS  65          HD2       LYS  65  -4.179   1.398 -13.212
  527   2HD   LYS  65          HD1       LYS  65  -2.785   2.480 -13.225
  528   1HE   LYS  65          HE2       LYS  65  -2.951  -0.260 -14.531
  529   2HE   LYS  65          HE1       LYS  65  -2.835   1.307 -15.358
  530   1HZ   LYS  65          HZ1       LYS  65  -0.784   1.611 -13.832
  531   2HZ   LYS  65          HZ2       LYS  65  -0.634   0.674 -15.241
  532   3HZ   LYS  65          HZ3       LYS  65  -0.810  -0.082 -13.731
  533    H    CYS  66           HN       CYS  66  -4.138  -1.004  -8.169
  534    HA   CYS  66           HA       CYS  66  -6.626  -0.057  -7.382
  535   1HB   CYS  66          HB2       CYS  66  -5.041  -2.197  -6.824
  536   2HB   CYS  66          HB1       CYS  66  -4.986  -1.360  -5.274
  537    H    PHE  67           HN       PHE  67  -3.563   0.440  -5.593
  538    HA   PHE  67           HA       PHE  67  -4.550   2.089  -3.521
  539   1HB   PHE  67          HB2       PHE  67  -2.287   1.047  -3.734
  540   2HB   PHE  67          HB1       PHE  67  -1.892   2.227  -4.985
  541    HD1  PHE  67           HD1      PHE  67  -2.248   4.747  -4.345
  542    HD2  PHE  67           HD2      PHE  67  -1.844   1.559  -1.495
  543    HE1  PHE  67           HE1      PHE  67  -1.612   6.388  -2.598
  544    HE2  PHE  67           HE2      PHE  67  -1.207   3.201   0.251
  545    HZ   PHE  67           HZ       PHE  67  -1.091   5.615  -0.301
  546    H    LYS  68           HN       LYS  68  -4.992   4.308  -3.399
  547    HA   LYS  68           HA       LYS  68  -4.648   5.904  -5.917
  548   1HB   LYS  68          HB2       LYS  68  -6.900   6.920  -5.183
  549   2HB   LYS  68          HB1       LYS  68  -6.946   5.274  -5.814
  550   1HG   LYS  68          HG2       LYS  68  -7.238   4.327  -3.692
  551   2HG   LYS  68          HG1       LYS  68  -6.588   5.743  -2.865
  552   1HD   LYS  68          HD2       LYS  68  -9.071   6.065  -4.507
  553   2HD   LYS  68          HD1       LYS  68  -9.203   5.298  -2.923
  554   1HE   LYS  68          HE2       LYS  68  -7.676   7.404  -2.222
  555   2HE   LYS  68          HE1       LYS  68  -8.532   8.123  -3.601
  556   1HZ   LYS  68          HZ1       LYS  68  -9.644   8.082  -1.253
  557   2HZ   LYS  68          HZ2       LYS  68 -10.040   6.487  -1.685
  558   3HZ   LYS  68          HZ3       LYS  68 -10.570   7.787  -2.643
  559    H    GLU  69           HN       GLU  69  -2.729   6.847  -4.853
  560    HA   GLU  69           HA       GLU  69  -2.644   8.052  -2.304
  561   1HB   GLU  69          HB2       GLU  69  -0.691   7.762  -3.712
  562   2HB   GLU  69          HB1       GLU  69  -1.382   8.800  -4.959
  563   1HG   GLU  69          HG2       GLU  69  -1.303  10.125  -2.361
  564   2HG   GLU  69          HG1       GLU  69   0.302   9.624  -2.897
  565    H    HIS  70           HN       HIS  70  -4.403   9.004  -5.133
  566    HA   HIS  70           HA       HIS  70  -4.830  11.764  -4.092
  567   1HB   HIS  70          HB2       HIS  70  -4.401  10.703  -6.600
  568   2HB   HIS  70          HB1       HIS  70  -6.156  10.890  -6.575
  569    HD1  HIS  70           HD1      HIS  70  -4.896  12.764  -8.461
  570    HD2  HIS  70           HD2      HIS  70  -5.142  13.679  -4.401
  571    HE1  HIS  70           HE1      HIS  70  -4.681  15.282  -8.280
  572    H    SER  71           HN       SER  71  -6.650  12.152  -2.900
  573    HA   SER  71           HA       SER  71  -8.722  10.099  -2.612
  574   1HB   SER  71          HB2       SER  71  -9.651  12.105  -1.175
  575   2HB   SER  71          HB1       SER  71  -8.204  11.249  -0.641
  576    HG   SER  71           HG       SER  71  -7.458  13.242  -0.654
  577    H    SER  72           HN       SER  72  -8.714  13.523  -3.687
  578    HA   SER  72           HA       SER  72 -10.272  14.688  -5.037
  579   1HB   SER  72          HB2       SER  72  -9.564  12.078  -6.248
  580   2HB   SER  72          HB1       SER  72 -10.975  12.870  -6.944
  581    HG   SER  72           HG       SER  72  -8.357  13.477  -7.196
  582    H    LEU  73           HN       LEU  73 -11.860  11.654  -5.779
  583    HA   LEU  73           HA       LEU  73 -14.242  12.588  -4.214
  584   1HB   LEU  73          HB2       LEU  73 -13.792  11.352  -6.902
  585   2HB   LEU  73          HB1       LEU  73 -15.297  10.963  -6.059
  586    HG   LEU  73           HG       LEU  73 -15.543  12.955  -7.524
  587   1HD1  LEU  73          HD11      LEU  73 -17.100  13.446  -5.969
  588   2HD1  LEU  73          HD12      LEU  73 -15.900  14.484  -5.196
  589   3HD1  LEU  73          HD13      LEU  73 -16.085  12.809  -4.674
  590   1HD2  LEU  73          HD21      LEU  73 -14.286  14.939  -7.169
  591   2HD2  LEU  73          HD22      LEU  73 -13.090  13.644  -7.103
  592   3HD2  LEU  73          HD23      LEU  73 -13.681  14.374  -5.610
  593    H    ALA  74           HN       ALA  74 -12.377  11.081  -2.795
  594    HA   ALA  74           HA       ALA  74 -12.668   8.246  -2.917
  595   1HB   ALA  74          HB1       ALA  74 -11.085   9.879  -1.589
  596   2HB   ALA  74          HB2       ALA  74 -11.496   8.314  -0.888
  597   3HB   ALA  74          HB3       ALA  74 -12.330   9.770  -0.345
  598    H    PHE  75           HN       PHE  75 -14.592  10.737  -1.269
  599    HA   PHE  75           HA       PHE  75 -16.629  10.558  -0.067
  600   1HB   PHE  75          HB2       PHE  75 -16.682   9.174  -2.624
  601   2HB   PHE  75          HB1       PHE  75 -17.839   8.463  -1.499
  602    HD1  PHE  75           HD1      PHE  75 -16.648  11.994  -1.684
  603    HD2  PHE  75           HD2      PHE  75 -19.929   9.281  -2.253
  604    HE1  PHE  75           HE1      PHE  75 -18.175  13.916  -2.043
  605    HE2  PHE  75           HE2      PHE  75 -21.456  11.203  -2.611
  606    HZ   PHE  75           HZ       PHE  75 -20.578  13.520  -2.506
  607    H    TRP  76           HN       TRP  76 -18.264   8.428   0.540
  608    HA   TRP  76           HA       TRP  76 -18.476   6.568   1.986
  609   1HB   TRP  76          HB2       TRP  76 -16.262   6.131   0.206
  610   2HB   TRP  76          HB1       TRP  76 -15.882   5.437   1.784
  611    HD1  TRP  76           HD1      TRP  76 -17.735   3.718   2.815
  612    HE1  TRP  76           HE1      TRP  76 -19.302   2.067   1.601
  613    HE3  TRP  76           HE3      TRP  76 -17.609   5.694  -1.877
  614    HZ2  TRP  76           HZ2      TRP  76 -20.365   1.648  -1.026
  615    HZ3  TRP  76           HZ3      TRP  76 -18.907   4.659  -3.720
  616    HH2  TRP  76           HH2      TRP  76 -20.284   2.640  -3.299
  617    H    LYS  77           HN       LYS  77 -16.732   5.407   3.770
  618    HA   LYS  77           HA       LYS  77 -15.253   7.554   5.183
  619   1HB   LYS  77          HB2       LYS  77 -17.960   6.857   5.717
  620   2HB   LYS  77          HB1       LYS  77 -16.994   6.242   7.059
  621   1HG   LYS  77          HG2       LYS  77 -16.594   8.322   7.841
  622   2HG   LYS  77          HG1       LYS  77 -16.153   8.914   6.239
  623   1HD   LYS  77          HD2       LYS  77 -18.087  10.155   6.781
  624   2HD   LYS  77          HD1       LYS  77 -18.693   8.864   5.742
  625   1HE   LYS  77          HE2       LYS  77 -18.587   8.350   8.695
  626   2HE   LYS  77          HE1       LYS  77 -19.887   9.380   8.062
  627   1HZ   LYS  77          HZ1       LYS  77 -20.841   7.396   7.608
  628   2HZ   LYS  77          HZ2       LYS  77 -19.365   6.555   7.585
  629   3HZ   LYS  77          HZ3       LYS  77 -19.853   7.457   6.232
  630    H    THR  78           HN       THR  78 -14.565   4.930   3.937
  631    HA   THR  78           HA       THR  78 -13.116   3.798   6.248
  632    HB   THR  78           HB       THR  78 -14.844   1.964   4.600
  633    HG1  THR  78           HG1      THR  78 -16.472   2.252   6.114
  634   1HG2  THR  78          HG21      THR  78 -14.599   0.490   6.454
  635   2HG2  THR  78          HG22      THR  78 -14.018   1.786   7.500
  636   3HG2  THR  78          HG23      THR  78 -13.001   1.185   6.190
  637    H    ASP  79           HN       ASP  79 -11.371   4.648   4.777
  638    HA   ASP  79           HA       ASP  79 -10.896   3.783   2.128
  639   1HB   ASP  79          HB2       ASP  79  -8.466   4.201   2.839
  640   2HB   ASP  79          HB1       ASP  79  -9.591   5.530   3.119
  641    H    ALA  80           HN       ALA  80  -9.854   1.953   1.271
  642    HA   ALA  80           HA       ALA  80 -10.224  -0.593   2.167
  643   1HB   ALA  80          HB1       ALA  80  -8.321  -1.196   0.764
  644   2HB   ALA  80          HB2       ALA  80  -7.657   0.431   0.917
  645   3HB   ALA  80          HB3       ALA  80  -9.159   0.172   0.032
  646    H    SER  81           HN       SER  81  -7.325   1.339   3.007
  647    HA   SER  81           HA       SER  81  -5.938  -0.486   4.597
  648   1HB   SER  81          HB2       SER  81  -4.711   1.376   5.010
  649   2HB   SER  81          HB1       SER  81  -5.866   2.215   3.978
  650    HG   SER  81           HG       SER  81  -6.101   3.322   5.786
  651    H    ASP  82           HN       ASP  82  -9.026   0.985   5.291
  652    HA   ASP  82           HA       ASP  82  -8.887  -0.132   8.074
  653   1HB   ASP  82          HB2       ASP  82 -10.190   2.340   6.924
  654   2HB   ASP  82          HB1       ASP  82 -10.558   1.738   8.540
  655    H    VAL  83           HN       VAL  83  -9.876  -1.433   5.537
  656    HA   VAL  83           HA       VAL  83 -12.790  -1.673   6.202
  657    HB   VAL  83           HB       VAL  83 -11.300  -2.560   3.719
  658   1HG1  VAL  83          HG11      VAL  83 -13.494  -2.620   2.710
  659   2HG1  VAL  83          HG12      VAL  83 -14.225  -1.895   4.143
  660   3HG1  VAL  83          HG13      VAL  83 -13.574  -3.532   4.217
  661   1HG2  VAL  83          HG21      VAL  83 -12.332  -0.419   2.759
  662   2HG2  VAL  83          HG22      VAL  83 -10.958  -0.203   3.841
  663   3HG2  VAL  83          HG23      VAL  83 -12.594   0.080   4.430
  664    H    LYS  84           HN       LYS  84 -13.693  -3.880   6.159
  665    HA   LYS  84           HA       LYS  84 -11.883  -5.826   7.410
  666   1HB   LYS  84          HB2       LYS  84 -14.785  -5.372   7.000
  667   2HB   LYS  84          HB1       LYS  84 -14.294  -7.062   7.123
  668   1HG   LYS  84          HG2       LYS  84 -13.626  -6.854   9.312
  669   2HG   LYS  84          HG1       LYS  84 -13.129  -5.175   9.109
  670   1HD   LYS  84          HD2       LYS  84 -15.460  -4.448   9.082
  671   2HD   LYS  84          HD1       LYS  84 -16.008  -6.122   9.178
  672   1HE   LYS  84          HE2       LYS  84 -15.902  -5.992  11.436
  673   2HE   LYS  84          HE1       LYS  84 -14.154  -5.702  11.316
  674   1HZ   LYS  84          HZ1       LYS  84 -14.738  -3.353  10.727
  675   2HZ   LYS  84          HZ2       LYS  84 -15.080  -3.789  12.333
  676   3HZ   LYS  84          HZ3       LYS  84 -16.334  -3.693  11.189
  677    HA   PRO  85           HA       PRO  85 -10.917  -7.901   3.599
  678   1HB   PRO  85          HB2       PRO  85 -10.529 -10.388   4.992
  679   2HB   PRO  85          HB1       PRO  85  -9.296  -9.257   4.418
  680   1HG   PRO  85          HG2       PRO  85 -10.067  -9.774   7.125
  681   2HG   PRO  85          HG1       PRO  85  -8.870  -8.613   6.544
  682   1HD   PRO  85          HD2       PRO  85 -11.496  -8.070   7.641
  683   2HD   PRO  85          HD1       PRO  85 -10.264  -6.901   7.107
  684    H    CYS  86           HN       CYS  86 -12.138  -9.139   2.136
  685    HA   CYS  86           HA       CYS  86 -14.859  -9.711   2.608
  686   1HB   CYS  86          HB2       CYS  86 -13.256  -9.628   0.470
  687   2HB   CYS  86          HB1       CYS  86 -13.269 -11.379   0.698
  Start of MODEL    2
    1   1H    THR   1          HT1       THR   1  23.019  -5.166  -8.813
    2   2H    THR   1          HT2       THR   1  21.649  -4.163  -8.802
    3   3H    THR   1          HT3       THR   1  22.347  -4.632 -10.277
    4    HA   THR   1           HA       THR   1  20.818  -6.260 -10.321
    5    HB   THR   1           HB       THR   1  22.241  -7.433  -7.946
    6    HG1  THR   1           HG1      THR   1  23.485  -7.483 -10.433
    7   1HG2  THR   1          HG21      THR   1  20.499  -8.553  -9.579
    8   2HG2  THR   1          HG22      THR   1  21.922  -9.453  -9.053
    9   3HG2  THR   1          HG23      THR   1  21.898  -8.694 -10.644
   10    H    LYS   2           HN       LYS   2  21.348  -5.044  -7.035
   11    HA   LYS   2           HA       LYS   2  18.442  -5.518  -6.477
   12   1HB   LYS   2          HB2       LYS   2  20.825  -5.961  -4.646
   13   2HB   LYS   2          HB1       LYS   2  19.136  -6.190  -4.193
   14   1HG   LYS   2          HG2       LYS   2  19.051  -7.792  -6.253
   15   2HG   LYS   2          HG1       LYS   2  20.809  -7.804  -6.103
   16   1HD   LYS   2          HD2       LYS   2  18.907  -8.439  -3.831
   17   2HD   LYS   2          HD1       LYS   2  19.701  -9.658  -4.831
   18   1HE   LYS   2          HE2       LYS   2  21.544  -9.518  -3.526
   19   2HE   LYS   2          HE1       LYS   2  21.694  -7.795  -3.925
   20   1HZ   LYS   2          HZ1       LYS   2  19.803  -8.874  -1.905
   21   2HZ   LYS   2          HZ2       LYS   2  20.135  -7.239  -2.225
   22   3HZ   LYS   2          HZ3       LYS   2  21.323  -8.228  -1.522
   23    H    ALA   3           HN       ALA   3  18.561  -3.114  -7.212
   24    HA   ALA   3           HA       ALA   3  19.767  -1.259  -5.257
   25   1HB   ALA   3          HB1       ALA   3  19.744  -0.947  -7.758
   26   2HB   ALA   3          HB2       ALA   3  19.053   0.414  -6.871
   27   3HB   ALA   3          HB3       ALA   3  17.994  -0.751  -7.666
   28    H    SER   4           HN       SER   4  18.646  -0.514  -3.504
   29    HA   SER   4           HA       SER   4  16.105  -1.324  -2.675
   30   1HB   SER   4          HB2       SER   4  16.235   0.809  -1.293
   31   2HB   SER   4          HB1       SER   4  17.663  -0.217  -1.211
   32    HG   SER   4           HG       SER   4  18.303   1.894  -1.597
   33    H    CYS   5           HN       CYS   5  14.146   0.229  -2.431
   34    HA   CYS   5           HA       CYS   5  13.537   1.370  -5.117
   35   1HB   CYS   5          HB2       CYS   5  11.694   0.800  -2.783
   36   2HB   CYS   5          HB1       CYS   5  11.242   1.007  -4.475
   37    H    LYS   6           HN       LYS   6  11.299   2.921  -3.913
   38    HA   LYS   6           HA       LYS   6  12.609   4.973  -2.235
   39   1HB   LYS   6          HB2       LYS   6  12.594   5.060  -5.082
   40   2HB   LYS   6          HB1       LYS   6  11.459   6.289  -4.523
   41   1HG   LYS   6          HG2       LYS   6  13.180   7.232  -3.045
   42   2HG   LYS   6          HG1       LYS   6  14.318   5.985  -3.557
   43   1HD   LYS   6          HD2       LYS   6  14.580   6.899  -5.678
   44   2HD   LYS   6          HD1       LYS   6  12.999   7.680  -5.648
   45   1HE   LYS   6          HE2       LYS   6  13.942   9.596  -4.898
   46   2HE   LYS   6          HE1       LYS   6  14.625   8.734  -3.504
   47   1HZ   LYS   6          HZ1       LYS   6  16.438   9.530  -4.805
   48   2HZ   LYS   6          HZ2       LYS   6  15.767   8.915  -6.239
   49   3HZ   LYS   6          HZ3       LYS   6  16.348   7.854  -5.046
   50    H    LEU   7           HN       LEU   7  10.958   4.946  -0.704
   51    HA   LEU   7           HA       LEU   7   8.285   4.394  -0.838
   52   1HB   LEU   7          HB2       LEU   7   8.058   6.226   0.923
   53   2HB   LEU   7          HB1       LEU   7   9.354   5.058   1.209
   54    HG   LEU   7           HG       LEU   7  10.385   7.158  -0.442
   55   1HD1  LEU   7          HD11      LEU   7   9.357   9.010   0.319
   56   2HD1  LEU   7          HD12      LEU   7   9.953   8.639   1.936
   57   3HD1  LEU   7          HD13      LEU   7   8.373   8.047   1.420
   58   1HD2  LEU   7          HD21      LEU   7  11.149   7.152   2.393
   59   2HD2  LEU   7          HD22      LEU   7  12.140   6.853   0.964
   60   3HD2  LEU   7          HD23      LEU   7  11.185   5.547   1.663
   61    HA   PRO   8           HA       PRO   8   7.260   7.378  -4.150
   62   1HB   PRO   8          HB2       PRO   8   4.761   5.968  -4.386
   63   2HB   PRO   8          HB1       PRO   8   6.135   5.943  -5.498
   64   1HG   PRO   8          HG2       PRO   8   5.248   3.845  -3.766
   65   2HG   PRO   8          HG1       PRO   8   6.648   3.840  -4.843
   66   1HD   PRO   8          HD2       PRO   8   6.614   3.998  -1.948
   67   2HD   PRO   8          HD1       PRO   8   8.027   3.917  -3.029
   68    H    VAL   9           HN       VAL   9   5.418   6.296  -1.347
   69    HA   VAL   9           HA       VAL   9   4.040   8.963  -1.281
   70    HB   VAL   9           HB       VAL   9   2.966   6.384  -0.130
   71   1HG1  VAL   9          HG11      VAL   9   1.796   8.321   0.641
   72   2HG1  VAL   9          HG12      VAL   9   0.794   7.632  -0.637
   73   3HG1  VAL   9          HG13      VAL   9   1.796   9.045  -0.967
   74   1HG2  VAL   9          HG21      VAL   9   1.658   6.156  -2.246
   75   2HG2  VAL   9          HG22      VAL   9   3.390   5.947  -2.498
   76   3HG2  VAL   9          HG23      VAL   9   2.611   7.466  -2.943
   77    H    LYS  10           HN       LYS  10   3.660   9.785   0.918
   78    HA   LYS  10           HA       LYS  10   5.772   8.884   2.813
   79   1HB   LYS  10          HB2       LYS  10   5.282  11.300   1.917
   80   2HB   LYS  10          HB1       LYS  10   3.992  11.292   3.120
   81   1HG   LYS  10          HG2       LYS  10   5.614  12.004   4.548
   82   2HG   LYS  10          HG1       LYS  10   6.092  10.306   4.577
   83   1HD   LYS  10          HD2       LYS  10   8.105  11.349   4.022
   84   2HD   LYS  10          HD1       LYS  10   7.466  10.944   2.428
   85   1HE   LYS  10          HE2       LYS  10   8.188  13.258   2.344
   86   2HE   LYS  10          HE1       LYS  10   6.414  13.274   2.391
   87   1HZ   LYS  10          HZ1       LYS  10   6.409  14.166   4.425
   88   2HZ   LYS  10          HZ2       LYS  10   8.050  14.528   4.173
   89   3HZ   LYS  10          HZ3       LYS  10   7.607  13.111   4.998
   90    H    LYS  11           HN       LYS  11   2.802   7.809   2.312
   91    HA   LYS  11           HA       LYS  11   2.346   7.183   5.150
   92   1HB   LYS  11          HB2       LYS  11   0.828   9.219   3.594
   93   2HB   LYS  11          HB1       LYS  11  -0.118   8.153   4.633
   94   1HG   LYS  11          HG2       LYS  11   1.753   8.726   6.406
   95   2HG   LYS  11          HG1       LYS  11   1.993  10.145   5.386
   96   1HD   LYS  11          HD2       LYS  11   0.352  10.985   6.763
   97   2HD   LYS  11          HD1       LYS  11  -0.682  10.224   5.555
   98   1HE   LYS  11          HE2       LYS  11  -0.140   8.118   7.266
   99   2HE   LYS  11          HE1       LYS  11  -0.287   9.498   8.374
  100   1HZ   LYS  11          HZ1       LYS  11  -2.412   8.262   7.494
  101   2HZ   LYS  11          HZ2       LYS  11  -2.187   9.282   6.153
  102   3HZ   LYS  11          HZ3       LYS  11  -2.407   9.946   7.701
  103    H    ALA  12           HN       ALA  12   2.887   5.503   2.919
  104    HA   ALA  12           HA       ALA  12   0.299   4.380   2.026
  105   1HB   ALA  12          HB1       ALA  12   2.726   4.697   0.862
  106   2HB   ALA  12          HB2       ALA  12   1.582   3.451   0.361
  107   3HB   ALA  12          HB3       ALA  12   2.898   3.048   1.465
  108    H    THR  13           HN       THR  13  -0.660   2.667   3.047
  109    HA   THR  13           HA       THR  13   0.897   1.227   5.160
  110    HB   THR  13           HB       THR  13  -2.070   1.588   4.650
  111    HG1  THR  13           HG1      THR  13  -0.849   3.412   5.424
  112   1HG2  THR  13          HG21      THR  13  -0.528   0.053   6.733
  113   2HG2  THR  13          HG22      THR  13  -1.895  -0.486   5.757
  114   3HG2  THR  13          HG23      THR  13  -2.147   0.667   7.067
  115    H    VAL  14           HN       VAL  14   1.771  -0.608   4.232
  116    HA   VAL  14           HA       VAL  14  -0.006  -2.248   2.454
  117    HB   VAL  14           HB       VAL  14   2.119  -3.004   1.449
  118   1HG1  VAL  14          HG11      VAL  14   2.792  -0.211   1.322
  119   2HG1  VAL  14          HG12      VAL  14   1.036  -0.380   1.354
  120   3HG1  VAL  14          HG13      VAL  14   1.980  -1.201   0.110
  121   1HG2  VAL  14          HG21      VAL  14   3.419  -2.783   3.606
  122   2HG2  VAL  14          HG22      VAL  14   3.445  -1.040   3.340
  123   3HG2  VAL  14          HG23      VAL  14   4.244  -2.117   2.195
  124    H    VAL  15           HN       VAL  15   1.451  -4.596   2.496
  125    HA   VAL  15           HA       VAL  15   1.441  -5.401   5.388
  126    HB   VAL  15           HB       VAL  15   0.291  -6.699   2.907
  127   1HG1  VAL  15          HG11      VAL  15   1.447  -7.954   5.269
  128   2HG1  VAL  15          HG12      VAL  15   0.856  -8.701   3.784
  129   3HG1  VAL  15          HG13      VAL  15  -0.264  -8.344   5.099
  130   1HG2  VAL  15          HG21      VAL  15  -1.688  -6.849   4.575
  131   2HG2  VAL  15          HG22      VAL  15  -1.298  -5.263   3.911
  132   3HG2  VAL  15          HG23      VAL  15  -0.779  -5.688   5.543
  133    H    TYR  16           HN       TYR  16   3.697  -5.533   5.667
  134    HA   TYR  16           HA       TYR  16   5.357  -6.885   3.626
  135   1HB   TYR  16          HB2       TYR  16   5.957  -4.777   4.922
  136   2HB   TYR  16          HB1       TYR  16   6.115  -5.800   6.351
  137    HD1  TYR  16           HD1      TYR  16   8.145  -6.889   6.787
  138    HD2  TYR  16           HD2      TYR  16   7.285  -5.529   2.805
  139    HE1  TYR  16           HE1      TYR  16  10.430  -7.539   6.071
  140    HE2  TYR  16           HE2      TYR  16   9.569  -6.177   2.089
  141    HH   TYR  16           HH       TYR  16  12.011  -7.124   4.379
  142    H    GLN  17           HN       GLN  17   5.658  -9.067   3.719
  143    HA   GLN  17           HA       GLN  17   5.742 -11.262   4.572
  144   1HB   GLN  17          HB2       GLN  17   6.903  -9.430   6.645
  145   2HB   GLN  17          HB1       GLN  17   6.717 -11.144   7.030
  146   1HG   GLN  17          HG2       GLN  17   8.358 -11.780   5.585
  147   2HG   GLN  17          HG1       GLN  17   7.879 -10.592   4.371
  148   1HE2  GLN  17          HE21      GLN  17  10.402 -10.347   4.350
  149   2HE2  GLN  17          HE22      GLN  17  11.058  -9.212   5.429
  150    H    GLY  18           HN       GLY  18   3.231  -9.623   4.963
  151   1HA   GLY  18          HA2       GLY  18   1.119 -10.305   5.817
  152   2HA   GLY  18          HA1       GLY  18   1.943 -11.476   6.847
  153    H    GLU  19           HN       GLU  19   3.151  -8.229   6.888
  154    HA   GLU  19           HA       GLU  19   1.742  -7.769   9.500
  155   1HB   GLU  19          HB2       GLU  19   4.613  -7.606   8.653
  156   2HB   GLU  19          HB1       GLU  19   4.043  -6.513   9.915
  157   1HG   GLU  19          HG2       GLU  19   3.934  -8.175  11.443
  158   2HG   GLU  19          HG1       GLU  19   3.107  -9.253  10.317
  159    H    ARG  20           HN       ARG  20   0.574  -5.897   9.478
  160    HA   ARG  20           HA       ARG  20   0.573  -4.071   7.256
  161   1HB   ARG  20          HB2       ARG  20  -0.608  -4.258  10.002
  162   2HB   ARG  20          HB1       ARG  20  -0.693  -2.703   9.168
  163   1HG   ARG  20          HG2       ARG  20  -2.506  -3.499   8.088
  164   2HG   ARG  20          HG1       ARG  20  -1.414  -4.580   7.221
  165   1HD   ARG  20          HD2       ARG  20  -3.297  -5.801   8.356
  166   2HD   ARG  20          HD1       ARG  20  -1.704  -6.302   8.958
  167    HE   ARG  20           HE       ARG  20  -3.375  -4.246  10.360
  168   1HH1  ARG  20          HH21      ARG  20  -2.329  -7.424  10.510
  169   2HH1  ARG  20          HH22      ARG  20  -1.691  -7.328  12.118
  170   1HH2  ARG  20          HH11      ARG  20  -2.070  -3.889  12.347
  171   2HH2  ARG  20          HH12      ARG  20  -1.544  -5.326  13.158
  172    H    VAL  21           HN       VAL  21   1.829  -2.261   6.917
  173    HA   VAL  21           HA       VAL  21   3.132  -0.875   9.168
  174    HB   VAL  21           HB       VAL  21   5.399  -1.280   8.029
  175   1HG1  VAL  21          HG11      VAL  21   4.292  -2.516  10.088
  176   2HG1  VAL  21          HG12      VAL  21   5.785  -3.136   9.381
  177   3HG1  VAL  21          HG13      VAL  21   4.239  -3.881   8.973
  178   1HG2  VAL  21          HG21      VAL  21   3.829  -3.549   6.764
  179   2HG2  VAL  21          HG22      VAL  21   5.553  -3.226   6.572
  180   3HG2  VAL  21          HG23      VAL  21   4.366  -2.109   5.896
  181    H    LYS  22           HN       LYS  22   4.064   1.171   8.468
  182    HA   LYS  22           HA       LYS  22   2.870   2.168   5.936
  183   1HB   LYS  22          HB2       LYS  22   3.991   3.350   8.472
  184   2HB   LYS  22          HB1       LYS  22   3.729   4.368   7.054
  185   1HG   LYS  22          HG2       LYS  22   1.456   2.610   7.652
  186   2HG   LYS  22          HG1       LYS  22   1.810   3.756   8.946
  187   1HD   LYS  22          HD2       LYS  22   2.058   5.338   6.712
  188   2HD   LYS  22          HD1       LYS  22   0.750   4.250   6.244
  189   1HE   LYS  22          HE2       LYS  22   0.360   5.082   8.982
  190   2HE   LYS  22          HE1       LYS  22   0.547   6.507   7.942
  191   1HZ   LYS  22          HZ1       LYS  22  -0.935   5.063   6.352
  192   2HZ   LYS  22          HZ2       LYS  22  -1.640   6.029   7.560
  193   3HZ   LYS  22          HZ3       LYS  22  -1.446   4.360   7.809
  194    H    ILE  23           HN       ILE  23   4.135   2.818   4.206
  195    HA   ILE  23           HA       ILE  23   6.884   1.957   4.036
  196    HB   ILE  23           HB       ILE  23   5.134   2.176   2.206
  197   1HG1  ILE  23          HG12      ILE  23   7.539   3.789   1.420
  198   2HG1  ILE  23          HG11      ILE  23   7.777   2.135   1.989
  199   1HG2  ILE  23          HG21      ILE  23   4.542   4.552   3.043
  200   2HG2  ILE  23          HG22      ILE  23   4.620   4.298   1.299
  201   3HG2  ILE  23          HG23      ILE  23   5.961   5.077   2.137
  202   1HD1  ILE  23          HD11      ILE  23   5.654   2.643  -0.060
  203   2HD1  ILE  23          HD12      ILE  23   6.644   1.206   0.194
  204   3HD1  ILE  23          HD13      ILE  23   7.340   2.629  -0.581
  205    H    GLN  24           HN       GLN  24   5.337   4.961   4.960
  206    HA   GLN  24           HA       GLN  24   7.464   6.797   4.502
  207   1HB   GLN  24          HB2       GLN  24   6.225   8.183   6.039
  208   2HB   GLN  24          HB1       GLN  24   5.039   7.203   5.168
  209   1HG   GLN  24          HG2       GLN  24   5.226   5.532   7.102
  210   2HG   GLN  24          HG1       GLN  24   6.079   6.802   7.978
  211   1HE2  GLN  24          HE21      GLN  24   3.406   5.697   8.652
  212   2HE2  GLN  24          HE22      GLN  24   2.321   6.999   8.571
  213    H    GLU  25           HN       GLU  25   6.881   4.491   7.125
  214    HA   GLU  25           HA       GLU  25   9.402   5.400   8.460
  215   1HB   GLU  25          HB2       GLU  25   7.040   3.771   9.441
  216   2HB   GLU  25          HB1       GLU  25   8.413   4.262  10.432
  217   1HG   GLU  25          HG2       GLU  25   7.542   6.625   9.205
  218   2HG   GLU  25          HG1       GLU  25   6.060   5.790   9.671
  219    H    LYS  26           HN       LYS  26   7.584   2.342   7.974
  220    HA   LYS  26           HA       LYS  26   9.615   0.503   8.479
  221   1HB   LYS  26          HB2       LYS  26   7.253  -0.015   7.994
  222   2HB   LYS  26          HB1       LYS  26   7.497   0.455   6.310
  223   1HG   LYS  26          HG2       LYS  26   7.661  -1.954   6.426
  224   2HG   LYS  26          HG1       LYS  26   9.284  -1.317   6.155
  225   1HD   LYS  26          HD2       LYS  26   9.186  -1.303   8.879
  226   2HD   LYS  26          HD1       LYS  26   8.178  -2.706   8.520
  227   1HE   LYS  26          HE2       LYS  26  10.524  -2.718   6.819
  228   2HE   LYS  26          HE1       LYS  26  10.996  -2.629   8.528
  229   1HZ   LYS  26          HZ1       LYS  26  10.282  -4.903   7.350
  230   2HZ   LYS  26          HZ2       LYS  26   8.761  -4.378   7.896
  231   3HZ   LYS  26          HZ3       LYS  26  10.033  -4.600   9.001
  232    H    PHE  27           HN       PHE  27   9.241   2.591   5.682
  233    HA   PHE  27           HA       PHE  27  11.779   1.444   4.563
  234   1HB   PHE  27          HB2       PHE  27   9.195   2.294   3.233
  235   2HB   PHE  27          HB1       PHE  27  10.694   2.071   2.324
  236    HD1  PHE  27           HD1      PHE  27  11.991  -0.215   3.052
  237    HD2  PHE  27           HD2      PHE  27   7.757   0.467   3.276
  238    HE1  PHE  27           HE1      PHE  27  11.594  -2.663   2.989
  239    HE2  PHE  27           HE2      PHE  27   7.359  -1.981   3.214
  240    HZ   PHE  27           HZ       PHE  27   9.278  -3.545   3.070
  241    H    LYS  28           HN       LYS  28  11.453   3.750   6.359
  242    HA   LYS  28           HA       LYS  28  11.315   6.289   5.281
  243   1HB   LYS  28          HB2       LYS  28  12.405   4.999   7.544
  244   2HB   LYS  28          HB1       LYS  28  13.693   6.025   6.911
  245   1HG   LYS  28          HG2       LYS  28  12.596   7.943   7.444
  246   2HG   LYS  28          HG1       LYS  28  11.032   7.295   6.950
  247   1HD   LYS  28          HD2       LYS  28  10.514   6.988   9.116
  248   2HD   LYS  28          HD1       LYS  28  11.833   5.821   9.236
  249   1HE   LYS  28          HE2       LYS  28  13.299   7.370  10.155
  250   2HE   LYS  28          HE1       LYS  28  12.507   8.745   9.359
  251   1HZ   LYS  28          HZ1       LYS  28  10.814   8.779  10.875
  252   2HZ   LYS  28          HZ2       LYS  28  12.077   8.251  11.881
  253   3HZ   LYS  28          HZ3       LYS  28  10.958   7.134  11.259
  254    H    ASN  29           HN       ASN  29  13.834   3.893   4.708
  255    HA   ASN  29           HA       ASN  29  15.304   5.879   3.011
  256   1HB   ASN  29          HB2       ASN  29  16.036   3.521   4.708
  257   2HB   ASN  29          HB1       ASN  29  17.051   3.881   3.308
  258   1HD2  ASN  29          HD21      ASN  29  15.336   6.109   5.569
  259   2HD2  ASN  29          HD22      ASN  29  16.735   6.955   6.029
  260    H    GLY  30           HN       GLY  30  12.937   4.601   2.009
  261   1HA   GLY  30          HA2       GLY  30  12.336   3.648  -0.067
  262   2HA   GLY  30          HA1       GLY  30  14.046   3.350  -0.381
  263    H    MET  31           HN       MET  31  12.404   1.343  -1.089
  264    HA   MET  31           HA       MET  31  12.324  -0.617   1.159
  265   1HB   MET  31          HB2       MET  31  11.211  -0.710  -1.667
  266   2HB   MET  31          HB1       MET  31  10.836  -1.840  -0.366
  267   1HG   MET  31          HG2       MET  31  10.246   0.505   0.862
  268   2HG   MET  31          HG1       MET  31   9.863   0.926  -0.806
  269   1HE   MET  31          HE1       MET  31   7.106  -1.154  -1.950
  270   2HE   MET  31          HE2       MET  31   8.588  -0.275  -2.315
  271   3HE   MET  31          HE3       MET  31   7.243   0.562  -1.544
  272    H    LEU  32           HN       LEU  32  13.177  -2.816   0.716
  273    HA   LEU  32           HA       LEU  32  15.768  -2.735  -0.634
  274   1HB   LEU  32          HB2       LEU  32  14.122  -4.734   0.909
  275   2HB   LEU  32          HB1       LEU  32  15.605  -5.242   0.092
  276    HG   LEU  32           HG       LEU  32  16.151  -4.633   2.382
  277   1HD1  LEU  32          HD11      LEU  32  17.107  -2.162   1.084
  278   2HD1  LEU  32          HD12      LEU  32  17.401  -3.631   0.154
  279   3HD1  LEU  32          HD13      LEU  32  18.028  -3.487   1.796
  280   1HD2  LEU  32          HD21      LEU  32  15.450  -2.670   3.427
  281   2HD2  LEU  32          HD22      LEU  32  14.062  -3.015   2.394
  282   3HD2  LEU  32          HD23      LEU  32  15.250  -1.810   1.900
  283    H    HIS  33           HN       HIS  33  16.355  -4.298  -2.362
  284    HA   HIS  33           HA       HIS  33  14.454  -4.326  -4.531
  285   1HB   HIS  33          HB2       HIS  33  16.822  -4.214  -4.943
  286   2HB   HIS  33          HB1       HIS  33  17.109  -5.682  -4.004
  287    HD1  HIS  33           HD1      HIS  33  15.147  -4.645  -7.116
  288    HD2  HIS  33           HD2      HIS  33  17.159  -7.955  -5.575
  289    HE1  HIS  33           HE1      HIS  33  15.086  -6.423  -8.918
  290    H    GLY  34           HN       GLY  34  12.984  -5.899  -5.092
  291   1HA   GLY  34          HA2       GLY  34  12.069  -8.094  -5.233
  292   2HA   GLY  34          HA1       GLY  34  13.308  -8.656  -4.111
  293    H    ASP  35           HN       ASP  35  12.388  -6.111  -2.462
  294    HA   ASP  35           HA       ASP  35  10.999  -7.365  -0.410
  295   1HB   ASP  35          HB2       ASP  35  11.459  -4.658  -1.400
  296   2HB   ASP  35          HB1       ASP  35   9.917  -4.789  -0.553
  297    H    LYS  36           HN       LYS  36   8.844  -7.913  -0.010
  298    HA   LYS  36           HA       LYS  36   6.922  -7.501  -2.278
  299   1HB   LYS  36          HB2       LYS  36   7.645  -9.789  -0.506
  300   2HB   LYS  36          HB1       LYS  36   5.948  -9.644  -0.967
  301   1HG   LYS  36          HG2       LYS  36   7.067  -9.228  -3.377
  302   2HG   LYS  36          HG1       LYS  36   8.329 -10.230  -2.659
  303   1HD   LYS  36          HD2       LYS  36   6.158 -11.650  -1.907
  304   2HD   LYS  36          HD1       LYS  36   5.541 -10.942  -3.401
  305   1HE   LYS  36          HE2       LYS  36   7.451 -11.832  -4.657
  306   2HE   LYS  36          HE1       LYS  36   8.152 -12.484  -3.162
  307   1HZ   LYS  36          HZ1       LYS  36   6.368 -13.943  -2.871
  308   2HZ   LYS  36          HZ2       LYS  36   6.704 -14.048  -4.534
  309   3HZ   LYS  36          HZ3       LYS  36   5.385 -13.128  -3.987
  310    H    VAL  37           HN       VAL  37   5.126  -6.328  -1.754
  311    HA   VAL  37           HA       VAL  37   4.229  -6.245   1.098
  312    HB   VAL  37           HB       VAL  37   3.974  -3.752   0.772
  313   1HG1  VAL  37          HG11      VAL  37   5.946  -3.714   1.854
  314   2HG1  VAL  37          HG12      VAL  37   6.785  -3.841   0.307
  315   3HG1  VAL  37          HG13      VAL  37   6.350  -5.300   1.196
  316   1HG2  VAL  37          HG21      VAL  37   3.944  -3.892  -1.740
  317   2HG2  VAL  37          HG22      VAL  37   5.667  -4.265  -1.694
  318   3HG2  VAL  37          HG23      VAL  37   5.087  -2.703  -1.117
  319    H    SER  38           HN       SER  38   1.975  -6.187   1.285
  320    HA   SER  38           HA       SER  38   0.445  -6.403  -1.263
  321   1HB   SER  38          HB2       SER  38  -0.820  -6.827   1.392
  322   2HB   SER  38          HB1       SER  38  -0.914  -7.813  -0.068
  323    HG   SER  38           HG       SER  38   1.190  -8.549   0.387
  324    H    PHE  39           HN       PHE  39  -1.044  -4.845  -1.845
  325    HA   PHE  39           HA       PHE  39  -1.303  -2.458  -0.080
  326   1HB   PHE  39          HB2       PHE  39  -1.654  -3.088  -3.004
  327   2HB   PHE  39          HB1       PHE  39  -2.359  -1.616  -2.324
  328    HD1  PHE  39           HD1      PHE  39   0.794  -3.429  -2.998
  329    HD2  PHE  39           HD2      PHE  39  -0.974   0.204  -1.540
  330    HE1  PHE  39           HE1      PHE  39   3.010  -2.317  -3.081
  331    HE2  PHE  39           HE2      PHE  39   1.240   1.316  -1.623
  332    HZ   PHE  39           HZ       PHE  39   3.232   0.056  -2.393
  333    H    PHE  40           HN       PHE  40  -3.287  -1.895   0.802
  334    HA   PHE  40           HA       PHE  40  -5.427  -3.881   0.756
  335   1HB   PHE  40          HB2       PHE  40  -4.816  -1.263   2.088
  336   2HB   PHE  40          HB1       PHE  40  -6.464  -1.894   2.161
  337    HD1  PHE  40           HD1      PHE  40  -3.096  -2.171   3.442
  338    HD2  PHE  40           HD2      PHE  40  -6.834  -4.252   3.048
  339    HE1  PHE  40           HE1      PHE  40  -2.413  -3.738   5.239
  340    HE2  PHE  40           HE2      PHE  40  -6.152  -5.818   4.846
  341    HZ   PHE  40           HZ       PHE  40  -3.942  -5.562   5.942
  342    H    CYS  41           HN       CYS  41  -7.257  -3.820  -0.495
  343    HA   CYS  41           HA       CYS  41  -7.997  -1.264  -1.855
  344   1HB   CYS  41          HB2       CYS  41  -6.926  -3.736  -3.006
  345   2HB   CYS  41          HB1       CYS  41  -8.472  -3.274  -3.726
  346    H    LYS  42           HN       LYS  42 -10.278  -1.220  -2.457
  347    HA   LYS  42           HA       LYS  42 -11.929  -3.018  -0.759
  348   1HB   LYS  42          HB2       LYS  42 -13.684  -1.303  -1.319
  349   2HB   LYS  42          HB1       LYS  42 -12.251  -0.623  -0.544
  350   1HG   LYS  42          HG2       LYS  42 -11.803  -0.684  -3.374
  351   2HG   LYS  42          HG1       LYS  42 -13.367   0.073  -3.071
  352   1HD   LYS  42          HD2       LYS  42 -10.758   0.843  -1.734
  353   2HD   LYS  42          HD1       LYS  42 -11.555   1.748  -3.022
  354   1HE   LYS  42          HE2       LYS  42 -13.453   1.210  -0.907
  355   2HE   LYS  42          HE1       LYS  42 -12.015   2.011  -0.244
  356   1HZ   LYS  42          HZ1       LYS  42 -12.213   3.778  -1.702
  357   2HZ   LYS  42          HZ2       LYS  42 -13.838   3.458  -1.320
  358   3HZ   LYS  42          HZ3       LYS  42 -13.185   2.917  -2.793
  359    H    ASN  43           HN       ASN  43 -13.601  -4.281  -1.620
  360    HA   ASN  43           HA       ASN  43 -13.514  -4.696  -4.588
  361   1HB   ASN  43          HB2       ASN  43 -12.796  -6.511  -2.921
  362   2HB   ASN  43          HB1       ASN  43 -14.497  -6.602  -2.449
  363   1HD2  ASN  43          HD21      ASN  43 -12.779  -8.632  -3.933
  364   2HD2  ASN  43          HD22      ASN  43 -13.627  -8.949  -5.368
  365    H    LYS  44           HN       LYS  44 -15.435  -4.444  -5.715
  366    HA   LYS  44           HA       LYS  44 -17.775  -3.418  -4.233
  367   1HB   LYS  44          HB2       LYS  44 -16.918  -3.693  -7.115
  368   2HB   LYS  44          HB1       LYS  44 -18.564  -3.210  -6.702
  369   1HG   LYS  44          HG2       LYS  44 -17.397  -1.468  -5.142
  370   2HG   LYS  44          HG1       LYS  44 -15.983  -1.766  -6.151
  371   1HD   LYS  44          HD2       LYS  44 -17.721  -1.415  -8.120
  372   2HD   LYS  44          HD1       LYS  44 -18.604  -0.520  -6.883
  373   1HE   LYS  44          HE2       LYS  44 -15.671   0.031  -7.194
  374   2HE   LYS  44          HE1       LYS  44 -16.796   0.723  -8.380
  375   1HZ   LYS  44          HZ1       LYS  44 -16.929   0.986  -5.425
  376   2HZ   LYS  44          HZ2       LYS  44 -18.173   1.474  -6.475
  377   3HZ   LYS  44          HZ3       LYS  44 -16.653   2.228  -6.547
  378    H    GLU  45           HN       GLU  45 -17.016  -6.128  -6.442
  379    HA   GLU  45           HA       GLU  45 -19.579  -7.348  -6.488
  380   1HB   GLU  45          HB2       GLU  45 -16.781  -8.529  -6.577
  381   2HB   GLU  45          HB1       GLU  45 -18.242  -9.365  -7.107
  382   1HG   GLU  45          HG2       GLU  45 -18.646  -7.656  -8.809
  383   2HG   GLU  45          HG1       GLU  45 -17.255  -6.730  -8.243
  384    H    LYS  46           HN       LYS  46 -16.854  -7.786  -4.217
  385    HA   LYS  46           HA       LYS  46 -18.491  -9.610  -2.543
  386   1HB   LYS  46          HB2       LYS  46 -15.637  -8.595  -2.355
  387   2HB   LYS  46          HB1       LYS  46 -16.334  -9.855  -1.334
  388   1HG   LYS  46          HG2       LYS  46 -16.965 -10.887  -3.728
  389   2HG   LYS  46          HG1       LYS  46 -15.537  -9.968  -4.206
  390   1HD   LYS  46          HD2       LYS  46 -14.110 -11.272  -2.964
  391   2HD   LYS  46          HD1       LYS  46 -15.315 -11.587  -1.716
  392   1HE   LYS  46          HE2       LYS  46 -16.433 -12.837  -3.910
  393   2HE   LYS  46          HE1       LYS  46 -14.700 -13.141  -4.138
  394   1HZ   LYS  46          HZ1       LYS  46 -14.924 -13.471  -1.507
  395   2HZ   LYS  46          HZ2       LYS  46 -15.066 -14.749  -2.617
  396   3HZ   LYS  46          HZ3       LYS  46 -16.459 -14.006  -1.991
  397    H    LYS  47           HN       LYS  47 -17.527  -6.285  -2.708
  398    HA   LYS  47           HA       LYS  47 -18.166  -4.454  -1.358
  399   1HB   LYS  47          HB2       LYS  47 -19.645  -6.451   0.351
  400   2HB   LYS  47          HB1       LYS  47 -20.068  -4.772   0.011
  401   1HG   LYS  47          HG2       LYS  47 -20.019  -5.837  -2.513
  402   2HG   LYS  47          HG1       LYS  47 -20.614  -7.203  -1.569
  403   1HD   LYS  47          HD2       LYS  47 -22.642  -6.241  -1.455
  404   2HD   LYS  47          HD1       LYS  47 -21.934  -4.853  -0.630
  405   1HE   LYS  47          HE2       LYS  47 -21.324  -3.883  -2.855
  406   2HE   LYS  47          HE1       LYS  47 -22.173  -5.234  -3.635
  407   1HZ   LYS  47          HZ1       LYS  47 -23.589  -3.858  -1.494
  408   2HZ   LYS  47          HZ2       LYS  47 -24.184  -4.499  -2.952
  409   3HZ   LYS  47          HZ3       LYS  47 -23.403  -2.990  -2.939
  410    H    CYS  48           HN       CYS  48 -15.782  -6.203  -0.735
  411    HA   CYS  48           HA       CYS  48 -15.427  -5.274   2.088
  412   1HB   CYS  48          HB2       CYS  48 -14.193  -7.864   1.299
  413   2HB   CYS  48          HB1       CYS  48 -14.845  -7.364   2.857
  414    H    SER  49           HN       SER  49 -12.981  -5.488   2.663
  415    HA   SER  49           HA       SER  49 -11.421  -4.440   0.352
  416   1HB   SER  49          HB2       SER  49 -10.521  -3.080   1.932
  417   2HB   SER  49          HB1       SER  49 -11.759  -3.694   3.020
  418    HG   SER  49           HG       SER  49 -10.329  -5.250   3.730
  419    H    TYR  50           HN       TYR  50  -9.068  -5.151   0.354
  420    HA   TYR  50           HA       TYR  50  -8.449  -7.777   1.521
  421   1HB   TYR  50          HB2       TYR  50  -8.191  -8.829  -0.742
  422   2HB   TYR  50          HB1       TYR  50  -9.863  -8.394  -0.374
  423    HD1  TYR  50           HD1      TYR  50 -11.070  -7.045  -1.864
  424    HD2  TYR  50           HD2      TYR  50  -6.777  -7.045  -2.017
  425    HE1  TYR  50           HE1      TYR  50 -11.141  -5.624  -3.894
  426    HE2  TYR  50           HE2      TYR  50  -6.848  -5.622  -4.045
  427    HH   TYR  50           HH       TYR  50  -9.618  -3.996  -5.052
  428    H    THR  51           HN       THR  51  -6.248  -8.529   0.218
  429    HA   THR  51           HA       THR  51  -4.533  -6.065   0.112
  430    HB   THR  51           HB       THR  51  -2.744  -7.766   0.835
  431    HG1  THR  51           HG1      THR  51  -3.424  -9.709   1.461
  432   1HG2  THR  51          HG21      THR  51  -3.126  -6.770   2.812
  433   2HG2  THR  51          HG22      THR  51  -4.444  -7.901   3.122
  434   3HG2  THR  51          HG23      THR  51  -4.767  -6.372   2.305
  435    H    GLU  52           HN       GLU  52  -2.928  -5.981  -1.505
  436    HA   GLU  52           HA       GLU  52  -3.114  -8.062  -3.660
  437   1HB   GLU  52          HB2       GLU  52  -3.469  -5.140  -3.617
  438   2HB   GLU  52          HB1       GLU  52  -2.348  -5.685  -4.866
  439   1HG   GLU  52          HG2       GLU  52  -4.042  -7.306  -5.665
  440   2HG   GLU  52          HG1       GLU  52  -5.168  -6.715  -4.441
  441    H    ASP  53           HN       ASP  53  -1.221  -9.070  -2.623
  442    HA   ASP  53           HA       ASP  53   1.172  -8.055  -1.795
  443   1HB   ASP  53          HB2       ASP  53   0.726 -10.327  -3.748
  444   2HB   ASP  53          HB1       ASP  53   2.185 -10.102  -2.779
  445    H    ALA  54           HN       ALA  54   3.029  -7.192  -2.700
  446    HA   ALA  54           HA       ALA  54   3.030  -6.622  -5.642
  447   1HB   ALA  54          HB1       ALA  54   2.411  -4.815  -3.633
  448   2HB   ALA  54          HB2       ALA  54   2.985  -4.381  -5.243
  449   3HB   ALA  54          HB3       ALA  54   4.128  -4.517  -3.906
  450    H    GLN  55           HN       GLN  55   5.362  -5.641  -6.167
  451    HA   GLN  55           HA       GLN  55   7.435  -6.984  -4.481
  452   1HB   GLN  55          HB2       GLN  55   6.494  -8.281  -6.560
  453   2HB   GLN  55          HB1       GLN  55   7.489  -7.155  -7.484
  454   1HG   GLN  55          HG2       GLN  55   9.437  -7.808  -6.003
  455   2HG   GLN  55          HG1       GLN  55   8.415  -9.085  -5.344
  456   1HE2  GLN  55          HE21      GLN  55  10.727  -9.875  -6.698
  457   2HE2  GLN  55          HE22      GLN  55  10.316 -10.555  -8.198
  458    H    CYS  56           HN       CYS  56   9.526  -6.009  -4.658
  459    HA   CYS  56           HA       CYS  56   9.513  -3.294  -5.918
  460   1HB   CYS  56          HB2       CYS  56  10.076  -4.235  -3.347
  461   2HB   CYS  56          HB1       CYS  56  11.664  -3.939  -4.050
  462    H    ILE  57           HN       ILE  57  11.412  -2.665  -7.134
  463    HA   ILE  57           HA       ILE  57  13.313  -4.868  -7.819
  464    HB   ILE  57           HB       ILE  57  11.535  -3.224  -9.626
  465   1HG1  ILE  57          HG12      ILE  57  11.645  -5.841 -10.509
  466   2HG1  ILE  57          HG11      ILE  57  11.763  -6.020  -8.758
  467   1HG2  ILE  57          HG21      ILE  57  13.787  -3.062 -10.555
  468   2HG2  ILE  57          HG22      ILE  57  12.831  -4.182 -11.528
  469   3HG2  ILE  57          HG23      ILE  57  14.012  -4.802 -10.374
  470   1HD1  ILE  57          HD11      ILE  57   9.776  -4.400  -8.617
  471   2HD1  ILE  57          HD12      ILE  57   9.429  -6.020  -9.220
  472   3HD1  ILE  57          HD13      ILE  57   9.576  -4.672 -10.348
  473    H    ASP  58           HN       ASP  58  15.158  -3.938  -9.179
  474    HA   ASP  58           HA       ASP  58  16.825  -2.207  -7.966
  475   1HB   ASP  58          HB2       ASP  58  17.001  -3.460 -10.190
  476   2HB   ASP  58          HB1       ASP  58  16.313  -2.015 -10.934
  477    H    GLY  59           HN       GLY  59  15.669  -0.498  -6.849
  478   1HA   GLY  59          HA2       GLY  59  14.865   1.688  -6.600
  479   2HA   GLY  59          HA1       GLY  59  15.745   2.030  -8.084
  480    H    THR  60           HN       THR  60  13.361  -0.391  -8.514
  481    HA   THR  60           HA       THR  60  11.365   1.666  -9.384
  482    HB   THR  60           HB       THR  60  12.187  -0.763 -10.982
  483    HG1  THR  60           HG1      THR  60  12.933   1.915 -11.476
  484   1HG2  THR  60          HG21      THR  60  10.052   1.112 -11.160
  485   2HG2  THR  60          HG22      THR  60  10.449  -0.193 -12.278
  486   3HG2  THR  60          HG23      THR  60  11.144   1.410 -12.512
  487    H    ILE  61           HN       ILE  61   9.294   1.099  -8.810
  488    HA   ILE  61           HA       ILE  61   8.756  -1.769  -8.150
  489    HB   ILE  61           HB       ILE  61   9.101  -0.772  -6.048
  490   1HG1  ILE  61          HG12      ILE  61   6.265  -0.071  -5.941
  491   2HG1  ILE  61          HG11      ILE  61   6.551  -1.602  -6.767
  492   1HG2  ILE  61          HG21      ILE  61   9.197   1.571  -6.949
  493   2HG2  ILE  61          HG22      ILE  61   8.330   1.441  -5.420
  494   3HG2  ILE  61          HG23      ILE  61   7.434   1.601  -6.930
  495   1HD1  ILE  61          HD11      ILE  61   6.275  -1.636  -4.181
  496   2HD1  ILE  61          HD12      ILE  61   7.918  -0.997  -4.155
  497   3HD1  ILE  61          HD13      ILE  61   7.594  -2.565  -4.894
  498    H    GLU  62           HN       GLU  62   6.840  -2.496  -8.961
  499    HA   GLU  62           HA       GLU  62   5.140  -0.552 -10.452
  500   1HB   GLU  62          HB2       GLU  62   5.830  -3.454 -10.580
  501   2HB   GLU  62          HB1       GLU  62   4.244  -2.975 -11.182
  502   1HG   GLU  62          HG2       GLU  62   6.535  -1.291 -12.042
  503   2HG   GLU  62          HG1       GLU  62   6.465  -2.919 -12.719
  504    H    VAL  63           HN       VAL  63   4.165   0.173  -8.329
  505    HA   VAL  63           HA       VAL  63   2.807  -1.328  -6.446
  506    HB   VAL  63           HB       VAL  63   2.987   1.314  -7.266
  507   1HG1  VAL  63          HG11      VAL  63   0.670   2.157  -7.367
  508   2HG1  VAL  63          HG12      VAL  63   0.066   0.500  -7.354
  509   3HG1  VAL  63          HG13      VAL  63   1.014   1.082  -8.723
  510   1HG2  VAL  63          HG21      VAL  63   2.705   1.497  -5.049
  511   2HG2  VAL  63          HG22      VAL  63   2.178  -0.185  -4.991
  512   3HG2  VAL  63          HG23      VAL  63   0.994   1.103  -5.216
  513    HA   PRO  64           HA       PRO  64  -0.344  -3.661  -8.433
  514   1HB   PRO  64          HB2       PRO  64  -2.363  -2.994  -6.492
  515   2HB   PRO  64          HB1       PRO  64  -1.390  -4.469  -6.592
  516   1HG   PRO  64          HG2       PRO  64  -1.180  -2.350  -4.666
  517   2HG   PRO  64          HG1       PRO  64  -0.207  -3.818  -4.775
  518   1HD   PRO  64          HD2       PRO  64   0.600  -1.114  -5.376
  519   2HD   PRO  64          HD1       PRO  64   1.579  -2.598  -5.495
  520    H    LYS  65           HN       LYS  65  -1.633  -3.088 -10.156
  521    HA   LYS  65           HA       LYS  65  -2.275  -0.546 -11.014
  522   1HB   LYS  65          HB2       LYS  65  -3.209  -3.282 -11.435
  523   2HB   LYS  65          HB1       LYS  65  -4.479  -2.097 -11.740
  524   1HG   LYS  65          HG2       LYS  65  -1.906  -1.254 -12.837
  525   2HG   LYS  65          HG1       LYS  65  -2.444  -2.795 -13.508
  526   1HD   LYS  65          HD2       LYS  65  -3.891  -1.690 -14.825
  527   2HD   LYS  65          HD1       LYS  65  -4.726  -1.109 -13.383
  528   1HE   LYS  65          HE2       LYS  65  -4.036   0.985 -13.911
  529   2HE   LYS  65          HE1       LYS  65  -2.367   0.455 -13.619
  530   1HZ   LYS  65          HZ1       LYS  65  -2.668   1.238 -15.903
  531   2HZ   LYS  65          HZ2       LYS  65  -3.875   0.069 -16.152
  532   3HZ   LYS  65          HZ3       LYS  65  -2.270  -0.410 -15.863
  533    H    CYS  66           HN       CYS  66  -4.278  -2.564  -8.840
  534    HA   CYS  66           HA       CYS  66  -6.563  -1.008  -8.557
  535   1HB   CYS  66          HB2       CYS  66  -5.888  -3.200  -7.440
  536   2HB   CYS  66          HB1       CYS  66  -5.011  -2.229  -6.256
  537    H    PHE  67           HN       PHE  67  -3.346  -0.393  -7.200
  538    HA   PHE  67           HA       PHE  67  -4.325   2.029  -5.787
  539   1HB   PHE  67          HB2       PHE  67  -2.735   0.340  -4.795
  540   2HB   PHE  67          HB1       PHE  67  -1.548   0.824  -6.006
  541    HD1  PHE  67           HD1      PHE  67  -3.496   1.951  -3.063
  542    HD2  PHE  67           HD2      PHE  67  -0.390   2.935  -5.864
  543    HE1  PHE  67           HE1      PHE  67  -2.824   3.871  -1.643
  544    HE2  PHE  67           HE2      PHE  67   0.281   4.854  -4.444
  545    HZ   PHE  67           HZ       PHE  67  -0.936   5.322  -2.333
  546    H    LYS  68           HN       LYS  68  -3.655   4.134  -6.392
  547    HA   LYS  68           HA       LYS  68  -2.007   4.383  -8.878
  548   1HB   LYS  68          HB2       LYS  68  -4.660   4.442  -9.018
  549   2HB   LYS  68          HB1       LYS  68  -4.433   6.096  -8.448
  550   1HG   LYS  68          HG2       LYS  68  -3.594   6.786 -10.438
  551   2HG   LYS  68          HG1       LYS  68  -2.592   5.345 -10.612
  552   1HD   LYS  68          HD2       LYS  68  -4.212   5.278 -12.386
  553   2HD   LYS  68          HD1       LYS  68  -4.706   4.071 -11.197
  554   1HE   LYS  68          HE2       LYS  68  -6.559   5.288 -10.531
  555   2HE   LYS  68          HE1       LYS  68  -5.790   6.848 -10.889
  556   1HZ   LYS  68          HZ1       LYS  68  -6.742   4.844 -12.868
  557   2HZ   LYS  68          HZ2       LYS  68  -5.862   6.244 -13.264
  558   3HZ   LYS  68          HZ3       LYS  68  -7.414   6.376 -12.583
  559    H    GLU  69           HN       GLU  69  -0.275   5.203  -7.550
  560    HA   GLU  69           HA       GLU  69  -0.550   7.278  -5.595
  561   1HB   GLU  69          HB2       GLU  69   1.899   7.438  -5.898
  562   2HB   GLU  69          HB1       GLU  69   1.385   5.751  -5.865
  563   1HG   GLU  69          HG2       GLU  69   1.165   6.427  -8.548
  564   2HG   GLU  69          HG1       GLU  69   2.629   7.268  -8.035
  565    H    HIS  70           HN       HIS  70  -1.982   8.855  -6.660
  566    HA   HIS  70           HA       HIS  70  -0.892  10.289  -9.019
  567   1HB   HIS  70          HB2       HIS  70  -3.438   9.658  -7.914
  568   2HB   HIS  70          HB1       HIS  70  -3.289  11.416  -7.895
  569    HD1  HIS  70           HD1      HIS  70  -4.836   9.238  -9.963
  570    HD2  HIS  70           HD2      HIS  70  -1.690  11.863 -10.729
  571    HE1  HIS  70           HE1      HIS  70  -4.833   9.642 -12.464
  572    H    SER  71           HN       SER  71  -1.724  10.900  -5.604
  573    HA   SER  71           HA       SER  71   0.240  13.097  -5.512
  574   1HB   SER  71          HB2       SER  71  -2.708  13.565  -4.991
  575   2HB   SER  71          HB1       SER  71  -1.429  14.776  -4.919
  576    HG   SER  71           HG       SER  71  -1.261  14.739  -7.073
  577    H    SER  72           HN       SER  72  -0.375  14.235  -3.123
  578    HA   SER  72           HA       SER  72   0.023  12.007  -1.230
  579   1HB   SER  72          HB2       SER  72   0.374  14.006   0.321
  580   2HB   SER  72          HB1       SER  72   1.468  13.914  -1.057
  581    HG   SER  72           HG       SER  72   0.488  16.006  -0.720
  582    H    LEU  73           HN       LEU  73  -1.985  14.967  -1.002
  583    HA   LEU  73           HA       LEU  73  -4.179  13.259   0.130
  584   1HB   LEU  73          HB2       LEU  73  -2.831  15.766   1.053
  585   2HB   LEU  73          HB1       LEU  73  -4.555  15.586   1.393
  586    HG   LEU  73           HG       LEU  73  -3.479  13.093   2.036
  587   1HD1  LEU  73          HD11      LEU  73  -1.697  13.868   3.733
  588   2HD1  LEU  73          HD12      LEU  73  -1.608  15.345   2.774
  589   3HD1  LEU  73          HD13      LEU  73  -1.212  13.791   2.040
  590   1HD2  LEU  73          HD21      LEU  73  -4.467  15.499   3.513
  591   2HD2  LEU  73          HD22      LEU  73  -3.701  14.218   4.452
  592   3HD2  LEU  73          HD23      LEU  73  -5.122  13.862   3.471
  593    H    ALA  74           HN       ALA  74  -5.229  13.261  -1.979
  594    HA   ALA  74           HA       ALA  74  -5.837  15.685  -3.434
  595   1HB   ALA  74          HB1       ALA  74  -6.376  12.806  -3.508
  596   2HB   ALA  74          HB2       ALA  74  -6.168  13.935  -4.846
  597   3HB   ALA  74          HB3       ALA  74  -7.746  13.761  -4.076
  598    H    PHE  75           HN       PHE  75  -7.981  13.523  -1.543
  599    HA   PHE  75           HA       PHE  75  -9.348  15.821  -0.318
  600   1HB   PHE  75          HB2       PHE  75 -10.169  14.775  -2.826
  601   2HB   PHE  75          HB1       PHE  75 -11.355  14.221  -1.642
  602    HD1  PHE  75           HD1      PHE  75 -11.762  16.213   0.263
  603    HD2  PHE  75           HD2      PHE  75 -10.775  16.755  -3.882
  604    HE1  PHE  75           HE1      PHE  75 -12.766  18.481   0.321
  605    HE2  PHE  75           HE2      PHE  75 -11.777  19.023  -3.825
  606    HZ   PHE  75           HZ       PHE  75 -12.773  19.886  -1.723
  607    H    TRP  76           HN       TRP  76 -11.758  14.285   0.245
  608    HA   TRP  76           HA       TRP  76 -10.605  12.384   2.230
  609   1HB   TRP  76          HB2       TRP  76 -12.822  14.270   2.060
  610   2HB   TRP  76          HB1       TRP  76 -13.333  12.699   2.684
  611    HD1  TRP  76           HD1      TRP  76 -10.507  15.265   3.281
  612    HE1  TRP  76           HE1      TRP  76  -9.897  15.219   5.788
  613    HE3  TRP  76           HE3      TRP  76 -13.570  11.509   4.853
  614    HZ2  TRP  76           HZ2      TRP  76 -10.617  13.770   8.149
  615    HZ3  TRP  76           HZ3      TRP  76 -13.592  10.809   7.234
  616    HH2  TRP  76           HH2      TRP  76 -12.118  11.933   8.880
  617    H    LYS  77           HN       LYS  77 -10.659  10.243   1.667
  618    HA   LYS  77           HA       LYS  77 -13.064   9.201   0.244
  619   1HB   LYS  77          HB2       LYS  77 -10.717   9.851  -1.045
  620   2HB   LYS  77          HB1       LYS  77 -10.489   8.135  -0.704
  621   1HG   LYS  77          HG2       LYS  77 -12.765   7.709  -1.687
  622   2HG   LYS  77          HG1       LYS  77 -12.816   9.404  -2.170
  623   1HD   LYS  77          HD2       LYS  77 -10.311   8.161  -2.963
  624   2HD   LYS  77          HD1       LYS  77 -11.695   7.296  -3.631
  625   1HE   LYS  77          HE2       LYS  77 -12.412   9.128  -4.876
  626   2HE   LYS  77          HE1       LYS  77 -11.666  10.298  -3.770
  627   1HZ   LYS  77          HZ1       LYS  77  -9.490   9.543  -4.464
  628   2HZ   LYS  77          HZ2       LYS  77 -10.376  10.049  -5.823
  629   3HZ   LYS  77          HZ3       LYS  77 -10.180   8.392  -5.501
  630    H    THR  78           HN       THR  78 -10.048   8.506   2.004
  631    HA   THR  78           HA       THR  78  -9.442   6.617   3.304
  632    HB   THR  78           HB       THR  78 -12.428   6.887   3.754
  633    HG1  THR  78           HG1      THR  78 -10.228   7.793   5.290
  634   1HG2  THR  78          HG21      THR  78 -11.743   4.706   4.532
  635   2HG2  THR  78          HG22      THR  78 -11.905   5.753   5.941
  636   3HG2  THR  78          HG23      THR  78 -10.306   5.381   5.299
  637    H    ASP  79           HN       ASP  79  -8.919   5.226   1.462
  638    HA   ASP  79           HA       ASP  79 -11.040   3.517   0.332
  639   1HB   ASP  79          HB2       ASP  79  -9.246   2.798  -1.136
  640   2HB   ASP  79          HB1       ASP  79  -9.123   4.547  -0.942
  641    H    ALA  80           HN       ALA  80  -9.526   1.157  -0.010
  642    HA   ALA  80           HA       ALA  80 -10.197  -0.543   2.026
  643   1HB   ALA  80          HB1       ALA  80  -7.489  -0.639   0.699
  644   2HB   ALA  80          HB2       ALA  80  -8.974  -0.920  -0.207
  645   3HB   ALA  80          HB3       ALA  80  -8.536  -1.993   1.124
  646    H    SER  81           HN       SER  81  -7.549   1.771   2.091
  647    HA   SER  81           HA       SER  81  -5.838   0.934   4.064
  648   1HB   SER  81          HB2       SER  81  -5.375   3.057   3.319
  649   2HB   SER  81          HB1       SER  81  -7.074   3.520   3.272
  650    HG   SER  81           HG       SER  81  -5.269   3.477   5.429
  651    H    ASP  82           HN       ASP  82  -9.238   1.742   4.530
  652    HA   ASP  82           HA       ASP  82  -8.942   0.944   7.398
  653   1HB   ASP  82          HB2       ASP  82 -10.231   3.387   6.184
  654   2HB   ASP  82          HB1       ASP  82 -10.658   2.829   7.802
  655    H    VAL  83           HN       VAL  83 -10.024  -0.435   4.930
  656    HA   VAL  83           HA       VAL  83 -12.917  -0.632   5.651
  657    HB   VAL  83           HB       VAL  83 -11.422  -1.802   3.286
  658   1HG1  VAL  83          HG11      VAL  83 -13.670  -2.736   3.797
  659   2HG1  VAL  83          HG12      VAL  83 -13.650  -1.853   2.270
  660   3HG1  VAL  83          HG13      VAL  83 -14.345  -1.109   3.710
  661   1HG2  VAL  83          HG21      VAL  83 -12.884   0.853   3.518
  662   2HG2  VAL  83          HG22      VAL  83 -12.171   0.195   2.045
  663   3HG2  VAL  83          HG23      VAL  83 -11.134   0.665   3.393
  664    H    LYS  84           HN       LYS  84 -13.833  -2.720   6.092
  665    HA   LYS  84           HA       LYS  84 -12.017  -4.573   7.438
  666   1HB   LYS  84          HB2       LYS  84 -14.991  -4.634   6.828
  667   2HB   LYS  84          HB1       LYS  84 -14.168  -5.716   7.953
  668   1HG   LYS  84          HG2       LYS  84 -13.584  -3.900   9.409
  669   2HG   LYS  84          HG1       LYS  84 -14.092  -2.702   8.217
  670   1HD   LYS  84          HD2       LYS  84 -16.255  -4.543   8.757
  671   2HD   LYS  84          HD1       LYS  84 -15.670  -3.832  10.262
  672   1HE   LYS  84          HE2       LYS  84 -17.274  -2.258   9.511
  673   2HE   LYS  84          HE1       LYS  84 -15.746  -1.572   8.922
  674   1HZ   LYS  84          HZ1       LYS  84 -17.820  -3.036   7.436
  675   2HZ   LYS  84          HZ2       LYS  84 -16.204  -3.148   6.920
  676   3HZ   LYS  84          HZ3       LYS  84 -16.974  -1.635   6.995
  677    HA   PRO  85           HA       PRO  85 -11.285  -7.043   3.786
  678   1HB   PRO  85          HB2       PRO  85 -10.659  -9.310   5.446
  679   2HB   PRO  85          HB1       PRO  85  -9.535  -8.237   4.602
  680   1HG   PRO  85          HG2       PRO  85 -10.032  -8.395   7.424
  681   2HG   PRO  85          HG1       PRO  85  -8.918  -7.317   6.576
  682   1HD   PRO  85          HD2       PRO  85 -11.416  -6.636   7.853
  683   2HD   PRO  85          HD1       PRO  85 -10.294  -5.550   6.998
  684    H    CYS  86           HN       CYS  86 -12.536  -8.614   2.649
  685    HA   CYS  86           HA       CYS  86 -15.204  -9.094   3.402
  686   1HB   CYS  86          HB2       CYS  86 -13.584  -9.586   1.245
  687   2HB   CYS  86          HB1       CYS  86 -13.878 -11.221   1.836
  Start of MODEL    3
    1   1H    THR   1          HT1       THR   1  23.995  -7.953  -8.553
    2   2H    THR   1          HT2       THR   1  23.007  -6.669  -9.065
    3   3H    THR   1          HT3       THR   1  22.308  -8.087  -8.444
    4    HA   THR   1           HA       THR   1  23.696  -7.505  -6.327
    5    HB   THR   1           HB       THR   1  24.118  -5.121  -6.172
    6    HG1  THR   1           HG1      THR   1  22.314  -4.422  -7.348
    7   1HG2  THR   1          HG21      THR   1  25.015  -5.827  -8.957
    8   2HG2  THR   1          HG22      THR   1  25.662  -6.683  -7.558
    9   3HG2  THR   1          HG23      THR   1  25.889  -4.940  -7.708
   10    H    LYS   2           HN       LYS   2  22.374  -6.345  -4.619
   11    HA   LYS   2           HA       LYS   2  19.471  -6.327  -5.382
   12   1HB   LYS   2          HB2       LYS   2  19.255  -6.841  -2.866
   13   2HB   LYS   2          HB1       LYS   2  19.950  -8.114  -3.871
   14   1HG   LYS   2          HG2       LYS   2  22.090  -7.793  -3.045
   15   2HG   LYS   2          HG1       LYS   2  21.799  -6.096  -2.661
   16   1HD   LYS   2          HD2       LYS   2  19.981  -7.585  -1.086
   17   2HD   LYS   2          HD1       LYS   2  21.539  -8.401  -0.948
   18   1HE   LYS   2          HE2       LYS   2  22.248  -6.778   0.462
   19   2HE   LYS   2          HE1       LYS   2  21.999  -5.570  -0.815
   20   1HZ   LYS   2          HZ1       LYS   2  19.640  -5.533  -0.263
   21   2HZ   LYS   2          HZ2       LYS   2  20.579  -5.104   1.086
   22   3HZ   LYS   2          HZ3       LYS   2  19.894  -6.655   0.982
   23    H    ALA   3           HN       ALA   3  19.236  -4.088  -5.808
   24    HA   ALA   3           HA       ALA   3  20.279  -2.098  -3.900
   25   1HB   ALA   3          HB1       ALA   3  19.961  -0.691  -5.671
   26   2HB   ALA   3          HB2       ALA   3  18.344  -1.316  -5.991
   27   3HB   ALA   3          HB3       ALA   3  19.759  -2.179  -6.594
   28    H    SER   4           HN       SER   4  17.890  -0.368  -4.366
   29    HA   SER   4           HA       SER   4  15.885  -1.747  -2.617
   30   1HB   SER   4          HB2       SER   4  16.014   1.028  -1.987
   31   2HB   SER   4          HB1       SER   4  16.470  -0.328  -0.962
   32    HG   SER   4           HG       SER   4  18.119   0.891  -2.931
   33    H    CYS   5           HN       CYS   5  14.204   0.557  -2.432
   34    HA   CYS   5           HA       CYS   5  13.535   1.194  -5.273
   35   1HB   CYS   5          HB2       CYS   5  11.859  -0.169  -3.167
   36   2HB   CYS   5          HB1       CYS   5  11.108   0.680  -4.519
   37    H    LYS   6           HN       LYS   6  12.180   3.123  -5.451
   38    HA   LYS   6           HA       LYS   6  12.580   4.991  -3.178
   39   1HB   LYS   6          HB2       LYS   6  11.559   5.426  -6.004
   40   2HB   LYS   6          HB1       LYS   6  12.104   6.677  -4.885
   41   1HG   LYS   6          HG2       LYS   6  14.160   4.701  -5.054
   42   2HG   LYS   6          HG1       LYS   6  13.682   5.131  -6.697
   43   1HD   LYS   6          HD2       LYS   6  13.759   7.598  -5.647
   44   2HD   LYS   6          HD1       LYS   6  14.932   6.820  -4.584
   45   1HE   LYS   6          HE2       LYS   6  16.212   6.037  -6.553
   46   2HE   LYS   6          HE1       LYS   6  15.037   6.829  -7.623
   47   1HZ   LYS   6          HZ1       LYS   6  17.020   8.024  -5.839
   48   2HZ   LYS   6          HZ2       LYS   6  15.525   8.819  -5.977
   49   3HZ   LYS   6          HZ3       LYS   6  16.478   8.550  -7.358
   50    H    LEU   7           HN       LEU   7  10.925   4.905  -1.698
   51    HA   LEU   7           HA       LEU   7   8.338   3.943  -1.922
   52   1HB   LEU   7          HB2       LEU   7   7.857   5.693  -0.124
   53   2HB   LEU   7          HB1       LEU   7   9.264   4.665   0.172
   54    HG   LEU   7           HG       LEU   7  10.007   6.977  -1.410
   55   1HD1  LEU   7          HD11      LEU   7   8.303   8.263  -0.401
   56   2HD1  LEU   7          HD12      LEU   7   9.710   8.558   0.621
   57   3HD1  LEU   7          HD13      LEU   7   8.463   7.425   1.142
   58   1HD2  LEU   7          HD21      LEU   7  11.134   7.048   1.189
   59   2HD2  LEU   7          HD22      LEU   7  11.873   6.412  -0.281
   60   3HD2  LEU   7          HD23      LEU   7  10.948   5.344   0.775
   61    HA   PRO   8           HA       PRO   8   6.968   6.837  -5.172
   62   1HB   PRO   8          HB2       PRO   8   4.532   5.307  -5.259
   63   2HB   PRO   8          HB1       PRO   8   5.846   5.331  -6.443
   64   1HG   PRO   8          HG2       PRO   8   5.158   3.220  -4.632
   65   2HG   PRO   8          HG1       PRO   8   6.493   3.263  -5.789
   66   1HD   PRO   8          HD2       PRO   8   6.626   3.455  -2.903
   67   2HD   PRO   8          HD1       PRO   8   7.975   3.456  -4.067
   68    H    VAL   9           HN       VAL   9   5.215   5.673  -2.322
   69    HA   VAL   9           HA       VAL   9   3.648   8.230  -2.285
   70    HB   VAL   9           HB       VAL   9   3.033   5.715  -0.732
   71   1HG1  VAL   9          HG11      VAL   9   1.650   8.235  -1.509
   72   2HG1  VAL   9          HG12      VAL   9   1.532   7.303  -0.017
   73   3HG1  VAL   9          HG13      VAL   9   0.669   6.771  -1.461
   74   1HG2  VAL   9          HG21      VAL   9   1.639   4.961  -2.609
   75   2HG2  VAL   9          HG22      VAL   9   3.319   5.093  -3.126
   76   3HG2  VAL   9          HG23      VAL   9   2.158   6.345  -3.571
   77    H    LYS  10           HN       LYS  10   3.175   8.966   0.046
   78    HA   LYS  10           HA       LYS  10   5.599   8.508   1.758
   79   1HB   LYS  10          HB2       LYS  10   3.865  10.964   1.331
   80   2HB   LYS  10          HB1       LYS  10   5.222  10.879   2.455
   81   1HG   LYS  10          HG2       LYS  10   6.286   9.918   0.069
   82   2HG   LYS  10          HG1       LYS  10   5.243  11.245  -0.443
   83   1HD   LYS  10          HD2       LYS  10   7.033  11.666   1.920
   84   2HD   LYS  10          HD1       LYS  10   7.744  11.707   0.306
   85   1HE   LYS  10          HE2       LYS  10   6.738  13.694  -0.216
   86   2HE   LYS  10          HE1       LYS  10   5.225  13.247   0.598
   87   1HZ   LYS  10          HZ1       LYS  10   7.731  13.801   2.082
   88   2HZ   LYS  10          HZ2       LYS  10   6.152  13.694   2.699
   89   3HZ   LYS  10          HZ3       LYS  10   6.602  15.018   1.734
   90    H    LYS  11           HN       LYS  11   2.540   7.530   1.610
   91    HA   LYS  11           HA       LYS  11   2.273   7.288   4.529
   92   1HB   LYS  11          HB2       LYS  11   0.086   8.469   4.550
   93   2HB   LYS  11          HB1       LYS  11   1.396   9.542   4.053
   94   1HG   LYS  11          HG2       LYS  11   0.293   9.964   2.140
   95   2HG   LYS  11          HG1       LYS  11   0.442   8.261   1.704
   96   1HD   LYS  11          HD2       LYS  11  -1.808   8.150   1.856
   97   2HD   LYS  11          HD1       LYS  11  -1.599   8.288   3.602
   98   1HE   LYS  11          HE2       LYS  11  -2.103  10.569   3.618
   99   2HE   LYS  11          HE1       LYS  11  -1.619  10.789   1.925
  100   1HZ   LYS  11          HZ1       LYS  11  -3.981   9.274   2.904
  101   2HZ   LYS  11          HZ2       LYS  11  -3.478   9.334   1.284
  102   3HZ   LYS  11          HZ3       LYS  11  -4.012  10.746   2.063
  103    H    ALA  12           HN       ALA  12   2.531   5.385   2.369
  104    HA   ALA  12           HA       ALA  12  -0.177   4.291   1.893
  105   1HB   ALA  12          HB1       ALA  12   2.168   2.717   1.097
  106   2HB   ALA  12          HB2       ALA  12   2.225   4.381   0.517
  107   3HB   ALA  12          HB3       ALA  12   0.855   3.350   0.104
  108    H    THR  13           HN       THR  13  -0.995   2.484   2.924
  109    HA   THR  13           HA       THR  13   0.666   1.275   5.109
  110    HB   THR  13           HB       THR  13  -2.333   1.189   4.666
  111    HG1  THR  13           HG1      THR  13  -2.470   3.021   5.808
  112   1HG2  THR  13          HG21      THR  13  -1.782   1.131   7.374
  113   2HG2  THR  13          HG22      THR  13  -0.464   0.181   6.687
  114   3HG2  THR  13          HG23      THR  13  -2.139  -0.278   6.376
  115    H    VAL  14           HN       VAL  14   1.723  -0.400   3.965
  116    HA   VAL  14           HA       VAL  14   0.021  -2.256   2.360
  117    HB   VAL  14           HB       VAL  14   2.274  -3.036   1.567
  118   1HG1  VAL  14          HG11      VAL  14   2.552  -1.230   0.107
  119   2HG1  VAL  14          HG12      VAL  14   2.196  -0.038   1.357
  120   3HG1  VAL  14          HG13      VAL  14   0.893  -0.998   0.658
  121   1HG2  VAL  14          HG21      VAL  14   3.339  -2.254   3.807
  122   2HG2  VAL  14          HG22      VAL  14   3.399  -0.662   3.052
  123   3HG2  VAL  14          HG23      VAL  14   4.265  -2.016   2.325
  124    H    VAL  15           HN       VAL  15   0.810  -4.637   2.576
  125    HA   VAL  15           HA       VAL  15   1.227  -5.269   5.480
  126    HB   VAL  15           HB       VAL  15  -0.392  -6.648   3.314
  127   1HG1  VAL  15          HG11      VAL  15   0.829  -7.721   5.672
  128   2HG1  VAL  15          HG12      VAL  15  -0.246  -8.532   4.533
  129   3HG1  VAL  15          HG13      VAL  15  -0.915  -7.676   5.923
  130   1HG2  VAL  15          HG21      VAL  15  -2.137  -6.160   5.283
  131   2HG2  VAL  15          HG22      VAL  15  -1.779  -4.950   4.051
  132   3HG2  VAL  15          HG23      VAL  15  -1.000  -4.858   5.630
  133    H    TYR  16           HN       TYR  16   3.193  -6.232   5.788
  134    HA   TYR  16           HA       TYR  16   4.723  -7.319   3.545
  135   1HB   TYR  16          HB2       TYR  16   5.306  -6.097   5.897
  136   2HB   TYR  16          HB1       TYR  16   5.538  -7.782   6.363
  137    HD1  TYR  16           HD1      TYR  16   6.283  -8.689   3.468
  138    HD2  TYR  16           HD2      TYR  16   7.684  -5.533   6.021
  139    HE1  TYR  16           HE1      TYR  16   8.467  -8.708   2.293
  140    HE2  TYR  16           HE2      TYR  16   9.868  -5.553   4.847
  141    HH   TYR  16           HH       TYR  16  11.171  -7.546   3.424
  142    H    GLN  17           HN       GLN  17   2.539  -8.862   3.473
  143    HA   GLN  17           HA       GLN  17   1.770 -11.090   3.606
  144   1HB   GLN  17          HB2       GLN  17   4.707 -11.521   4.218
  145   2HB   GLN  17          HB1       GLN  17   3.592 -12.722   3.559
  146   1HG   GLN  17          HG2       GLN  17   3.318 -10.534   1.850
  147   2HG   GLN  17          HG1       GLN  17   5.049 -10.600   2.182
  148   1HE2  GLN  17          HE21      GLN  17   5.880 -13.076   2.142
  149   2HE2  GLN  17          HE22      GLN  17   5.342 -13.973   0.805
  150    H    GLY  18           HN       GLY  18   1.145  -9.795   5.930
  151   1HA   GLY  18          HA2       GLY  18   0.419 -11.416   7.862
  152   2HA   GLY  18          HA1       GLY  18   2.158 -11.508   8.146
  153    H    GLU  19           HN       GLU  19   3.010  -8.937   7.870
  154    HA   GLU  19           HA       GLU  19   1.628  -7.589  10.144
  155   1HB   GLU  19          HB2       GLU  19   4.319  -8.084   9.321
  156   2HB   GLU  19          HB1       GLU  19   4.072  -6.337   9.319
  157   1HG   GLU  19          HG2       GLU  19   3.521  -6.281  11.599
  158   2HG   GLU  19          HG1       GLU  19   3.116  -7.997  11.640
  159    H    ARG  20           HN       ARG  20   1.603  -5.125   9.989
  160    HA   ARG  20           HA       ARG  20   1.232  -4.153   7.182
  161   1HB   ARG  20          HB2       ARG  20  -0.631  -3.525   9.482
  162   2HB   ARG  20          HB1       ARG  20  -0.915  -3.271   7.757
  163   1HG   ARG  20          HG2       ARG  20  -1.021  -5.658   7.361
  164   2HG   ARG  20          HG1       ARG  20  -0.542  -6.000   9.024
  165   1HD   ARG  20          HD2       ARG  20  -2.740  -4.344   9.363
  166   2HD   ARG  20          HD1       ARG  20  -3.198  -5.339   7.966
  167    HE   ARG  20           HE       ARG  20  -2.795  -7.339   9.326
  168   1HH1  ARG  20          HH11      ARG  20  -0.813  -6.397  11.278
  169   2HH1  ARG  20          HH12      ARG  20  -1.754  -6.152  12.712
  170   1HH2  ARG  20          HH21      ARG  20  -4.789  -6.119  11.036
  171   2HH2  ARG  20          HH22      ARG  20  -4.005  -5.996  12.575
  172    H    VAL  21           HN       VAL  21   2.096  -2.088   6.893
  173    HA   VAL  21           HA       VAL  21   2.447  -0.286   9.200
  174    HB   VAL  21           HB       VAL  21   4.972  -0.237   8.687
  175   1HG1  VAL  21          HG11      VAL  21   5.393  -1.970  10.261
  176   2HG1  VAL  21          HG12      VAL  21   3.970  -2.881   9.756
  177   3HG1  VAL  21          HG13      VAL  21   3.780  -1.376  10.656
  178   1HG2  VAL  21          HG21      VAL  21   4.218  -1.871   6.597
  179   2HG2  VAL  21          HG22      VAL  21   4.822  -3.034   7.778
  180   3HG2  VAL  21          HG23      VAL  21   5.863  -1.724   7.217
  181    H    LYS  22           HN       LYS  22   3.856   1.687   8.345
  182    HA   LYS  22           HA       LYS  22   2.600   2.553   5.810
  183   1HB   LYS  22          HB2       LYS  22   3.986   3.780   8.167
  184   2HB   LYS  22          HB1       LYS  22   3.921   4.699   6.662
  185   1HG   LYS  22          HG2       LYS  22   1.384   3.423   7.545
  186   2HG   LYS  22          HG1       LYS  22   1.952   4.795   8.500
  187   1HD   LYS  22          HD2       LYS  22   1.910   6.256   6.636
  188   2HD   LYS  22          HD1       LYS  22   1.821   4.919   5.487
  189   1HE   LYS  22          HE2       LYS  22  -0.442   4.924   5.586
  190   2HE   LYS  22          HE1       LYS  22  -0.401   4.803   7.356
  191   1HZ   LYS  22          HZ1       LYS  22  -1.232   6.984   6.106
  192   2HZ   LYS  22          HZ2       LYS  22   0.426   7.343   6.195
  193   3HZ   LYS  22          HZ3       LYS  22  -0.456   7.036   7.613
  194    H    ILE  23           HN       ILE  23   3.730   2.045   3.966
  195    HA   ILE  23           HA       ILE  23   6.423   1.260   3.753
  196    HB   ILE  23           HB       ILE  23   4.471   1.217   2.077
  197   1HG1  ILE  23          HG12      ILE  23   6.897   0.591   1.616
  198   2HG1  ILE  23          HG11      ILE  23   5.963   1.086   0.205
  199   1HG2  ILE  23          HG21      ILE  23   4.428   3.149   0.505
  200   2HG2  ILE  23          HG22      ILE  23   5.536   4.010   1.573
  201   3HG2  ILE  23          HG23      ILE  23   3.918   3.592   2.134
  202   1HD1  ILE  23          HD11      ILE  23   7.513   2.663  -0.207
  203   2HD1  ILE  23          HD12      ILE  23   8.358   2.274   1.291
  204   3HD1  ILE  23          HD13      ILE  23   7.054   3.459   1.297
  205    H    GLN  24           HN       GLN  24   5.085   4.423   4.267
  206    HA   GLN  24           HA       GLN  24   7.438   5.899   3.327
  207   1HB   GLN  24          HB2       GLN  24   6.168   7.812   4.139
  208   2HB   GLN  24          HB1       GLN  24   5.057   6.716   3.311
  209   1HG   GLN  24          HG2       GLN  24   3.836   6.500   5.187
  210   2HG   GLN  24          HG1       GLN  24   5.254   5.924   6.062
  211   1HE2  GLN  24          HE21      GLN  24   3.116   7.811   7.022
  212   2HE2  GLN  24          HE22      GLN  24   3.934   9.231   7.466
  213    H    GLU  25           HN       GLU  25   6.689   4.094   6.101
  214    HA   GLU  25           HA       GLU  25   8.572   5.688   7.802
  215   1HB   GLU  25          HB2       GLU  25   6.271   3.808   8.326
  216   2HB   GLU  25          HB1       GLU  25   7.427   4.204   9.598
  217   1HG   GLU  25          HG2       GLU  25   6.924   6.563   9.409
  218   2HG   GLU  25          HG1       GLU  25   5.912   6.279   7.993
  219    H    LYS  26           HN       LYS  26   7.601   2.242   7.527
  220    HA   LYS  26           HA       LYS  26   9.989   1.131   8.547
  221   1HB   LYS  26          HB2       LYS  26   7.796  -0.004   8.093
  222   2HB   LYS  26          HB1       LYS  26   8.189   0.027   6.371
  223   1HG   LYS  26          HG2       LYS  26   9.291  -1.915   6.665
  224   2HG   LYS  26          HG1       LYS  26  10.470  -1.027   7.629
  225   1HD   LYS  26          HD2       LYS  26   9.062  -1.385   9.645
  226   2HD   LYS  26          HD1       LYS  26   7.942  -2.338   8.670
  227   1HE   LYS  26          HE2       LYS  26   9.376  -3.956   9.680
  228   2HE   LYS  26          HE1       LYS  26  10.030  -3.761   8.041
  229   1HZ   LYS  26          HZ1       LYS  26  11.810  -2.614   8.781
  230   2HZ   LYS  26          HZ2       LYS  26  11.503  -3.440  10.234
  231   3HZ   LYS  26          HZ3       LYS  26  10.950  -1.847  10.026
  232    H    PHE  27           HN       PHE  27   9.259   2.388   5.348
  233    HA   PHE  27           HA       PHE  27  12.016   1.618   4.449
  234   1HB   PHE  27          HB2       PHE  27   9.423   2.090   2.938
  235   2HB   PHE  27          HB1       PHE  27  10.975   1.752   2.165
  236    HD1  PHE  27           HD1      PHE  27   8.009   0.274   3.271
  237    HD2  PHE  27           HD2      PHE  27  12.258  -0.359   3.278
  238    HE1  PHE  27           HE1      PHE  27   7.648  -2.158   3.601
  239    HE2  PHE  27           HE2      PHE  27  11.896  -2.789   3.609
  240    HZ   PHE  27           HZ       PHE  27   9.590  -3.690   3.771
  241    H    LYS  28           HN       LYS  28  11.635   3.955   6.012
  242    HA   LYS  28           HA       LYS  28  11.055   6.384   4.794
  243   1HB   LYS  28          HB2       LYS  28  12.212   5.526   7.105
  244   2HB   LYS  28          HB1       LYS  28  13.606   6.248   6.303
  245   1HG   LYS  28          HG2       LYS  28  12.789   8.157   7.273
  246   2HG   LYS  28          HG1       LYS  28  11.784   8.176   5.823
  247   1HD   LYS  28          HD2       LYS  28   9.922   7.919   7.057
  248   2HD   LYS  28          HD1       LYS  28  10.580   6.464   7.804
  249   1HE   LYS  28          HE2       LYS  28  11.444   7.629   9.633
  250   2HE   LYS  28          HE1       LYS  28  11.561   9.154   8.732
  251   1HZ   LYS  28          HZ1       LYS  28   9.661   9.340  10.107
  252   2HZ   LYS  28          HZ2       LYS  28   9.100   7.793   9.680
  253   3HZ   LYS  28          HZ3       LYS  28   9.078   9.054   8.540
  254    H    ASN  29           HN       ASN  29  14.025   4.449   4.413
  255    HA   ASN  29           HA       ASN  29  15.041   6.404   2.407
  256   1HB   ASN  29          HB2       ASN  29  16.364   3.926   3.533
  257   2HB   ASN  29          HB1       ASN  29  17.149   5.318   2.781
  258   1HD2  ASN  29          HD21      ASN  29  15.119   7.112   4.301
  259   2HD2  ASN  29          HD22      ASN  29  15.764   7.200   5.869
  260    H    GLY  30           HN       GLY  30  12.756   4.728   1.712
  261   1HA   GLY  30          HA2       GLY  30  12.198   3.729  -0.386
  262   2HA   GLY  30          HA1       GLY  30  13.913   3.423  -0.669
  263    H    MET  31           HN       MET  31  12.294   1.346  -1.220
  264    HA   MET  31           HA       MET  31  12.205  -0.417   1.182
  265   1HB   MET  31          HB2       MET  31  11.200  -0.936  -1.629
  266   2HB   MET  31          HB1       MET  31  10.674  -1.712  -0.135
  267   1HG   MET  31          HG2       MET  31   9.805   0.478   0.666
  268   2HG   MET  31          HG1       MET  31  10.267   1.201  -0.875
  269   1HE   MET  31          HE1       MET  31   6.862  -1.552   0.211
  270   2HE   MET  31          HE2       MET  31   8.283  -1.074   1.137
  271   3HE   MET  31          HE3       MET  31   8.397  -2.400  -0.018
  272    H    LEU  32           HN       LEU  32  13.264  -2.493   1.124
  273    HA   LEU  32           HA       LEU  32  15.813  -2.535  -0.256
  274   1HB   LEU  32          HB2       LEU  32  14.210  -4.382   1.503
  275   2HB   LEU  32          HB1       LEU  32  15.712  -4.943   0.762
  276    HG   LEU  32           HG       LEU  32  16.061  -3.990   3.044
  277   1HD1  LEU  32          HD11      LEU  32  17.567  -3.627   0.772
  278   2HD1  LEU  32          HD12      LEU  32  18.099  -3.219   2.403
  279   3HD1  LEU  32          HD13      LEU  32  17.400  -1.975   1.365
  280   1HD2  LEU  32          HD21      LEU  32  15.276  -1.367   1.739
  281   2HD2  LEU  32          HD22      LEU  32  15.745  -1.616   3.421
  282   3HD2  LEU  32          HD23      LEU  32  14.224  -2.278   2.823
  283    H    HIS  33           HN       HIS  33  16.477  -4.295  -1.745
  284    HA   HIS  33           HA       HIS  33  14.676  -4.624  -3.964
  285   1HB   HIS  33          HB2       HIS  33  17.017  -4.578  -4.363
  286   2HB   HIS  33          HB1       HIS  33  17.330  -5.785  -3.112
  287    HD1  HIS  33           HD1      HIS  33  15.306  -5.630  -6.360
  288    HD2  HIS  33           HD2      HIS  33  17.694  -8.282  -4.204
  289    HE1  HIS  33           HE1      HIS  33  15.447  -7.752  -7.738
  290    H    GLY  34           HN       GLY  34  13.480  -6.450  -4.605
  291   1HA   GLY  34          HA2       GLY  34  12.426  -8.546  -4.415
  292   2HA   GLY  34          HA1       GLY  34  13.662  -8.998  -3.241
  293    H    ASP  35           HN       ASP  35  12.186  -6.071  -2.393
  294    HA   ASP  35           HA       ASP  35  10.951  -7.235  -0.035
  295   1HB   ASP  35          HB2       ASP  35  11.355  -4.568  -1.299
  296   2HB   ASP  35          HB1       ASP  35  10.037  -4.693  -0.132
  297    H    LYS  36           HN       LYS  36   8.813  -7.862   0.218
  298    HA   LYS  36           HA       LYS  36   6.973  -7.367  -2.098
  299   1HB   LYS  36          HB2       LYS  36   7.390  -9.609  -0.132
  300   2HB   LYS  36          HB1       LYS  36   5.839  -9.439  -0.955
  301   1HG   LYS  36          HG2       LYS  36   7.829  -9.108  -2.940
  302   2HG   LYS  36          HG1       LYS  36   8.312 -10.507  -1.981
  303   1HD   LYS  36          HD2       LYS  36   5.432 -10.336  -2.697
  304   2HD   LYS  36          HD1       LYS  36   6.549 -10.674  -4.020
  305   1HE   LYS  36          HE2       LYS  36   6.624 -12.833  -3.337
  306   2HE   LYS  36          HE1       LYS  36   7.368 -12.288  -1.820
  307   1HZ   LYS  36          HZ1       LYS  36   5.155 -11.768  -0.974
  308   2HZ   LYS  36          HZ2       LYS  36   5.278 -13.414  -1.377
  309   3HZ   LYS  36          HZ3       LYS  36   4.454 -12.344  -2.407
  310    H    VAL  37           HN       VAL  37   5.232  -6.077  -1.683
  311    HA   VAL  37           HA       VAL  37   4.187  -5.902   1.114
  312    HB   VAL  37           HB       VAL  37   4.078  -3.400   0.728
  313   1HG1  VAL  37          HG11      VAL  37   6.872  -4.555   0.523
  314   2HG1  VAL  37          HG12      VAL  37   5.918  -4.563   2.005
  315   3HG1  VAL  37          HG13      VAL  37   6.403  -3.032   1.277
  316   1HG2  VAL  37          HG21      VAL  37   5.947  -4.030  -1.575
  317   2HG2  VAL  37          HG22      VAL  37   5.352  -2.443  -1.091
  318   3HG2  VAL  37          HG23      VAL  37   4.243  -3.625  -1.785
  319    H    SER  38           HN       SER  38   1.940  -5.834   1.156
  320    HA   SER  38           HA       SER  38   0.544  -5.786  -1.489
  321   1HB   SER  38          HB2       SER  38  -0.870  -6.568   0.996
  322   2HB   SER  38          HB1       SER  38  -0.823  -7.377  -0.571
  323    HG   SER  38           HG       SER  38   0.820  -7.641   1.645
  324    H    PHE  39           HN       PHE  39  -1.164  -4.318  -1.833
  325    HA   PHE  39           HA       PHE  39  -1.364  -2.079   0.132
  326   1HB   PHE  39          HB2       PHE  39  -1.993  -2.448  -2.802
  327   2HB   PHE  39          HB1       PHE  39  -2.460  -0.993  -1.916
  328    HD1  PHE  39           HD1      PHE  39   0.449  -3.106  -2.892
  329    HD2  PHE  39           HD2      PHE  39  -0.870   0.697  -1.393
  330    HE1  PHE  39           HE1      PHE  39   2.745  -2.205  -3.156
  331    HE2  PHE  39           HE2      PHE  39   1.425   1.598  -1.657
  332    HZ   PHE  39           HZ       PHE  39   3.233   0.146  -2.538
  333    H    PHE  40           HN       PHE  40  -3.360  -1.531   1.064
  334    HA   PHE  40           HA       PHE  40  -5.445  -3.586   1.033
  335   1HB   PHE  40          HB2       PHE  40  -4.805  -1.037   2.462
  336   2HB   PHE  40          HB1       PHE  40  -6.478  -1.603   2.507
  337    HD1  PHE  40           HD1      PHE  40  -3.275  -1.888   4.009
  338    HD2  PHE  40           HD2      PHE  40  -6.800  -4.157   3.071
  339    HE1  PHE  40           HE1      PHE  40  -2.667  -3.550   5.746
  340    HE2  PHE  40           HE2      PHE  40  -6.192  -5.819   4.808
  341    HZ   PHE  40           HZ       PHE  40  -4.126  -5.517   6.146
  342    H    CYS  41           HN       CYS  41  -7.342  -3.515  -0.132
  343    HA   CYS  41           HA       CYS  41  -8.156  -0.936  -1.401
  344   1HB   CYS  41          HB2       CYS  41  -6.947  -3.213  -2.658
  345   2HB   CYS  41          HB1       CYS  41  -8.619  -3.091  -3.218
  346    H    LYS  42           HN       LYS  42 -10.452  -0.990  -2.092
  347    HA   LYS  42           HA       LYS  42 -12.060  -2.869  -0.406
  348   1HB   LYS  42          HB2       LYS  42 -13.818  -1.092  -0.756
  349   2HB   LYS  42          HB1       LYS  42 -12.364  -0.509   0.055
  350   1HG   LYS  42          HG2       LYS  42 -12.026  -0.305  -2.803
  351   2HG   LYS  42          HG1       LYS  42 -13.520   0.498  -2.322
  352   1HD   LYS  42          HD2       LYS  42 -10.961   0.959  -0.798
  353   2HD   LYS  42          HD1       LYS  42 -11.329   1.884  -2.255
  354   1HE   LYS  42          HE2       LYS  42 -13.609   1.740  -0.410
  355   2HE   LYS  42          HE1       LYS  42 -12.193   2.547   0.294
  356   1HZ   LYS  42          HZ1       LYS  42 -13.032   3.115  -2.479
  357   2HZ   LYS  42          HZ2       LYS  42 -12.088   4.066  -1.436
  358   3HZ   LYS  42          HZ3       LYS  42 -13.762   3.928  -1.182
  359    H    ASN  43           HN       ASN  43 -13.729  -4.069  -1.346
  360    HA   ASN  43           HA       ASN  43 -13.748  -4.133  -4.347
  361   1HB   ASN  43          HB2       ASN  43 -12.927  -6.093  -2.815
  362   2HB   ASN  43          HB1       ASN  43 -14.649  -6.356  -2.523
  363   1HD2  ASN  43          HD21      ASN  43 -12.877  -8.189  -4.005
  364   2HD2  ASN  43          HD22      ASN  43 -13.490  -8.285  -5.585
  365    H    LYS  44           HN       LYS  44 -15.573  -3.094  -5.066
  366    HA   LYS  44           HA       LYS  44 -17.978  -2.825  -3.446
  367   1HB   LYS  44          HB2       LYS  44 -16.829  -1.417  -5.431
  368   2HB   LYS  44          HB1       LYS  44 -17.958  -2.371  -6.395
  369   1HG   LYS  44          HG2       LYS  44 -19.828  -1.610  -5.007
  370   2HG   LYS  44          HG1       LYS  44 -18.718  -0.701  -3.981
  371   1HD   LYS  44          HD2       LYS  44 -18.165   0.807  -5.745
  372   2HD   LYS  44          HD1       LYS  44 -18.923  -0.223  -6.960
  373   1HE   LYS  44          HE2       LYS  44 -20.946   0.297  -5.061
  374   2HE   LYS  44          HE1       LYS  44 -20.140   1.852  -5.352
  375   1HZ   LYS  44          HZ1       LYS  44 -21.485   0.074  -7.263
  376   2HZ   LYS  44          HZ2       LYS  44 -20.170   1.003  -7.805
  377   3HZ   LYS  44          HZ3       LYS  44 -21.539   1.765  -7.148
  378    H    GLU  45           HN       GLU  45 -16.773  -5.163  -5.697
  379    HA   GLU  45           HA       GLU  45 -19.434  -6.255  -6.366
  380   1HB   GLU  45          HB2       GLU  45 -16.938  -6.148  -7.556
  381   2HB   GLU  45          HB1       GLU  45 -17.017  -7.814  -6.984
  382   1HG   GLU  45          HG2       GLU  45 -19.549  -7.358  -8.057
  383   2HG   GLU  45          HG1       GLU  45 -18.459  -6.546  -9.181
  384    H    LYS  46           HN       LYS  46 -16.960  -6.703  -3.981
  385    HA   LYS  46           HA       LYS  46 -18.177  -9.315  -3.151
  386   1HB   LYS  46          HB2       LYS  46 -15.439  -8.067  -2.852
  387   2HB   LYS  46          HB1       LYS  46 -15.923  -9.500  -1.939
  388   1HG   LYS  46          HG2       LYS  46 -16.652  -9.893  -4.679
  389   2HG   LYS  46          HG1       LYS  46 -14.968  -9.371  -4.625
  390   1HD   LYS  46          HD2       LYS  46 -14.338 -11.401  -3.894
  391   2HD   LYS  46          HD1       LYS  46 -15.417 -11.254  -2.506
  392   1HE   LYS  46          HE2       LYS  46 -17.308 -12.071  -3.887
  393   2HE   LYS  46          HE1       LYS  46 -16.206 -12.252  -5.268
  394   1HZ   LYS  46          HZ1       LYS  46 -15.970 -13.586  -2.623
  395   2HZ   LYS  46          HZ2       LYS  46 -14.788 -13.657  -3.841
  396   3HZ   LYS  46          HZ3       LYS  46 -16.324 -14.335  -4.102
  397    H    LYS  47           HN       LYS  47 -17.759  -6.014  -2.314
  398    HA   LYS  47           HA       LYS  47 -18.585  -4.805  -0.457
  399   1HB   LYS  47          HB2       LYS  47 -19.494  -7.455   0.663
  400   2HB   LYS  47          HB1       LYS  47 -20.249  -5.870   0.840
  401   1HG   LYS  47          HG2       LYS  47 -20.228  -6.219  -1.900
  402   2HG   LYS  47          HG1       LYS  47 -20.552  -7.849  -1.306
  403   1HD   LYS  47          HD2       LYS  47 -22.512  -7.189  -0.185
  404   2HD   LYS  47          HD1       LYS  47 -22.046  -5.487  -0.182
  405   1HE   LYS  47          HE2       LYS  47 -22.110  -5.956  -2.865
  406   2HE   LYS  47          HE1       LYS  47 -23.383  -7.061  -2.308
  407   1HZ   LYS  47          HZ1       LYS  47 -23.140  -4.153  -1.788
  408   2HZ   LYS  47          HZ2       LYS  47 -24.163  -5.159  -0.875
  409   3HZ   LYS  47          HZ3       LYS  47 -24.418  -4.972  -2.544
  410    H    CYS  48           HN       CYS  48 -15.881  -6.151  -0.525
  411    HA   CYS  48           HA       CYS  48 -15.312  -5.863   2.379
  412   1HB   CYS  48          HB2       CYS  48 -14.027  -8.169   0.999
  413   2HB   CYS  48          HB1       CYS  48 -14.526  -8.011   2.680
  414    H    SER  49           HN       SER  49 -12.701  -6.397   2.470
  415    HA   SER  49           HA       SER  49 -11.497  -4.744   0.277
  416   1HB   SER  49          HB2       SER  49  -9.795  -4.502   2.371
  417   2HB   SER  49          HB1       SER  49 -11.169  -3.429   2.129
  418    HG   SER  49           HG       SER  49 -10.717  -4.975   4.180
  419    H    TYR  50           HN       TYR  50  -9.069  -5.241   0.086
  420    HA   TYR  50           HA       TYR  50  -8.236  -7.955   0.867
  421   1HB   TYR  50          HB2       TYR  50  -7.881  -8.507  -1.622
  422   2HB   TYR  50          HB1       TYR  50  -9.548  -8.529  -1.041
  423    HD1  TYR  50           HD1      TYR  50  -7.174  -6.970  -3.288
  424    HD2  TYR  50           HD2      TYR  50 -11.027  -6.509  -1.443
  425    HE1  TYR  50           HE1      TYR  50  -7.775  -5.256  -4.974
  426    HE2  TYR  50           HE2      TYR  50 -11.626  -4.795  -3.133
  427    HH   TYR  50           HH       TYR  50 -10.355  -4.417  -5.899
  428    H    THR  51           HN       THR  51  -5.964  -8.371  -0.216
  429    HA   THR  51           HA       THR  51  -4.473  -5.778  -0.107
  430    HB   THR  51           HB       THR  51  -2.572  -7.314   0.514
  431    HG1  THR  51           HG1      THR  51  -3.071  -9.268  -0.182
  432   1HG2  THR  51          HG21      THR  51  -4.231  -6.180   2.136
  433   2HG2  THR  51          HG22      THR  51  -3.267  -7.517   2.763
  434   3HG2  THR  51          HG23      THR  51  -4.950  -7.780   2.308
  435    H    GLU  52           HN       GLU  52  -2.996  -5.282  -1.714
  436    HA   GLU  52           HA       GLU  52  -3.053  -7.008  -4.166
  437   1HB   GLU  52          HB2       GLU  52  -2.715  -4.046  -3.638
  438   2HB   GLU  52          HB1       GLU  52  -2.322  -4.759  -5.203
  439   1HG   GLU  52          HG2       GLU  52  -5.012  -4.920  -3.809
  440   2HG   GLU  52          HG1       GLU  52  -4.631  -3.911  -5.206
  441    H    ASP  53           HN       ASP  53  -1.316  -8.317  -3.128
  442    HA   ASP  53           HA       ASP  53   1.115  -7.610  -2.105
  443   1HB   ASP  53          HB2       ASP  53   0.675  -9.606  -4.340
  444   2HB   ASP  53          HB1       ASP  53   1.955  -9.658  -3.124
  445    H    ALA  54           HN       ALA  54   3.069  -6.824  -2.837
  446    HA   ALA  54           HA       ALA  54   3.345  -6.080  -5.719
  447   1HB   ALA  54          HB1       ALA  54   2.484  -4.270  -3.965
  448   2HB   ALA  54          HB2       ALA  54   3.659  -3.827  -5.204
  449   3HB   ALA  54          HB3       ALA  54   4.197  -4.178  -3.562
  450    H    GLN  55           HN       GLN  55   5.723  -5.471  -6.165
  451    HA   GLN  55           HA       GLN  55   7.593  -6.733  -4.201
  452   1HB   GLN  55          HB2       GLN  55   6.684  -8.244  -6.111
  453   2HB   GLN  55          HB1       GLN  55   7.739  -7.295  -7.159
  454   1HG   GLN  55          HG2       GLN  55   9.688  -8.017  -6.064
  455   2HG   GLN  55          HG1       GLN  55   8.807  -8.498  -4.614
  456   1HE2  GLN  55          HE21      GLN  55   9.130  -9.374  -8.095
  457   2HE2  GLN  55          HE22      GLN  55   8.805 -11.024  -7.860
  458    H    CYS  56           HN       CYS  56   9.596  -5.743  -4.113
  459    HA   CYS  56           HA       CYS  56   9.992  -3.309  -5.773
  460   1HB   CYS  56          HB2       CYS  56  10.199  -2.841  -3.488
  461   2HB   CYS  56          HB1       CYS  56  10.944  -4.394  -3.140
  462    H    ILE  57           HN       ILE  57  11.679  -3.173  -7.238
  463    HA   ILE  57           HA       ILE  57  13.369  -5.621  -7.574
  464    HB   ILE  57           HB       ILE  57  12.776  -3.432  -9.583
  465   1HG1  ILE  57          HG12      ILE  57  10.661  -4.419  -8.664
  466   2HG1  ILE  57          HG11      ILE  57  10.905  -4.782 -10.373
  467   1HG2  ILE  57          HG21      ILE  57  14.452  -4.737 -10.512
  468   2HG2  ILE  57          HG22      ILE  57  13.034  -5.647 -11.035
  469   3HG2  ILE  57          HG23      ILE  57  13.956  -6.183  -9.631
  470   1HD1  ILE  57          HD11      ILE  57  10.875  -6.987  -9.936
  471   2HD1  ILE  57          HD12      ILE  57  10.548  -6.628  -8.241
  472   3HD1  ILE  57          HD13      ILE  57  12.211  -6.800  -8.801
  473    H    ASP  58           HN       ASP  58  15.478  -4.819  -8.918
  474    HA   ASP  58           HA       ASP  58  17.191  -3.495  -7.105
  475   1HB   ASP  58          HB2       ASP  58  17.496  -4.997  -9.263
  476   2HB   ASP  58          HB1       ASP  58  17.659  -3.430 -10.063
  477    H    GLY  59           HN       GLY  59  15.651  -1.533  -6.677
  478   1HA   GLY  59          HA2       GLY  59  15.948   0.865  -6.760
  479   2HA   GLY  59          HA1       GLY  59  16.611   0.697  -8.382
  480    H    THR  60           HN       THR  60  14.396  -1.035  -9.318
  481    HA   THR  60           HA       THR  60  12.378   1.145  -9.654
  482    HB   THR  60           HB       THR  60  12.958  -1.371 -11.242
  483    HG1  THR  60           HG1      THR  60  13.459   1.333 -11.899
  484   1HG2  THR  60          HG21      THR  60  11.483   0.861 -12.473
  485   2HG2  THR  60          HG22      THR  60  10.610   0.039 -11.180
  486   3HG2  THR  60          HG23      THR  60  11.187  -0.874 -12.575
  487    H    ILE  61           HN       ILE  61  10.158   0.718  -9.302
  488    HA   ILE  61           HA       ILE  61   9.365  -1.991  -8.384
  489    HB   ILE  61           HB       ILE  61  10.278  -0.515  -6.499
  490   1HG1  ILE  61          HG12      ILE  61   8.499  -2.507  -6.473
  491   2HG1  ILE  61          HG11      ILE  61   8.922  -1.632  -5.005
  492   1HG2  ILE  61          HG21      ILE  61   9.311   1.605  -7.123
  493   2HG2  ILE  61          HG22      ILE  61   8.590   1.113  -5.591
  494   3HG2  ILE  61          HG23      ILE  61   7.685   0.924  -7.093
  495   1HD1  ILE  61          HD11      ILE  61   6.661  -0.649  -6.720
  496   2HD1  ILE  61          HD12      ILE  61   6.921  -0.428  -4.993
  497   3HD1  ILE  61          HD13      ILE  61   6.397  -1.994  -5.612
  498    H    GLU  62           HN       GLU  62   7.008  -2.192  -8.253
  499    HA   GLU  62           HA       GLU  62   5.579  -0.130  -9.903
  500   1HB   GLU  62          HB2       GLU  62   5.663  -3.127  -9.881
  501   2HB   GLU  62          HB1       GLU  62   4.174  -2.332 -10.396
  502   1HG   GLU  62          HG2       GLU  62   5.192  -1.319 -12.238
  503   2HG   GLU  62          HG1       GLU  62   6.804  -1.422 -11.527
  504    H    VAL  63           HN       VAL  63   3.542   0.520  -9.160
  505    HA   VAL  63           HA       VAL  63   2.736  -0.519  -6.467
  506    HB   VAL  63           HB       VAL  63   3.453   1.896  -6.811
  507   1HG1  VAL  63          HG11      VAL  63   2.058   1.816  -9.089
  508   2HG1  VAL  63          HG12      VAL  63   2.274   3.320  -8.193
  509   3HG1  VAL  63          HG13      VAL  63   0.774   2.405  -8.032
  510   1HG2  VAL  63          HG21      VAL  63   2.048   1.250  -4.907
  511   2HG2  VAL  63          HG22      VAL  63   0.602   1.363  -5.913
  512   3HG2  VAL  63          HG23      VAL  63   1.527   2.816  -5.529
  513    HA   PRO  64           HA       PRO  64  -0.866  -2.247  -8.408
  514   1HB   PRO  64          HB2       PRO  64  -2.419  -1.866  -6.015
  515   2HB   PRO  64          HB1       PRO  64  -1.665  -3.356  -6.599
  516   1HG   PRO  64          HG2       PRO  64  -0.876  -1.747  -4.361
  517   2HG   PRO  64          HG1       PRO  64  -0.112  -3.224  -4.957
  518   1HD   PRO  64          HD2       PRO  64   0.879  -0.516  -5.139
  519   2HD   PRO  64          HD1       PRO  64   1.654  -2.008  -5.729
  520    H    LYS  65           HN       LYS  65  -2.037  -0.983  -9.825
  521    HA   LYS  65           HA       LYS  65  -2.671   1.742  -9.577
  522   1HB   LYS  65          HB2       LYS  65  -2.849   0.509 -11.659
  523   2HB   LYS  65          HB1       LYS  65  -4.088  -0.546 -10.979
  524   1HG   LYS  65          HG2       LYS  65  -5.455   0.948 -12.086
  525   2HG   LYS  65          HG1       LYS  65  -5.306   1.796 -10.547
  526   1HD   LYS  65          HD2       LYS  65  -4.524   3.552 -11.729
  527   2HD   LYS  65          HD1       LYS  65  -3.053   2.609 -11.968
  528   1HE   LYS  65          HE2       LYS  65  -3.616   2.027 -14.136
  529   2HE   LYS  65          HE1       LYS  65  -5.359   2.063 -13.802
  530   1HZ   LYS  65          HZ1       LYS  65  -5.107   4.041 -14.905
  531   2HZ   LYS  65          HZ2       LYS  65  -3.525   4.294 -14.340
  532   3HZ   LYS  65          HZ3       LYS  65  -4.850   4.562 -13.312
  533    H    CYS  66           HN       CYS  66  -4.236  -1.040  -8.139
  534    HA   CYS  66           HA       CYS  66  -6.796   0.056  -7.539
  535   1HB   CYS  66          HB2       CYS  66  -5.855  -2.332  -7.328
  536   2HB   CYS  66          HB1       CYS  66  -5.183  -1.808  -5.783
  537    H    PHE  67           HN       PHE  67  -3.671   0.327  -5.870
  538    HA   PHE  67           HA       PHE  67  -4.462   1.448  -3.416
  539   1HB   PHE  67          HB2       PHE  67  -2.177   0.850  -3.894
  540   2HB   PHE  67          HB1       PHE  67  -2.109   1.970  -5.254
  541    HD1  PHE  67           HD1      PHE  67  -0.873   3.891  -4.842
  542    HD2  PHE  67           HD2      PHE  67  -3.155   2.149  -1.647
  543    HE1  PHE  67           HE1      PHE  67  -0.124   5.700  -3.321
  544    HE2  PHE  67           HE2      PHE  67  -2.404   3.957  -0.125
  545    HZ   PHE  67           HZ       PHE  67  -0.888   5.732  -0.962
  546    H    LYS  68           HN       LYS  68  -5.372   3.406  -2.863
  547    HA   LYS  68           HA       LYS  68  -6.072   5.297  -5.020
  548   1HB   LYS  68          HB2       LYS  68  -6.862   4.666  -2.225
  549   2HB   LYS  68          HB1       LYS  68  -7.065   6.345  -2.725
  550   1HG   LYS  68          HG2       LYS  68  -8.207   5.374  -4.834
  551   2HG   LYS  68          HG1       LYS  68  -8.316   3.872  -3.916
  552   1HD   LYS  68          HD2       LYS  68  -9.413   6.562  -3.042
  553   2HD   LYS  68          HD1       LYS  68 -10.369   5.204  -3.638
  554   1HE   LYS  68          HE2       LYS  68 -10.073   3.965  -1.692
  555   2HE   LYS  68          HE1       LYS  68  -8.522   4.740  -1.315
  556   1HZ   LYS  68          HZ1       LYS  68 -10.760   5.450  -0.115
  557   2HZ   LYS  68          HZ2       LYS  68 -10.874   6.461  -1.475
  558   3HZ   LYS  68          HZ3       LYS  68  -9.525   6.564  -0.446
  559    H    GLU  69           HN       GLU  69  -3.530   5.695  -5.126
  560    HA   GLU  69           HA       GLU  69  -2.131   7.131  -3.132
  561   1HB   GLU  69          HB2       GLU  69  -1.059   6.246  -5.109
  562   2HB   GLU  69          HB1       GLU  69  -2.081   7.223  -6.163
  563   1HG   GLU  69          HG2       GLU  69  -0.881   9.046  -4.384
  564   2HG   GLU  69          HG1       GLU  69   0.407   7.943  -4.869
  565    H    HIS  70           HN       HIS  70  -4.354   8.303  -5.656
  566    HA   HIS  70           HA       HIS  70  -4.094  11.086  -4.641
  567   1HB   HIS  70          HB2       HIS  70  -4.885   9.687  -7.111
  568   2HB   HIS  70          HB1       HIS  70  -5.907  11.069  -6.719
  569    HD1  HIS  70           HD1      HIS  70  -3.163  10.480  -8.732
  570    HD2  HIS  70           HD2      HIS  70  -3.810  13.269  -5.703
  571    HE1  HIS  70           HE1      HIS  70  -1.504  12.354  -9.119
  572    H    SER  71           HN       SER  71  -6.911   9.144  -5.720
  573    HA   SER  71           HA       SER  71  -8.315   9.087  -3.257
  574   1HB   SER  71          HB2       SER  71  -8.106  11.675  -4.541
  575   2HB   SER  71          HB1       SER  71  -9.797  11.183  -4.428
  576    HG   SER  71           HG       SER  71  -9.630  11.079  -2.265
  577    H    SER  72           HN       SER  72  -8.750   9.757  -6.742
  578    HA   SER  72           HA       SER  72 -10.145   8.678  -8.322
  579   1HB   SER  72          HB2       SER  72 -10.724   6.616  -6.213
  580   2HB   SER  72          HB1       SER  72 -10.442   6.387  -7.937
  581    HG   SER  72           HG       SER  72  -8.415   6.141  -7.484
  582    H    LEU  73           HN       LEU  73 -11.882  10.164  -8.396
  583    HA   LEU  73           HA       LEU  73 -14.063  10.988  -7.986
  584   1HB   LEU  73          HB2       LEU  73 -14.067   8.050  -7.388
  585   2HB   LEU  73          HB1       LEU  73 -15.520   8.982  -7.015
  586    HG   LEU  73           HG       LEU  73 -14.782   9.872  -9.554
  587   1HD1  LEU  73          HD11      LEU  73 -13.243   7.781  -9.466
  588   2HD1  LEU  73          HD12      LEU  73 -14.272   7.993 -10.884
  589   3HD1  LEU  73          HD13      LEU  73 -14.737   6.857  -9.617
  590   1HD2  LEU  73          HD21      LEU  73 -16.701   7.624  -9.444
  591   2HD2  LEU  73          HD22      LEU  73 -16.938   9.277 -10.011
  592   3HD2  LEU  73          HD23      LEU  73 -17.011   8.918  -8.286
  593    H    ALA  74           HN       ALA  74 -15.848  10.769  -5.993
  594    HA   ALA  74           HA       ALA  74 -14.856  12.233  -3.819
  595   1HB   ALA  74          HB1       ALA  74 -17.152  12.200  -3.886
  596   2HB   ALA  74          HB2       ALA  74 -16.945  10.883  -2.731
  597   3HB   ALA  74          HB3       ALA  74 -17.209  10.526  -4.437
  598    H    PHE  75           HN       PHE  75 -13.824  11.680  -1.899
  599    HA   PHE  75           HA       PHE  75 -12.674   8.990  -1.683
  600   1HB   PHE  75          HB2       PHE  75 -11.263  10.818  -1.136
  601   2HB   PHE  75          HB1       PHE  75 -12.512  11.599  -0.168
  602    HD1  PHE  75           HD1      PHE  75 -11.920  11.628   2.085
  603    HD2  PHE  75           HD2      PHE  75 -11.095   8.121  -0.253
  604    HE1  PHE  75           HE1      PHE  75 -11.072  10.477   4.111
  605    HE2  PHE  75           HE2      PHE  75 -10.247   6.969   1.773
  606    HZ   PHE  75           HZ       PHE  75 -10.236   8.148   3.956
  607    H    TRP  76           HN       TRP  76 -14.348   7.534  -1.127
  608    HA   TRP  76           HA       TRP  76 -16.456   8.010   0.725
  609   1HB   TRP  76          HB2       TRP  76 -15.287   5.864  -0.799
  610   2HB   TRP  76          HB1       TRP  76 -15.690   5.284   0.819
  611    HD1  TRP  76           HD1      TRP  76 -18.250   5.706   1.644
  612    HE1  TRP  76           HE1      TRP  76 -20.438   5.764   0.277
  613    HE3  TRP  76           HE3      TRP  76 -16.341   6.458  -3.019
  614    HZ2  TRP  76           HZ2      TRP  76 -21.264   6.092  -2.444
  615    HZ3  TRP  76           HZ3      TRP  76 -17.844   6.642  -4.984
  616    HH2  TRP  76           HH2      TRP  76 -20.302   6.463  -4.701
  617    H    LYS  77           HN       LYS  77 -16.578   6.684   2.878
  618    HA   LYS  77           HA       LYS  77 -14.248   7.470   4.524
  619   1HB   LYS  77          HB2       LYS  77 -17.007   6.364   5.136
  620   2HB   LYS  77          HB1       LYS  77 -15.852   6.888   6.361
  621   1HG   LYS  77          HG2       LYS  77 -16.819   8.680   4.119
  622   2HG   LYS  77          HG1       LYS  77 -17.564   8.640   5.718
  623   1HD   LYS  77          HD2       LYS  77 -15.427   9.259   6.754
  624   2HD   LYS  77          HD1       LYS  77 -14.643   9.249   5.173
  625   1HE   LYS  77          HE2       LYS  77 -15.166  11.549   5.602
  626   2HE   LYS  77          HE1       LYS  77 -16.429  10.996   4.483
  627   1HZ   LYS  77          HZ1       LYS  77 -16.855  10.551   7.341
  628   2HZ   LYS  77          HZ2       LYS  77 -17.983  10.897   6.120
  629   3HZ   LYS  77          HZ3       LYS  77 -17.027  12.139   6.774
  630    H    THR  78           HN       THR  78 -13.517   5.859   6.230
  631    HA   THR  78           HA       THR  78 -12.546   3.769   6.756
  632    HB   THR  78           HB       THR  78 -14.883   2.654   5.199
  633    HG1  THR  78           HG1      THR  78 -15.839   4.149   6.446
  634   1HG2  THR  78          HG21      THR  78 -14.299   0.734   6.206
  635   2HG2  THR  78          HG22      THR  78 -14.388   1.506   7.789
  636   3HG2  THR  78          HG23      THR  78 -12.882   1.548   6.870
  637    H    ASP  79           HN       ASP  79 -11.087   4.744   4.796
  638    HA   ASP  79           HA       ASP  79 -11.101   3.672   2.205
  639   1HB   ASP  79          HB2       ASP  79  -8.638   4.091   2.332
  640   2HB   ASP  79          HB1       ASP  79  -9.584   5.419   3.005
  641    H    ALA  80           HN       ALA  80  -9.913   1.847   1.289
  642    HA   ALA  80           HA       ALA  80 -10.384  -0.675   2.310
  643   1HB   ALA  80          HB1       ALA  80  -7.958   0.286   0.762
  644   2HB   ALA  80          HB2       ALA  80  -9.523  -0.132   0.063
  645   3HB   ALA  80          HB3       ALA  80  -8.535  -1.378   0.824
  646    H    SER  81           HN       SER  81  -7.548   1.366   3.017
  647    HA   SER  81           HA       SER  81  -5.983  -0.479   4.472
  648   1HB   SER  81          HB2       SER  81  -5.740   2.071   3.748
  649   2HB   SER  81          HB1       SER  81  -6.284   2.354   5.399
  650    HG   SER  81           HG       SER  81  -4.483   1.487   6.153
  651    H    ASP  82           HN       ASP  82  -9.064   0.864   5.292
  652    HA   ASP  82           HA       ASP  82  -8.738  -0.113   8.110
  653   1HB   ASP  82          HB2       ASP  82 -10.504   2.091   7.016
  654   2HB   ASP  82          HB1       ASP  82 -10.285   1.681   8.717
  655    H    VAL  83           HN       VAL  83  -9.710  -1.611   5.681
  656    HA   VAL  83           HA       VAL  83 -12.534  -2.105   6.575
  657    HB   VAL  83           HB       VAL  83 -11.392  -2.837   3.882
  658   1HG1  VAL  83          HG11      VAL  83 -14.167  -2.016   4.791
  659   2HG1  VAL  83          HG12      VAL  83 -13.628  -3.684   4.608
  660   3HG1  VAL  83          HG13      VAL  83 -13.726  -2.630   3.197
  661   1HG2  VAL  83          HG21      VAL  83 -10.867  -0.476   4.134
  662   2HG2  VAL  83          HG22      VAL  83 -12.480  -0.143   4.764
  663   3HG2  VAL  83          HG23      VAL  83 -12.272  -0.620   3.078
  664    H    LYS  84           HN       LYS  84 -13.203  -4.347   6.649
  665    HA   LYS  84           HA       LYS  84 -11.042  -6.183   7.416
  666   1HB   LYS  84          HB2       LYS  84 -14.069  -6.297   7.328
  667   2HB   LYS  84          HB1       LYS  84 -13.082  -7.648   7.886
  668   1HG   LYS  84          HG2       LYS  84 -12.752  -6.673   9.890
  669   2HG   LYS  84          HG1       LYS  84 -12.243  -5.163   9.135
  670   1HD   LYS  84          HD2       LYS  84 -14.985  -5.239   8.664
  671   2HD   LYS  84          HD1       LYS  84 -14.826  -5.868  10.303
  672   1HE   LYS  84          HE2       LYS  84 -13.894  -3.885  11.119
  673   2HE   LYS  84          HE1       LYS  84 -13.294  -3.396   9.521
  674   1HZ   LYS  84          HZ1       LYS  84 -15.191  -2.109   9.771
  675   2HZ   LYS  84          HZ2       LYS  84 -16.060  -3.342  10.552
  676   3HZ   LYS  84          HZ3       LYS  84 -15.768  -3.432   8.880
  677    HA   PRO  85           HA       PRO  85 -10.654  -8.117   3.441
  678   1HB   PRO  85          HB2       PRO  85 -10.067 -10.663   4.648
  679   2HB   PRO  85          HB1       PRO  85  -8.928  -9.496   3.958
  680   1HG   PRO  85          HG2       PRO  85  -9.325 -10.138   6.725
  681   2HG   PRO  85          HG1       PRO  85  -8.202  -8.964   6.034
  682   1HD   PRO  85          HD2       PRO  85 -10.623  -8.440   7.519
  683   2HD   PRO  85          HD1       PRO  85  -9.486  -7.257   6.828
  684    H    CYS  86           HN       CYS  86 -12.142  -9.195   2.117
  685    HA   CYS  86           HA       CYS  86 -14.740  -9.833   2.909
  686   1HB   CYS  86          HB2       CYS  86 -13.325  -9.817   0.594
  687   2HB   CYS  86          HB1       CYS  86 -13.499 -11.558   0.826
  Start of MODEL    4
    1   1H    THR   1          HT1       THR   1  22.578  -8.145  -9.383
    2   2H    THR   1          HT2       THR   1  23.660  -7.492  -8.247
    3   3H    THR   1          HT3       THR   1  24.017  -7.414  -9.906
    4    HA   THR   1           HA       THR   1  23.192  -5.274  -8.922
    5    HB   THR   1           HB       THR   1  21.595  -5.032 -10.904
    6    HG1  THR   1           HG1      THR   1  22.339  -7.738 -11.295
    7   1HG2  THR   1          HG21      THR   1  24.111  -6.495 -11.680
    8   2HG2  THR   1          HG22      THR   1  24.185  -4.906 -10.919
    9   3HG2  THR   1          HG23      THR   1  23.358  -5.106 -12.464
   10    H    LYS   2           HN       LYS   2  22.188  -5.725  -6.785
   11    HA   LYS   2           HA       LYS   2  19.220  -6.141  -6.990
   12   1HB   LYS   2          HB2       LYS   2  21.289  -6.986  -4.948
   13   2HB   LYS   2          HB1       LYS   2  19.560  -7.019  -4.600
   14   1HG   LYS   2          HG2       LYS   2  19.261  -8.433  -6.674
   15   2HG   LYS   2          HG1       LYS   2  21.019  -8.541  -6.774
   16   1HD   LYS   2          HD2       LYS   2  20.838  -9.305  -4.268
   17   2HD   LYS   2          HD1       LYS   2  19.170  -9.684  -4.700
   18   1HE   LYS   2          HE2       LYS   2  21.333 -10.629  -6.546
   19   2HE   LYS   2          HE1       LYS   2  21.085 -11.505  -5.023
   20   1HZ   LYS   2          HZ1       LYS   2  18.830 -10.737  -6.781
   21   2HZ   LYS   2          HZ2       LYS   2  18.839 -11.873  -5.518
   22   3HZ   LYS   2          HZ3       LYS   2  19.646 -12.211  -6.974
   23    H    ALA   3           HN       ALA   3  19.193  -3.715  -7.266
   24    HA   ALA   3           HA       ALA   3  20.022  -2.089  -4.950
   25   1HB   ALA   3          HB1       ALA   3  20.204  -1.440  -7.389
   26   2HB   ALA   3          HB2       ALA   3  19.358  -0.258  -6.391
   27   3HB   ALA   3          HB3       ALA   3  18.443  -1.348  -7.432
   28    H    SER   4           HN       SER   4  18.622  -1.329  -3.375
   29    HA   SER   4           HA       SER   4  16.099  -2.574  -2.911
   30   1HB   SER   4          HB2       SER   4  16.238  -0.028  -1.624
   31   2HB   SER   4          HB1       SER   4  16.582  -1.609  -0.931
   32    HG   SER   4           HG       SER   4  18.592  -1.032  -0.927
   33    H    CYS   5           HN       CYS   5  14.463  -0.291  -2.247
   34    HA   CYS   5           HA       CYS   5  13.764   0.708  -4.990
   35   1HB   CYS   5          HB2       CYS   5  11.968  -0.009  -2.655
   36   2HB   CYS   5          HB1       CYS   5  11.426   0.499  -4.254
   37    H    LYS   6           HN       LYS   6  11.763   2.498  -4.199
   38    HA   LYS   6           HA       LYS   6  12.954   4.312  -2.169
   39   1HB   LYS   6          HB2       LYS   6  13.702   4.504  -4.784
   40   2HB   LYS   6          HB1       LYS   6  12.296   5.571  -4.770
   41   1HG   LYS   6          HG2       LYS   6  13.569   6.314  -2.458
   42   2HG   LYS   6          HG1       LYS   6  14.934   5.927  -3.506
   43   1HD   LYS   6          HD2       LYS   6  14.378   7.568  -5.066
   44   2HD   LYS   6          HD1       LYS   6  12.683   7.596  -4.579
   45   1HE   LYS   6          HE2       LYS   6  13.093   8.964  -2.737
   46   2HE   LYS   6          HE1       LYS   6  14.780   8.428  -2.589
   47   1HZ   LYS   6          HZ1       LYS   6  15.367   9.585  -4.554
   48   2HZ   LYS   6          HZ2       LYS   6  14.483  10.685  -3.607
   49   3HZ   LYS   6          HZ3       LYS   6  13.749   9.921  -4.936
   50    H    LEU   7           HN       LEU   7  11.104   4.479  -0.918
   51    HA   LEU   7           HA       LEU   7   8.432   4.254  -1.511
   52   1HB   LEU   7          HB2       LEU   7   8.122   5.924   0.345
   53   2HB   LEU   7          HB1       LEU   7   9.325   4.682   0.713
   54    HG   LEU   7           HG       LEU   7  10.626   6.841  -0.655
   55   1HD1  LEU   7          HD11      LEU   7   9.988   8.747   0.444
   56   2HD1  LEU   7          HD12      LEU   7   9.580   7.880   1.924
   57   3HD1  LEU   7          HD13      LEU   7   8.452   7.889   0.568
   58   1HD2  LEU   7          HD21      LEU   7  11.202   5.034   1.301
   59   2HD2  LEU   7          HD22      LEU   7  10.987   6.494   2.267
   60   3HD2  LEU   7          HD23      LEU   7  12.186   6.460   0.974
   61    HA   PRO   8           HA       PRO   8   8.330   7.532  -4.694
   62   1HB   PRO   8          HB2       PRO   8   5.764   6.469  -5.448
   63   2HB   PRO   8          HB1       PRO   8   7.297   6.336  -6.319
   64   1HG   PRO   8          HG2       PRO   8   5.893   4.257  -4.966
   65   2HG   PRO   8          HG1       PRO   8   7.477   4.155  -5.739
   66   1HD   PRO   8          HD2       PRO   8   6.849   4.185  -2.894
   67   2HD   PRO   8          HD1       PRO   8   8.423   3.915  -3.680
   68    H    VAL   9           HN       VAL   9   6.047   6.603  -2.206
   69    HA   VAL   9           HA       VAL   9   4.628   9.227  -2.465
   70    HB   VAL   9           HB       VAL   9   3.789   7.027  -0.600
   71   1HG1  VAL   9          HG11      VAL   9   1.945   8.428  -2.464
   72   2HG1  VAL   9          HG12      VAL   9   2.711   9.421  -1.226
   73   3HG1  VAL   9          HG13      VAL   9   1.734   8.029  -0.760
   74   1HG2  VAL   9          HG21      VAL   9   4.041   6.787  -3.535
   75   2HG2  VAL   9          HG22      VAL   9   2.437   6.403  -2.911
   76   3HG2  VAL   9          HG23      VAL   9   3.846   5.524  -2.318
   77    H    LYS  10           HN       LYS  10   3.727   8.931   0.362
   78    HA   LYS  10           HA       LYS  10   6.274   9.487   1.827
   79   1HB   LYS  10          HB2       LYS  10   4.920  11.491   0.816
   80   2HB   LYS  10          HB1       LYS  10   3.816  11.190   2.158
   81   1HG   LYS  10          HG2       LYS  10   5.367  12.801   2.977
   82   2HG   LYS  10          HG1       LYS  10   5.881  11.265   3.674
   83   1HD   LYS  10          HD2       LYS  10   7.755  11.120   2.327
   84   2HD   LYS  10          HD1       LYS  10   7.020  12.058   1.025
   85   1HE   LYS  10          HE2       LYS  10   7.144  14.085   2.573
   86   2HE   LYS  10          HE1       LYS  10   8.170  13.097   3.630
   87   1HZ   LYS  10          HZ1       LYS  10   9.546  14.270   2.053
   88   2HZ   LYS  10          HZ2       LYS  10   8.639  13.664   0.750
   89   3HZ   LYS  10          HZ3       LYS  10   9.580  12.613   1.697
   90    H    LYS  11           HN       LYS  11   2.889   8.486   1.905
   91    HA   LYS  11           HA       LYS  11   3.372   7.248   4.572
   92   1HB   LYS  11          HB2       LYS  11   0.956   8.963   3.933
   93   2HB   LYS  11          HB1       LYS  11   1.427   8.322   5.506
   94   1HG   LYS  11          HG2       LYS  11   3.462   9.712   5.474
   95   2HG   LYS  11          HG1       LYS  11   3.008  10.346   3.892
   96   1HD   LYS  11          HD2       LYS  11   1.915  11.977   5.010
   97   2HD   LYS  11          HD1       LYS  11   0.725  10.743   5.423
   98   1HE   LYS  11          HE2       LYS  11   1.408  10.661   7.597
   99   2HE   LYS  11          HE1       LYS  11   3.123  10.713   7.147
  100   1HZ   LYS  11          HZ1       LYS  11   1.611  13.110   6.545
  101   2HZ   LYS  11          HZ2       LYS  11   3.169  12.945   7.202
  102   3HZ   LYS  11          HZ3       LYS  11   1.802  12.793   8.200
  103    H    ALA  12           HN       ALA  12   3.334   5.516   2.646
  104    HA   ALA  12           HA       ALA  12   0.591   4.778   1.816
  105   1HB   ALA  12          HB1       ALA  12   1.714   3.790   0.111
  106   2HB   ALA  12          HB2       ALA  12   2.793   2.941   1.217
  107   3HB   ALA  12          HB3       ALA  12   3.148   4.601   0.740
  108    H    THR  13           HN       THR  13  -0.515   2.981   2.616
  109    HA   THR  13           HA       THR  13   0.696   1.611   4.990
  110    HB   THR  13           HB       THR  13  -2.198   1.419   4.256
  111    HG1  THR  13           HG1      THR  13  -2.346   3.536   5.414
  112   1HG2  THR  13          HG21      THR  13  -0.913   2.122   6.895
  113   2HG2  THR  13          HG22      THR  13  -1.034   0.455   6.335
  114   3HG2  THR  13          HG23      THR  13  -2.497   1.401   6.609
  115    H    VAL  14           HN       VAL  14   1.799  -0.125   3.998
  116    HA   VAL  14           HA       VAL  14   0.215  -1.860   2.143
  117    HB   VAL  14           HB       VAL  14   2.396  -2.618   1.389
  118   1HG1  VAL  14          HG11      VAL  14   3.236  -0.586   0.469
  119   2HG1  VAL  14          HG12      VAL  14   2.665   0.358   1.845
  120   3HG1  VAL  14          HG13      VAL  14   1.508  -0.316   0.697
  121   1HG2  VAL  14          HG21      VAL  14   3.242  -1.349   3.954
  122   2HG2  VAL  14          HG22      VAL  14   4.373  -1.271   2.604
  123   3HG2  VAL  14          HG23      VAL  14   3.813  -2.835   3.197
  124    H    VAL  15           HN       VAL  15   1.318  -4.274   2.417
  125    HA   VAL  15           HA       VAL  15   1.208  -4.938   5.341
  126    HB   VAL  15           HB       VAL  15  -0.107  -6.359   3.001
  127   1HG1  VAL  15          HG11      VAL  15  -0.573  -6.909   5.927
  128   2HG1  VAL  15          HG12      VAL  15   0.746  -7.701   5.065
  129   3HG1  VAL  15          HG13      VAL  15  -0.920  -7.944   4.541
  130   1HG2  VAL  15          HG21      VAL  15  -1.936  -5.506   5.023
  131   2HG2  VAL  15          HG22      VAL  15  -1.842  -4.964   3.346
  132   3HG2  VAL  15          HG23      VAL  15  -0.924  -4.125   4.598
  133    H    TYR  16           HN       TYR  16   3.536  -5.192   5.339
  134    HA   TYR  16           HA       TYR  16   4.702  -7.195   3.486
  135   1HB   TYR  16          HB2       TYR  16   5.763  -4.973   3.999
  136   2HB   TYR  16          HB1       TYR  16   5.956  -5.500   5.670
  137    HD1  TYR  16           HD1      TYR  16   6.284  -7.693   2.689
  138    HD2  TYR  16           HD2      TYR  16   8.352  -5.540   5.778
  139    HE1  TYR  16           HE1      TYR  16   8.389  -8.850   2.085
  140    HE2  TYR  16           HE2      TYR  16  10.459  -6.700   5.172
  141    HH   TYR  16           HH       TYR  16  11.292  -8.521   4.031
  142    H    GLN  17           HN       GLN  17   5.606  -9.166   4.251
  143    HA   GLN  17           HA       GLN  17   5.645 -11.075   5.648
  144   1HB   GLN  17          HB2       GLN  17   6.290  -8.693   7.384
  145   2HB   GLN  17          HB1       GLN  17   6.312 -10.330   8.047
  146   1HG   GLN  17          HG2       GLN  17   7.755  -9.854   5.475
  147   2HG   GLN  17          HG1       GLN  17   8.494  -9.244   6.958
  148   1HE2  GLN  17          HE21      GLN  17   9.326 -11.585   5.214
  149   2HE2  GLN  17          HE22      GLN  17   9.375 -12.916   6.265
  150    H    GLY  18           HN       GLY  18   3.000  -9.835   5.191
  151   1HA   GLY  18          HA2       GLY  18   0.813 -10.090   6.001
  152   2HA   GLY  18          HA1       GLY  18   1.471 -11.267   7.140
  153    H    GLU  19           HN       GLU  19   2.534  -7.910   6.944
  154    HA   GLU  19           HA       GLU  19   1.125  -7.343   9.525
  155   1HB   GLU  19          HB2       GLU  19   4.033  -7.347   8.818
  156   2HB   GLU  19          HB1       GLU  19   3.463  -6.128   9.959
  157   1HG   GLU  19          HG2       GLU  19   2.415  -8.821  10.499
  158   2HG   GLU  19          HG1       GLU  19   4.170  -8.707  10.630
  159    H    ARG  20           HN       ARG  20   0.289  -5.263   9.618
  160    HA   ARG  20           HA       ARG  20   0.386  -3.603   7.207
  161   1HB   ARG  20          HB2       ARG  20  -0.835  -3.212   9.958
  162   2HB   ARG  20          HB1       ARG  20  -1.195  -2.226   8.537
  163   1HG   ARG  20          HG2       ARG  20  -2.592  -3.787   7.682
  164   2HG   ARG  20          HG1       ARG  20  -1.464  -5.099   8.024
  165   1HD   ARG  20          HD2       ARG  20  -2.272  -4.450  10.558
  166   2HD   ARG  20          HD1       ARG  20  -3.749  -4.131   9.630
  167    HE   ARG  20           HE       ARG  20  -2.267  -6.732   9.536
  168   1HH1  ARG  20          HH21      ARG  20  -4.927  -6.123  11.044
  169   2HH1  ARG  20          HH22      ARG  20  -6.058  -6.863   9.961
  170   1HH2  ARG  20          HH11      ARG  20  -3.798  -7.118   7.346
  171   2HH2  ARG  20          HH12      ARG  20  -5.419  -7.426   7.870
  172    H    VAL  21           HN       VAL  21   1.695  -1.805   6.914
  173    HA   VAL  21           HA       VAL  21   2.873  -0.399   9.216
  174    HB   VAL  21           HB       VAL  21   5.213  -0.903   8.231
  175   1HG1  VAL  21          HG11      VAL  21   3.997  -1.927  10.322
  176   2HG1  VAL  21          HG12      VAL  21   5.473  -2.683   9.720
  177   3HG1  VAL  21          HG13      VAL  21   3.901  -3.376   9.321
  178   1HG2  VAL  21          HG21      VAL  21   5.422  -2.422   6.557
  179   2HG2  VAL  21          HG22      VAL  21   3.704  -2.147   6.275
  180   3HG2  VAL  21          HG23      VAL  21   4.228  -3.502   7.276
  181    H    LYS  22           HN       LYS  22   3.743   1.644   8.588
  182    HA   LYS  22           HA       LYS  22   2.858   2.601   5.937
  183   1HB   LYS  22          HB2       LYS  22   3.899   3.789   8.506
  184   2HB   LYS  22          HB1       LYS  22   3.785   4.779   7.050
  185   1HG   LYS  22          HG2       LYS  22   1.418   3.133   7.875
  186   2HG   LYS  22          HG1       LYS  22   1.743   4.648   8.718
  187   1HD   LYS  22          HD2       LYS  22   1.955   5.675   6.342
  188   2HD   LYS  22          HD1       LYS  22   1.124   4.217   5.799
  189   1HE   LYS  22          HE2       LYS  22  -0.657   5.724   6.205
  190   2HE   LYS  22          HE1       LYS  22  -0.585   4.793   7.714
  191   1HZ   LYS  22          HZ1       LYS  22   0.292   6.513   8.846
  192   2HZ   LYS  22          HZ2       LYS  22  -0.396   7.461   7.615
  193   3HZ   LYS  22          HZ3       LYS  22   1.246   7.034   7.544
  194    H    ILE  23           HN       ILE  23   4.263   2.953   4.242
  195    HA   ILE  23           HA       ILE  23   6.980   2.009   4.338
  196    HB   ILE  23           HB       ILE  23   5.291   2.218   2.397
  197   1HG1  ILE  23          HG12      ILE  23   8.188   3.067   2.148
  198   2HG1  ILE  23          HG11      ILE  23   7.527   1.443   1.961
  199   1HG2  ILE  23          HG21      ILE  23   6.492   4.810   1.676
  200   2HG2  ILE  23          HG22      ILE  23   5.382   4.887   3.046
  201   3HG2  ILE  23          HG23      ILE  23   4.828   4.252   1.496
  202   1HD1  ILE  23          HD11      ILE  23   7.243   3.808   0.113
  203   2HD1  ILE  23          HD12      ILE  23   6.101   2.465   0.053
  204   3HD1  ILE  23          HD13      ILE  23   7.813   2.182  -0.262
  205    H    GLN  24           HN       GLN  24   5.572   4.967   5.318
  206    HA   GLN  24           HA       GLN  24   7.700   6.801   4.697
  207   1HB   GLN  24          HB2       GLN  24   6.466   8.270   6.103
  208   2HB   GLN  24          HB1       GLN  24   5.250   7.184   5.424
  209   1HG   GLN  24          HG2       GLN  24   5.297   5.814   7.452
  210   2HG   GLN  24          HG1       GLN  24   6.575   6.824   8.129
  211   1HE2  GLN  24          HE21      GLN  24   3.253   7.206   6.758
  212   2HE2  GLN  24          HE22      GLN  24   2.785   8.417   7.851
  213    H    GLU  25           HN       GLU  25   7.231   4.456   7.279
  214    HA   GLU  25           HA       GLU  25   9.765   5.422   8.563
  215   1HB   GLU  25          HB2       GLU  25   7.222   4.164   9.580
  216   2HB   GLU  25          HB1       GLU  25   8.700   4.098  10.539
  217   1HG   GLU  25          HG2       GLU  25   8.368   6.770   9.548
  218   2HG   GLU  25          HG1       GLU  25   6.867   6.261  10.322
  219    H    LYS  26           HN       LYS  26   7.846   2.434   8.044
  220    HA   LYS  26           HA       LYS  26   9.854   0.545   8.654
  221   1HB   LYS  26          HB2       LYS  26   7.471   0.059   8.292
  222   2HB   LYS  26          HB1       LYS  26   7.639   0.474   6.583
  223   1HG   LYS  26          HG2       LYS  26   8.114  -1.707   6.235
  224   2HG   LYS  26          HG1       LYS  26   9.667  -1.382   7.008
  225   1HD   LYS  26          HD2       LYS  26   8.585  -1.863   9.229
  226   2HD   LYS  26          HD1       LYS  26   7.138  -2.367   8.356
  227   1HE   LYS  26          HE2       LYS  26   8.530  -4.335   8.884
  228   2HE   LYS  26          HE1       LYS  26   8.521  -4.065   7.129
  229   1HZ   LYS  26          HZ1       LYS  26  10.541  -2.809   8.889
  230   2HZ   LYS  26          HZ2       LYS  26  10.593  -3.015   7.204
  231   3HZ   LYS  26          HZ3       LYS  26  10.783  -4.354   8.232
  232    H    PHE  27           HN       PHE  27   9.497   2.593   5.846
  233    HA   PHE  27           HA       PHE  27  11.946   1.324   4.672
  234   1HB   PHE  27          HB2       PHE  27   9.330   2.127   3.370
  235   2HB   PHE  27          HB1       PHE  27  10.798   1.815   2.438
  236    HD1  PHE  27           HD1      PHE  27   7.855   0.335   3.476
  237    HD2  PHE  27           HD2      PHE  27  12.078  -0.443   3.370
  238    HE1  PHE  27           HE1      PHE  27   7.408  -2.102   3.584
  239    HE2  PHE  27           HE2      PHE  27  11.631  -2.881   3.478
  240    HZ   PHE  27           HZ       PHE  27   9.296  -3.710   3.585
  241    H    LYS  28           HN       LYS  28  11.791   3.674   6.351
  242    HA   LYS  28           HA       LYS  28  11.569   6.188   5.270
  243   1HB   LYS  28          HB2       LYS  28  12.584   5.185   7.509
  244   2HB   LYS  28          HB1       LYS  28  14.115   5.469   6.681
  245   1HG   LYS  28          HG2       LYS  28  13.815   7.519   7.732
  246   2HG   LYS  28          HG1       LYS  28  13.042   7.833   6.178
  247   1HD   LYS  28          HD2       LYS  28  10.979   7.999   7.105
  248   2HD   LYS  28          HD1       LYS  28  11.246   6.606   8.155
  249   1HE   LYS  28          HE2       LYS  28  12.824   8.193   9.496
  250   2HE   LYS  28          HE1       LYS  28  11.965   9.495   8.647
  251   1HZ   LYS  28          HZ1       LYS  28  10.014   8.998   9.648
  252   2HZ   LYS  28          HZ2       LYS  28  11.029   8.387  10.865
  253   3HZ   LYS  28          HZ3       LYS  28  10.334   7.335   9.725
  254    H    ASN  29           HN       ASN  29  14.083   3.815   4.471
  255    HA   ASN  29           HA       ASN  29  15.219   5.777   2.506
  256   1HB   ASN  29          HB2       ASN  29  16.330   3.550   4.193
  257   2HB   ASN  29          HB1       ASN  29  17.172   4.022   2.712
  258   1HD2  ASN  29          HD21      ASN  29  16.789   4.804   6.021
  259   2HD2  ASN  29          HD22      ASN  29  17.532   6.330   5.987
  260    H    GLY  30           HN       GLY  30  12.870   4.250   1.849
  261   1HA   GLY  30          HA2       GLY  30  12.229   3.207  -0.196
  262   2HA   GLY  30          HA1       GLY  30  13.920   2.810  -0.494
  263    H    MET  31           HN       MET  31  12.568   0.729  -1.059
  264    HA   MET  31           HA       MET  31  12.255  -0.960   1.396
  265   1HB   MET  31          HB2       MET  31  11.157  -1.158  -1.428
  266   2HB   MET  31          HB1       MET  31  10.859  -2.352  -0.165
  267   1HG   MET  31          HG2       MET  31  10.237   0.034   1.090
  268   2HG   MET  31          HG1       MET  31   9.650   0.291  -0.553
  269   1HE   MET  31          HE1       MET  31   7.685  -0.294  -1.376
  270   2HE   MET  31          HE2       MET  31   7.040   0.361   0.126
  271   3HE   MET  31          HE3       MET  31   6.374  -1.131  -0.534
  272    H    LEU  32           HN       LEU  32  12.653  -3.433   0.623
  273    HA   LEU  32           HA       LEU  32  15.476  -3.519  -0.251
  274   1HB   LEU  32          HB2       LEU  32  13.467  -5.397   0.981
  275   2HB   LEU  32          HB1       LEU  32  14.989  -6.020   0.335
  276    HG   LEU  32           HG       LEU  32  15.271  -3.629   2.043
  277   1HD1  LEU  32          HD11      LEU  32  14.528  -4.484   4.038
  278   2HD1  LEU  32          HD12      LEU  32  14.872  -6.149   3.571
  279   3HD1  LEU  32          HD13      LEU  32  13.412  -5.352   2.984
  280   1HD2  LEU  32          HD21      LEU  32  17.209  -4.824   2.811
  281   2HD2  LEU  32          HD22      LEU  32  17.103  -5.110   1.073
  282   3HD2  LEU  32          HD23      LEU  32  16.579  -6.356   2.206
  283    H    HIS  33           HN       HIS  33  16.148  -5.030  -1.967
  284    HA   HIS  33           HA       HIS  33  14.510  -4.860  -4.345
  285   1HB   HIS  33          HB2       HIS  33  16.862  -4.848  -4.605
  286   2HB   HIS  33          HB1       HIS  33  17.073  -6.225  -3.521
  287    HD1  HIS  33           HD1      HIS  33  14.863  -5.813  -6.612
  288    HD2  HIS  33           HD2      HIS  33  17.878  -8.298  -5.157
  289    HE1  HIS  33           HE1      HIS  33  15.172  -7.646  -8.331
  290    H    GLY  34           HN       GLY  34  13.058  -6.356  -5.143
  291   1HA   GLY  34          HA2       GLY  34  11.925  -8.413  -5.390
  292   2HA   GLY  34          HA1       GLY  34  13.155  -9.164  -4.373
  293    H    ASP  35           HN       ASP  35  12.157  -6.512  -2.693
  294    HA   ASP  35           HA       ASP  35  10.858  -7.956  -0.619
  295   1HB   ASP  35          HB2       ASP  35  11.951  -5.690  -0.529
  296   2HB   ASP  35          HB1       ASP  35  10.549  -5.031  -1.374
  297    H    LYS  36           HN       LYS  36   8.783  -8.733  -0.478
  298    HA   LYS  36           HA       LYS  36   6.831  -7.951  -2.590
  299   1HB   LYS  36          HB2       LYS  36   7.321 -10.270  -0.765
  300   2HB   LYS  36          HB1       LYS  36   5.672  -9.995  -1.327
  301   1HG   LYS  36          HG2       LYS  36   7.482  -9.697  -3.542
  302   2HG   LYS  36          HG1       LYS  36   7.793 -11.237  -2.742
  303   1HD   LYS  36          HD2       LYS  36   5.082 -10.253  -3.680
  304   2HD   LYS  36          HD1       LYS  36   6.056 -11.492  -4.471
  305   1HE   LYS  36          HE2       LYS  36   5.464 -11.882  -1.567
  306   2HE   LYS  36          HE1       LYS  36   4.145 -12.159  -2.720
  307   1HZ   LYS  36          HZ1       LYS  36   5.624 -13.560  -4.023
  308   2HZ   LYS  36          HZ2       LYS  36   5.481 -14.160  -2.440
  309   3HZ   LYS  36          HZ3       LYS  36   6.878 -13.313  -2.907
  310    H    VAL  37           HN       VAL  37   5.184  -6.583  -2.065
  311    HA   VAL  37           HA       VAL  37   4.238  -6.468   0.767
  312    HB   VAL  37           HB       VAL  37   6.008  -4.714   0.107
  313   1HG1  VAL  37          HG11      VAL  37   5.209  -4.197  -2.128
  314   2HG1  VAL  37          HG12      VAL  37   5.040  -2.754  -1.129
  315   3HG1  VAL  37          HG13      VAL  37   3.626  -3.742  -1.500
  316   1HG2  VAL  37          HG21      VAL  37   4.940  -4.101   2.051
  317   2HG2  VAL  37          HG22      VAL  37   3.333  -4.264   1.343
  318   3HG2  VAL  37          HG23      VAL  37   4.306  -2.834   1.001
  319    H    SER  38           HN       SER  38   1.997  -6.162   0.909
  320    HA   SER  38           HA       SER  38   0.532  -6.035  -1.695
  321   1HB   SER  38          HB2       SER  38  -0.775  -6.734   0.892
  322   2HB   SER  38          HB1       SER  38  -0.993  -7.450  -0.705
  323    HG   SER  38           HG       SER  38   0.376  -8.464   1.203
  324    H    PHE  39           HN       PHE  39  -1.210  -4.566  -1.945
  325    HA   PHE  39           HA       PHE  39  -1.197  -2.252  -0.047
  326   1HB   PHE  39          HB2       PHE  39  -1.847  -2.682  -2.961
  327   2HB   PHE  39          HB1       PHE  39  -2.424  -1.239  -2.121
  328    HD1  PHE  39           HD1      PHE  39   0.718  -3.251  -2.536
  329    HD2  PHE  39           HD2      PHE  39  -1.046   0.637  -2.079
  330    HE1  PHE  39           HE1      PHE  39   2.952  -2.209  -2.795
  331    HE2  PHE  39           HE2      PHE  39   1.189   1.682  -2.338
  332    HZ   PHE  39           HZ       PHE  39   3.188   0.258  -2.697
  333    H    PHE  40           HN       PHE  40  -3.224  -1.499   0.800
  334    HA   PHE  40           HA       PHE  40  -5.296  -3.564   1.011
  335   1HB   PHE  40          HB2       PHE  40  -4.650  -0.898   2.201
  336   2HB   PHE  40          HB1       PHE  40  -6.319  -1.469   2.322
  337    HD1  PHE  40           HD1      PHE  40  -3.226  -1.476   3.945
  338    HD2  PHE  40           HD2      PHE  40  -6.476  -4.099   2.944
  339    HE1  PHE  40           HE1      PHE  40  -2.578  -2.987   5.803
  340    HE2  PHE  40           HE2      PHE  40  -5.830  -5.610   4.802
  341    HZ   PHE  40           HZ       PHE  40  -3.881  -5.054   6.231
  342    H    CYS  41           HN       CYS  41  -7.163  -3.642  -0.161
  343    HA   CYS  41           HA       CYS  41  -8.067  -1.191  -1.614
  344   1HB   CYS  41          HB2       CYS  41  -6.677  -3.218  -2.809
  345   2HB   CYS  41          HB1       CYS  41  -8.335  -3.795  -3.005
  346    H    LYS  42           HN       LYS  42 -10.389  -1.660  -2.507
  347    HA   LYS  42           HA       LYS  42 -11.871  -3.326  -0.500
  348   1HB   LYS  42          HB2       LYS  42 -13.651  -1.597  -0.745
  349   2HB   LYS  42          HB1       LYS  42 -12.130  -0.915  -0.164
  350   1HG   LYS  42          HG2       LYS  42 -11.568  -0.218  -2.469
  351   2HG   LYS  42          HG1       LYS  42 -13.100  -0.880  -3.037
  352   1HD   LYS  42          HD2       LYS  42 -13.962   1.171  -2.629
  353   2HD   LYS  42          HD1       LYS  42 -13.867   0.738  -0.922
  354   1HE   LYS  42          HE2       LYS  42 -11.840   1.904  -0.608
  355   2HE   LYS  42          HE1       LYS  42 -11.473   1.911  -2.344
  356   1HZ   LYS  42          HZ1       LYS  42 -12.500   3.869  -2.447
  357   2HZ   LYS  42          HZ2       LYS  42 -13.047   3.751  -0.844
  358   3HZ   LYS  42          HZ3       LYS  42 -13.960   3.075  -2.107
  359    H    ASN  43           HN       ASN  43 -13.706  -4.463  -1.290
  360    HA   ASN  43           HA       ASN  43 -13.765  -4.799  -4.270
  361   1HB   ASN  43          HB2       ASN  43 -13.111  -6.649  -2.518
  362   2HB   ASN  43          HB1       ASN  43 -14.856  -6.758  -2.263
  363   1HD2  ASN  43          HD21      ASN  43 -12.261  -7.385  -4.569
  364   2HD2  ASN  43          HD22      ASN  43 -13.222  -8.205  -5.705
  365    H    LYS  44           HN       LYS  44 -15.405  -3.326  -4.839
  366    HA   LYS  44           HA       LYS  44 -17.764  -2.731  -3.391
  367   1HB   LYS  44          HB2       LYS  44 -16.540  -2.070  -5.806
  368   2HB   LYS  44          HB1       LYS  44 -18.075  -2.785  -6.300
  369   1HG   LYS  44          HG2       LYS  44 -18.877  -0.681  -5.919
  370   2HG   LYS  44          HG1       LYS  44 -18.911  -1.221  -4.239
  371   1HD   LYS  44          HD2       LYS  44 -16.661  -0.287  -3.881
  372   2HD   LYS  44          HD1       LYS  44 -16.604   0.235  -5.565
  373   1HE   LYS  44          HE2       LYS  44 -18.055   1.994  -5.208
  374   2HE   LYS  44          HE1       LYS  44 -18.959   1.124  -3.952
  375   1HZ   LYS  44          HZ1       LYS  44 -17.452   1.652  -2.356
  376   2HZ   LYS  44          HZ2       LYS  44 -17.214   3.006  -3.355
  377   3HZ   LYS  44          HZ3       LYS  44 -16.142   1.690  -3.432
  378    H    GLU  45           HN       GLU  45 -17.029  -5.429  -5.562
  379    HA   GLU  45           HA       GLU  45 -19.729  -6.369  -5.905
  380   1HB   GLU  45          HB2       GLU  45 -17.730  -6.933  -7.299
  381   2HB   GLU  45          HB1       GLU  45 -17.094  -7.873  -5.948
  382   1HG   GLU  45          HG2       GLU  45 -18.240  -9.621  -6.816
  383   2HG   GLU  45          HG1       GLU  45 -19.689  -8.820  -6.208
  384    H    LYS  46           HN       LYS  46 -17.099  -7.680  -3.835
  385    HA   LYS  46           HA       LYS  46 -19.041  -9.242  -2.271
  386   1HB   LYS  46          HB2       LYS  46 -16.063  -8.775  -1.934
  387   2HB   LYS  46          HB1       LYS  46 -17.004 -10.072  -1.189
  388   1HG   LYS  46          HG2       LYS  46 -17.144 -11.275  -3.135
  389   2HG   LYS  46          HG1       LYS  46 -17.201  -9.830  -4.147
  390   1HD   LYS  46          HD2       LYS  46 -14.986  -9.945  -4.527
  391   2HD   LYS  46          HD1       LYS  46 -14.652  -9.987  -2.796
  392   1HE   LYS  46          HE2       LYS  46 -14.003 -12.145  -3.072
  393   2HE   LYS  46          HE1       LYS  46 -15.698 -12.538  -3.424
  394   1HZ   LYS  46          HZ1       LYS  46 -13.515 -11.904  -5.294
  395   2HZ   LYS  46          HZ2       LYS  46 -15.112 -11.522  -5.727
  396   3HZ   LYS  46          HZ3       LYS  46 -14.682 -13.131  -5.387
  397    H    LYS  47           HN       LYS  47 -17.882  -6.064  -2.190
  398    HA   LYS  47           HA       LYS  47 -18.148  -4.348  -0.592
  399   1HB   LYS  47          HB2       LYS  47 -19.696  -6.446   0.942
  400   2HB   LYS  47          HB1       LYS  47 -19.915  -4.695   0.992
  401   1HG   LYS  47          HG2       LYS  47 -20.132  -5.629  -1.733
  402   2HG   LYS  47          HG1       LYS  47 -21.242  -6.529  -0.698
  403   1HD   LYS  47          HD2       LYS  47 -21.989  -4.298   0.256
  404   2HD   LYS  47          HD1       LYS  47 -21.059  -3.525  -1.029
  405   1HE   LYS  47          HE2       LYS  47 -22.469  -5.325  -2.499
  406   2HE   LYS  47          HE1       LYS  47 -23.629  -5.001  -1.195
  407   1HZ   LYS  47          HZ1       LYS  47 -22.207  -2.954  -2.816
  408   2HZ   LYS  47          HZ2       LYS  47 -23.259  -2.622  -1.523
  409   3HZ   LYS  47          HZ3       LYS  47 -23.852  -3.349  -2.941
  410    H    CYS  48           HN       CYS  48 -15.896  -6.323  -0.397
  411    HA   CYS  48           HA       CYS  48 -15.259  -5.861   2.492
  412   1HB   CYS  48          HB2       CYS  48 -13.927  -8.220   1.579
  413   2HB   CYS  48          HB1       CYS  48 -15.135  -8.076   2.850
  414    H    SER  49           HN       SER  49 -12.787  -6.145   2.814
  415    HA   SER  49           HA       SER  49 -11.417  -4.813   0.515
  416   1HB   SER  49          HB2       SER  49 -10.517  -3.477   2.109
  417   2HB   SER  49          HB1       SER  49 -11.672  -4.203   3.219
  418    HG   SER  49           HG       SER  49  -9.029  -4.396   3.229
  419    H    TYR  50           HN       TYR  50  -9.054  -5.364   0.345
  420    HA   TYR  50           HA       TYR  50  -8.171  -7.975   1.360
  421   1HB   TYR  50          HB2       TYR  50  -7.906  -8.810  -1.050
  422   2HB   TYR  50          HB1       TYR  50  -9.563  -8.732  -0.443
  423    HD1  TYR  50           HD1      TYR  50  -7.095  -7.220  -2.716
  424    HD2  TYR  50           HD2      TYR  50 -11.116  -7.007  -1.216
  425    HE1  TYR  50           HE1      TYR  50  -7.705  -5.688  -4.569
  426    HE2  TYR  50           HE2      TYR  50 -11.724  -5.474  -3.069
  427    HH   TYR  50           HH       TYR  50  -9.998  -5.108  -5.795
  428    H    THR  51           HN       THR  51  -5.955  -8.473   0.039
  429    HA   THR  51           HA       THR  51  -4.519  -5.845  -0.103
  430    HB   THR  51           HB       THR  51  -2.544  -7.277   0.569
  431    HG1  THR  51           HG1      THR  51  -3.431  -9.311   1.599
  432   1HG2  THR  51          HG21      THR  51  -4.990  -6.825   2.225
  433   2HG2  THR  51          HG22      THR  51  -3.377  -6.132   2.393
  434   3HG2  THR  51          HG23      THR  51  -3.685  -7.786   2.921
  435    H    GLU  52           HN       GLU  52  -3.116  -5.486  -1.814
  436    HA   GLU  52           HA       GLU  52  -3.243  -7.451  -4.076
  437   1HB   GLU  52          HB2       GLU  52  -3.242  -4.485  -3.772
  438   2HB   GLU  52          HB1       GLU  52  -2.391  -5.130  -5.177
  439   1HG   GLU  52          HG2       GLU  52  -4.781  -6.594  -5.053
  440   2HG   GLU  52          HG1       GLU  52  -5.249  -4.929  -4.704
  441    H    ASP  53           HN       ASP  53  -1.432  -8.709  -3.359
  442    HA   ASP  53           HA       ASP  53   1.015  -7.929  -2.342
  443   1HB   ASP  53          HB2       ASP  53   0.552  -9.958  -4.543
  444   2HB   ASP  53          HB1       ASP  53   1.858  -9.973  -3.352
  445    H    ALA  54           HN       ALA  54   2.939  -7.137  -3.147
  446    HA   ALA  54           HA       ALA  54   3.063  -6.333  -6.030
  447   1HB   ALA  54          HB1       ALA  54   3.985  -4.610  -3.716
  448   2HB   ALA  54          HB2       ALA  54   2.343  -4.511  -4.351
  449   3HB   ALA  54          HB3       ALA  54   3.714  -4.123  -5.389
  450    H    GLN  55           HN       GLN  55   5.515  -5.539  -6.405
  451    HA   GLN  55           HA       GLN  55   7.366  -7.216  -4.763
  452   1HB   GLN  55          HB2       GLN  55   6.434  -8.331  -6.889
  453   2HB   GLN  55          HB1       GLN  55   7.410  -7.164  -7.785
  454   1HG   GLN  55          HG2       GLN  55   9.437  -7.954  -6.665
  455   2HG   GLN  55          HG1       GLN  55   8.485  -9.071  -5.685
  456   1HE2  GLN  55          HE21      GLN  55   7.955 -11.097  -6.607
  457   2HE2  GLN  55          HE22      GLN  55   8.330 -11.534  -8.204
  458    H    CYS  56           HN       CYS  56   9.478  -6.392  -4.642
  459    HA   CYS  56           HA       CYS  56   9.840  -3.618  -5.664
  460   1HB   CYS  56          HB2       CYS  56  10.303  -4.993  -3.245
  461   2HB   CYS  56          HB1       CYS  56  11.900  -4.672  -3.916
  462    H    ILE  57           HN       ILE  57  11.660  -3.108  -6.971
  463    HA   ILE  57           HA       ILE  57  13.339  -5.422  -7.876
  464    HB   ILE  57           HB       ILE  57  12.229  -3.225  -9.638
  465   1HG1  ILE  57          HG12      ILE  57  10.416  -4.584  -8.531
  466   2HG1  ILE  57          HG11      ILE  57  10.455  -4.743 -10.287
  467   1HG2  ILE  57          HG21      ILE  57  13.600  -5.877 -10.092
  468   2HG2  ILE  57          HG22      ILE  57  14.061  -4.287 -10.700
  469   3HG2  ILE  57          HG23      ILE  57  12.645  -5.105 -11.358
  470   1HD1  ILE  57          HD11      ILE  57  11.889  -6.673  -8.451
  471   2HD1  ILE  57          HD12      ILE  57  11.532  -6.873 -10.167
  472   3HD1  ILE  57          HD13      ILE  57  10.225  -6.926  -8.982
  473    H    ASP  58           HN       ASP  58  15.235  -4.481  -9.262
  474    HA   ASP  58           HA       ASP  58  17.044  -3.044  -7.745
  475   1HB   ASP  58          HB2       ASP  58  17.082  -4.234 -10.113
  476   2HB   ASP  58          HB1       ASP  58  16.912  -2.578 -10.703
  477    H    GLY  59           HN       GLY  59  16.250  -1.190  -6.682
  478   1HA   GLY  59          HA2       GLY  59  15.516   1.026  -6.427
  479   2HA   GLY  59          HA1       GLY  59  16.490   1.318  -7.865
  480    H    THR  60           HN       THR  60  13.835  -0.890  -8.220
  481    HA   THR  60           HA       THR  60  12.109   1.300  -9.295
  482    HB   THR  60           HB       THR  60  12.809  -1.255 -10.757
  483    HG1  THR  60           HG1      THR  60  13.763   0.680 -12.098
  484   1HG2  THR  60          HG21      THR  60  11.490   1.272 -11.767
  485   2HG2  THR  60          HG22      THR  60  10.591  -0.146 -11.227
  486   3HG2  THR  60          HG23      THR  60  11.662  -0.260 -12.624
  487    H    ILE  61           HN       ILE  61   9.939   0.921  -8.905
  488    HA   ILE  61           HA       ILE  61   9.065  -1.838  -8.198
  489    HB   ILE  61           HB       ILE  61   9.668  -0.895  -6.084
  490   1HG1  ILE  61          HG12      ILE  61   6.864  -0.091  -5.830
  491   2HG1  ILE  61          HG11      ILE  61   7.060  -1.615  -6.697
  492   1HG2  ILE  61          HG21      ILE  61   9.070   1.561  -7.380
  493   2HG2  ILE  61          HG22      ILE  61   9.768   1.332  -5.778
  494   3HG2  ILE  61          HG23      ILE  61   8.020   1.458  -5.968
  495   1HD1  ILE  61          HD11      ILE  61   6.905  -1.652  -4.082
  496   2HD1  ILE  61          HD12      ILE  61   8.590  -1.138  -4.155
  497   3HD1  ILE  61          HD13      ILE  61   8.102  -2.667  -4.888
  498    H    GLU  62           HN       GLU  62   6.887  -2.203  -8.698
  499    HA   GLU  62           HA       GLU  62   5.503   0.040 -10.121
  500   1HB   GLU  62          HB2       GLU  62   6.255  -2.266 -11.157
  501   2HB   GLU  62          HB1       GLU  62   4.802  -2.874 -10.362
  502   1HG   GLU  62          HG2       GLU  62   4.948  -0.618 -12.382
  503   2HG   GLU  62          HG1       GLU  62   4.219  -2.206 -12.626
  504    H    VAL  63           HN       VAL  63   4.392   0.932  -8.300
  505    HA   VAL  63           HA       VAL  63   3.000  -0.557  -6.308
  506    HB   VAL  63           HB       VAL  63   2.675   2.208  -7.494
  507   1HG1  VAL  63          HG11      VAL  63   0.820   2.523  -6.262
  508   2HG1  VAL  63          HG12      VAL  63   1.667   1.988  -4.810
  509   3HG1  VAL  63          HG13      VAL  63   0.842   0.813  -5.834
  510   1HG2  VAL  63          HG21      VAL  63   4.642   2.392  -6.355
  511   2HG2  VAL  63          HG22      VAL  63   4.333   0.944  -5.396
  512   3HG2  VAL  63          HG23      VAL  63   3.597   2.479  -4.937
  513    HA   PRO  64           HA       PRO  64  -0.390  -2.193  -8.679
  514   1HB   PRO  64          HB2       PRO  64  -2.106  -2.106  -6.367
  515   2HB   PRO  64          HB1       PRO  64  -1.278  -3.509  -7.060
  516   1HG   PRO  64          HG2       PRO  64  -0.655  -2.102  -4.622
  517   2HG   PRO  64          HG1       PRO  64   0.133  -3.535  -5.288
  518   1HD   PRO  64          HD2       PRO  64   1.193  -0.875  -5.142
  519   2HD   PRO  64          HD1       PRO  64   1.943  -2.295  -5.912
  520    H    LYS  65           HN       LYS  65  -2.237  -1.299  -9.694
  521    HA   LYS  65           HA       LYS  65  -2.599   1.458  -9.878
  522   1HB   LYS  65          HB2       LYS  65  -4.450  -0.904 -10.234
  523   2HB   LYS  65          HB1       LYS  65  -4.957   0.736 -10.645
  524   1HG   LYS  65          HG2       LYS  65  -3.440   0.915 -12.393
  525   2HG   LYS  65          HG1       LYS  65  -2.331  -0.262 -11.688
  526   1HD   LYS  65          HD2       LYS  65  -5.025  -0.877 -12.939
  527   2HD   LYS  65          HD1       LYS  65  -3.447  -1.235 -13.641
  528   1HE   LYS  65          HE2       LYS  65  -3.146  -2.446 -11.234
  529   2HE   LYS  65          HE1       LYS  65  -4.896  -2.639 -11.461
  530   1HZ   LYS  65          HZ1       LYS  65  -2.752  -3.386 -13.377
  531   2HZ   LYS  65          HZ2       LYS  65  -4.408  -3.383 -13.761
  532   3HZ   LYS  65          HZ3       LYS  65  -3.810  -4.439 -12.572
  533    H    CYS  66           HN       CYS  66  -4.436  -0.784  -7.774
  534    HA   CYS  66           HA       CYS  66  -6.264   0.907  -6.571
  535   1HB   CYS  66          HB2       CYS  66  -5.911  -1.508  -6.114
  536   2HB   CYS  66          HB1       CYS  66  -4.448  -1.112  -5.212
  537    H    PHE  67           HN       PHE  67  -3.100   0.280  -5.020
  538    HA   PHE  67           HA       PHE  67  -1.747   1.690  -3.690
  539   1HB   PHE  67          HB2       PHE  67  -1.581   2.822  -5.873
  540   2HB   PHE  67          HB1       PHE  67  -3.065   3.714  -5.533
  541    HD1  PHE  67           HD1      PHE  67   0.038   2.904  -3.579
  542    HD2  PHE  67           HD2      PHE  67  -2.653   5.940  -4.991
  543    HE1  PHE  67           HE1      PHE  67   1.347   4.628  -2.368
  544    HE2  PHE  67           HE2      PHE  67  -1.344   7.664  -3.780
  545    HZ   PHE  67           HZ       PHE  67   0.656   7.008  -2.469
  546    H    LYS  68           HN       LYS  68  -1.903   3.302  -1.927
  547    HA   LYS  68           HA       LYS  68  -4.723   3.618  -0.963
  548   1HB   LYS  68          HB2       LYS  68  -2.917   2.230   0.261
  549   2HB   LYS  68          HB1       LYS  68  -2.184   3.782   0.670
  550   1HG   LYS  68          HG2       LYS  68  -5.108   3.268   1.197
  551   2HG   LYS  68          HG1       LYS  68  -3.877   2.757   2.352
  552   1HD   LYS  68          HD2       LYS  68  -2.988   5.133   2.296
  553   2HD   LYS  68          HD1       LYS  68  -4.430   5.570   1.380
  554   1HE   LYS  68          HE2       LYS  68  -4.796   4.043   3.937
  555   2HE   LYS  68          HE1       LYS  68  -4.432   5.778   4.026
  556   1HZ   LYS  68          HZ1       LYS  68  -6.887   4.826   3.607
  557   2HZ   LYS  68          HZ2       LYS  68  -6.356   4.986   2.001
  558   3HZ   LYS  68          HZ3       LYS  68  -6.362   6.334   3.035
  559    H    GLU  69           HN       GLU  69  -4.675   5.605  -2.466
  560    HA   GLU  69           HA       GLU  69  -2.993   7.863  -1.931
  561   1HB   GLU  69          HB2       GLU  69  -4.621   9.024  -3.308
  562   2HB   GLU  69          HB1       GLU  69  -4.442   7.389  -3.948
  563   1HG   GLU  69          HG2       GLU  69  -6.482   6.666  -2.944
  564   2HG   GLU  69          HG1       GLU  69  -6.586   8.114  -1.943
  565    H    HIS  70           HN       HIS  70  -4.503  10.022  -1.347
  566    HA   HIS  70           HA       HIS  70  -5.570   9.435   1.396
  567   1HB   HIS  70          HB2       HIS  70  -4.844  11.852   1.774
  568   2HB   HIS  70          HB1       HIS  70  -3.533  10.715   1.460
  569    HD1  HIS  70           HD1      HIS  70  -2.004  12.537   0.414
  570    HD2  HIS  70           HD2      HIS  70  -5.642  12.068  -1.566
  571    HE1  HIS  70           HE1      HIS  70  -1.799  13.799  -1.771
  572    H    SER  71           HN       SER  71  -7.053  11.452   2.065
  573    HA   SER  71           HA       SER  71  -8.780  12.278  -0.227
  574   1HB   SER  71          HB2       SER  71  -9.372  10.419   2.000
  575   2HB   SER  71          HB1       SER  71 -10.609  11.644   1.711
  576    HG   SER  71           HG       SER  71 -10.127  10.921  -0.635
  577    H    SER  72           HN       SER  72 -10.150  14.134   0.333
  578    HA   SER  72           HA       SER  72  -9.015  15.729   2.598
  579   1HB   SER  72          HB2       SER  72  -9.170  16.262  -0.068
  580   2HB   SER  72          HB1       SER  72 -10.676  16.987   0.488
  581    HG   SER  72           HG       SER  72  -8.030  17.515   1.357
  582    H    LEU  73           HN       LEU  73 -11.373  17.600   2.120
  583    HA   LEU  73           HA       LEU  73 -13.410  17.984   3.271
  584   1HB   LEU  73          HB2       LEU  73 -13.789  15.185   2.165
  585   2HB   LEU  73          HB1       LEU  73 -15.091  16.279   2.639
  586    HG   LEU  73           HG       LEU  73 -13.072  16.707   0.418
  587   1HD1  LEU  73          HD11      LEU  73 -16.092  16.630   0.273
  588   2HD1  LEU  73          HD12      LEU  73 -15.104  15.183   0.075
  589   3HD1  LEU  73          HD13      LEU  73 -14.938  16.526  -1.056
  590   1HD2  LEU  73          HD21      LEU  73 -14.435  18.810   0.023
  591   2HD2  LEU  73          HD22      LEU  73 -13.443  18.841   1.481
  592   3HD2  LEU  73          HD23      LEU  73 -15.177  18.541   1.600
  593    H    ALA  74           HN       ALA  74 -15.100  16.141   4.591
  594    HA   ALA  74           HA       ALA  74 -13.845  15.910   7.163
  595   1HB   ALA  74          HB1       ALA  74 -16.179  14.208   6.436
  596   2HB   ALA  74          HB2       ALA  74 -16.365  15.944   6.196
  597   3HB   ALA  74          HB3       ALA  74 -15.978  15.312   7.796
  598    H    PHE  75           HN       PHE  75 -13.705  13.726   8.332
  599    HA   PHE  75           HA       PHE  75 -12.412  11.721   6.521
  600   1HB   PHE  75          HB2       PHE  75 -11.072  12.862   8.306
  601   2HB   PHE  75          HB1       PHE  75 -12.156  12.172   9.513
  602    HD1  PHE  75           HD1      PHE  75 -11.589  10.128  10.478
  603    HD2  PHE  75           HD2      PHE  75 -10.073  11.101   6.578
  604    HE1  PHE  75           HE1      PHE  75 -10.266   8.029  10.468
  605    HE2  PHE  75           HE2      PHE  75  -8.752   9.003   6.567
  606    HZ   PHE  75           HZ       PHE  75  -8.848   7.467   8.512
  607    H    TRP  76           HN       TRP  76 -14.630  10.828   6.051
  608    HA   TRP  76           HA       TRP  76 -15.404   8.851   8.141
  609   1HB   TRP  76          HB2       TRP  76 -16.882  11.233   7.256
  610   2HB   TRP  76          HB1       TRP  76 -17.833   9.748   7.214
  611    HD1  TRP  76           HD1      TRP  76 -18.116   8.400   9.510
  612    HE1  TRP  76           HE1      TRP  76 -17.999   9.190  11.965
  613    HE3  TRP  76           HE3      TRP  76 -15.726  12.844   8.869
  614    HZ2  TRP  76           HZ2      TRP  76 -17.006  11.428  13.457
  615    HZ3  TRP  76           HZ3      TRP  76 -15.198  14.292  10.812
  616    HH2  TRP  76           HH2      TRP  76 -15.833  13.588  13.105
  617    H    LYS  77           HN       LYS  77 -14.060   8.042   5.923
  618    HA   LYS  77           HA       LYS  77 -16.207   6.953   4.128
  619   1HB   LYS  77          HB2       LYS  77 -14.666   8.730   3.173
  620   2HB   LYS  77          HB1       LYS  77 -13.333   7.597   3.404
  621   1HG   LYS  77          HG2       LYS  77 -13.842   6.703   1.401
  622   2HG   LYS  77          HG1       LYS  77 -15.346   6.118   2.113
  623   1HD   LYS  77          HD2       LYS  77 -16.035   7.397   0.239
  624   2HD   LYS  77          HD1       LYS  77 -16.290   8.463   1.621
  625   1HE   LYS  77          HE2       LYS  77 -14.072   9.524   1.180
  626   2HE   LYS  77          HE1       LYS  77 -13.904   8.506  -0.265
  627   1HZ   LYS  77          HZ1       LYS  77 -16.370   9.421  -0.605
  628   2HZ   LYS  77          HZ2       LYS  77 -15.003  10.214  -1.229
  629   3HZ   LYS  77          HZ3       LYS  77 -15.706  10.743   0.225
  630    H    THR  78           HN       THR  78 -13.086   6.396   5.719
  631    HA   THR  78           HA       THR  78 -11.961   4.386   6.240
  632    HB   THR  78           HB       THR  78 -14.885   3.609   6.182
  633    HG1  THR  78           HG1      THR  78 -13.076   4.115   8.304
  634   1HG2  THR  78          HG21      THR  78 -12.674   1.867   6.196
  635   2HG2  THR  78          HG22      THR  78 -14.345   1.466   6.592
  636   3HG2  THR  78          HG23      THR  78 -13.227   1.950   7.868
  637    H    ASP  79           HN       ASP  79 -11.173   4.589   3.863
  638    HA   ASP  79           HA       ASP  79 -12.383   2.854   1.863
  639   1HB   ASP  79          HB2       ASP  79 -10.411   3.520   0.572
  640   2HB   ASP  79          HB1       ASP  79 -11.043   4.925   1.431
  641    H    ALA  80           HN       ALA  80 -10.491   1.318   0.783
  642    HA   ALA  80           HA       ALA  80 -10.334  -1.075   2.115
  643   1HB   ALA  80          HB1       ALA  80  -8.057   0.163   0.545
  644   2HB   ALA  80          HB2       ALA  80  -9.530  -0.466  -0.197
  645   3HB   ALA  80          HB3       ALA  80  -8.449  -1.550   0.678
  646    H    SER  81           HN       SER  81  -8.057   1.635   2.532
  647    HA   SER  81           HA       SER  81  -6.114   0.491   4.173
  648   1HB   SER  81          HB2       SER  81  -5.853   2.785   5.032
  649   2HB   SER  81          HB1       SER  81  -6.189   2.815   3.302
  650    HG   SER  81           HG       SER  81  -7.671   3.739   5.415
  651    H    ASP  82           HN       ASP  82  -9.483   1.053   4.939
  652    HA   ASP  82           HA       ASP  82  -8.968  -0.004   7.688
  653   1HB   ASP  82          HB2       ASP  82 -10.576   2.425   6.868
  654   2HB   ASP  82          HB1       ASP  82 -10.622   1.725   8.486
  655    H    VAL  83           HN       VAL  83 -10.151  -1.176   5.154
  656    HA   VAL  83           HA       VAL  83 -12.978  -1.592   6.024
  657    HB   VAL  83           HB       VAL  83 -11.511  -2.368   3.486
  658   1HG1  VAL  83          HG11      VAL  83 -14.437  -2.375   4.266
  659   2HG1  VAL  83          HG12      VAL  83 -13.450  -3.770   3.826
  660   3HG1  VAL  83          HG13      VAL  83 -13.866  -2.563   2.608
  661   1HG2  VAL  83          HG21      VAL  83 -13.565  -0.288   3.333
  662   2HG2  VAL  83          HG22      VAL  83 -11.928  -0.291   2.678
  663   3HG2  VAL  83          HG23      VAL  83 -12.206   0.178   4.355
  664    H    LYS  84           HN       LYS  84 -13.703  -3.677   6.581
  665    HA   LYS  84           HA       LYS  84 -11.760  -5.543   7.605
  666   1HB   LYS  84          HB2       LYS  84 -13.820  -6.908   7.997
  667   2HB   LYS  84          HB1       LYS  84 -14.000  -5.240   8.542
  668   1HG   LYS  84          HG2       LYS  84 -14.823  -5.031   5.944
  669   2HG   LYS  84          HG1       LYS  84 -15.369  -6.661   6.343
  670   1HD   LYS  84          HD2       LYS  84 -17.013  -5.880   7.677
  671   2HD   LYS  84          HD1       LYS  84 -15.912  -4.775   8.501
  672   1HE   LYS  84          HE2       LYS  84 -16.074  -3.283   6.416
  673   2HE   LYS  84          HE1       LYS  84 -17.447  -4.297   5.934
  674   1HZ   LYS  84          HZ1       LYS  84 -17.691  -3.706   8.665
  675   2HZ   LYS  84          HZ2       LYS  84 -18.717  -3.240   7.395
  676   3HZ   LYS  84          HZ3       LYS  84 -17.415  -2.248   7.846
  677    HA   PRO  85           HA       PRO  85 -10.870  -7.745   3.843
  678   1HB   PRO  85          HB2       PRO  85 -10.250 -10.126   5.336
  679   2HB   PRO  85          HB1       PRO  85  -9.122  -8.956   4.636
  680   1HG   PRO  85          HG2       PRO  85  -9.712  -9.372   7.405
  681   2HG   PRO  85          HG1       PRO  85  -8.627  -8.171   6.699
  682   1HD   PRO  85          HD2       PRO  85 -11.223  -7.741   7.914
  683   2HD   PRO  85          HD1       PRO  85 -10.098  -6.524   7.262
  684    H    CYS  86           HN       CYS  86 -12.116  -9.099   2.519
  685    HA   CYS  86           HA       CYS  86 -14.754  -9.818   3.179
  686   1HB   CYS  86          HB2       CYS  86 -13.208  -9.805   0.961
  687   2HB   CYS  86          HB1       CYS  86 -13.242 -11.541   1.279
  Start of MODEL    5
    1   1H    THR   1          HT1       THR   1  22.235  -7.107  -9.930
    2   2H    THR   1          HT2       THR   1  22.296  -8.281  -8.702
    3   3H    THR   1          HT3       THR   1  23.734  -7.677  -9.377
    4    HA   THR   1           HA       THR   1  23.554  -6.562  -7.333
    5    HB   THR   1           HB       THR   1  23.118  -4.240  -8.166
    6    HG1  THR   1           HG1      THR   1  21.329  -4.711  -9.458
    7   1HG2  THR   1          HG21      THR   1  24.472  -5.037 -10.515
    8   2HG2  THR   1          HG22      THR   1  24.909  -6.210  -9.272
    9   3HG2  THR   1          HG23      THR   1  25.190  -4.490  -9.000
   10    H    LYS   2           HN       LYS   2  22.235  -5.681  -5.668
   11    HA   LYS   2           HA       LYS   2  19.274  -5.958  -6.092
   12   1HB   LYS   2          HB2       LYS   2  20.773  -6.340  -3.492
   13   2HB   LYS   2          HB1       LYS   2  19.150  -6.895  -3.902
   14   1HG   LYS   2          HG2       LYS   2  20.502  -8.169  -5.835
   15   2HG   LYS   2          HG1       LYS   2  21.796  -8.056  -4.643
   16   1HD   LYS   2          HD2       LYS   2  19.118  -8.935  -3.669
   17   2HD   LYS   2          HD1       LYS   2  20.047 -10.084  -4.633
   18   1HE   LYS   2          HE2       LYS   2  21.363  -8.617  -2.347
   19   2HE   LYS   2          HE1       LYS   2  20.421 -10.093  -2.053
   20   1HZ   LYS   2          HZ1       LYS   2  22.869  -9.739  -3.636
   21   2HZ   LYS   2          HZ2       LYS   2  21.755 -10.927  -4.121
   22   3HZ   LYS   2          HZ3       LYS   2  22.450 -10.992  -2.572
   23    H    ALA   3           HN       ALA   3  19.304  -3.611  -6.638
   24    HA   ALA   3           HA       ALA   3  20.133  -1.717  -4.540
   25   1HB   ALA   3          HB1       ALA   3  19.852  -1.723  -7.310
   26   2HB   ALA   3          HB2       ALA   3  20.158  -0.300  -6.314
   27   3HB   ALA   3          HB3       ALA   3  18.506  -0.723  -6.763
   28    H    SER   4           HN       SER   4  18.715  -0.623  -3.166
   29    HA   SER   4           HA       SER   4  16.132  -1.757  -2.604
   30   1HB   SER   4          HB2       SER   4  17.757   0.619  -1.771
   31   2HB   SER   4          HB1       SER   4  16.063   0.555  -1.293
   32    HG   SER   4           HG       SER   4  18.148  -1.275  -0.725
   33    H    CYS   5           HN       CYS   5  14.290   0.193  -2.352
   34    HA   CYS   5           HA       CYS   5  13.921   1.204  -5.151
   35   1HB   CYS   5          HB2       CYS   5  11.811   0.744  -3.035
   36   2HB   CYS   5          HB1       CYS   5  11.581   0.881  -4.777
   37    H    LYS   6           HN       LYS   6  11.716   2.908  -4.425
   38    HA   LYS   6           HA       LYS   6  12.967   4.942  -2.622
   39   1HB   LYS   6          HB2       LYS   6  12.377   5.039  -5.534
   40   2HB   LYS   6          HB1       LYS   6  11.934   6.478  -4.616
   41   1HG   LYS   6          HG2       LYS   6  14.302   6.328  -3.596
   42   2HG   LYS   6          HG1       LYS   6  14.659   5.217  -4.919
   43   1HD   LYS   6          HD2       LYS   6  15.182   7.120  -6.059
   44   2HD   LYS   6          HD1       LYS   6  13.435   7.250  -6.271
   45   1HE   LYS   6          HE2       LYS   6  13.641   8.409  -3.844
   46   2HE   LYS   6          HE1       LYS   6  15.241   8.818  -4.493
   47   1HZ   LYS   6          HZ1       LYS   6  14.319   9.849  -6.346
   48   2HZ   LYS   6          HZ2       LYS   6  13.298  10.353  -5.086
   49   3HZ   LYS   6          HZ3       LYS   6  12.805   9.114  -6.137
   50    H    LEU   7           HN       LEU   7  11.390   4.943  -1.024
   51    HA   LEU   7           HA       LEU   7   8.744   4.302  -0.982
   52   1HB   LEU   7          HB2       LEU   7   8.520   6.114   0.732
   53   2HB   LEU   7          HB1       LEU   7   9.997   5.164   0.926
   54    HG   LEU   7           HG       LEU   7  10.527   7.319  -0.893
   55   1HD1  LEU   7          HD11      LEU   7  10.239   9.085   1.056
   56   2HD1  LEU   7          HD12      LEU   7   8.949   7.996   1.568
   57   3HD1  LEU   7          HD13      LEU   7   8.895   8.738  -0.032
   58   1HD2  LEU   7          HD21      LEU   7  11.800   5.920   1.112
   59   2HD2  LEU   7          HD22      LEU   7  11.572   7.503   1.855
   60   3HD2  LEU   7          HD23      LEU   7  12.444   7.363   0.328
   61    HA   PRO   8           HA       PRO   8   7.414   7.068  -4.379
   62   1HB   PRO   8          HB2       PRO   8   5.010   5.488  -4.467
   63   2HB   PRO   8          HB1       PRO   8   6.345   5.509  -5.629
   64   1HG   PRO   8          HG2       PRO   8   5.664   3.418  -3.810
   65   2HG   PRO   8          HG1       PRO   8   7.043   3.481  -4.910
   66   1HD   PRO   8          HD2       PRO   8   7.033   3.761  -2.017
   67   2HD   PRO   8          HD1       PRO   8   8.432   3.698  -3.116
   68    H    VAL   9           HN       VAL   9   5.884   6.093  -1.383
   69    HA   VAL   9           HA       VAL   9   4.346   8.663  -1.383
   70    HB   VAL   9           HB       VAL   9   3.243   6.062  -0.317
   71   1HG1  VAL   9          HG11      VAL   9   2.227   8.804  -0.954
   72   2HG1  VAL   9          HG12      VAL   9   1.879   7.778   0.438
   73   3HG1  VAL   9          HG13      VAL   9   1.119   7.441  -1.118
   74   1HG2  VAL   9          HG21      VAL   9   2.961   7.177  -3.128
   75   2HG2  VAL   9          HG22      VAL   9   2.034   5.824  -2.479
   76   3HG2  VAL   9          HG23      VAL   9   3.780   5.679  -2.687
   77    H    LYS  10           HN       LYS  10   3.845   9.417   0.810
   78    HA   LYS  10           HA       LYS  10   5.820   8.422   2.824
   79   1HB   LYS  10          HB2       LYS  10   4.262  11.020   2.601
   80   2HB   LYS  10          HB1       LYS  10   5.534  10.681   3.774
   81   1HG   LYS  10          HG2       LYS  10   7.203  10.544   2.068
   82   2HG   LYS  10          HG1       LYS  10   5.989  10.513   0.789
   83   1HD   LYS  10          HD2       LYS  10   6.127  12.852   2.674
   84   2HD   LYS  10          HD1       LYS  10   7.226  12.760   1.298
   85   1HE   LYS  10          HE2       LYS  10   4.883  12.156   0.058
   86   2HE   LYS  10          HE1       LYS  10   4.298  13.241   1.335
   87   1HZ   LYS  10          HZ1       LYS  10   5.797  14.911   0.693
   88   2HZ   LYS  10          HZ2       LYS  10   5.136  14.347  -0.767
   89   3HZ   LYS  10          HZ3       LYS  10   6.693  13.862  -0.292
   90    H    LYS  11           HN       LYS  11   2.795   7.652   2.106
   91    HA   LYS  11           HA       LYS  11   2.037   7.208   4.937
   92   1HB   LYS  11          HB2       LYS  11  -0.097   8.354   4.657
   93   2HB   LYS  11          HB1       LYS  11   1.199   9.469   4.217
   94   1HG   LYS  11          HG2       LYS  11   0.585   8.051   1.859
   95   2HG   LYS  11          HG1       LYS  11  -0.969   8.474   2.581
   96   1HD   LYS  11          HD2       LYS  11   1.305  10.373   1.939
   97   2HD   LYS  11          HD1       LYS  11  -0.266  10.300   1.139
   98   1HE   LYS  11          HE2       LYS  11  -0.479  10.591   4.060
   99   2HE   LYS  11          HE1       LYS  11   0.325  11.960   3.267
  100   1HZ   LYS  11          HZ1       LYS  11  -2.302  11.739   3.331
  101   2HZ   LYS  11          HZ2       LYS  11  -2.009  10.818   1.934
  102   3HZ   LYS  11          HZ3       LYS  11  -1.490  12.433   2.014
  103    H    ALA  12           HN       ALA  12   2.785   5.451   2.706
  104    HA   ALA  12           HA       ALA  12   0.258   4.218   1.788
  105   1HB   ALA  12          HB1       ALA  12   1.650   3.765   0.071
  106   2HB   ALA  12          HB2       ALA  12   2.563   2.687   1.127
  107   3HB   ALA  12          HB3       ALA  12   3.018   4.386   0.994
  108    H    THR  13           HN       THR  13  -0.733   2.705   3.069
  109    HA   THR  13           HA       THR  13   0.885   1.255   5.120
  110    HB   THR  13           HB       THR  13  -2.104   1.141   4.848
  111    HG1  THR  13           HG1      THR  13  -2.222   3.212   5.028
  112   1HG2  THR  13          HG21      THR  13  -1.862   1.309   7.367
  113   2HG2  THR  13          HG22      THR  13  -0.117   1.219   7.129
  114   3HG2  THR  13          HG23      THR  13  -1.144  -0.130   6.644
  115    H    VAL  14           HN       VAL  14   1.651  -0.691   4.361
  116    HA   VAL  14           HA       VAL  14  -0.189  -2.337   2.652
  117    HB   VAL  14           HB       VAL  14   1.976  -3.212   1.684
  118   1HG1  VAL  14          HG11      VAL  14   0.580  -1.267   0.751
  119   2HG1  VAL  14          HG12      VAL  14   2.258  -1.359   0.216
  120   3HG1  VAL  14          HG13      VAL  14   1.792  -0.202   1.464
  121   1HG2  VAL  14          HG21      VAL  14   4.034  -2.353   2.321
  122   2HG2  VAL  14          HG22      VAL  14   3.181  -2.260   3.863
  123   3HG2  VAL  14          HG23      VAL  14   3.345  -0.820   2.857
  124    H    VAL  15           HN       VAL  15   0.877  -4.752   2.730
  125    HA   VAL  15           HA       VAL  15   1.140  -5.422   5.645
  126    HB   VAL  15           HB       VAL  15  -0.022  -7.013   3.332
  127   1HG1  VAL  15          HG11      VAL  15   0.532  -8.664   4.848
  128   2HG1  VAL  15          HG12      VAL  15  -1.024  -8.178   5.520
  129   3HG1  VAL  15          HG13      VAL  15   0.470  -7.565   6.226
  130   1HG2  VAL  15          HG21      VAL  15  -1.581  -5.302   3.693
  131   2HG2  VAL  15          HG22      VAL  15  -1.214  -5.198   5.415
  132   3HG2  VAL  15          HG23      VAL  15  -2.154  -6.554   4.793
  133    H    TYR  16           HN       TYR  16   3.465  -5.424   5.631
  134    HA   TYR  16           HA       TYR  16   4.865  -7.137   3.663
  135   1HB   TYR  16          HB2       TYR  16   5.660  -4.867   4.357
  136   2HB   TYR  16          HB1       TYR  16   5.878  -5.479   5.996
  137    HD1  TYR  16           HD1      TYR  16   6.522  -7.413   2.890
  138    HD2  TYR  16           HD2      TYR  16   8.259  -5.251   6.170
  139    HE1  TYR  16           HE1      TYR  16   8.761  -8.276   2.273
  140    HE2  TYR  16           HE2      TYR  16  10.499  -6.115   5.552
  141    HH   TYR  16           HH       TYR  16  11.302  -8.348   4.207
  142    H    GLN  17           HN       GLN  17   5.515  -9.204   4.146
  143    HA   GLN  17           HA       GLN  17   5.762 -11.203   5.376
  144   1HB   GLN  17          HB2       GLN  17   6.744  -8.959   7.128
  145   2HB   GLN  17          HB1       GLN  17   6.783 -10.625   7.713
  146   1HG   GLN  17          HG2       GLN  17   7.810 -10.325   4.978
  147   2HG   GLN  17          HG1       GLN  17   8.750  -9.442   6.181
  148   1HE2  GLN  17          HE21      GLN  17   8.790 -11.016   8.396
  149   2HE2  GLN  17          HE22      GLN  17   9.399 -12.564   8.057
  150    H    GLY  18           HN       GLY  18   3.127  -9.751   5.496
  151   1HA   GLY  18          HA2       GLY  18   1.075 -10.299   6.535
  152   2HA   GLY  18          HA1       GLY  18   1.961 -11.333   7.655
  153    H    GLU  19           HN       GLU  19   3.124  -8.100   7.308
  154    HA   GLU  19           HA       GLU  19   1.824  -7.377   9.917
  155   1HB   GLU  19          HB2       GLU  19   4.626  -6.964   8.846
  156   2HB   GLU  19          HB1       GLU  19   4.019  -6.115  10.267
  157   1HG   GLU  19          HG2       GLU  19   4.251  -9.118   9.915
  158   2HG   GLU  19          HG1       GLU  19   5.198  -8.107  11.007
  159    H    ARG  20           HN       ARG  20   0.519  -5.615   9.683
  160    HA   ARG  20           HA       ARG  20   0.554  -3.969   7.279
  161   1HB   ARG  20          HB2       ARG  20  -0.952  -4.120   9.876
  162   2HB   ARG  20          HB1       ARG  20  -1.151  -2.700   8.844
  163   1HG   ARG  20          HG2       ARG  20  -2.080  -3.943   7.091
  164   2HG   ARG  20          HG1       ARG  20  -1.377  -5.457   7.663
  165   1HD   ARG  20          HD2       ARG  20  -3.893  -5.200   8.064
  166   2HD   ARG  20          HD1       ARG  20  -2.936  -5.561   9.515
  167    HE   ARG  20           HE       ARG  20  -3.836  -2.805   8.764
  168   1HH1  ARG  20          HH11      ARG  20  -4.946  -4.691  11.009
  169   2HH1  ARG  20          HH12      ARG  20  -4.253  -3.922  12.398
  170   1HH2  ARG  20          HH21      ARG  20  -2.016  -2.018  10.557
  171   2HH2  ARG  20          HH22      ARG  20  -2.594  -2.408  12.142
  172    H    VAL  21           HN       VAL  21   1.841  -2.184   6.987
  173    HA   VAL  21           HA       VAL  21   2.493  -0.417   9.256
  174    HB   VAL  21           HB       VAL  21   4.971  -0.725   8.762
  175   1HG1  VAL  21          HG11      VAL  21   3.568  -1.862  10.629
  176   2HG1  VAL  21          HG12      VAL  21   5.160  -2.529  10.267
  177   3HG1  VAL  21          HG13      VAL  21   3.710  -3.318   9.644
  178   1HG2  VAL  21          HG21      VAL  21   3.850  -3.090   7.225
  179   2HG2  VAL  21          HG22      VAL  21   5.549  -2.909   7.662
  180   3HG2  VAL  21          HG23      VAL  21   4.793  -1.755   6.563
  181    H    LYS  22           HN       LYS  22   3.535   1.589   8.486
  182    HA   LYS  22           HA       LYS  22   2.661   2.302   5.769
  183   1HB   LYS  22          HB2       LYS  22   2.687   3.594   8.123
  184   2HB   LYS  22          HB1       LYS  22   4.258   4.121   7.518
  185   1HG   LYS  22          HG2       LYS  22   2.637   5.737   6.768
  186   2HG   LYS  22          HG1       LYS  22   3.099   4.773   5.363
  187   1HD   LYS  22          HD2       LYS  22   0.646   5.064   5.474
  188   2HD   LYS  22          HD1       LYS  22   1.097   3.368   5.655
  189   1HE   LYS  22          HE2       LYS  22   0.125   3.282   7.699
  190   2HE   LYS  22          HE1       LYS  22   1.063   4.688   8.244
  191   1HZ   LYS  22          HZ1       LYS  22  -1.374   5.097   8.149
  192   2HZ   LYS  22          HZ2       LYS  22  -1.312   4.861   6.468
  193   3HZ   LYS  22          HZ3       LYS  22  -0.469   6.154   7.179
  194    H    ILE  23           HN       ILE  23   4.013   1.779   4.096
  195    HA   ILE  23           HA       ILE  23   6.714   1.041   4.199
  196    HB   ILE  23           HB       ILE  23   5.194   0.790   2.270
  197   1HG1  ILE  23          HG12      ILE  23   7.562   2.539   1.536
  198   2HG1  ILE  23          HG11      ILE  23   7.697   0.833   1.966
  199   1HG2  ILE  23          HG21      ILE  23   4.607   2.704   0.887
  200   2HG2  ILE  23          HG22      ILE  23   5.564   3.778   1.908
  201   3HG2  ILE  23          HG23      ILE  23   4.101   3.026   2.545
  202   1HD1  ILE  23          HD11      ILE  23   7.591   1.119  -0.484
  203   2HD1  ILE  23          HD12      ILE  23   6.040   1.942  -0.320
  204   3HD1  ILE  23          HD13      ILE  23   6.185   0.238   0.111
  205    H    GLN  24           HN       GLN  24   5.302   4.257   4.282
  206    HA   GLN  24           HA       GLN  24   7.689   5.736   3.610
  207   1HB   GLN  24          HB2       GLN  24   6.378   7.619   4.497
  208   2HB   GLN  24          HB1       GLN  24   5.347   6.576   3.514
  209   1HG   GLN  24          HG2       GLN  24   3.964   6.419   5.284
  210   2HG   GLN  24          HG1       GLN  24   5.221   5.491   6.101
  211   1HE2  GLN  24          HE21      GLN  24   3.617   7.038   7.736
  212   2HE2  GLN  24          HE22      GLN  24   4.462   8.405   8.282
  213    H    GLU  25           HN       GLU  25   6.916   3.863   6.326
  214    HA   GLU  25           HA       GLU  25   8.775   5.440   8.071
  215   1HB   GLU  25          HB2       GLU  25   6.539   3.480   8.654
  216   2HB   GLU  25          HB1       GLU  25   7.584   4.170   9.896
  217   1HG   GLU  25          HG2       GLU  25   6.873   6.436   9.253
  218   2HG   GLU  25          HG1       GLU  25   5.845   5.764   7.988
  219    H    LYS  26           HN       LYS  26   7.762   2.028   7.579
  220    HA   LYS  26           HA       LYS  26  10.162   0.892   8.667
  221   1HB   LYS  26          HB2       LYS  26   7.916  -0.199   8.346
  222   2HB   LYS  26          HB1       LYS  26   8.245  -0.245   6.611
  223   1HG   LYS  26          HG2       LYS  26   9.624  -2.024   6.818
  224   2HG   LYS  26          HG1       LYS  26  10.458  -1.312   8.198
  225   1HD   LYS  26          HD2       LYS  26   8.409  -1.930   9.589
  226   2HD   LYS  26          HD1       LYS  26   7.881  -2.895   8.211
  227   1HE   LYS  26          HE2       LYS  26   9.457  -4.514   8.589
  228   2HE   LYS  26          HE1       LYS  26  10.698  -3.329   9.046
  229   1HZ   LYS  26          HZ1       LYS  26   9.774  -3.073  11.167
  230   2HZ   LYS  26          HZ2       LYS  26   9.740  -4.752  10.905
  231   3HZ   LYS  26          HZ3       LYS  26   8.321  -3.833  10.735
  232    H    PHE  27           HN       PHE  27   9.434   2.321   5.601
  233    HA   PHE  27           HA       PHE  27  12.110   1.444   4.564
  234   1HB   PHE  27          HB2       PHE  27   9.457   1.714   3.108
  235   2HB   PHE  27          HB1       PHE  27  10.999   1.343   2.328
  236    HD1  PHE  27           HD1      PHE  27   8.090  -0.113   3.536
  237    HD2  PHE  27           HD2      PHE  27  12.354  -0.618   3.674
  238    HE1  PHE  27           HE1      PHE  27   7.788  -2.514   4.079
  239    HE2  PHE  27           HE2      PHE  27  12.052  -3.019   4.217
  240    HZ   PHE  27           HZ       PHE  27   9.770  -3.967   4.420
  241    H    LYS  28           HN       LYS  28  11.934   3.826   5.924
  242    HA   LYS  28           HA       LYS  28  11.159   6.092   4.323
  243   1HB   LYS  28          HB2       LYS  28  11.299   6.523   6.600
  244   2HB   LYS  28          HB1       LYS  28  12.720   5.502   6.807
  245   1HG   LYS  28          HG2       LYS  28  12.909   8.037   5.196
  246   2HG   LYS  28          HG1       LYS  28  13.003   8.095   6.958
  247   1HD   LYS  28          HD2       LYS  28  14.688   6.024   6.435
  248   2HD   LYS  28          HD1       LYS  28  14.942   7.020   5.001
  249   1HE   LYS  28          HE2       LYS  28  16.475   8.029   6.429
  250   2HE   LYS  28          HE1       LYS  28  15.033   8.965   6.869
  251   1HZ   LYS  28          HZ1       LYS  28  14.697   6.765   8.345
  252   2HZ   LYS  28          HZ2       LYS  28  15.461   8.171   8.918
  253   3HZ   LYS  28          HZ3       LYS  28  16.390   6.868   8.348
  254    H    ASN  29           HN       ASN  29  14.076   4.139   4.531
  255    HA   ASN  29           HA       ASN  29  15.551   6.053   2.781
  256   1HB   ASN  29          HB2       ASN  29  16.199   3.793   4.642
  257   2HB   ASN  29          HB1       ASN  29  17.348   4.173   3.353
  258   1HD2  ASN  29          HD21      ASN  29  17.335   6.908   3.191
  259   2HD2  ASN  29          HD22      ASN  29  17.753   7.612   4.678
  260    H    GLY  30           HN       GLY  30  13.333   4.513   1.674
  261   1HA   GLY  30          HA2       GLY  30  13.108   3.556  -0.510
  262   2HA   GLY  30          HA1       GLY  30  14.818   3.126  -0.471
  263    H    MET  31           HN       MET  31  12.960   1.225  -1.277
  264    HA   MET  31           HA       MET  31  12.544  -0.545   1.093
  265   1HB   MET  31          HB2       MET  31  11.528  -0.574  -1.766
  266   2HB   MET  31          HB1       MET  31  11.097  -1.776  -0.553
  267   1HG   MET  31          HG2       MET  31  10.719   0.854   0.548
  268   2HG   MET  31          HG1       MET  31   9.871   0.742  -0.994
  269   1HE   MET  31          HE1       MET  31   9.132  -2.503  -1.092
  270   2HE   MET  31          HE2       MET  31   8.450  -1.005  -1.719
  271   3HE   MET  31          HE3       MET  31   7.455  -2.070  -0.728
  272    H    LEU  32           HN       LEU  32  13.104  -2.879   0.775
  273    HA   LEU  32           HA       LEU  32  15.789  -3.199  -0.294
  274   1HB   LEU  32          HB2       LEU  32  13.730  -5.155   0.770
  275   2HB   LEU  32          HB1       LEU  32  15.440  -5.522   0.522
  276    HG   LEU  32           HG       LEU  32  15.436  -3.153   2.013
  277   1HD1  LEU  32          HD11      LEU  32  12.947  -3.834   2.374
  278   2HD1  LEU  32          HD12      LEU  32  13.913  -3.414   3.789
  279   3HD1  LEU  32          HD13      LEU  32  13.609  -5.107   3.401
  280   1HD2  LEU  32          HD21      LEU  32  15.994  -4.956   3.889
  281   2HD2  LEU  32          HD22      LEU  32  17.096  -4.686   2.540
  282   3HD2  LEU  32          HD23      LEU  32  15.986  -6.055   2.510
  283    H    HIS  33           HN       HIS  33  16.385  -4.609  -2.060
  284    HA   HIS  33           HA       HIS  33  14.664  -4.496  -4.366
  285   1HB   HIS  33          HB2       HIS  33  17.025  -4.500  -4.665
  286   2HB   HIS  33          HB1       HIS  33  17.227  -5.917  -3.631
  287    HD1  HIS  33           HD1      HIS  33  14.620  -5.675  -6.355
  288    HD2  HIS  33           HD2      HIS  33  18.228  -7.633  -5.632
  289    HE1  HIS  33           HE1      HIS  33  14.892  -7.380  -8.207
  290    H    GLY  34           HN       GLY  34  13.070  -5.916  -4.963
  291   1HA   GLY  34          HA2       GLY  34  12.031  -8.045  -5.242
  292   2HA   GLY  34          HA1       GLY  34  13.219  -8.742  -4.141
  293    H    ASP  35           HN       ASP  35  12.443  -6.240  -2.367
  294    HA   ASP  35           HA       ASP  35  10.944  -7.509  -0.398
  295   1HB   ASP  35          HB2       ASP  35  12.040  -5.105  -0.680
  296   2HB   ASP  35          HB1       ASP  35  10.381  -4.639  -1.062
  297    H    LYS  36           HN       LYS  36   8.760  -7.978  -0.091
  298    HA   LYS  36           HA       LYS  36   6.912  -7.276  -2.350
  299   1HB   LYS  36          HB2       LYS  36   7.391  -9.695  -0.653
  300   2HB   LYS  36          HB1       LYS  36   5.750  -9.408  -1.236
  301   1HG   LYS  36          HG2       LYS  36   6.947  -9.013  -3.546
  302   2HG   LYS  36          HG1       LYS  36   8.249  -9.949  -2.811
  303   1HD   LYS  36          HD2       LYS  36   6.451 -11.676  -2.201
  304   2HD   LYS  36          HD1       LYS  36   5.395 -10.807  -3.316
  305   1HE   LYS  36          HE2       LYS  36   7.020 -11.155  -5.146
  306   2HE   LYS  36          HE1       LYS  36   8.088 -12.029  -4.029
  307   1HZ   LYS  36          HZ1       LYS  36   6.735 -13.642  -5.104
  308   2HZ   LYS  36          HZ2       LYS  36   5.317 -12.754  -4.810
  309   3HZ   LYS  36          HZ3       LYS  36   6.146 -13.486  -3.520
  310    H    VAL  37           HN       VAL  37   5.172  -6.023  -1.805
  311    HA   VAL  37           HA       VAL  37   4.233  -6.005   1.036
  312    HB   VAL  37           HB       VAL  37   4.099  -3.501   0.807
  313   1HG1  VAL  37          HG11      VAL  37   6.353  -5.145   1.265
  314   2HG1  VAL  37          HG12      VAL  37   6.116  -3.483   1.808
  315   3HG1  VAL  37          HG13      VAL  37   6.921  -3.802   0.272
  316   1HG2  VAL  37          HG21      VAL  37   4.106  -3.679  -1.762
  317   2HG2  VAL  37          HG22      VAL  37   5.854  -3.875  -1.625
  318   3HG2  VAL  37          HG23      VAL  37   5.085  -2.395  -1.053
  319    H    SER  38           HN       SER  38   1.990  -5.933   1.186
  320    HA   SER  38           HA       SER  38   0.474  -5.930  -1.379
  321   1HB   SER  38          HB2       SER  38  -0.799  -6.524   1.241
  322   2HB   SER  38          HB1       SER  38  -0.922  -7.392  -0.291
  323    HG   SER  38           HG       SER  38   0.342  -8.346   1.564
  324    H    PHE  39           HN       PHE  39  -1.279  -4.502  -1.715
  325    HA   PHE  39           HA       PHE  39  -1.385  -2.145   0.131
  326   1HB   PHE  39          HB2       PHE  39  -1.876  -2.625  -2.807
  327   2HB   PHE  39          HB1       PHE  39  -2.505  -1.175  -2.016
  328    HD1  PHE  39           HD1      PHE  39   0.357  -2.697  -3.539
  329    HD2  PHE  39           HD2      PHE  39  -0.827   0.242  -0.639
  330    HE1  PHE  39           HE1      PHE  39   2.597  -1.642  -3.694
  331    HE2  PHE  39           HE2      PHE  39   1.412   1.297  -0.794
  332    HZ   PHE  39           HZ       PHE  39   3.123   0.356  -2.321
  333    H    PHE  40           HN       PHE  40  -3.390  -1.561   1.034
  334    HA   PHE  40           HA       PHE  40  -5.487  -3.599   1.023
  335   1HB   PHE  40          HB2       PHE  40  -4.887  -0.992   2.374
  336   2HB   PHE  40          HB1       PHE  40  -6.544  -1.601   2.434
  337    HD1  PHE  40           HD1      PHE  40  -3.067  -2.176   3.475
  338    HD2  PHE  40           HD2      PHE  40  -7.075  -3.718   3.556
  339    HE1  PHE  40           HE1      PHE  40  -2.419  -3.764   5.265
  340    HE2  PHE  40           HE2      PHE  40  -6.427  -5.306   5.347
  341    HZ   PHE  40           HZ       PHE  40  -4.100  -5.329   6.202
  342    H    CYS  41           HN       CYS  41  -7.196  -3.645  -0.362
  343    HA   CYS  41           HA       CYS  41  -8.093  -1.091  -1.643
  344   1HB   CYS  41          HB2       CYS  41  -6.924  -3.520  -2.809
  345   2HB   CYS  41          HB1       CYS  41  -8.462  -3.072  -3.554
  346    H    LYS  42           HN       LYS  42 -10.365  -1.290  -2.476
  347    HA   LYS  42           HA       LYS  42 -11.955  -3.127  -0.737
  348   1HB   LYS  42          HB2       LYS  42 -13.770  -1.496  -1.239
  349   2HB   LYS  42          HB1       LYS  42 -12.348  -0.716  -0.541
  350   1HG   LYS  42          HG2       LYS  42 -11.931  -0.780  -3.342
  351   2HG   LYS  42          HG1       LYS  42 -13.591  -0.238  -3.097
  352   1HD   LYS  42          HD2       LYS  42 -11.158   0.938  -1.720
  353   2HD   LYS  42          HD1       LYS  42 -11.994   1.663  -3.093
  354   1HE   LYS  42          HE2       LYS  42 -13.721   0.934  -0.785
  355   2HE   LYS  42          HE1       LYS  42 -12.606   2.291  -0.529
  356   1HZ   LYS  42          HZ1       LYS  42 -13.378   3.313  -2.545
  357   2HZ   LYS  42          HZ2       LYS  42 -14.723   2.981  -1.563
  358   3HZ   LYS  42          HZ3       LYS  42 -14.376   1.988  -2.897
  359    H    ASN  43           HN       ASN  43 -13.619  -4.396  -1.649
  360    HA   ASN  43           HA       ASN  43 -13.400  -4.827  -4.609
  361   1HB   ASN  43          HB2       ASN  43 -12.776  -6.613  -2.843
  362   2HB   ASN  43          HB1       ASN  43 -14.514  -6.735  -2.546
  363   1HD2  ASN  43          HD21      ASN  43 -13.583  -9.052  -3.488
  364   2HD2  ASN  43          HD22      ASN  43 -13.868  -9.252  -5.150
  365    H    LYS  44           HN       LYS  44 -15.148  -4.036  -5.713
  366    HA   LYS  44           HA       LYS  44 -17.584  -3.184  -4.413
  367   1HB   LYS  44          HB2       LYS  44 -16.722  -3.617  -7.285
  368   2HB   LYS  44          HB1       LYS  44 -18.276  -2.907  -6.848
  369   1HG   LYS  44          HG2       LYS  44 -16.318  -1.565  -5.302
  370   2HG   LYS  44          HG1       LYS  44 -15.691  -1.643  -6.949
  371   1HD   LYS  44          HD2       LYS  44 -17.205  -0.144  -7.694
  372   2HD   LYS  44          HD1       LYS  44 -18.533  -0.995  -6.903
  373   1HE   LYS  44          HE2       LYS  44 -18.610   0.826  -5.524
  374   2HE   LYS  44          HE1       LYS  44 -17.171   0.122  -4.759
  375   1HZ   LYS  44          HZ1       LYS  44 -15.910   1.222  -6.667
  376   2HZ   LYS  44          HZ2       LYS  44 -16.473   2.231  -5.421
  377   3HZ   LYS  44          HZ3       LYS  44 -17.306   2.157  -6.900
  378    H    GLU  45           HN       GLU  45 -16.646  -6.109  -6.196
  379    HA   GLU  45           HA       GLU  45 -19.286  -7.205  -6.508
  380   1HB   GLU  45          HB2       GLU  45 -16.714  -7.793  -7.286
  381   2HB   GLU  45          HB1       GLU  45 -17.035  -9.071  -6.113
  382   1HG   GLU  45          HG2       GLU  45 -17.854 -10.008  -8.097
  383   2HG   GLU  45          HG1       GLU  45 -19.309  -9.316  -7.381
  384    H    LYS  46           HN       LYS  46 -16.726  -8.155  -4.170
  385    HA   LYS  46           HA       LYS  46 -18.714  -9.513  -2.480
  386   1HB   LYS  46          HB2       LYS  46 -15.770  -8.954  -2.024
  387   2HB   LYS  46          HB1       LYS  46 -16.742 -10.213  -1.255
  388   1HG   LYS  46          HG2       LYS  46 -17.198 -10.992  -3.716
  389   2HG   LYS  46          HG1       LYS  46 -15.747 -10.060  -4.089
  390   1HD   LYS  46          HD2       LYS  46 -15.078 -11.525  -1.797
  391   2HD   LYS  46          HD1       LYS  46 -15.975 -12.659  -2.807
  392   1HE   LYS  46          HE2       LYS  46 -14.370 -12.659  -4.462
  393   2HE   LYS  46          HE1       LYS  46 -13.937 -10.961  -4.181
  394   1HZ   LYS  46          HZ1       LYS  46 -13.246 -11.937  -1.855
  395   2HZ   LYS  46          HZ2       LYS  46 -12.174 -11.969  -3.173
  396   3HZ   LYS  46          HZ3       LYS  46 -13.053 -13.361  -2.754
  397    H    LYS  47           HN       LYS  47 -17.629  -6.335  -2.810
  398    HA   LYS  47           HA       LYS  47 -17.908  -4.410  -1.488
  399   1HB   LYS  47          HB2       LYS  47 -19.770  -6.444  -0.277
  400   2HB   LYS  47          HB1       LYS  47 -19.656  -4.812   0.379
  401   1HG   LYS  47          HG2       LYS  47 -19.864  -4.303  -2.305
  402   2HG   LYS  47          HG1       LYS  47 -20.871  -5.742  -2.140
  403   1HD   LYS  47          HD2       LYS  47 -22.407  -4.048  -1.675
  404   2HD   LYS  47          HD1       LYS  47 -21.851  -4.475  -0.055
  405   1HE   LYS  47          HE2       LYS  47 -21.865  -1.994  -0.446
  406   2HE   LYS  47          HE1       LYS  47 -20.235  -2.609  -0.102
  407   1HZ   LYS  47          HZ1       LYS  47 -19.581  -2.365  -2.241
  408   2HZ   LYS  47          HZ2       LYS  47 -20.781  -1.162  -2.254
  409   3HZ   LYS  47          HZ3       LYS  47 -21.116  -2.706  -2.877
  410    H    CYS  48           HN       CYS  48 -15.757  -6.411  -0.807
  411    HA   CYS  48           HA       CYS  48 -15.346  -5.543   2.036
  412   1HB   CYS  48          HB2       CYS  48 -13.873  -7.923   1.547
  413   2HB   CYS  48          HB1       CYS  48 -15.229  -7.705   2.645
  414    H    SER  49           HN       SER  49 -12.920  -5.692   2.588
  415    HA   SER  49           HA       SER  49 -11.386  -4.566   0.287
  416   1HB   SER  49          HB2       SER  49  -9.902  -4.010   2.452
  417   2HB   SER  49          HB1       SER  49 -11.283  -3.019   1.988
  418    HG   SER  49           HG       SER  49 -11.165  -5.107   3.905
  419    H    TYR  50           HN       TYR  50  -9.027  -5.149   0.271
  420    HA   TYR  50           HA       TYR  50  -8.253  -7.682   1.567
  421   1HB   TYR  50          HB2       TYR  50  -7.866  -8.731  -0.716
  422   2HB   TYR  50          HB1       TYR  50  -9.565  -8.502  -0.286
  423    HD1  TYR  50           HD1      TYR  50  -6.741  -6.701  -1.977
  424    HD2  TYR  50           HD2      TYR  50 -10.974  -7.406  -1.794
  425    HE1  TYR  50           HE1      TYR  50  -7.061  -5.301  -3.999
  426    HE2  TYR  50           HE2      TYR  50 -11.295  -6.005  -3.816
  427    HH   TYR  50           HH       TYR  50  -8.520  -4.663  -5.580
  428    H    THR  51           HN       THR  51  -6.023  -8.341   0.177
  429    HA   THR  51           HA       THR  51  -4.428  -5.801   0.167
  430    HB   THR  51           HB       THR  51  -2.564  -7.307   0.861
  431    HG1  THR  51           HG1      THR  51  -3.546  -9.189  -0.117
  432   1HG2  THR  51          HG21      THR  51  -4.978  -7.710   2.638
  433   2HG2  THR  51          HG22      THR  51  -4.151  -6.159   2.493
  434   3HG2  THR  51          HG23      THR  51  -3.290  -7.561   3.124
  435    H    GLU  52           HN       GLU  52  -2.976  -5.472  -1.517
  436    HA   GLU  52           HA       GLU  52  -3.119  -7.407  -3.808
  437   1HB   GLU  52          HB2       GLU  52  -2.960  -4.395  -3.592
  438   2HB   GLU  52          HB1       GLU  52  -2.546  -5.227  -5.092
  439   1HG   GLU  52          HG2       GLU  52  -4.807  -6.380  -4.944
  440   2HG   GLU  52          HG1       GLU  52  -5.202  -5.259  -3.640
  441    H    ASP  53           HN       ASP  53  -1.254  -8.530  -2.816
  442    HA   ASP  53           HA       ASP  53   1.166  -7.610  -1.945
  443   1HB   ASP  53          HB2       ASP  53   0.691  -9.778  -4.006
  444   2HB   ASP  53          HB1       ASP  53   2.119  -9.640  -2.976
  445    H    ALA  54           HN       ALA  54   3.018  -6.734  -2.801
  446    HA   ALA  54           HA       ALA  54   3.049  -6.031  -5.714
  447   1HB   ALA  54          HB1       ALA  54   3.329  -3.804  -5.191
  448   2HB   ALA  54          HB2       ALA  54   4.236  -4.164  -3.721
  449   3HB   ALA  54          HB3       ALA  54   2.476  -4.280  -3.723
  450    H    GLN  55           HN       GLN  55   5.431  -5.337  -6.303
  451    HA   GLN  55           HA       GLN  55   7.395  -6.864  -4.636
  452   1HB   GLN  55          HB2       GLN  55   6.339  -8.023  -6.738
  453   2HB   GLN  55          HB1       GLN  55   7.425  -6.967  -7.642
  454   1HG   GLN  55          HG2       GLN  55   9.288  -7.824  -6.097
  455   2HG   GLN  55          HG1       GLN  55   8.151  -9.079  -5.608
  456   1HE2  GLN  55          HE21      GLN  55   6.872  -9.548  -8.129
  457   2HE2  GLN  55          HE22      GLN  55   8.016 -10.211  -9.193
  458    H    CYS  56           HN       CYS  56   9.457  -5.959  -4.583
  459    HA   CYS  56           HA       CYS  56   9.770  -3.298  -5.903
  460   1HB   CYS  56          HB2       CYS  56  10.146  -4.303  -3.304
  461   2HB   CYS  56          HB1       CYS  56  11.772  -4.079  -3.943
  462    H    ILE  57           HN       ILE  57  11.660  -2.894  -7.152
  463    HA   ILE  57           HA       ILE  57  13.355  -5.297  -7.753
  464    HB   ILE  57           HB       ILE  57  12.550  -3.155  -9.733
  465   1HG1  ILE  57          HG12      ILE  57  10.517  -4.229  -8.725
  466   2HG1  ILE  57          HG11      ILE  57  10.709  -4.588 -10.441
  467   1HG2  ILE  57          HG21      ILE  57  14.083  -5.649  -9.764
  468   2HG2  ILE  57          HG22      ILE  57  14.045  -4.342 -10.947
  469   3HG2  ILE  57          HG23      ILE  57  12.821  -5.611 -10.995
  470   1HD1  ILE  57          HD11      ILE  57  10.320  -6.484  -8.499
  471   2HD1  ILE  57          HD12      ILE  57  12.077  -6.486  -8.648
  472   3HD1  ILE  57          HD13      ILE  57  11.072  -6.799 -10.063
  473    H    ASP  58           HN       ASP  58  15.336  -4.354  -9.166
  474    HA   ASP  58           HA       ASP  58  17.047  -2.937  -7.449
  475   1HB   ASP  58          HB2       ASP  58  17.331  -4.324  -9.686
  476   2HB   ASP  58          HB1       ASP  58  17.301  -2.721 -10.429
  477    H    GLY  59           HN       GLY  59  15.703  -1.078  -6.703
  478   1HA   GLY  59          HA2       GLY  59  15.475   1.268  -6.678
  479   2HA   GLY  59          HA1       GLY  59  16.333   1.324  -8.213
  480    H    THR  60           HN       THR  60  13.967  -0.831  -8.850
  481    HA   THR  60           HA       THR  60  12.032   1.336  -9.615
  482    HB   THR  60           HB       THR  60  12.707  -1.190 -11.133
  483    HG1  THR  60           HG1      THR  60  14.286  -0.125 -12.016
  484   1HG2  THR  60          HG21      THR  60  10.664   0.811 -11.369
  485   2HG2  THR  60          HG22      THR  60  10.926  -0.616 -12.371
  486   3HG2  THR  60          HG23      THR  60  11.728   0.903 -12.774
  487    H    ILE  61           HN       ILE  61   9.898   0.936  -9.135
  488    HA   ILE  61           HA       ILE  61   9.088  -1.837  -8.377
  489    HB   ILE  61           HB       ILE  61   9.663  -0.793  -6.305
  490   1HG1  ILE  61          HG12      ILE  61   6.843  -0.029  -6.088
  491   2HG1  ILE  61          HG11      ILE  61   7.067  -1.590  -6.879
  492   1HG2  ILE  61          HG21      ILE  61   9.894   1.465  -6.472
  493   2HG2  ILE  61          HG22      ILE  61   8.204   1.501  -5.971
  494   3HG2  ILE  61          HG23      ILE  61   8.620   1.600  -7.683
  495   1HD1  ILE  61          HD11      ILE  61   6.876  -1.718  -4.363
  496   2HD1  ILE  61          HD12      ILE  61   8.402  -0.838  -4.268
  497   3HD1  ILE  61          HD13      ILE  61   8.348  -2.433  -5.020
  498    H    GLU  62           HN       GLU  62   6.890  -2.268  -8.823
  499    HA   GLU  62           HA       GLU  62   5.460  -0.132 -10.363
  500   1HB   GLU  62          HB2       GLU  62   6.233  -2.646 -11.093
  501   2HB   GLU  62          HB1       GLU  62   4.600  -2.965 -10.506
  502   1HG   GLU  62          HG2       GLU  62   5.108  -0.658 -12.371
  503   2HG   GLU  62          HG1       GLU  62   4.925  -2.293 -13.011
  504    H    VAL  63           HN       VAL  63   3.670   0.709  -9.375
  505    HA   VAL  63           HA       VAL  63   2.592  -0.587  -6.951
  506    HB   VAL  63           HB       VAL  63   2.141   2.029  -8.404
  507   1HG1  VAL  63          HG11      VAL  63   1.097   1.815  -5.673
  508   2HG1  VAL  63          HG12      VAL  63   0.250   0.773  -6.816
  509   3HG1  VAL  63          HG13      VAL  63   0.346   2.509  -7.109
  510   1HG2  VAL  63          HG21      VAL  63   3.475   2.982  -6.740
  511   2HG2  VAL  63          HG22      VAL  63   4.252   1.414  -6.957
  512   3HG2  VAL  63          HG23      VAL  63   3.158   1.675  -5.599
  513    HA   PRO  64           HA       PRO  64  -0.722  -2.606  -9.097
  514   1HB   PRO  64          HB2       PRO  64  -2.470  -2.299  -6.829
  515   2HB   PRO  64          HB1       PRO  64  -1.577  -3.740  -7.333
  516   1HG   PRO  64          HG2       PRO  64  -1.053  -2.059  -5.070
  517   2HG   PRO  64          HG1       PRO  64  -0.148  -3.481  -5.598
  518   1HD   PRO  64          HD2       PRO  64   0.655  -0.710  -5.749
  519   2HD   PRO  64          HD1       PRO  64   1.573  -2.146  -6.265
  520    H    LYS  65           HN       LYS  65  -2.274  -1.773 -10.457
  521    HA   LYS  65           HA       LYS  65  -2.877   0.958 -10.690
  522   1HB   LYS  65          HB2       LYS  65  -4.806   0.070 -12.073
  523   2HB   LYS  65          HB1       LYS  65  -3.240  -0.637 -12.466
  524   1HG   LYS  65          HG2       LYS  65  -3.751  -2.675 -11.451
  525   2HG   LYS  65          HG1       LYS  65  -4.976  -1.958 -10.402
  526   1HD   LYS  65          HD2       LYS  65  -6.157  -1.421 -12.720
  527   2HD   LYS  65          HD1       LYS  65  -5.184  -2.785 -13.271
  528   1HE   LYS  65          HE2       LYS  65  -6.163  -3.828 -10.962
  529   2HE   LYS  65          HE1       LYS  65  -7.502  -2.755 -11.414
  530   1HZ   LYS  65          HZ1       LYS  65  -8.034  -4.447 -12.786
  531   2HZ   LYS  65          HZ2       LYS  65  -6.465  -5.097 -12.787
  532   3HZ   LYS  65          HZ3       LYS  65  -6.840  -3.775 -13.786
  533    H    CYS  66           HN       CYS  66  -4.216  -1.357  -8.462
  534    HA   CYS  66           HA       CYS  66  -6.717   0.051  -7.968
  535   1HB   CYS  66          HB2       CYS  66  -6.201  -2.394  -7.583
  536   2HB   CYS  66          HB1       CYS  66  -5.197  -1.905  -6.217
  537    H    PHE  67           HN       PHE  67  -3.441   0.489  -6.949
  538    HA   PHE  67           HA       PHE  67  -3.731   1.616  -4.371
  539   1HB   PHE  67          HB2       PHE  67  -1.580   1.109  -5.330
  540   2HB   PHE  67          HB1       PHE  67  -1.871   2.189  -6.694
  541    HD1  PHE  67           HD1      PHE  67  -0.874   4.288  -6.613
  542    HD2  PHE  67           HD2      PHE  67  -1.906   2.319  -2.937
  543    HE1  PHE  67           HE1      PHE  67   0.095   6.175  -5.331
  544    HE2  PHE  67           HE2      PHE  67  -0.936   4.208  -1.655
  545    HZ   PHE  67           HZ       PHE  67   0.064   6.136  -2.851
  546    H    LYS  68           HN       LYS  68  -3.704   3.947  -3.786
  547    HA   LYS  68           HA       LYS  68  -5.106   5.682  -5.794
  548   1HB   LYS  68          HB2       LYS  68  -5.945   4.638  -3.230
  549   2HB   LYS  68          HB1       LYS  68  -5.892   6.400  -3.171
  550   1HG   LYS  68          HG2       LYS  68  -7.162   6.349  -5.406
  551   2HG   LYS  68          HG1       LYS  68  -7.462   4.646  -5.063
  552   1HD   LYS  68          HD2       LYS  68  -8.134   6.872  -3.122
  553   2HD   LYS  68          HD1       LYS  68  -9.291   6.214  -4.282
  554   1HE   LYS  68          HE2       LYS  68  -8.197   3.944  -3.069
  555   2HE   LYS  68          HE1       LYS  68  -8.419   5.093  -1.734
  556   1HZ   LYS  68          HZ1       LYS  68 -10.408   3.925  -3.524
  557   2HZ   LYS  68          HZ2       LYS  68 -10.635   5.551  -3.086
  558   3HZ   LYS  68          HZ3       LYS  68 -10.544   4.351  -1.887
  559    H    GLU  69           HN       GLU  69  -2.942   6.621  -6.200
  560    HA   GLU  69           HA       GLU  69  -1.156   7.681  -4.317
  561   1HB   GLU  69          HB2       GLU  69  -1.384   7.608  -7.014
  562   2HB   GLU  69          HB1       GLU  69  -1.765   9.307  -6.732
  563   1HG   GLU  69          HG2       GLU  69   0.376   9.081  -5.115
  564   2HG   GLU  69          HG1       GLU  69   0.790   7.842  -6.301
  565    H    HIS  70           HN       HIS  70  -3.921   9.396  -5.839
  566    HA   HIS  70           HA       HIS  70  -4.356  10.937  -3.365
  567   1HB   HIS  70          HB2       HIS  70  -2.568  11.830  -5.359
  568   2HB   HIS  70          HB1       HIS  70  -4.028  12.798  -5.561
  569    HD1  HIS  70           HD1      HIS  70  -1.181  12.196  -3.239
  570    HD2  HIS  70           HD2      HIS  70  -4.734  14.378  -3.247
  571    HE1  HIS  70           HE1      HIS  70  -1.035  13.808  -1.291
  572    H    SER  71           HN       SER  71  -5.061  10.871  -6.882
  573    HA   SER  71           HA       SER  71  -7.152  10.845  -7.994
  574   1HB   SER  71          HB2       SER  71  -8.485  10.602  -5.312
  575   2HB   SER  71          HB1       SER  71  -8.895   9.805  -6.832
  576    HG   SER  71           HG       SER  71  -7.883   8.251  -5.717
  577    H    SER  72           HN       SER  72  -9.617  11.946  -7.016
  578    HA   SER  72           HA       SER  72  -8.858  14.834  -6.904
  579   1HB   SER  72          HB2       SER  72 -11.123  15.155  -7.800
  580   2HB   SER  72          HB1       SER  72 -10.265  13.955  -8.764
  581    HG   SER  72           HG       SER  72 -11.770  12.602  -8.232
  582    H    LEU  73           HN       LEU  73  -8.476  13.894  -4.441
  583    HA   LEU  73           HA       LEU  73  -9.262  13.862  -2.198
  584   1HB   LEU  73          HB2       LEU  73 -10.472  16.204  -3.647
  585   2HB   LEU  73          HB1       LEU  73 -10.885  15.929  -1.952
  586    HG   LEU  73           HG       LEU  73  -8.896  17.458  -2.335
  587   1HD1  LEU  73          HD11      LEU  73  -8.015  14.980  -0.875
  588   2HD1  LEU  73          HD12      LEU  73  -9.390  15.910  -0.278
  589   3HD1  LEU  73          HD13      LEU  73  -7.806  16.671  -0.419
  590   1HD2  LEU  73          HD21      LEU  73  -6.801  16.465  -3.029
  591   2HD2  LEU  73          HD22      LEU  73  -8.007  16.086  -4.259
  592   3HD2  LEU  73          HD23      LEU  73  -7.527  14.859  -3.087
  593    H    ALA  74           HN       ALA  74 -10.632  11.953  -3.805
  594    HA   ALA  74           HA       ALA  74 -13.527  12.272  -3.358
  595   1HB   ALA  74          HB1       ALA  74 -12.016   9.816  -4.272
  596   2HB   ALA  74          HB2       ALA  74 -12.298  11.184  -5.348
  597   3HB   ALA  74          HB3       ALA  74 -13.664  10.293  -4.680
  598    H    PHE  75           HN       PHE  75 -11.358   9.532  -2.560
  599    HA   PHE  75           HA       PHE  75 -11.218   8.233  -0.588
  600   1HB   PHE  75          HB2       PHE  75 -11.221  10.783   0.197
  601   2HB   PHE  75          HB1       PHE  75 -12.785  10.328   0.871
  602    HD1  PHE  75           HD1      PHE  75  -9.255   9.071   0.666
  603    HD2  PHE  75           HD2      PHE  75 -12.860   9.346   2.983
  604    HE1  PHE  75           HE1      PHE  75  -8.116   7.957   2.567
  605    HE2  PHE  75           HE2      PHE  75 -11.722   8.231   4.886
  606    HZ   PHE  75           HZ       PHE  75  -9.351   7.537   4.677
  607    H    TRP  76           HN       TRP  76 -14.321   9.950  -0.083
  608    HA   TRP  76           HA       TRP  76 -16.507   9.097   0.186
  609   1HB   TRP  76          HB2       TRP  76 -15.200   7.910  -2.098
  610   2HB   TRP  76          HB1       TRP  76 -16.355   6.772  -1.401
  611    HD1  TRP  76           HD1      TRP  76 -18.899   7.673  -1.088
  612    HE1  TRP  76           HE1      TRP  76 -20.237   9.381  -2.486
  613    HE3  TRP  76           HE3      TRP  76 -15.070  10.016  -3.489
  614    HZ2  TRP  76           HZ2      TRP  76 -19.736  11.473  -4.375
  615    HZ3  TRP  76           HZ3      TRP  76 -15.517  11.864  -5.081
  616    HH2  TRP  76           HH2      TRP  76 -17.844  12.596  -5.526
  617    H    LYS  77           HN       LYS  77 -16.962   8.220   2.172
  618    HA   LYS  77           HA       LYS  77 -17.112   6.621   3.905
  619   1HB   LYS  77          HB2       LYS  77 -16.404   4.762   1.611
  620   2HB   LYS  77          HB1       LYS  77 -17.232   4.314   3.104
  621   1HG   LYS  77          HG2       LYS  77 -18.408   6.521   1.469
  622   2HG   LYS  77          HG1       LYS  77 -18.595   4.869   0.879
  623   1HD   LYS  77          HD2       LYS  77 -19.209   5.529   3.751
  624   2HD   LYS  77          HD1       LYS  77 -20.408   5.833   2.492
  625   1HE   LYS  77          HE2       LYS  77 -19.660   3.302   1.826
  626   2HE   LYS  77          HE1       LYS  77 -19.450   3.248   3.588
  627   1HZ   LYS  77          HZ1       LYS  77 -21.872   3.686   2.025
  628   2HZ   LYS  77          HZ2       LYS  77 -21.703   4.621   3.434
  629   3HZ   LYS  77          HZ3       LYS  77 -21.678   2.925   3.528
  630    H    THR  78           HN       THR  78 -15.522   4.125   3.951
  631    HA   THR  78           HA       THR  78 -12.947   5.315   4.845
  632    HB   THR  78           HB       THR  78 -14.396   2.695   5.278
  633    HG1  THR  78           HG1      THR  78 -15.046   3.705   6.977
  634   1HG2  THR  78          HG21      THR  78 -11.713   3.502   6.426
  635   2HG2  THR  78          HG22      THR  78 -11.914   2.359   5.099
  636   3HG2  THR  78          HG23      THR  78 -12.566   1.983   6.694
  637    H    ASP  79           HN       ASP  79 -11.007   4.814   3.841
  638    HA   ASP  79           HA       ASP  79 -11.067   3.524   1.225
  639   1HB   ASP  79          HB2       ASP  79  -8.624   4.063   1.333
  640   2HB   ASP  79          HB1       ASP  79  -9.639   5.449   1.732
  641    H    ALA  80           HN       ALA  80 -10.118   1.510   0.688
  642    HA   ALA  80           HA       ALA  80 -10.408  -0.743   2.200
  643   1HB   ALA  80          HB1       ALA  80  -9.627  -0.567  -0.165
  644   2HB   ALA  80          HB2       ALA  80  -8.679  -1.726   0.768
  645   3HB   ALA  80          HB3       ALA  80  -8.026  -0.124   0.425
  646    H    SER  81           HN       SER  81  -7.797   1.607   2.563
  647    HA   SER  81           HA       SER  81  -5.913   0.181   4.071
  648   1HB   SER  81          HB2       SER  81  -6.240   2.724   3.266
  649   2HB   SER  81          HB1       SER  81  -6.699   2.923   4.954
  650    HG   SER  81           HG       SER  81  -4.683   1.733   5.402
  651    H    ASP  82           HN       ASP  82  -9.099   1.332   5.047
  652    HA   ASP  82           HA       ASP  82  -8.649   0.078   7.736
  653   1HB   ASP  82          HB2       ASP  82 -10.097   2.630   6.985
  654   2HB   ASP  82          HB1       ASP  82 -10.093   1.933   8.605
  655    H    VAL  83           HN       VAL  83  -9.937  -1.000   5.243
  656    HA   VAL  83           HA       VAL  83 -12.805  -1.110   6.049
  657    HB   VAL  83           HB       VAL  83 -11.309  -2.112   3.608
  658   1HG1  VAL  83          HG11      VAL  83 -13.393  -3.363   4.068
  659   2HG1  VAL  83          HG12      VAL  83 -13.555  -2.361   2.626
  660   3HG1  VAL  83          HG13      VAL  83 -14.282  -1.842   4.146
  661   1HG2  VAL  83          HG21      VAL  83 -12.659  -0.155   2.575
  662   2HG2  VAL  83          HG22      VAL  83 -11.239   0.254   3.536
  663   3HG2  VAL  83          HG23      VAL  83 -12.849   0.409   4.236
  664    H    LYS  84           HN       LYS  84 -13.839  -3.240   6.222
  665    HA   LYS  84           HA       LYS  84 -12.221  -5.160   7.679
  666   1HB   LYS  84          HB2       LYS  84 -14.373  -6.347   7.834
  667   2HB   LYS  84          HB1       LYS  84 -14.600  -4.625   8.142
  668   1HG   LYS  84          HG2       LYS  84 -15.062  -4.485   5.570
  669   2HG   LYS  84          HG1       LYS  84 -15.347  -6.220   5.704
  670   1HD   LYS  84          HD2       LYS  84 -16.707  -4.156   7.456
  671   2HD   LYS  84          HD1       LYS  84 -17.424  -4.819   5.986
  672   1HE   LYS  84          HE2       LYS  84 -18.108  -6.654   7.121
  673   2HE   LYS  84          HE1       LYS  84 -16.442  -6.980   7.639
  674   1HZ   LYS  84          HZ1       LYS  84 -17.763  -6.521   9.575
  675   2HZ   LYS  84          HZ2       LYS  84 -18.357  -5.083   8.893
  676   3HZ   LYS  84          HZ3       LYS  84 -16.718  -5.208   9.321
  677    HA   PRO  85           HA       PRO  85 -10.803  -7.289   3.991
  678   1HB   PRO  85          HB2       PRO  85 -10.151  -9.569   5.620
  679   2HB   PRO  85          HB1       PRO  85  -9.049  -8.359   4.948
  680   1HG   PRO  85          HG2       PRO  85  -9.857  -8.691   7.691
  681   2HG   PRO  85          HG1       PRO  85  -8.727  -7.511   7.022
  682   1HD   PRO  85          HD2       PRO  85 -11.372  -7.022   8.033
  683   2HD   PRO  85          HD1       PRO  85 -10.263  -5.847   7.286
  684    H    CYS  86           HN       CYS  86 -12.097  -8.465   2.624
  685    HA   CYS  86           HA       CYS  86 -14.637  -9.409   3.073
  686   1HB   CYS  86          HB2       CYS  86 -12.931  -9.393   1.001
  687   2HB   CYS  86          HB1       CYS  86 -12.830 -11.107   1.405
  Start of MODEL    6
    1   1H    THR   1          HT1       THR   1  24.743  -2.314  -8.822
    2   2H    THR   1          HT2       THR   1  25.070  -3.184  -7.399
    3   3H    THR   1          HT3       THR   1  24.217  -1.717  -7.325
    4    HA   THR   1           HA       THR   1  22.604  -3.032  -8.960
    5    HB   THR   1           HB       THR   1  22.600  -5.405  -8.029
    6    HG1  THR   1           HG1      THR   1  24.893  -5.840  -7.252
    7   1HG2  THR   1          HG21      THR   1  23.826  -4.431 -10.181
    8   2HG2  THR   1          HG22      THR   1  24.033  -6.113  -9.694
    9   3HG2  THR   1          HG23      THR   1  25.265  -4.920  -9.287
   10    H    LYS   2           HN       LYS   2  20.906  -4.466  -7.392
   11    HA   LYS   2           HA       LYS   2  19.235  -4.050  -5.757
   12   1HB   LYS   2          HB2       LYS   2  21.947  -4.184  -4.549
   13   2HB   LYS   2          HB1       LYS   2  20.661  -3.597  -3.493
   14   1HG   LYS   2          HG2       LYS   2  19.365  -5.690  -4.532
   15   2HG   LYS   2          HG1       LYS   2  21.012  -6.288  -4.740
   16   1HD   LYS   2          HD2       LYS   2  20.069  -5.149  -2.108
   17   2HD   LYS   2          HD1       LYS   2  19.840  -6.849  -2.515
   18   1HE   LYS   2          HE2       LYS   2  22.364  -6.898  -3.041
   19   2HE   LYS   2          HE1       LYS   2  22.445  -5.348  -2.181
   20   1HZ   LYS   2          HZ1       LYS   2  21.223  -6.418  -0.333
   21   2HZ   LYS   2          HZ2       LYS   2  22.754  -7.106  -0.599
   22   3HZ   LYS   2          HZ3       LYS   2  21.353  -7.906  -1.134
   23    H    ALA   3           HN       ALA   3  18.725  -1.932  -6.914
   24    HA   ALA   3           HA       ALA   3  19.783   0.516  -5.639
   25   1HB   ALA   3          HB1       ALA   3  19.333   1.273  -7.716
   26   2HB   ALA   3          HB2       ALA   3  17.617   0.958  -7.456
   27   3HB   ALA   3          HB3       ALA   3  18.653  -0.302  -8.128
   28    H    SER   4           HN       SER   4  17.873  -1.562  -4.375
   29    HA   SER   4           HA       SER   4  15.995  -1.520  -2.927
   30   1HB   SER   4          HB2       SER   4  16.175   0.254  -1.440
   31   2HB   SER   4          HB1       SER   4  17.723   0.408  -2.266
   32    HG   SER   4           HG       SER   4  16.605   2.394  -2.204
   33    H    CYS   5           HN       CYS   5  14.287   0.908  -2.612
   34    HA   CYS   5           HA       CYS   5  13.042   1.091  -5.324
   35   1HB   CYS   5          HB2       CYS   5  11.568   0.502  -2.742
   36   2HB   CYS   5          HB1       CYS   5  10.886   0.520  -4.370
   37    H    LYS   6           HN       LYS   6  11.028   2.717  -4.997
   38    HA   LYS   6           HA       LYS   6  11.981   5.015  -3.318
   39   1HB   LYS   6          HB2       LYS   6  12.464   5.171  -5.786
   40   2HB   LYS   6          HB1       LYS   6  10.727   5.097  -6.081
   41   1HG   LYS   6          HG2       LYS   6  10.806   7.071  -4.223
   42   2HG   LYS   6          HG1       LYS   6  12.368   7.319  -5.006
   43   1HD   LYS   6          HD2       LYS   6  11.427   7.943  -6.999
   44   2HD   LYS   6          HD1       LYS   6  10.054   6.851  -6.811
   45   1HE   LYS   6          HE2       LYS   6   9.223   8.417  -4.965
   46   2HE   LYS   6          HE1       LYS   6  10.447   9.571  -5.532
   47   1HZ   LYS   6          HZ1       LYS   6   9.538   9.525  -7.709
   48   2HZ   LYS   6          HZ2       LYS   6   8.233   9.777  -6.649
   49   3HZ   LYS   6          HZ3       LYS   6   8.494   8.243  -7.330
   50    H    LEU   7           HN       LEU   7  10.400   4.645  -1.673
   51    HA   LEU   7           HA       LEU   7   7.770   3.879  -1.767
   52   1HB   LEU   7          HB2       LEU   7   7.458   5.354   0.176
   53   2HB   LEU   7          HB1       LEU   7   9.056   4.602   0.227
   54    HG   LEU   7           HG       LEU   7   9.415   6.945  -1.273
   55   1HD1  LEU   7          HD11      LEU   7   8.467   8.715   0.068
   56   2HD1  LEU   7          HD12      LEU   7   7.843   7.560   1.245
   57   3HD1  LEU   7          HD13      LEU   7   7.151   7.628  -0.375
   58   1HD2  LEU   7          HD21      LEU   7  10.189   7.492   1.374
   59   2HD2  LEU   7          HD22      LEU   7  11.188   6.768   0.114
   60   3HD2  LEU   7          HD23      LEU   7  10.284   5.737   1.222
   61    HA   PRO   8           HA       PRO   8   6.402   6.913  -4.896
   62   1HB   PRO   8          HB2       PRO   8   3.947   5.415  -4.996
   63   2HB   PRO   8          HB1       PRO   8   5.238   5.474  -6.202
   64   1HG   PRO   8          HG2       PRO   8   4.563   3.301  -4.459
   65   2HG   PRO   8          HG1       PRO   8   5.865   3.372  -5.650
   66   1HD   PRO   8          HD2       PRO   8   6.086   3.437  -2.769
   67   2HD   PRO   8          HD1       PRO   8   7.399   3.491  -3.970
   68    H    VAL   9           HN       VAL   9   5.032   5.873  -1.872
   69    HA   VAL   9           HA       VAL   9   3.454   8.419  -1.745
   70    HB   VAL   9           HB       VAL   9   2.617   5.786  -0.519
   71   1HG1  VAL   9          HG11      VAL   9   0.375   7.231  -1.150
   72   2HG1  VAL   9          HG12      VAL   9   1.523   8.514  -0.768
   73   3HG1  VAL   9          HG13      VAL   9   1.168   7.264   0.425
   74   1HG2  VAL   9          HG21      VAL   9   2.756   5.340  -2.883
   75   2HG2  VAL   9          HG22      VAL   9   2.030   6.899  -3.277
   76   3HG2  VAL   9          HG23      VAL   9   1.057   5.640  -2.518
   77    H    LYS  10           HN       LYS  10   3.316   9.326   0.408
   78    HA   LYS  10           HA       LYS  10   5.489   8.377   2.223
   79   1HB   LYS  10          HB2       LYS  10   5.415  10.675   3.060
   80   2HB   LYS  10          HB1       LYS  10   5.493  10.702   1.298
   81   1HG   LYS  10          HG2       LYS  10   3.430  11.626   1.106
   82   2HG   LYS  10          HG1       LYS  10   2.752  10.584   2.357
   83   1HD   LYS  10          HD2       LYS  10   2.644  12.690   3.370
   84   2HD   LYS  10          HD1       LYS  10   4.172  12.063   3.988
   85   1HE   LYS  10          HE2       LYS  10   5.374  13.259   2.152
   86   2HE   LYS  10          HE1       LYS  10   3.826  13.963   1.640
   87   1HZ   LYS  10          HZ1       LYS  10   3.547  14.722   3.985
   88   2HZ   LYS  10          HZ2       LYS  10   4.820  15.483   3.155
   89   3HZ   LYS  10          HZ3       LYS  10   5.150  14.254   4.281
   90    H    LYS  11           HN       LYS  11   2.477   7.494   1.957
   91    HA   LYS  11           HA       LYS  11   2.059   7.212   4.856
   92   1HB   LYS  11          HB2       LYS  11  -0.060   8.430   4.855
   93   2HB   LYS  11          HB1       LYS  11   1.210   9.492   4.245
   94   1HG   LYS  11          HG2       LYS  11   0.450   9.358   2.042
   95   2HG   LYS  11          HG1       LYS  11  -0.378   7.826   2.313
   96   1HD   LYS  11          HD2       LYS  11  -2.140   8.884   3.535
   97   2HD   LYS  11          HD1       LYS  11  -1.244  10.398   3.646
   98   1HE   LYS  11          HE2       LYS  11  -1.312  10.086   0.941
   99   2HE   LYS  11          HE1       LYS  11  -2.851   9.329   1.395
  100   1HZ   LYS  11          HZ1       LYS  11  -3.034  11.350   2.972
  101   2HZ   LYS  11          HZ2       LYS  11  -3.412  11.554   1.328
  102   3HZ   LYS  11          HZ3       LYS  11  -1.909  12.070   1.927
  103    H    ALA  12           HN       ALA  12   2.423   5.385   2.599
  104    HA   ALA  12           HA       ALA  12  -0.255   4.249   2.059
  105   1HB   ALA  12          HB1       ALA  12   2.097   2.727   1.221
  106   2HB   ALA  12          HB2       ALA  12   2.192   4.419   0.732
  107   3HB   ALA  12          HB3       ALA  12   0.816   3.432   0.235
  108    H    THR  13           HN       THR  13  -1.048   2.417   3.064
  109    HA   THR  13           HA       THR  13   0.626   1.210   5.228
  110    HB   THR  13           HB       THR  13  -2.273   0.607   4.905
  111    HG1  THR  13           HG1      THR  13  -2.869   2.639   5.591
  112   1HG2  THR  13          HG21      THR  13  -2.124   0.255   7.136
  113   2HG2  THR  13          HG22      THR  13  -1.247   1.761   7.401
  114   3HG2  THR  13          HG23      THR  13  -0.379   0.315   6.886
  115    H    VAL  14           HN       VAL  14   1.808  -0.362   4.032
  116    HA   VAL  14           HA       VAL  14   0.262  -2.252   2.321
  117    HB   VAL  14           HB       VAL  14   2.411  -2.793   1.405
  118   1HG1  VAL  14          HG11      VAL  14   2.352   0.154   2.132
  119   2HG1  VAL  14          HG12      VAL  14   1.562  -0.584   0.739
  120   3HG1  VAL  14          HG13      VAL  14   3.323  -0.555   0.841
  121   1HG2  VAL  14          HG21      VAL  14   4.495  -1.812   2.500
  122   2HG2  VAL  14          HG22      VAL  14   3.713  -3.115   3.395
  123   3HG2  VAL  14          HG23      VAL  14   3.483  -1.440   3.895
  124    H    VAL  15           HN       VAL  15   1.422  -4.594   2.517
  125    HA   VAL  15           HA       VAL  15   1.512  -5.297   5.434
  126    HB   VAL  15           HB       VAL  15   0.220  -6.773   3.114
  127   1HG1  VAL  15          HG11      VAL  15   0.061  -8.569   4.468
  128   2HG1  VAL  15          HG12      VAL  15  -0.558  -7.582   5.791
  129   3HG1  VAL  15          HG13      VAL  15   1.181  -7.760   5.563
  130   1HG2  VAL  15          HG21      VAL  15  -1.460  -5.303   3.506
  131   2HG2  VAL  15          HG22      VAL  15  -0.711  -4.723   4.994
  132   3HG2  VAL  15          HG23      VAL  15  -1.709  -6.177   5.016
  133    H    TYR  16           HN       TYR  16   3.684  -5.798   5.711
  134    HA   TYR  16           HA       TYR  16   4.980  -7.551   3.656
  135   1HB   TYR  16          HB2       TYR  16   5.932  -5.279   4.119
  136   2HB   TYR  16          HB1       TYR  16   6.191  -5.767   5.793
  137    HD1  TYR  16           HD1      TYR  16   8.601  -5.595   5.785
  138    HD2  TYR  16           HD2      TYR  16   6.577  -8.051   2.897
  139    HE1  TYR  16           HE1      TYR  16  10.762  -6.631   5.149
  140    HE2  TYR  16           HE2      TYR  16   8.738  -9.087   2.266
  141    HH   TYR  16           HH       TYR  16  11.097  -8.621   2.361
  142    H    GLN  17           HN       GLN  17   5.399  -9.634   4.291
  143    HA   GLN  17           HA       GLN  17   5.755 -11.499   5.701
  144   1HB   GLN  17          HB2       GLN  17   6.323  -9.428   7.831
  145   2HB   GLN  17          HB1       GLN  17   7.018 -11.044   7.676
  146   1HG   GLN  17          HG2       GLN  17   7.602  -9.778   5.244
  147   2HG   GLN  17          HG1       GLN  17   7.899  -8.549   6.474
  148   1HE2  GLN  17          HE21      GLN  17   9.105 -11.508   5.095
  149   2HE2  GLN  17          HE22      GLN  17  10.428 -11.698   6.141
  150    H    GLY  18           HN       GLY  18   3.105 -10.105   5.524
  151   1HA   GLY  18          HA2       GLY  18   0.988 -10.462   6.483
  152   2HA   GLY  18          HA1       GLY  18   1.756 -11.566   7.624
  153    H    GLU  19           HN       GLU  19   2.905  -8.282   7.271
  154    HA   GLU  19           HA       GLU  19   1.626  -7.592   9.897
  155   1HB   GLU  19          HB2       GLU  19   4.434  -6.959   8.932
  156   2HB   GLU  19          HB1       GLU  19   3.769  -6.577  10.520
  157   1HG   GLU  19          HG2       GLU  19   3.264  -9.272  10.337
  158   2HG   GLU  19          HG1       GLU  19   4.803  -9.134   9.488
  159    H    ARG  20           HN       ARG  20   0.434  -5.738   9.720
  160    HA   ARG  20           HA       ARG  20   0.532  -4.094   7.309
  161   1HB   ARG  20          HB2       ARG  20  -0.871  -3.640   9.958
  162   2HB   ARG  20          HB1       ARG  20  -1.319  -2.955   8.394
  163   1HG   ARG  20          HG2       ARG  20  -1.751  -5.238   7.532
  164   2HG   ARG  20          HG1       ARG  20  -1.343  -5.902   9.115
  165   1HD   ARG  20          HD2       ARG  20  -3.491  -3.792   8.832
  166   2HD   ARG  20          HD1       ARG  20  -3.857  -5.517   8.631
  167    HE   ARG  20           HE       ARG  20  -2.291  -4.863  11.033
  168   1HH1  ARG  20          HH11      ARG  20  -5.402  -4.084  10.178
  169   2HH1  ARG  20          HH12      ARG  20  -6.183  -5.028  11.403
  170   1HH2  ARG  20          HH21      ARG  20  -3.278  -6.655  12.372
  171   2HH2  ARG  20          HH22      ARG  20  -4.980  -6.483  12.645
  172    H    VAL  21           HN       VAL  21   1.685  -2.202   7.050
  173    HA   VAL  21           HA       VAL  21   2.559  -0.628   9.381
  174    HB   VAL  21           HB       VAL  21   4.990  -0.889   8.523
  175   1HG1  VAL  21          HG11      VAL  21   5.358  -2.588  10.081
  176   2HG1  VAL  21          HG12      VAL  21   3.902  -3.467   9.615
  177   3HG1  VAL  21          HG13      VAL  21   3.772  -1.995  10.576
  178   1HG2  VAL  21          HG21      VAL  21   4.511  -3.598   7.625
  179   2HG2  VAL  21          HG22      VAL  21   5.372  -2.297   6.801
  180   3HG2  VAL  21          HG23      VAL  21   3.627  -2.461   6.608
  181    H    LYS  22           HN       LYS  22   3.439   1.453   8.715
  182    HA   LYS  22           HA       LYS  22   2.398   2.359   6.117
  183   1HB   LYS  22          HB2       LYS  22   3.532   3.537   8.629
  184   2HB   LYS  22          HB1       LYS  22   3.512   4.533   7.173
  185   1HG   LYS  22          HG2       LYS  22   1.054   3.053   8.115
  186   2HG   LYS  22          HG1       LYS  22   1.443   4.670   8.700
  187   1HD   LYS  22          HD2       LYS  22   1.554   5.448   6.321
  188   2HD   LYS  22          HD1       LYS  22   1.006   3.850   5.815
  189   1HE   LYS  22          HE2       LYS  22  -1.124   4.560   6.115
  190   2HE   LYS  22          HE1       LYS  22  -0.784   4.699   7.853
  191   1HZ   LYS  22          HZ1       LYS  22   0.359   6.864   7.242
  192   2HZ   LYS  22          HZ2       LYS  22  -1.339   6.861   7.186
  193   3HZ   LYS  22          HZ3       LYS  22  -0.439   6.755   5.749
  194    H    ILE  23           HN       ILE  23   3.740   1.682   4.435
  195    HA   ILE  23           HA       ILE  23   6.449   1.173   4.339
  196    HB   ILE  23           HB       ILE  23   4.841   0.958   2.478
  197   1HG1  ILE  23          HG12      ILE  23   7.265   2.697   1.936
  198   2HG1  ILE  23          HG11      ILE  23   7.175   0.937   1.852
  199   1HG2  ILE  23          HG21      ILE  23   5.078   3.978   2.302
  200   2HG2  ILE  23          HG22      ILE  23   3.663   3.109   2.896
  201   3HG2  ILE  23          HG23      ILE  23   4.156   2.942   1.211
  202   1HD1  ILE  23          HD11      ILE  23   5.533   2.790   0.105
  203   2HD1  ILE  23          HD12      ILE  23   5.674   1.038  -0.042
  204   3HD1  ILE  23          HD13      ILE  23   7.061   2.068  -0.395
  205    H    GLN  24           HN       GLN  24   4.917   4.348   4.536
  206    HA   GLN  24           HA       GLN  24   7.227   5.932   3.878
  207   1HB   GLN  24          HB2       GLN  24   5.871   7.712   4.999
  208   2HB   GLN  24          HB1       GLN  24   4.923   6.761   3.849
  209   1HG   GLN  24          HG2       GLN  24   3.563   5.981   5.474
  210   2HG   GLN  24          HG1       GLN  24   4.926   5.574   6.517
  211   1HE2  GLN  24          HE21      GLN  24   2.558   6.777   7.585
  212   2HE2  GLN  24          HE22      GLN  24   2.944   8.341   8.119
  213    H    GLU  25           HN       GLU  25   6.360   4.125   6.702
  214    HA   GLU  25           HA       GLU  25   8.318   5.628   8.384
  215   1HB   GLU  25          HB2       GLU  25   6.061   3.685   8.893
  216   2HB   GLU  25          HB1       GLU  25   7.201   4.131  10.163
  217   1HG   GLU  25          HG2       GLU  25   5.702   6.195   8.539
  218   2HG   GLU  25          HG1       GLU  25   5.062   5.528  10.041
  219    H    LYS  26           HN       LYS  26   7.417   2.228   7.649
  220    HA   LYS  26           HA       LYS  26   9.815   1.089   8.759
  221   1HB   LYS  26          HB2       LYS  26   7.599  -0.028   8.293
  222   2HB   LYS  26          HB1       LYS  26   8.007   0.018   6.575
  223   1HG   LYS  26          HG2       LYS  26   9.288  -1.818   6.786
  224   2HG   LYS  26          HG1       LYS  26  10.232  -1.049   8.063
  225   1HD   LYS  26          HD2       LYS  26   8.393  -1.654   9.678
  226   2HD   LYS  26          HD1       LYS  26   7.642  -2.588   8.383
  227   1HE   LYS  26          HE2       LYS  26   9.494  -4.101   8.264
  228   2HE   LYS  26          HE1       LYS  26  10.509  -3.042   9.264
  229   1HZ   LYS  26          HZ1       LYS  26   9.177  -3.414  11.136
  230   2HZ   LYS  26          HZ2       LYS  26   9.362  -4.956  10.447
  231   3HZ   LYS  26          HZ3       LYS  26   7.916  -4.092  10.227
  232    H    PHE  27           HN       PHE  27   9.121   2.640   5.726
  233    HA   PHE  27           HA       PHE  27  11.852   1.881   4.746
  234   1HB   PHE  27          HB2       PHE  27   9.178   2.033   3.340
  235   2HB   PHE  27          HB1       PHE  27  10.704   2.044   2.448
  236    HD1  PHE  27           HD1      PHE  27  12.405   0.225   3.939
  237    HD2  PHE  27           HD2      PHE  27   8.213  -0.086   3.056
  238    HE1  PHE  27           HE1      PHE  27  12.545  -2.241   4.149
  239    HE2  PHE  27           HE2      PHE  27   8.353  -2.554   3.266
  240    HZ   PHE  27           HZ       PHE  27  10.519  -3.632   3.813
  241    H    LYS  28           HN       LYS  28  11.561   4.190   6.231
  242    HA   LYS  28           HA       LYS  28  10.753   6.589   5.078
  243   1HB   LYS  28          HB2       LYS  28  13.308   5.930   6.582
  244   2HB   LYS  28          HB1       LYS  28  12.650   7.555   6.390
  245   1HG   LYS  28          HG2       LYS  28  10.914   5.374   7.511
  246   2HG   LYS  28          HG1       LYS  28  12.078   6.189   8.557
  247   1HD   LYS  28          HD2       LYS  28  10.662   8.136   6.963
  248   2HD   LYS  28          HD1       LYS  28   9.511   7.109   7.819
  249   1HE   LYS  28          HE2       LYS  28  10.453   7.653   9.951
  250   2HE   LYS  28          HE1       LYS  28  11.889   8.384   9.205
  251   1HZ   LYS  28          HZ1       LYS  28   9.870   9.868   9.923
  252   2HZ   LYS  28          HZ2       LYS  28   9.239   9.373   8.427
  253   3HZ   LYS  28          HZ3       LYS  28  10.722  10.199   8.495
  254    H    ASN  29           HN       ASN  29  13.731   4.760   4.387
  255    HA   ASN  29           HA       ASN  29  14.430   6.704   2.237
  256   1HB   ASN  29          HB2       ASN  29  15.852   4.500   3.737
  257   2HB   ASN  29          HB1       ASN  29  16.558   5.240   2.297
  258   1HD2  ASN  29          HD21      ASN  29  16.129   5.623   5.696
  259   2HD2  ASN  29          HD22      ASN  29  16.719   7.210   5.817
  260    H    GLY  30           HN       GLY  30  12.180   5.139   1.628
  261   1HA   GLY  30          HA2       GLY  30  11.431   3.910  -0.244
  262   2HA   GLY  30          HA1       GLY  30  13.111   3.748  -0.756
  263    H    MET  31           HN       MET  31  11.823   1.497  -1.127
  264    HA   MET  31           HA       MET  31  12.106  -0.196   1.320
  265   1HB   MET  31          HB2       MET  31  10.821  -0.688  -1.390
  266   2HB   MET  31          HB1       MET  31  10.730  -1.773  -0.002
  267   1HG   MET  31          HG2       MET  31   9.861   0.460   1.193
  268   2HG   MET  31          HG1       MET  31   9.367   0.841  -0.455
  269   1HE   MET  31          HE1       MET  31   6.867  -1.752  -1.478
  270   2HE   MET  31          HE2       MET  31   8.546  -1.478  -1.936
  271   3HE   MET  31          HE3       MET  31   7.475  -0.103  -1.676
  272    H    LEU  32           HN       LEU  32  12.860  -2.557   0.619
  273    HA   LEU  32           HA       LEU  32  15.522  -2.246  -0.611
  274   1HB   LEU  32          HB2       LEU  32  14.115  -4.672   0.539
  275   2HB   LEU  32          HB1       LEU  32  15.854  -4.484   0.285
  276    HG   LEU  32           HG       LEU  32  14.099  -2.982   2.243
  277   1HD1  LEU  32          HD11      LEU  32  15.551  -5.338   2.473
  278   2HD1  LEU  32          HD12      LEU  32  15.034  -4.315   3.814
  279   3HD1  LEU  32          HD13      LEU  32  16.647  -4.119   3.127
  280   1HD2  LEU  32          HD21      LEU  32  16.529  -2.008   2.775
  281   2HD2  LEU  32          HD22      LEU  32  15.473  -1.239   1.591
  282   3HD2  LEU  32          HD23      LEU  32  16.761  -2.317   1.054
  283    H    HIS  33           HN       HIS  33  16.223  -3.911  -2.257
  284    HA   HIS  33           HA       HIS  33  14.356  -4.000  -4.487
  285   1HB   HIS  33          HB2       HIS  33  16.663  -3.687  -4.956
  286   2HB   HIS  33          HB1       HIS  33  17.137  -5.019  -3.899
  287    HD1  HIS  33           HD1      HIS  33  15.473  -4.357  -7.237
  288    HD2  HIS  33           HD2      HIS  33  17.133  -7.543  -5.123
  289    HE1  HIS  33           HE1      HIS  33  15.580  -6.308  -8.849
  290    H    GLY  34           HN       GLY  34  13.142  -5.756  -5.192
  291   1HA   GLY  34          HA2       GLY  34  12.373  -7.993  -5.307
  292   2HA   GLY  34          HA1       GLY  34  13.672  -8.460  -4.211
  293    H    ASP  35           HN       ASP  35  12.485  -6.044  -2.496
  294    HA   ASP  35           HA       ASP  35  11.227  -7.537  -0.491
  295   1HB   ASP  35          HB2       ASP  35  11.707  -4.814  -1.194
  296   2HB   ASP  35          HB1       ASP  35  10.021  -4.935  -0.691
  297    H    LYS  36           HN       LYS  36   8.951  -7.822   0.056
  298    HA   LYS  36           HA       LYS  36   7.089  -7.603  -2.288
  299   1HB   LYS  36          HB2       LYS  36   7.735  -9.839  -0.389
  300   2HB   LYS  36          HB1       LYS  36   6.120  -9.750  -1.094
  301   1HG   LYS  36          HG2       LYS  36   7.792  -9.292  -3.265
  302   2HG   LYS  36          HG1       LYS  36   8.647 -10.531  -2.344
  303   1HD   LYS  36          HD2       LYS  36   6.632 -11.929  -2.306
  304   2HD   LYS  36          HD1       LYS  36   5.735 -10.683  -3.174
  305   1HE   LYS  36          HE2       LYS  36   7.345 -10.897  -5.080
  306   2HE   LYS  36          HE1       LYS  36   8.125 -12.240  -4.221
  307   1HZ   LYS  36          HZ1       LYS  36   6.475 -13.200  -5.601
  308   2HZ   LYS  36          HZ2       LYS  36   5.304 -12.064  -5.126
  309   3HZ   LYS  36          HZ3       LYS  36   5.851 -13.239  -4.026
  310    H    VAL  37           HN       VAL  37   5.328  -6.366  -1.788
  311    HA   VAL  37           HA       VAL  37   4.325  -6.364   1.028
  312    HB   VAL  37           HB       VAL  37   4.076  -3.821   0.665
  313   1HG1  VAL  37          HG11      VAL  37   5.751  -4.825   2.169
  314   2HG1  VAL  37          HG12      VAL  37   6.419  -3.422   1.337
  315   3HG1  VAL  37          HG13      VAL  37   6.846  -5.048   0.806
  316   1HG2  VAL  37          HG21      VAL  37   6.371  -3.966  -1.205
  317   2HG2  VAL  37          HG22      VAL  37   5.026  -2.827  -1.160
  318   3HG2  VAL  37          HG23      VAL  37   4.810  -4.417  -1.891
  319    H    SER  38           HN       SER  38   2.070  -6.059   1.176
  320    HA   SER  38           HA       SER  38   0.598  -6.140  -1.429
  321   1HB   SER  38          HB2       SER  38  -0.719  -6.763   1.161
  322   2HB   SER  38          HB1       SER  38  -0.820  -7.612  -0.383
  323    HG   SER  38           HG       SER  38   0.359  -8.714   1.339
  324    H    PHE  39           HN       PHE  39  -0.935  -4.545  -1.864
  325    HA   PHE  39           HA       PHE  39  -1.100  -2.285   0.076
  326   1HB   PHE  39          HB2       PHE  39  -1.597  -2.679  -2.877
  327   2HB   PHE  39          HB1       PHE  39  -2.146  -1.220  -2.046
  328    HD1  PHE  39           HD1      PHE  39  -0.628   0.520  -1.488
  329    HD2  PHE  39           HD2      PHE  39   0.865  -3.298  -2.772
  330    HE1  PHE  39           HE1      PHE  39   1.662   1.463  -1.632
  331    HE2  PHE  39           HE2      PHE  39   3.155  -2.355  -2.914
  332    HZ   PHE  39           HZ       PHE  39   3.551   0.025  -2.345
  333    H    PHE  40           HN       PHE  40  -3.137  -1.574   0.861
  334    HA   PHE  40           HA       PHE  40  -5.255  -3.590   0.912
  335   1HB   PHE  40          HB2       PHE  40  -4.694  -0.894   2.112
  336   2HB   PHE  40          HB1       PHE  40  -6.329  -1.558   2.218
  337    HD1  PHE  40           HD1      PHE  40  -6.145  -4.314   2.682
  338    HD2  PHE  40           HD2      PHE  40  -3.456  -1.258   4.049
  339    HE1  PHE  40           HE1      PHE  40  -5.432  -5.779   4.552
  340    HE2  PHE  40           HE2      PHE  40  -2.742  -2.722   5.920
  341    HZ   PHE  40           HZ       PHE  40  -3.730  -4.983   6.171
  342    H    CYS  41           HN       CYS  41  -7.146  -3.571  -0.253
  343    HA   CYS  41           HA       CYS  41  -7.851  -1.133  -1.827
  344   1HB   CYS  41          HB2       CYS  41  -7.471  -3.975  -2.811
  345   2HB   CYS  41          HB1       CYS  41  -8.289  -2.727  -3.758
  346    H    LYS  42           HN       LYS  42 -10.158  -1.417  -2.734
  347    HA   LYS  42           HA       LYS  42 -11.820  -2.862  -0.702
  348   1HB   LYS  42          HB2       LYS  42 -13.532  -1.131  -1.480
  349   2HB   LYS  42          HB1       LYS  42 -12.116  -0.486  -0.643
  350   1HG   LYS  42          HG2       LYS  42 -11.094   0.194  -2.694
  351   2HG   LYS  42          HG1       LYS  42 -12.254  -0.725  -3.655
  352   1HD   LYS  42          HD2       LYS  42 -13.217   1.359  -3.838
  353   2HD   LYS  42          HD1       LYS  42 -13.988   0.835  -2.339
  354   1HE   LYS  42          HE2       LYS  42 -13.097   2.683  -1.365
  355   2HE   LYS  42          HE1       LYS  42 -11.508   1.912  -1.546
  356   1HZ   LYS  42          HZ1       LYS  42 -12.729   3.178  -3.892
  357   2HZ   LYS  42          HZ2       LYS  42 -11.087   2.996  -3.496
  358   3HZ   LYS  42          HZ3       LYS  42 -12.024   4.184  -2.722
  359    H    ASN  43           HN       ASN  43 -13.517  -4.175  -1.417
  360    HA   ASN  43           HA       ASN  43 -13.504  -4.847  -4.337
  361   1HB   ASN  43          HB2       ASN  43 -12.914  -6.443  -2.287
  362   2HB   ASN  43          HB1       ASN  43 -14.673  -6.590  -2.196
  363   1HD2  ASN  43          HD21      ASN  43 -15.573  -6.747  -4.728
  364   2HD2  ASN  43          HD22      ASN  43 -14.817  -7.988  -5.605
  365    H    LYS  44           HN       LYS  44 -15.444  -4.683  -5.460
  366    HA   LYS  44           HA       LYS  44 -17.720  -3.410  -4.069
  367   1HB   LYS  44          HB2       LYS  44 -16.608  -3.666  -6.765
  368   2HB   LYS  44          HB1       LYS  44 -18.364  -3.843  -6.743
  369   1HG   LYS  44          HG2       LYS  44 -17.592  -1.684  -4.995
  370   2HG   LYS  44          HG1       LYS  44 -16.884  -1.437  -6.592
  371   1HD   LYS  44          HD2       LYS  44 -18.955  -1.333  -7.647
  372   2HD   LYS  44          HD1       LYS  44 -19.756  -2.279  -6.392
  373   1HE   LYS  44          HE2       LYS  44 -19.844  -0.432  -4.896
  374   2HE   LYS  44          HE1       LYS  44 -18.645   0.484  -5.833
  375   1HZ   LYS  44          HZ1       LYS  44 -20.491   1.377  -6.753
  376   2HZ   LYS  44          HZ2       LYS  44 -21.475   0.045  -6.371
  377   3HZ   LYS  44          HZ3       LYS  44 -20.439  -0.019  -7.717
  378    H    GLU  45           HN       GLU  45 -17.477  -6.112  -6.420
  379    HA   GLU  45           HA       GLU  45 -20.001  -7.256  -5.986
  380   1HB   GLU  45          HB2       GLU  45 -18.574  -7.959  -7.780
  381   2HB   GLU  45          HB1       GLU  45 -17.294  -8.432  -6.661
  382   1HG   GLU  45          HG2       GLU  45 -18.333 -10.400  -6.083
  383   2HG   GLU  45          HG1       GLU  45 -19.951  -9.729  -6.298
  384    H    LYS  46           HN       LYS  46 -17.217  -7.292  -3.880
  385    HA   LYS  46           HA       LYS  46 -18.484  -9.411  -2.187
  386   1HB   LYS  46          HB2       LYS  46 -15.703  -8.323  -2.584
  387   2HB   LYS  46          HB1       LYS  46 -16.103  -9.227  -1.120
  388   1HG   LYS  46          HG2       LYS  46 -16.379 -11.209  -2.250
  389   2HG   LYS  46          HG1       LYS  46 -16.963 -10.415  -3.713
  390   1HD   LYS  46          HD2       LYS  46 -14.885 -10.290  -4.600
  391   2HD   LYS  46          HD1       LYS  46 -14.183  -9.736  -3.079
  392   1HE   LYS  46          HE2       LYS  46 -14.686 -12.299  -2.395
  393   2HE   LYS  46          HE1       LYS  46 -14.436 -12.508  -4.140
  394   1HZ   LYS  46          HZ1       LYS  46 -12.305 -12.580  -3.120
  395   2HZ   LYS  46          HZ2       LYS  46 -12.616 -11.182  -2.205
  396   3HZ   LYS  46          HZ3       LYS  46 -12.428 -11.074  -3.890
  397    H    LYS  47           HN       LYS  47 -17.626  -6.031  -2.297
  398    HA   LYS  47           HA       LYS  47 -18.201  -4.276  -0.823
  399   1HB   LYS  47          HB2       LYS  47 -19.576  -6.395   0.829
  400   2HB   LYS  47          HB1       LYS  47 -20.009  -4.693   0.656
  401   1HG   LYS  47          HG2       LYS  47 -20.050  -5.671  -1.958
  402   2HG   LYS  47          HG1       LYS  47 -20.777  -6.963  -1.001
  403   1HD   LYS  47          HD2       LYS  47 -21.970  -4.777   0.111
  404   2HD   LYS  47          HD1       LYS  47 -21.782  -4.238  -1.558
  405   1HE   LYS  47          HE2       LYS  47 -23.806  -5.359  -1.758
  406   2HE   LYS  47          HE1       LYS  47 -22.710  -6.727  -2.034
  407   1HZ   LYS  47          HZ1       LYS  47 -23.141  -6.088   0.748
  408   2HZ   LYS  47          HZ2       LYS  47 -23.150  -7.596  -0.032
  409   3HZ   LYS  47          HZ3       LYS  47 -24.538  -6.617  -0.053
  410    H    CYS  48           HN       CYS  48 -15.762  -5.978  -0.437
  411    HA   CYS  48           HA       CYS  48 -15.254  -5.214   2.407
  412   1HB   CYS  48          HB2       CYS  48 -14.038  -7.745   1.433
  413   2HB   CYS  48          HB1       CYS  48 -14.624  -7.332   3.040
  414    H    SER  49           HN       SER  49 -12.720  -5.650   2.764
  415    HA   SER  49           HA       SER  49 -11.333  -4.481   0.380
  416   1HB   SER  49          HB2       SER  49  -9.720  -3.954   2.488
  417   2HB   SER  49          HB1       SER  49 -11.048  -2.899   2.014
  418    HG   SER  49           HG       SER  49 -10.758  -4.006   4.313
  419    H    TYR  50           HN       TYR  50  -8.926  -5.080   0.373
  420    HA   TYR  50           HA       TYR  50  -8.184  -7.631   1.626
  421   1HB   TYR  50          HB2       TYR  50  -7.853  -8.650  -0.715
  422   2HB   TYR  50          HB1       TYR  50  -9.521  -8.503  -0.152
  423    HD1  TYR  50           HD1      TYR  50 -11.020  -6.795  -1.069
  424    HD2  TYR  50           HD2      TYR  50  -6.982  -7.205  -2.475
  425    HE1  TYR  50           HE1      TYR  50 -11.560  -5.378  -3.032
  426    HE2  TYR  50           HE2      TYR  50  -7.521  -5.789  -4.437
  427    HH   TYR  50           HH       TYR  50  -9.271  -4.936  -5.663
  428    H    THR  51           HN       THR  51  -5.978  -8.341   0.331
  429    HA   THR  51           HA       THR  51  -4.371  -5.817   0.105
  430    HB   THR  51           HB       THR  51  -2.502  -7.503   0.749
  431    HG1  THR  51           HG1      THR  51  -3.588  -9.402   0.477
  432   1HG2  THR  51          HG21      THR  51  -2.898  -7.108   3.067
  433   2HG2  THR  51          HG22      THR  51  -4.645  -7.046   2.832
  434   3HG2  THR  51          HG23      THR  51  -3.627  -5.743   2.221
  435    H    GLU  52           HN       GLU  52  -2.910  -5.650  -1.612
  436    HA   GLU  52           HA       GLU  52  -3.136  -7.747  -3.747
  437   1HB   GLU  52          HB2       GLU  52  -3.848  -5.063  -3.755
  438   2HB   GLU  52          HB1       GLU  52  -2.254  -5.051  -4.514
  439   1HG   GLU  52          HG2       GLU  52  -4.694  -6.628  -5.367
  440   2HG   GLU  52          HG1       GLU  52  -3.837  -5.387  -6.283
  441    H    ASP  53           HN       ASP  53  -1.270  -8.872  -2.850
  442    HA   ASP  53           HA       ASP  53   1.176  -7.976  -2.018
  443   1HB   ASP  53          HB2       ASP  53   0.714 -10.147  -4.078
  444   2HB   ASP  53          HB1       ASP  53   2.074 -10.040  -2.954
  445    H    ALA  54           HN       ALA  54   3.035  -7.142  -2.916
  446    HA   ALA  54           HA       ALA  54   3.090  -6.563  -5.848
  447   1HB   ALA  54          HB1       ALA  54   4.206  -4.344  -4.515
  448   2HB   ALA  54          HB2       ALA  54   2.740  -4.732  -3.616
  449   3HB   ALA  54          HB3       ALA  54   2.651  -4.397  -5.345
  450    H    GLN  55           HN       GLN  55   5.429  -5.777  -6.423
  451    HA   GLN  55           HA       GLN  55   7.410  -7.121  -4.613
  452   1HB   GLN  55          HB2       GLN  55   6.605  -8.351  -6.745
  453   2HB   GLN  55          HB1       GLN  55   7.550  -7.149  -7.626
  454   1HG   GLN  55          HG2       GLN  55   9.558  -7.775  -6.343
  455   2HG   GLN  55          HG1       GLN  55   8.619  -8.972  -5.452
  456   1HE2  GLN  55          HE21      GLN  55  10.724 -10.053  -6.792
  457   2HE2  GLN  55          HE22      GLN  55  10.226 -10.839  -8.212
  458    H    CYS  56           HN       CYS  56   9.565  -6.249  -4.725
  459    HA   CYS  56           HA       CYS  56   9.659  -3.416  -5.659
  460   1HB   CYS  56          HB2       CYS  56  10.343  -4.816  -3.297
  461   2HB   CYS  56          HB1       CYS  56  11.868  -4.335  -4.033
  462    H    ILE  57           HN       ILE  57  11.331  -2.775  -7.078
  463    HA   ILE  57           HA       ILE  57  13.195  -4.920  -8.027
  464    HB   ILE  57           HB       ILE  57  11.832  -2.909  -9.829
  465   1HG1  ILE  57          HG12      ILE  57  10.136  -4.295  -8.572
  466   2HG1  ILE  57          HG11      ILE  57  10.119  -4.554 -10.317
  467   1HG2  ILE  57          HG21      ILE  57  13.263  -3.871 -11.287
  468   2HG2  ILE  57          HG22      ILE  57  12.297  -5.339 -11.135
  469   3HG2  ILE  57          HG23      ILE  57  13.720  -5.110 -10.119
  470   1HD1  ILE  57          HD11      ILE  57  10.833  -6.704 -10.127
  471   2HD1  ILE  57          HD12      ILE  57  10.277  -6.564  -8.460
  472   3HD1  ILE  57          HD13      ILE  57  11.979  -6.310  -8.847
  473    H    ASP  58           HN       ASP  58  14.913  -3.807  -9.514
  474    HA   ASP  58           HA       ASP  58  16.657  -2.193  -8.166
  475   1HB   ASP  58          HB2       ASP  58  16.547  -3.233 -10.617
  476   2HB   ASP  58          HB1       ASP  58  16.175  -1.561 -11.050
  477    H    GLY  59           HN       GLY  59  15.757  -0.525  -6.905
  478   1HA   GLY  59          HA2       GLY  59  14.692   1.524  -6.430
  479   2HA   GLY  59          HA1       GLY  59  15.621   2.064  -7.825
  480    H    THR  60           HN       THR  60  13.151  -0.378  -8.255
  481    HA   THR  60           HA       THR  60  11.260   1.702  -9.273
  482    HB   THR  60           HB       THR  60  12.319  -0.715 -10.759
  483    HG1  THR  60           HG1      THR  60  13.528   0.681 -11.768
  484   1HG2  THR  60          HG21      THR  60   9.791   0.167 -10.966
  485   2HG2  THR  60          HG22      THR  60  10.698  -0.430 -12.355
  486   3HG2  THR  60          HG23      THR  60  10.572   1.305 -12.064
  487    H    ILE  61           HN       ILE  61   9.070   1.048  -9.160
  488    HA   ILE  61           HA       ILE  61   8.381  -1.726  -8.449
  489    HB   ILE  61           HB       ILE  61   9.037  -0.921  -6.290
  490   1HG1  ILE  61          HG12      ILE  61   6.237  -0.241  -5.827
  491   2HG1  ILE  61          HG11      ILE  61   6.405  -1.656  -6.866
  492   1HG2  ILE  61          HG21      ILE  61   7.574   1.284  -5.612
  493   2HG2  ILE  61          HG22      ILE  61   7.882   1.598  -7.319
  494   3HG2  ILE  61          HG23      ILE  61   9.231   1.349  -6.211
  495   1HD1  ILE  61          HD11      ILE  61   6.719  -2.830  -4.959
  496   2HD1  ILE  61          HD12      ILE  61   6.988  -1.367  -4.010
  497   3HD1  ILE  61          HD13      ILE  61   8.320  -2.091  -4.912
  498    H    GLU  62           HN       GLU  62   6.161  -2.133  -8.825
  499    HA   GLU  62           HA       GLU  62   4.682   0.104 -10.143
  500   1HB   GLU  62          HB2       GLU  62   4.133  -2.876 -10.195
  501   2HB   GLU  62          HB1       GLU  62   3.545  -1.658 -11.327
  502   1HG   GLU  62          HG2       GLU  62   5.773  -1.271 -12.176
  503   2HG   GLU  62          HG1       GLU  62   6.479  -2.294 -10.925
  504    H    VAL  63           HN       VAL  63   2.140  -0.386  -9.896
  505    HA   VAL  63           HA       VAL  63   1.581  -0.955  -7.009
  506    HB   VAL  63           HB       VAL  63   0.481   1.250  -8.776
  507   1HG1  VAL  63          HG11      VAL  63   0.040   0.614  -5.843
  508   2HG1  VAL  63          HG12      VAL  63  -1.163   0.484  -7.126
  509   3HG1  VAL  63          HG13      VAL  63  -0.538   2.066  -6.660
  510   1HG2  VAL  63          HG21      VAL  63   2.381   2.322  -8.186
  511   2HG2  VAL  63          HG22      VAL  63   2.834   1.033  -7.071
  512   3HG2  VAL  63          HG23      VAL  63   1.762   2.327  -6.534
  513    HA   PRO  64           HA       PRO  64  -1.421  -3.759  -8.698
  514   1HB   PRO  64          HB2       PRO  64  -3.087  -3.469  -6.368
  515   2HB   PRO  64          HB1       PRO  64  -1.978  -4.792  -6.759
  516   1HG   PRO  64          HG2       PRO  64  -1.658  -2.770  -4.749
  517   2HG   PRO  64          HG1       PRO  64  -0.546  -4.079  -5.157
  518   1HD   PRO  64          HD2       PRO  64  -0.237  -1.257  -5.690
  519   2HD   PRO  64          HD1       PRO  64   0.890  -2.577  -6.090
  520    H    LYS  65           HN       LYS  65  -3.513  -3.604  -9.676
  521    HA   LYS  65           HA       LYS  65  -4.460  -0.951 -10.288
  522   1HB   LYS  65          HB2       LYS  65  -4.943  -3.735 -10.999
  523   2HB   LYS  65          HB1       LYS  65  -6.449  -2.818 -10.934
  524   1HG   LYS  65          HG2       LYS  65  -5.689  -2.493 -13.148
  525   2HG   LYS  65          HG1       LYS  65  -5.185  -1.027 -12.309
  526   1HD   LYS  65          HD2       LYS  65  -2.932  -1.773 -12.134
  527   2HD   LYS  65          HD1       LYS  65  -3.368  -3.428 -12.559
  528   1HE   LYS  65          HE2       LYS  65  -4.224  -2.326 -14.802
  529   2HE   LYS  65          HE1       LYS  65  -3.099  -1.030 -14.350
  530   1HZ   LYS  65          HZ1       LYS  65  -1.313  -2.508 -14.256
  531   2HZ   LYS  65          HZ2       LYS  65  -2.149  -2.986 -15.656
  532   3HZ   LYS  65          HZ3       LYS  65  -2.313  -3.878 -14.218
  533    H    CYS  66           HN       CYS  66  -5.683  -3.527  -8.132
  534    HA   CYS  66           HA       CYS  66  -8.160  -2.521  -7.370
  535   1HB   CYS  66          HB2       CYS  66  -7.804  -3.771  -5.338
  536   2HB   CYS  66          HB1       CYS  66  -6.921  -4.610  -6.611
  537    H    PHE  67           HN       PHE  67  -4.977  -1.267  -6.537
  538    HA   PHE  67           HA       PHE  67  -5.724   0.444  -4.368
  539   1HB   PHE  67          HB2       PHE  67  -3.425  -0.319  -5.266
  540   2HB   PHE  67          HB1       PHE  67  -3.588   0.990  -6.436
  541    HD1  PHE  67           HD1      PHE  67  -2.516   2.963  -5.851
  542    HD2  PHE  67           HD2      PHE  67  -4.216   0.513  -2.759
  543    HE1  PHE  67           HE1      PHE  67  -1.753   4.591  -4.141
  544    HE2  PHE  67           HE2      PHE  67  -3.453   2.139  -1.050
  545    HZ   PHE  67           HZ       PHE  67  -2.222   4.179  -1.741
  546    H    LYS  68           HN       LYS  68  -5.312   2.989  -4.798
  547    HA   LYS  68           HA       LYS  68  -6.372   4.038  -7.301
  548   1HB   LYS  68          HB2       LYS  68  -8.395   5.013  -5.838
  549   2HB   LYS  68          HB1       LYS  68  -8.515   3.456  -6.651
  550   1HG   LYS  68          HG2       LYS  68  -9.270   3.185  -4.360
  551   2HG   LYS  68          HG1       LYS  68  -7.723   2.356  -4.535
  552   1HD   LYS  68          HD2       LYS  68  -7.631   3.618  -2.484
  553   2HD   LYS  68          HD1       LYS  68  -6.608   4.450  -3.654
  554   1HE   LYS  68          HE2       LYS  68  -8.612   5.927  -4.200
  555   2HE   LYS  68          HE1       LYS  68  -9.413   5.214  -2.788
  556   1HZ   LYS  68          HZ1       LYS  68  -8.203   6.495  -1.458
  557   2HZ   LYS  68          HZ2       LYS  68  -7.499   7.245  -2.810
  558   3HZ   LYS  68          HZ3       LYS  68  -6.762   5.884  -2.111
  559    H    GLU  69           HN       GLU  69  -4.147   5.001  -6.582
  560    HA   GLU  69           HA       GLU  69  -3.678   6.717  -4.458
  561   1HB   GLU  69          HB2       GLU  69  -2.144   6.125  -6.343
  562   2HB   GLU  69          HB1       GLU  69  -3.043   7.233  -7.381
  563   1HG   GLU  69          HG2       GLU  69  -2.435   9.124  -6.011
  564   2HG   GLU  69          HG1       GLU  69  -1.726   8.073  -4.786
  565    H    HIS  70           HN       HIS  70  -5.903   7.209  -7.121
  566    HA   HIS  70           HA       HIS  70  -6.258  10.080  -6.562
  567   1HB   HIS  70          HB2       HIS  70  -6.627   8.325  -8.706
  568   2HB   HIS  70          HB1       HIS  70  -8.266   8.749  -8.213
  569    HD1  HIS  70           HD1      HIS  70  -8.956  10.546  -9.821
  570    HD2  HIS  70           HD2      HIS  70  -5.116  11.189  -8.331
  571    HE1  HIS  70           HE1      HIS  70  -8.217  12.804 -10.696
  572    H    SER  71           HN       SER  71  -9.072  10.239  -6.863
  573    HA   SER  71           HA       SER  71 -10.944  10.357  -5.407
  574   1HB   SER  71          HB2       SER  71 -10.237   7.696  -6.198
  575   2HB   SER  71          HB1       SER  71 -10.877   7.628  -4.554
  576    HG   SER  71           HG       SER  71 -12.301   7.706  -6.650
  577    H    SER  72           HN       SER  72  -8.806  11.357  -4.019
  578    HA   SER  72           HA       SER  72  -8.811   9.923  -1.387
  579   1HB   SER  72          HB2       SER  72  -6.604  10.176  -2.246
  580   2HB   SER  72          HB1       SER  72  -6.922  11.819  -2.794
  581    HG   SER  72           HG       SER  72  -6.134  10.899  -0.349
  582    H    LEU  73           HN       LEU  73 -10.818  11.952  -2.595
  583    HA   LEU  73           HA       LEU  73 -10.554  14.405  -1.086
  584   1HB   LEU  73          HB2       LEU  73 -12.731  12.961  -2.594
  585   2HB   LEU  73          HB1       LEU  73 -13.076  14.465  -1.734
  586    HG   LEU  73           HG       LEU  73 -12.508  14.971  -4.055
  587   1HD1  LEU  73          HD11      LEU  73 -11.245  16.037  -1.781
  588   2HD1  LEU  73          HD12      LEU  73 -11.399  16.805  -3.362
  589   3HD1  LEU  73          HD13      LEU  73  -9.963  15.855  -2.980
  590   1HD2  LEU  73          HD21      LEU  73  -9.774  13.784  -3.556
  591   2HD2  LEU  73          HD22      LEU  73 -10.498  14.254  -5.094
  592   3HD2  LEU  73          HD23      LEU  73 -11.082  12.823  -4.246
  593    H    ALA  74           HN       ALA  74 -12.183  15.039   0.623
  594    HA   ALA  74           HA       ALA  74 -12.302  12.996   2.724
  595   1HB   ALA  74          HB1       ALA  74 -13.751  15.312   3.439
  596   2HB   ALA  74          HB2       ALA  74 -12.442  15.874   2.399
  597   3HB   ALA  74          HB3       ALA  74 -12.075  14.945   3.853
  598    H    PHE  75           HN       PHE  75 -13.805  11.749   0.994
  599    HA   PHE  75           HA       PHE  75 -16.635  12.639   1.168
  600   1HB   PHE  75          HB2       PHE  75 -14.963  11.234  -0.667
  601   2HB   PHE  75          HB1       PHE  75 -16.238  10.126  -0.161
  602    HD1  PHE  75           HD1      PHE  75 -15.524  13.394  -1.738
  603    HD2  PHE  75           HD2      PHE  75 -18.562  10.536  -0.713
  604    HE1  PHE  75           HE1      PHE  75 -17.135  14.582  -3.201
  605    HE2  PHE  75           HE2      PHE  75 -20.174  11.725  -2.175
  606    HZ   PHE  75           HZ       PHE  75 -19.460  13.748  -3.419
  607    H    TRP  76           HN       TRP  76 -17.939  10.195   1.171
  608    HA   TRP  76           HA       TRP  76 -17.500   9.289   3.970
  609   1HB   TRP  76          HB2       TRP  76 -19.706   9.833   2.252
  610   2HB   TRP  76          HB1       TRP  76 -19.771   8.121   2.675
  611    HD1  TRP  76           HD1      TRP  76 -19.597   7.565   5.368
  612    HE1  TRP  76           HE1      TRP  76 -20.580   8.880   7.360
  613    HE3  TRP  76           HE3      TRP  76 -20.337  12.085   3.141
  614    HZ2  TRP  76           HZ2      TRP  76 -21.552  11.515   7.926
  615    HZ3  TRP  76           HZ3      TRP  76 -21.291  13.984   4.420
  616    HH2  TRP  76           HH2      TRP  76 -21.897  13.705   6.809
  617    H    LYS  77           HN       LYS  77 -15.668   8.370   1.840
  618    HA   LYS  77           HA       LYS  77 -16.441   5.479   1.672
  619   1HB   LYS  77          HB2       LYS  77 -16.003   7.042  -0.380
  620   2HB   LYS  77          HB1       LYS  77 -14.302   6.838   0.045
  621   1HG   LYS  77          HG2       LYS  77 -14.317   4.559  -0.423
  622   2HG   LYS  77          HG1       LYS  77 -16.053   4.410  -0.148
  623   1HD   LYS  77          HD2       LYS  77 -16.048   4.333  -2.452
  624   2HD   LYS  77          HD1       LYS  77 -16.141   6.082  -2.234
  625   1HE   LYS  77          HE2       LYS  77 -13.393   5.464  -2.084
  626   2HE   LYS  77          HE1       LYS  77 -14.022   4.533  -3.458
  627   1HZ   LYS  77          HZ1       LYS  77 -15.276   6.634  -4.051
  628   2HZ   LYS  77          HZ2       LYS  77 -13.598   6.666  -4.312
  629   3HZ   LYS  77          HZ3       LYS  77 -14.265   7.443  -2.956
  630    H    THR  78           HN       THR  78 -15.275   4.129   2.961
  631    HA   THR  78           HA       THR  78 -13.002   5.070   4.516
  632    HB   THR  78           HB       THR  78 -14.181   2.313   4.056
  633    HG1  THR  78           HG1      THR  78 -15.286   2.805   5.996
  634   1HG2  THR  78          HG21      THR  78 -11.804   2.635   5.112
  635   2HG2  THR  78          HG22      THR  78 -12.964   1.565   5.902
  636   3HG2  THR  78          HG23      THR  78 -12.709   3.197   6.519
  637    H    ASP  79           HN       ASP  79 -10.985   5.259   3.602
  638    HA   ASP  79           HA       ASP  79 -10.137   4.254   1.117
  639   1HB   ASP  79          HB2       ASP  79  -7.858   4.674   2.062
  640   2HB   ASP  79          HB1       ASP  79  -8.984   5.989   2.401
  641    H    ALA  80           HN       ALA  80  -9.670   2.207   0.435
  642    HA   ALA  80           HA       ALA  80 -10.084  -0.184   1.719
  643   1HB   ALA  80          HB1       ALA  80  -7.991  -0.859   0.197
  644   2HB   ALA  80          HB2       ALA  80  -8.215   0.788  -0.393
  645   3HB   ALA  80          HB3       ALA  80  -9.532  -0.378  -0.514
  646    H    SER  81           HN       SER  81  -7.278   1.915   2.123
  647    HA   SER  81           HA       SER  81  -5.547   0.085   3.470
  648   1HB   SER  81          HB2       SER  81  -4.695   2.147   2.637
  649   2HB   SER  81          HB1       SER  81  -5.935   3.081   3.468
  650    HG   SER  81           HG       SER  81  -4.174   1.452   4.934
  651    H    ASP  82           HN       ASP  82  -8.554   1.346   4.479
  652    HA   ASP  82           HA       ASP  82  -7.953   0.525   7.289
  653   1HB   ASP  82          HB2       ASP  82  -9.225   3.075   6.281
  654   2HB   ASP  82          HB1       ASP  82  -9.287   2.571   7.969
  655    H    VAL  83           HN       VAL  83  -9.478  -0.747   5.029
  656    HA   VAL  83           HA       VAL  83 -12.265  -0.634   6.113
  657    HB   VAL  83           HB       VAL  83 -11.265  -1.976   3.595
  658   1HG1  VAL  83          HG11      VAL  83 -13.811  -1.663   4.875
  659   2HG1  VAL  83          HG12      VAL  83 -13.443  -2.480   3.355
  660   3HG1  VAL  83          HG13      VAL  83 -13.830  -0.760   3.361
  661   1HG2  VAL  83          HG21      VAL  83 -12.166   0.898   3.963
  662   2HG2  VAL  83          HG22      VAL  83 -11.820   0.124   2.417
  663   3HG2  VAL  83          HG23      VAL  83 -10.525   0.376   3.585
  664    H    LYS  84           HN       LYS  84 -13.385  -2.760   6.330
  665    HA   LYS  84           HA       LYS  84 -11.669  -4.730   7.662
  666   1HB   LYS  84          HB2       LYS  84 -13.964  -3.944   8.388
  667   2HB   LYS  84          HB1       LYS  84 -14.627  -4.813   7.004
  668   1HG   LYS  84          HG2       LYS  84 -14.519  -6.769   8.110
  669   2HG   LYS  84          HG1       LYS  84 -12.811  -6.519   8.470
  670   1HD   LYS  84          HD2       LYS  84 -14.922  -5.036  10.022
  671   2HD   LYS  84          HD1       LYS  84 -14.491  -6.690  10.460
  672   1HE   LYS  84          HE2       LYS  84 -12.239  -4.772  10.016
  673   2HE   LYS  84          HE1       LYS  84 -13.181  -4.605  11.511
  674   1HZ   LYS  84          HZ1       LYS  84 -11.238  -6.310  11.412
  675   2HZ   LYS  84          HZ2       LYS  84 -12.371  -7.282  10.599
  676   3HZ   LYS  84          HZ3       LYS  84 -12.692  -6.735  12.175
  677    HA   PRO  85           HA       PRO  85 -11.033  -7.042   3.874
  678   1HB   PRO  85          HB2       PRO  85 -10.361  -9.363   5.439
  679   2HB   PRO  85          HB1       PRO  85  -9.263  -8.269   4.587
  680   1HG   PRO  85          HG2       PRO  85  -9.666  -8.508   7.421
  681   2HG   PRO  85          HG1       PRO  85  -8.569  -7.420   6.566
  682   1HD   PRO  85          HD2       PRO  85 -11.002  -6.738   7.951
  683   2HD   PRO  85          HD1       PRO  85  -9.910  -5.645   7.066
  684    H    CYS  86           HN       CYS  86 -12.305  -8.579   2.728
  685    HA   CYS  86           HA       CYS  86 -14.959  -9.081   3.534
  686   1HB   CYS  86          HB2       CYS  86 -13.407  -9.470   1.310
  687   2HB   CYS  86          HB1       CYS  86 -13.673 -11.133   1.836
  Start of MODEL    7
    1   1H    THR   1          HT1       THR   1  23.028  -5.870  -7.692
    2   2H    THR   1          HT2       THR   1  22.989  -4.186  -7.911
    3   3H    THR   1          HT3       THR   1  23.814  -5.170  -9.022
    4    HA   THR   1           HA       THR   1  21.632  -4.398  -9.869
    5    HB   THR   1           HB       THR   1  21.818  -7.378  -9.360
    6    HG1  THR   1           HG1      THR   1  23.699  -7.290 -10.243
    7   1HG2  THR   1          HG21      THR   1  21.239  -7.186 -11.933
    8   2HG2  THR   1          HG22      THR   1  20.644  -5.596 -11.459
    9   3HG2  THR   1          HG23      THR   1  19.968  -7.045 -10.718
   10    H    LYS   2           HN       LYS   2  21.596  -4.860  -6.684
   11    HA   LYS   2           HA       LYS   2  18.653  -5.450  -6.585
   12   1HB   LYS   2          HB2       LYS   2  20.764  -6.007  -4.477
   13   2HB   LYS   2          HB1       LYS   2  19.089  -6.563  -4.473
   14   1HG   LYS   2          HG2       LYS   2  20.418  -7.312  -6.942
   15   2HG   LYS   2          HG1       LYS   2  21.301  -7.922  -5.542
   16   1HD   LYS   2          HD2       LYS   2  18.535  -8.317  -5.017
   17   2HD   LYS   2          HD1       LYS   2  18.838  -8.893  -6.657
   18   1HE   LYS   2          HE2       LYS   2  21.036  -9.840  -5.219
   19   2HE   LYS   2          HE1       LYS   2  19.664 -10.076  -4.118
   20   1HZ   LYS   2          HZ1       LYS   2  18.484 -10.825  -6.299
   21   2HZ   LYS   2          HZ2       LYS   2  19.468 -11.918  -5.450
   22   3HZ   LYS   2          HZ3       LYS   2  20.065 -11.131  -6.832
   23    H    ALA   3           HN       ALA   3  19.322  -2.834  -6.989
   24    HA   ALA   3           HA       ALA   3  19.930  -1.307  -4.628
   25   1HB   ALA   3          HB1       ALA   3  19.458  -0.925  -7.382
   26   2HB   ALA   3          HB2       ALA   3  19.951   0.303  -6.217
   27   3HB   ALA   3          HB3       ALA   3  18.240   0.050  -6.558
   28    H    SER   4           HN       SER   4  18.488  -0.238  -3.186
   29    HA   SER   4           HA       SER   4  16.059  -1.574  -2.494
   30   1HB   SER   4          HB2       SER   4  16.043   1.123  -1.563
   31   2HB   SER   4          HB1       SER   4  16.517  -0.321  -0.673
   32    HG   SER   4           HG       SER   4  18.123   1.473  -1.040
   33    H    CYS   5           HN       CYS   5  14.213   0.536  -2.124
   34    HA   CYS   5           HA       CYS   5  13.494   1.223  -4.956
   35   1HB   CYS   5          HB2       CYS   5  11.648   0.651  -2.626
   36   2HB   CYS   5          HB1       CYS   5  11.200   0.791  -4.327
   37    H    LYS   6           HN       LYS   6  11.198   2.768  -4.097
   38    HA   LYS   6           HA       LYS   6  12.344   4.965  -2.447
   39   1HB   LYS   6          HB2       LYS   6  11.610   6.537  -4.338
   40   2HB   LYS   6          HB1       LYS   6  13.036   5.553  -4.666
   41   1HG   LYS   6          HG2       LYS   6  12.009   4.490  -6.368
   42   2HG   LYS   6          HG1       LYS   6  10.594   4.140  -5.374
   43   1HD   LYS   6          HD2       LYS   6   9.440   5.940  -6.158
   44   2HD   LYS   6          HD1       LYS   6  10.871   6.970  -6.178
   45   1HE   LYS   6          HE2       LYS   6  10.855   6.724  -8.439
   46   2HE   LYS   6          HE1       LYS   6  11.366   5.047  -8.164
   47   1HZ   LYS   6          HZ1       LYS   6   8.610   6.099  -8.424
   48   2HZ   LYS   6          HZ2       LYS   6   8.929   4.588  -7.715
   49   3HZ   LYS   6          HZ3       LYS   6   9.355   4.876  -9.335
   50    H    LEU   7           HN       LEU   7  10.719   4.924  -0.893
   51    HA   LEU   7           HA       LEU   7   8.083   4.175  -0.985
   52   1HB   LEU   7          HB2       LEU   7   7.746   5.946   0.762
   53   2HB   LEU   7          HB1       LEU   7   9.223   5.005   1.003
   54    HG   LEU   7           HG       LEU   7   9.837   7.193  -0.733
   55   1HD1  LEU   7          HD11      LEU   7   9.268   9.096   0.662
   56   2HD1  LEU   7          HD12      LEU   7   8.549   8.040   1.878
   57   3HD1  LEU   7          HD13      LEU   7   7.786   8.214   0.298
   58   1HD2  LEU   7          HD21      LEU   7  10.977   5.789   1.349
   59   2HD2  LEU   7          HD22      LEU   7  10.688   7.368   2.079
   60   3HD2  LEU   7          HD23      LEU   7  11.665   7.238   0.616
   61    HA   PRO   8           HA       PRO   8   6.806   6.895  -4.432
   62   1HB   PRO   8          HB2       PRO   8   4.286   5.509  -4.322
   63   2HB   PRO   8          HB1       PRO   8   5.557   5.366  -5.545
   64   1HG   PRO   8          HG2       PRO   8   4.832   3.464  -3.506
   65   2HG   PRO   8          HG1       PRO   8   6.062   3.304  -4.762
   66   1HD   PRO   8          HD2       PRO   8   6.484   3.660  -1.947
   67   2HD   PRO   8          HD1       PRO   8   7.721   3.604  -3.226
   68    H    VAL   9           HN       VAL   9   4.644   5.908  -1.743
   69    HA   VAL   9           HA       VAL   9   3.603   8.720  -1.663
   70    HB   VAL   9           HB       VAL   9   2.347   6.236  -0.481
   71   1HG1  VAL   9          HG11      VAL   9   0.380   7.949  -1.391
   72   2HG1  VAL   9          HG12      VAL   9   1.626   9.062  -0.827
   73   3HG1  VAL   9          HG13      VAL   9   0.954   7.858   0.274
   74   1HG2  VAL   9          HG21      VAL   9   2.296   5.505  -2.655
   75   2HG2  VAL   9          HG22      VAL   9   2.546   7.122  -3.311
   76   3HG2  VAL   9          HG23      VAL   9   0.943   6.631  -2.763
   77    H    LYS  10           HN       LYS  10   3.258   9.629   0.502
   78    HA   LYS  10           HA       LYS  10   5.317   8.722   2.432
   79   1HB   LYS  10          HB2       LYS  10   5.026  10.912   3.360
   80   2HB   LYS  10          HB1       LYS  10   4.919  11.118   1.612
   81   1HG   LYS  10          HG2       LYS  10   2.312  10.596   2.218
   82   2HG   LYS  10          HG1       LYS  10   2.828  11.439   3.680
   83   1HD   LYS  10          HD2       LYS  10   2.367  13.312   2.463
   84   2HD   LYS  10          HD1       LYS  10   3.963  13.014   1.769
   85   1HE   LYS  10          HE2       LYS  10   2.836  11.602  -0.008
   86   2HE   LYS  10          HE1       LYS  10   1.280  12.188   0.614
   87   1HZ   LYS  10          HZ1       LYS  10   1.741  13.844  -0.865
   88   2HZ   LYS  10          HZ2       LYS  10   3.424  13.672  -0.721
   89   3HZ   LYS  10          HZ3       LYS  10   2.543  14.474   0.490
   90    H    LYS  11           HN       LYS  11   2.335   7.656   1.870
   91    HA   LYS  11           HA       LYS  11   1.844   7.008   4.715
   92   1HB   LYS  11          HB2       LYS  11   0.242   8.863   3.003
   93   2HB   LYS  11          HB1       LYS  11  -0.639   7.810   4.110
   94   1HG   LYS  11          HG2       LYS  11   1.301   8.676   5.776
   95   2HG   LYS  11          HG1       LYS  11   1.189  10.075   4.707
   96   1HD   LYS  11          HD2       LYS  11  -1.305  10.052   5.064
   97   2HD   LYS  11          HD1       LYS  11  -1.061   8.803   6.287
   98   1HE   LYS  11          HE2       LYS  11   0.128  10.274   7.720
   99   2HE   LYS  11          HE1       LYS  11   0.424  11.438   6.414
  100   1HZ   LYS  11          HZ1       LYS  11  -1.396  12.369   7.442
  101   2HZ   LYS  11          HZ2       LYS  11  -2.076  10.868   7.859
  102   3HZ   LYS  11          HZ3       LYS  11  -2.154  11.422   6.255
  103    H    ALA  12           HN       ALA  12   2.596   5.357   2.493
  104    HA   ALA  12           HA       ALA  12   0.139   4.011   1.545
  105   1HB   ALA  12          HB1       ALA  12   2.748   2.766   1.031
  106   2HB   ALA  12          HB2       ALA  12   2.698   4.469   0.573
  107   3HB   ALA  12          HB3       ALA  12   1.536   3.336  -0.117
  108    H    THR  13           HN       THR  13  -0.787   2.465   2.835
  109    HA   THR  13           HA       THR  13   0.892   1.080   4.875
  110    HB   THR  13           HB       THR  13  -2.030   0.632   4.731
  111    HG1  THR  13           HG1      THR  13  -2.219   2.852   5.681
  112   1HG2  THR  13          HG21      THR  13  -0.183   0.222   6.611
  113   2HG2  THR  13          HG22      THR  13  -1.846   0.634   7.029
  114   3HG2  THR  13          HG23      THR  13  -0.601   1.883   7.033
  115    H    VAL  14           HN       VAL  14   1.663  -0.910   4.296
  116    HA   VAL  14           HA       VAL  14  -0.018  -2.597   2.469
  117    HB   VAL  14           HB       VAL  14   2.071  -3.342   1.465
  118   1HG1  VAL  14          HG11      VAL  14   2.426  -0.367   1.743
  119   2HG1  VAL  14          HG12      VAL  14   1.001  -1.016   0.931
  120   3HG1  VAL  14          HG13      VAL  14   2.612  -1.375   0.309
  121   1HG2  VAL  14          HG21      VAL  14   3.179  -2.062   3.896
  122   2HG2  VAL  14          HG22      VAL  14   4.109  -1.800   2.420
  123   3HG2  VAL  14          HG23      VAL  14   3.782  -3.441   2.977
  124    H    VAL  15           HN       VAL  15   1.090  -4.986   2.641
  125    HA   VAL  15           HA       VAL  15   1.308  -5.608   5.570
  126    HB   VAL  15           HB       VAL  15   0.045  -7.273   3.371
  127   1HG1  VAL  15          HG11      VAL  15   0.406  -8.787   5.066
  128   2HG1  VAL  15          HG12      VAL  15  -1.100  -8.090   5.660
  129   3HG1  VAL  15          HG13      VAL  15   0.444  -7.541   6.313
  130   1HG2  VAL  15          HG21      VAL  15  -1.318  -5.325   3.533
  131   2HG2  VAL  15          HG22      VAL  15  -1.129  -5.245   5.284
  132   3HG2  VAL  15          HG23      VAL  15  -2.109  -6.521   4.561
  133    H    TYR  16           HN       TYR  16   3.631  -5.744   5.496
  134    HA   TYR  16           HA       TYR  16   4.827  -7.674   3.570
  135   1HB   TYR  16          HB2       TYR  16   5.770  -5.392   3.895
  136   2HB   TYR  16          HB1       TYR  16   6.053  -5.770   5.594
  137    HD1  TYR  16           HD1      TYR  16   8.465  -5.515   5.499
  138    HD2  TYR  16           HD2      TYR  16   6.440  -8.268   2.896
  139    HE1  TYR  16           HE1      TYR  16  10.637  -6.557   4.908
  140    HE2  TYR  16           HE2      TYR  16   8.611  -9.309   2.307
  141    HH   TYR  16           HH       TYR  16  11.202  -9.202   3.936
  142    H    GLN  17           HN       GLN  17   5.517  -9.683   4.257
  143    HA   GLN  17           HA       GLN  17   5.854 -11.520   5.701
  144   1HB   GLN  17          HB2       GLN  17   6.837  -9.068   7.132
  145   2HB   GLN  17          HB1       GLN  17   6.840 -10.618   7.978
  146   1HG   GLN  17          HG2       GLN  17   8.006 -10.384   5.212
  147   2HG   GLN  17          HG1       GLN  17   8.964  -9.952   6.629
  148   1HE2  GLN  17          HE21      GLN  17   9.181 -12.339   4.718
  149   2HE2  GLN  17          HE22      GLN  17   9.160 -13.694   5.738
  150    H    GLY  18           HN       GLY  18   3.166 -10.477   5.593
  151   1HA   GLY  18          HA2       GLY  18   1.139 -10.694   6.752
  152   2HA   GLY  18          HA1       GLY  18   2.012 -11.733   7.879
  153    H    GLU  19           HN       GLU  19   2.888  -8.378   7.234
  154    HA   GLU  19           HA       GLU  19   1.814  -7.611   9.920
  155   1HB   GLU  19          HB2       GLU  19   4.616  -7.330   8.804
  156   2HB   GLU  19          HB1       GLU  19   4.056  -6.417  10.206
  157   1HG   GLU  19          HG2       GLU  19   3.498  -8.533  11.357
  158   2HG   GLU  19          HG1       GLU  19   4.086  -9.440   9.964
  159    H    ARG  20           HN       ARG  20   0.967  -5.529   9.955
  160    HA   ARG  20           HA       ARG  20   0.845  -4.078   7.377
  161   1HB   ARG  20          HB2       ARG  20  -0.470  -3.655  10.078
  162   2HB   ARG  20          HB1       ARG  20  -0.894  -2.796   8.595
  163   1HG   ARG  20          HG2       ARG  20  -2.048  -4.566   7.755
  164   2HG   ARG  20          HG1       ARG  20  -0.859  -5.734   8.332
  165   1HD   ARG  20          HD2       ARG  20  -1.799  -5.228  10.699
  166   2HD   ARG  20          HD1       ARG  20  -3.182  -4.525   9.837
  167    HE   ARG  20           HE       ARG  20  -2.287  -7.243   9.033
  168   1HH1  ARG  20          HH21      ARG  20  -4.902  -5.285   8.922
  169   2HH1  ARG  20          HH22      ARG  20  -6.026  -6.378   9.658
  170   1HH2  ARG  20          HH11      ARG  20  -3.584  -8.609  10.699
  171   2HH2  ARG  20          HH12      ARG  20  -5.280  -8.257  10.666
  172    H    VAL  21           HN       VAL  21   1.933  -2.159   7.007
  173    HA   VAL  21           HA       VAL  21   2.964  -0.537   9.241
  174    HB   VAL  21           HB       VAL  21   5.328  -0.806   8.294
  175   1HG1  VAL  21          HG11      VAL  21   4.263  -3.438   9.292
  176   2HG1  VAL  21          HG12      VAL  21   4.240  -2.020  10.340
  177   3HG1  VAL  21          HG13      VAL  21   5.772  -2.625   9.708
  178   1HG2  VAL  21          HG21      VAL  21   4.206  -1.952   6.184
  179   2HG2  VAL  21          HG22      VAL  21   4.359  -3.409   7.165
  180   3HG2  VAL  21          HG23      VAL  21   5.795  -2.476   6.744
  181    H    LYS  22           HN       LYS  22   3.827   1.525   8.450
  182    HA   LYS  22           HA       LYS  22   2.629   2.322   5.861
  183   1HB   LYS  22          HB2       LYS  22   3.729   3.640   8.326
  184   2HB   LYS  22          HB1       LYS  22   3.572   4.590   6.848
  185   1HG   LYS  22          HG2       LYS  22   1.252   2.920   7.756
  186   2HG   LYS  22          HG1       LYS  22   1.560   4.465   8.551
  187   1HD   LYS  22          HD2       LYS  22   1.753   5.368   6.086
  188   2HD   LYS  22          HD1       LYS  22   0.817   3.924   5.693
  189   1HE   LYS  22          HE2       LYS  22  -0.692   4.750   7.725
  190   2HE   LYS  22          HE1       LYS  22   0.006   6.324   7.294
  191   1HZ   LYS  22          HZ1       LYS  22  -2.014   5.784   5.997
  192   2HZ   LYS  22          HZ2       LYS  22  -1.209   4.436   5.347
  193   3HZ   LYS  22          HZ3       LYS  22  -0.644   6.006   5.022
  194    H    ILE  23           HN       ILE  23   3.961   1.935   4.101
  195    HA   ILE  23           HA       ILE  23   6.691   1.480   3.983
  196    HB   ILE  23           HB       ILE  23   4.906   1.490   2.148
  197   1HG1  ILE  23          HG12      ILE  23   7.550   2.836   1.510
  198   2HG1  ILE  23          HG11      ILE  23   7.335   1.100   1.732
  199   1HG2  ILE  23          HG21      ILE  23   5.745   4.401   1.986
  200   2HG2  ILE  23          HG22      ILE  23   4.173   3.835   2.552
  201   3HG2  ILE  23          HG23      ILE  23   4.655   3.568   0.877
  202   1HD1  ILE  23          HD11      ILE  23   5.535   2.467  -0.216
  203   2HD1  ILE  23          HD12      ILE  23   6.218   0.842  -0.267
  204   3HD1  ILE  23          HD13      ILE  23   7.217   2.233  -0.690
  205    H    GLN  24           HN       GLN  24   5.059   4.584   4.393
  206    HA   GLN  24           HA       GLN  24   7.323   6.286   3.890
  207   1HB   GLN  24          HB2       GLN  24   5.907   7.956   5.009
  208   2HB   GLN  24          HB1       GLN  24   4.922   6.955   3.938
  209   1HG   GLN  24          HG2       GLN  24   3.651   6.297   5.672
  210   2HG   GLN  24          HG1       GLN  24   5.078   5.695   6.519
  211   1HE2  GLN  24          HE21      GLN  24   2.565   7.840   6.894
  212   2HE2  GLN  24          HE22      GLN  24   3.301   8.955   7.942
  213    H    GLU  25           HN       GLU  25   6.441   4.265   6.571
  214    HA   GLU  25           HA       GLU  25   8.445   5.617   8.334
  215   1HB   GLU  25          HB2       GLU  25   6.154   3.700   8.851
  216   2HB   GLU  25          HB1       GLU  25   7.235   4.303  10.106
  217   1HG   GLU  25          HG2       GLU  25   6.516   6.641   8.919
  218   2HG   GLU  25          HG1       GLU  25   5.049   5.692   8.669
  219    H    LYS  26           HN       LYS  26   7.256   2.265   7.897
  220    HA   LYS  26           HA       LYS  26   9.535   0.912   8.818
  221   1HB   LYS  26          HB2       LYS  26   7.408  -0.162   8.352
  222   2HB   LYS  26          HB1       LYS  26   7.541   0.239   6.637
  223   1HG   LYS  26          HG2       LYS  26   8.290  -1.967   6.641
  224   2HG   LYS  26          HG1       LYS  26   9.811  -1.090   6.806
  225   1HD   LYS  26          HD2       LYS  26  10.143  -1.813   8.938
  226   2HD   LYS  26          HD1       LYS  26   8.437  -1.651   9.358
  227   1HE   LYS  26          HE2       LYS  26   8.039  -3.851   8.946
  228   2HE   LYS  26          HE1       LYS  26   8.914  -3.790   7.403
  229   1HZ   LYS  26          HZ1       LYS  26  10.185  -5.149   8.857
  230   2HZ   LYS  26          HZ2       LYS  26  10.071  -4.025  10.127
  231   3HZ   LYS  26          HZ3       LYS  26  10.999  -3.665   8.751
  232    H    PHE  27           HN       PHE  27   8.888   2.238   5.585
  233    HA   PHE  27           HA       PHE  27  11.721   1.582   4.834
  234   1HB   PHE  27          HB2       PHE  27   9.177   1.731   3.183
  235   2HB   PHE  27          HB1       PHE  27  10.788   1.466   2.507
  236    HD1  PHE  27           HD1      PHE  27   7.917  -0.081   4.001
  237    HD2  PHE  27           HD2      PHE  27  12.148  -0.533   3.419
  238    HE1  PHE  27           HE1      PHE  27   7.726  -2.503   4.499
  239    HE2  PHE  27           HE2      PHE  27  11.958  -2.954   3.917
  240    HZ   PHE  27           HZ       PHE  27   9.747  -3.940   4.457
  241    H    LYS  28           HN       LYS  28  10.630   4.045   6.153
  242    HA   LYS  28           HA       LYS  28  10.171   6.227   4.491
  243   1HB   LYS  28          HB2       LYS  28  10.706   7.468   6.380
  244   2HB   LYS  28          HB1       LYS  28  10.507   5.875   7.104
  245   1HG   LYS  28          HG2       LYS  28  13.162   7.022   6.189
  246   2HG   LYS  28          HG1       LYS  28  12.592   7.032   7.857
  247   1HD   LYS  28          HD2       LYS  28  12.260   4.383   6.973
  248   2HD   LYS  28          HD1       LYS  28  13.841   4.883   6.374
  249   1HE   LYS  28          HE2       LYS  28  14.597   4.408   8.473
  250   2HE   LYS  28          HE1       LYS  28  13.783   5.905   8.967
  251   1HZ   LYS  28          HZ1       LYS  28  12.595   3.183   8.878
  252   2HZ   LYS  28          HZ2       LYS  28  11.709   4.603   9.172
  253   3HZ   LYS  28          HZ3       LYS  28  12.910   4.105  10.266
  254    H    ASN  29           HN       ASN  29  13.100   4.361   4.758
  255    HA   ASN  29           HA       ASN  29  14.604   6.410   3.179
  256   1HB   ASN  29          HB2       ASN  29  15.277   4.174   5.066
  257   2HB   ASN  29          HB1       ASN  29  16.485   4.680   3.880
  258   1HD2  ASN  29          HD21      ASN  29  16.185   5.105   6.963
  259   2HD2  ASN  29          HD22      ASN  29  16.456   6.770   7.151
  260    H    GLY  30           HN       GLY  30  12.562   4.704   1.950
  261   1HA   GLY  30          HA2       GLY  30  12.530   3.722  -0.233
  262   2HA   GLY  30          HA1       GLY  30  14.268   3.444  -0.106
  263    H    MET  31           HN       MET  31  12.540   1.400  -0.975
  264    HA   MET  31           HA       MET  31  12.296  -0.413   1.393
  265   1HB   MET  31          HB2       MET  31  11.250  -0.734  -1.438
  266   2HB   MET  31          HB1       MET  31  10.748  -1.639  -0.012
  267   1HG   MET  31          HG2       MET  31   9.544   0.149   0.870
  268   2HG   MET  31          HG1       MET  31  10.496   1.351   0.000
  269   1HE   MET  31          HE1       MET  31   7.050  -0.937  -0.438
  270   2HE   MET  31          HE2       MET  31   8.615  -1.737  -0.321
  271   3HE   MET  31          HE3       MET  31   7.761  -1.713  -1.861
  272    H    LEU  32           HN       LEU  32  12.988  -2.715   0.988
  273    HA   LEU  32           HA       LEU  32  15.664  -2.815  -0.148
  274   1HB   LEU  32          HB2       LEU  32  13.725  -4.721   1.148
  275   2HB   LEU  32          HB1       LEU  32  15.225  -5.328   0.440
  276    HG   LEU  32           HG       LEU  32  15.369  -4.756   2.905
  277   1HD1  LEU  32          HD11      LEU  32  17.579  -4.278   2.623
  278   2HD1  LEU  32          HD12      LEU  32  17.246  -2.875   1.608
  279   3HD1  LEU  32          HD13      LEU  32  17.216  -4.496   0.912
  280   1HD2  LEU  32          HD21      LEU  32  13.921  -2.728   2.765
  281   2HD2  LEU  32          HD22      LEU  32  15.184  -1.920   1.837
  282   3HD2  LEU  32          HD23      LEU  32  15.482  -2.387   3.512
  283    H    HIS  33           HN       HIS  33  16.273  -4.421  -1.849
  284    HA   HIS  33           HA       HIS  33  14.528  -4.228  -4.173
  285   1HB   HIS  33          HB2       HIS  33  16.938  -4.094  -4.377
  286   2HB   HIS  33          HB1       HIS  33  17.133  -5.650  -3.563
  287    HD1  HIS  33           HD1      HIS  33  16.132  -4.123  -6.841
  288    HD2  HIS  33           HD2      HIS  33  16.545  -7.924  -5.181
  289    HE1  HIS  33           HE1      HIS  33  15.994  -5.763  -8.766
  290    H    GLY  34           HN       GLY  34  13.114  -5.784  -4.923
  291   1HA   GLY  34          HA2       GLY  34  12.096  -7.902  -5.168
  292   2HA   GLY  34          HA1       GLY  34  13.392  -8.595  -4.192
  293    H    ASP  35           HN       ASP  35  12.053  -5.908  -2.652
  294    HA   ASP  35           HA       ASP  35  11.002  -7.440  -0.463
  295   1HB   ASP  35          HB2       ASP  35  11.726  -4.829  -1.018
  296   2HB   ASP  35          HB1       ASP  35   9.977  -4.707  -0.830
  297    H    LYS  36           HN       LYS  36   8.974  -8.326  -0.207
  298    HA   LYS  36           HA       LYS  36   6.954  -7.812  -2.338
  299   1HB   LYS  36          HB2       LYS  36   7.575  -9.984  -0.363
  300   2HB   LYS  36          HB1       LYS  36   5.941  -9.867  -1.017
  301   1HG   LYS  36          HG2       LYS  36   7.835  -9.561  -3.160
  302   2HG   LYS  36          HG1       LYS  36   8.216 -11.027  -2.254
  303   1HD   LYS  36          HD2       LYS  36   5.867 -11.763  -2.454
  304   2HD   LYS  36          HD1       LYS  36   5.490 -10.303  -3.370
  305   1HE   LYS  36          HE2       LYS  36   5.897 -11.803  -5.114
  306   2HE   LYS  36          HE1       LYS  36   7.530 -11.150  -4.876
  307   1HZ   LYS  36          HZ1       LYS  36   7.217 -13.690  -4.814
  308   2HZ   LYS  36          HZ2       LYS  36   6.567 -13.428  -3.266
  309   3HZ   LYS  36          HZ3       LYS  36   8.166 -12.966  -3.608
  310    H    VAL  37           HN       VAL  37   5.267  -6.480  -1.866
  311    HA   VAL  37           HA       VAL  37   4.279  -6.332   0.949
  312    HB   VAL  37           HB       VAL  37   4.235  -3.851   0.705
  313   1HG1  VAL  37          HG11      VAL  37   6.155  -4.837   1.808
  314   2HG1  VAL  37          HG12      VAL  37   6.733  -3.540   0.761
  315   3HG1  VAL  37          HG13      VAL  37   6.902  -5.221   0.257
  316   1HG2  VAL  37          HG21      VAL  37   4.275  -3.093  -1.431
  317   2HG2  VAL  37          HG22      VAL  37   4.959  -4.602  -2.035
  318   3HG2  VAL  37          HG23      VAL  37   6.017  -3.359  -1.368
  319    H    SER  38           HN       SER  38   2.029  -6.096   1.059
  320    HA   SER  38           HA       SER  38   0.586  -6.124  -1.560
  321   1HB   SER  38          HB2       SER  38  -0.720  -6.764   1.047
  322   2HB   SER  38          HB1       SER  38  -0.896  -7.556  -0.519
  323    HG   SER  38           HG       SER  38   0.960  -7.954   1.510
  324    H    PHE  39           HN       PHE  39  -1.016  -4.579  -1.972
  325    HA   PHE  39           HA       PHE  39  -1.162  -2.285  -0.069
  326   1HB   PHE  39          HB2       PHE  39  -1.683  -2.737  -3.007
  327   2HB   PHE  39          HB1       PHE  39  -2.272  -1.279  -2.199
  328    HD1  PHE  39           HD1      PHE  39   0.755  -3.220  -3.105
  329    HD2  PHE  39           HD2      PHE  39  -0.762   0.455  -1.480
  330    HE1  PHE  39           HE1      PHE  39   3.015  -2.214  -3.271
  331    HE2  PHE  39           HE2      PHE  39   1.499   1.462  -1.647
  332    HZ   PHE  39           HZ       PHE  39   3.388   0.127  -2.543
  333    H    PHE  40           HN       PHE  40  -3.173  -1.631   0.788
  334    HA   PHE  40           HA       PHE  40  -5.289  -3.655   0.824
  335   1HB   PHE  40          HB2       PHE  40  -4.691  -1.011   2.121
  336   2HB   PHE  40          HB1       PHE  40  -6.318  -1.692   2.253
  337    HD1  PHE  40           HD1      PHE  40  -6.021  -4.501   2.524
  338    HD2  PHE  40           HD2      PHE  40  -3.469  -1.409   4.066
  339    HE1  PHE  40           HE1      PHE  40  -5.235  -6.038   4.304
  340    HE2  PHE  40           HE2      PHE  40  -2.683  -2.946   5.847
  341    HZ   PHE  40           HZ       PHE  40  -3.567  -5.260   5.966
  342    H    CYS  41           HN       CYS  41  -7.247  -3.552  -0.243
  343    HA   CYS  41           HA       CYS  41  -7.934  -1.058  -1.744
  344   1HB   CYS  41          HB2       CYS  41  -7.305  -3.793  -2.728
  345   2HB   CYS  41          HB1       CYS  41  -8.703  -3.010  -3.474
  346    H    LYS  42           HN       LYS  42 -10.308  -1.750  -2.836
  347    HA   LYS  42           HA       LYS  42 -11.904  -2.899  -0.566
  348   1HB   LYS  42          HB2       LYS  42 -13.570  -1.156  -1.075
  349   2HB   LYS  42          HB1       LYS  42 -12.000  -0.432  -0.720
  350   1HG   LYS  42          HG2       LYS  42 -11.828  -0.840  -3.432
  351   2HG   LYS  42          HG1       LYS  42 -13.534  -0.444  -3.234
  352   1HD   LYS  42          HD2       LYS  42 -11.217   1.205  -2.179
  353   2HD   LYS  42          HD1       LYS  42 -12.190   1.596  -3.597
  354   1HE   LYS  42          HE2       LYS  42 -13.942   1.072  -1.361
  355   2HE   LYS  42          HE1       LYS  42 -12.748   2.308  -0.916
  356   1HZ   LYS  42          HZ1       LYS  42 -14.328   3.543  -2.038
  357   2HZ   LYS  42          HZ2       LYS  42 -14.663   2.309  -3.157
  358   3HZ   LYS  42          HZ3       LYS  42 -13.221   3.198  -3.275
  359    H    ASN  43           HN       ASN  43 -13.760  -4.064  -1.153
  360    HA   ASN  43           HA       ASN  43 -13.974  -4.814  -4.055
  361   1HB   ASN  43          HB2       ASN  43 -13.061  -6.413  -2.150
  362   2HB   ASN  43          HB1       ASN  43 -14.777  -6.605  -1.780
  363   1HD2  ASN  43          HD21      ASN  43 -15.405  -6.143  -4.758
  364   2HD2  ASN  43          HD22      ASN  43 -15.048  -7.634  -5.488
  365    H    LYS  44           HN       LYS  44 -15.799  -3.608  -4.669
  366    HA   LYS  44           HA       LYS  44 -18.035  -3.038  -2.956
  367   1HB   LYS  44          HB2       LYS  44 -17.187  -2.705  -5.742
  368   2HB   LYS  44          HB1       LYS  44 -18.930  -2.930  -5.585
  369   1HG   LYS  44          HG2       LYS  44 -19.110  -1.087  -4.045
  370   2HG   LYS  44          HG1       LYS  44 -17.355  -0.952  -3.919
  371   1HD   LYS  44          HD2       LYS  44 -18.707  -0.687  -6.596
  372   2HD   LYS  44          HD1       LYS  44 -18.626   0.693  -5.500
  373   1HE   LYS  44          HE2       LYS  44 -16.413   1.015  -5.917
  374   2HE   LYS  44          HE1       LYS  44 -16.057  -0.717  -5.768
  375   1HZ   LYS  44          HZ1       LYS  44 -17.568   0.345  -8.073
  376   2HZ   LYS  44          HZ2       LYS  44 -16.735  -1.129  -7.941
  377   3HZ   LYS  44          HZ3       LYS  44 -15.873   0.328  -8.081
  378    H    GLU  45           HN       GLU  45 -17.610  -5.475  -5.553
  379    HA   GLU  45           HA       GLU  45 -20.179  -6.674  -5.370
  380   1HB   GLU  45          HB2       GLU  45 -17.804  -6.993  -6.782
  381   2HB   GLU  45          HB1       GLU  45 -17.958  -8.511  -5.897
  382   1HG   GLU  45          HG2       GLU  45 -20.368  -8.604  -6.720
  383   2HG   GLU  45          HG1       GLU  45 -19.956  -7.273  -7.803
  384    H    LYS  46           HN       LYS  46 -17.172  -7.368  -3.577
  385    HA   LYS  46           HA       LYS  46 -18.521  -9.474  -1.998
  386   1HB   LYS  46          HB2       LYS  46 -15.728  -8.293  -2.020
  387   2HB   LYS  46          HB1       LYS  46 -16.216  -9.673  -1.030
  388   1HG   LYS  46          HG2       LYS  46 -17.125 -10.378  -3.544
  389   2HG   LYS  46          HG1       LYS  46 -15.604  -9.558  -3.898
  390   1HD   LYS  46          HD2       LYS  46 -14.349 -11.059  -2.576
  391   2HD   LYS  46          HD1       LYS  46 -15.780 -11.642  -1.725
  392   1HE   LYS  46          HE2       LYS  46 -15.811 -12.013  -4.675
  393   2HE   LYS  46          HE1       LYS  46 -14.649 -13.010  -3.776
  394   1HZ   LYS  46          HZ1       LYS  46 -17.509 -12.683  -3.041
  395   2HZ   LYS  46          HZ2       LYS  46 -16.382 -13.707  -2.290
  396   3HZ   LYS  46          HZ3       LYS  46 -16.887 -14.018  -3.882
  397    H    LYS  47           HN       LYS  47 -17.845  -6.093  -1.795
  398    HA   LYS  47           HA       LYS  47 -18.446  -4.526  -0.126
  399   1HB   LYS  47          HB2       LYS  47 -19.501  -6.871   1.449
  400   2HB   LYS  47          HB1       LYS  47 -20.112  -5.216   1.402
  401   1HG   LYS  47          HG2       LYS  47 -20.349  -5.889  -1.219
  402   2HG   LYS  47          HG1       LYS  47 -20.605  -7.463  -0.467
  403   1HD   LYS  47          HD2       LYS  47 -22.574  -6.828   0.515
  404   2HD   LYS  47          HD1       LYS  47 -22.027  -5.172   0.778
  405   1HE   LYS  47          HE2       LYS  47 -23.251  -4.556  -1.027
  406   2HE   LYS  47          HE1       LYS  47 -22.157  -5.525  -2.036
  407   1HZ   LYS  47          HZ1       LYS  47 -24.457  -6.306  -2.208
  408   2HZ   LYS  47          HZ2       LYS  47 -24.495  -6.580  -0.532
  409   3HZ   LYS  47          HZ3       LYS  47 -23.453  -7.489  -1.520
  410    H    CYS  48           HN       CYS  48 -15.853  -6.017  -0.090
  411    HA   CYS  48           HA       CYS  48 -15.131  -5.394   2.730
  412   1HB   CYS  48          HB2       CYS  48 -14.003  -7.894   1.571
  413   2HB   CYS  48          HB1       CYS  48 -14.395  -7.520   3.245
  414    H    SER  49           HN       SER  49 -12.595  -5.707   2.879
  415    HA   SER  49           HA       SER  49 -11.428  -4.540   0.382
  416   1HB   SER  49          HB2       SER  49  -9.638  -3.967   2.292
  417   2HB   SER  49          HB1       SER  49 -11.069  -2.975   2.039
  418    HG   SER  49           HG       SER  49 -10.417  -4.687   4.101
  419    H    TYR  50           HN       TYR  50  -9.012  -5.118   0.191
  420    HA   TYR  50           HA       TYR  50  -8.214  -7.717   1.329
  421   1HB   TYR  50          HB2       TYR  50  -7.938  -8.600  -1.081
  422   2HB   TYR  50          HB1       TYR  50  -9.585  -8.518  -0.448
  423    HD1  TYR  50           HD1      TYR  50  -7.084  -6.590  -2.451
  424    HD2  TYR  50           HD2      TYR  50 -11.233  -7.250  -1.556
  425    HE1  TYR  50           HE1      TYR  50  -7.724  -5.087  -4.316
  426    HE2  TYR  50           HE2      TYR  50 -11.873  -5.746  -3.421
  427    HH   TYR  50           HH       TYR  50 -10.685  -3.743  -4.658
  428    H    THR  51           HN       THR  51  -6.006  -8.353   0.163
  429    HA   THR  51           HA       THR  51  -4.435  -5.815  -0.100
  430    HB   THR  51           HB       THR  51  -2.550  -7.347   0.634
  431    HG1  THR  51           HG1      THR  51  -3.004  -9.374   1.135
  432   1HG2  THR  51          HG21      THR  51  -4.465  -6.028   2.103
  433   2HG2  THR  51          HG22      THR  51  -3.009  -6.763   2.774
  434   3HG2  THR  51          HG23      THR  51  -4.530  -7.654   2.783
  435    H    GLU  52           HN       GLU  52  -2.969  -5.622  -1.809
  436    HA   GLU  52           HA       GLU  52  -3.174  -7.700  -3.965
  437   1HB   GLU  52          HB2       GLU  52  -2.582  -4.722  -4.111
  438   2HB   GLU  52          HB1       GLU  52  -2.799  -5.802  -5.489
  439   1HG   GLU  52          HG2       GLU  52  -4.952  -5.563  -3.400
  440   2HG   GLU  52          HG1       GLU  52  -4.831  -4.372  -4.695
  441    H    ASP  53           HN       ASP  53  -1.346  -8.906  -3.169
  442    HA   ASP  53           HA       ASP  53   1.094  -8.161  -2.208
  443   1HB   ASP  53          HB2       ASP  53   0.577 -10.094  -4.482
  444   2HB   ASP  53          HB1       ASP  53   1.989 -10.114  -3.421
  445    H    ALA  54           HN       ALA  54   3.010  -7.286  -2.975
  446    HA   ALA  54           HA       ALA  54   3.114  -6.369  -5.821
  447   1HB   ALA  54          HB1       ALA  54   3.224  -4.167  -5.191
  448   2HB   ALA  54          HB2       ALA  54   4.158  -4.532  -3.740
  449   3HB   ALA  54          HB3       ALA  54   2.407  -4.745  -3.739
  450    H    GLN  55           HN       GLN  55   5.491  -5.459  -6.189
  451    HA   GLN  55           HA       GLN  55   7.458  -7.009  -4.557
  452   1HB   GLN  55          HB2       GLN  55   6.556  -8.136  -6.723
  453   2HB   GLN  55          HB1       GLN  55   7.547  -6.947  -7.570
  454   1HG   GLN  55          HG2       GLN  55   9.554  -7.760  -6.590
  455   2HG   GLN  55          HG1       GLN  55   8.676  -8.682  -5.370
  456   1HE2  GLN  55          HE21      GLN  55  10.384  -9.109  -8.183
  457   2HE2  GLN  55          HE22      GLN  55   9.643 -10.526  -8.752
  458    H    CYS  56           HN       CYS  56   9.579  -6.100  -4.573
  459    HA   CYS  56           HA       CYS  56   9.717  -3.296  -5.603
  460   1HB   CYS  56          HB2       CYS  56  10.205  -4.525  -3.123
  461   2HB   CYS  56          HB1       CYS  56  11.802  -4.160  -3.771
  462    H    ILE  57           HN       ILE  57  11.526  -2.687  -6.881
  463    HA   ILE  57           HA       ILE  57  13.461  -4.849  -7.614
  464    HB   ILE  57           HB       ILE  57  11.799  -3.081  -9.438
  465   1HG1  ILE  57          HG12      ILE  57  10.645  -5.071  -8.517
  466   2HG1  ILE  57          HG11      ILE  57  10.923  -5.237 -10.251
  467   1HG2  ILE  57          HG21      ILE  57  12.953  -4.360 -11.272
  468   2HG2  ILE  57          HG22      ILE  57  14.062  -4.998 -10.057
  469   3HG2  ILE  57          HG23      ILE  57  14.019  -3.266 -10.388
  470   1HD1  ILE  57          HD11      ILE  57  11.543  -7.326  -9.207
  471   2HD1  ILE  57          HD12      ILE  57  12.539  -6.491  -8.016
  472   3HD1  ILE  57          HD13      ILE  57  13.027  -6.517  -9.711
  473    H    ASP  58           HN       ASP  58  15.287  -3.822  -8.984
  474    HA   ASP  58           HA       ASP  58  16.924  -2.105  -7.693
  475   1HB   ASP  58          HB2       ASP  58  17.075  -3.267  -9.995
  476   2HB   ASP  58          HB1       ASP  58  16.427  -1.758 -10.644
  477    H    GLY  59           HN       GLY  59  15.788  -0.455  -6.512
  478   1HA   GLY  59          HA2       GLY  59  14.821   1.658  -6.180
  479   2HA   GLY  59          HA1       GLY  59  15.759   2.116  -7.598
  480    H    THR  60           HN       THR  60  13.405  -0.373  -8.100
  481    HA   THR  60           HA       THR  60  11.456   1.655  -9.132
  482    HB   THR  60           HB       THR  60  12.263  -0.846 -10.614
  483    HG1  THR  60           HG1      THR  60  13.589   0.578 -11.847
  484   1HG2  THR  60          HG21      THR  60  10.556  -0.195 -11.920
  485   2HG2  THR  60          HG22      THR  60  11.489   1.245 -12.329
  486   3HG2  THR  60          HG23      THR  60  10.350   1.286 -10.984
  487    H    ILE  61           HN       ILE  61   9.386   1.139  -8.549
  488    HA   ILE  61           HA       ILE  61   8.765  -1.712  -7.893
  489    HB   ILE  61           HB       ILE  61   9.098  -0.736  -5.774
  490   1HG1  ILE  61          HG12      ILE  61   6.318   0.106  -5.660
  491   2HG1  ILE  61          HG11      ILE  61   6.491  -1.390  -6.577
  492   1HG2  ILE  61          HG21      ILE  61   7.830   1.715  -7.000
  493   2HG2  ILE  61          HG22      ILE  61   9.439   1.553  -6.295
  494   3HG2  ILE  61          HG23      ILE  61   8.015   1.544  -5.255
  495   1HD1  ILE  61          HD11      ILE  61   6.234  -1.478  -3.953
  496   2HD1  ILE  61          HD12      ILE  61   7.955  -1.100  -3.976
  497   3HD1  ILE  61          HD13      ILE  61   7.365  -2.562  -4.765
  498    H    GLU  62           HN       GLU  62   6.774  -2.373  -8.642
  499    HA   GLU  62           HA       GLU  62   5.238  -0.423 -10.275
  500   1HB   GLU  62          HB2       GLU  62   5.835  -3.295 -10.231
  501   2HB   GLU  62          HB1       GLU  62   4.136  -2.954 -10.565
  502   1HG   GLU  62          HG2       GLU  62   5.706  -1.088 -12.049
  503   2HG   GLU  62          HG1       GLU  62   6.368  -2.697 -12.335
  504    H    VAL  63           HN       VAL  63   4.601   0.424  -7.908
  505    HA   VAL  63           HA       VAL  63   2.905  -0.884  -6.143
  506    HB   VAL  63           HB       VAL  63   3.770   1.474  -6.059
  507   1HG1  VAL  63          HG11      VAL  63   1.378   2.314  -7.660
  508   2HG1  VAL  63          HG12      VAL  63   2.834   1.805  -8.514
  509   3HG1  VAL  63          HG13      VAL  63   2.899   3.165  -7.394
  510   1HG2  VAL  63          HG21      VAL  63   1.343   2.398  -5.349
  511   2HG2  VAL  63          HG22      VAL  63   2.222   1.223  -4.372
  512   3HG2  VAL  63          HG23      VAL  63   0.956   0.682  -5.472
  513    HA   PRO  64           HA       PRO  64  -0.504  -2.188  -8.693
  514   1HB   PRO  64          HB2       PRO  64  -2.275  -2.115  -6.423
  515   2HB   PRO  64          HB1       PRO  64  -1.518  -3.528  -7.173
  516   1HG   PRO  64          HG2       PRO  64  -0.881  -2.312  -4.645
  517   2HG   PRO  64          HG1       PRO  64  -0.149  -3.739  -5.384
  518   1HD   PRO  64          HD2       PRO  64   1.033  -1.141  -5.051
  519   2HD   PRO  64          HD1       PRO  64   1.743  -2.559  -5.861
  520    H    LYS  65           HN       LYS  65  -2.067  -1.031  -9.824
  521    HA   LYS  65           HA       LYS  65  -2.385   1.799  -9.321
  522   1HB   LYS  65          HB2       LYS  65  -4.034   1.533 -11.225
  523   2HB   LYS  65          HB1       LYS  65  -2.429   0.878 -11.559
  524   1HG   LYS  65          HG2       LYS  65  -3.288  -1.177 -11.873
  525   2HG   LYS  65          HG1       LYS  65  -4.045  -1.138 -10.279
  526   1HD   LYS  65          HD2       LYS  65  -5.573   0.602 -11.884
  527   2HD   LYS  65          HD1       LYS  65  -5.275  -0.824 -12.880
  528   1HE   LYS  65          HE2       LYS  65  -6.087  -2.274 -11.029
  529   2HE   LYS  65          HE1       LYS  65  -6.443  -0.822 -10.072
  530   1HZ   LYS  65          HZ1       LYS  65  -7.541  -1.451 -12.762
  531   2HZ   LYS  65          HZ2       LYS  65  -7.836  -0.021 -11.894
  532   3HZ   LYS  65          HZ3       LYS  65  -8.401  -1.509 -11.302
  533    H    CYS  66           HN       CYS  66  -4.142  -1.051  -8.328
  534    HA   CYS  66           HA       CYS  66  -6.721   0.053  -7.838
  535   1HB   CYS  66          HB2       CYS  66  -6.160  -2.342  -7.779
  536   2HB   CYS  66          HB1       CYS  66  -5.128  -2.078  -6.374
  537    H    PHE  67           HN       PHE  67  -3.687   0.492  -6.192
  538    HA   PHE  67           HA       PHE  67  -4.806   1.381  -3.650
  539   1HB   PHE  67          HB2       PHE  67  -2.591   0.414  -3.782
  540   2HB   PHE  67          HB1       PHE  67  -2.098   1.594  -4.997
  541    HD1  PHE  67           HD1      PHE  67  -1.383   3.793  -4.385
  542    HD2  PHE  67           HD2      PHE  67  -3.085   1.169  -1.439
  543    HE1  PHE  67           HE1      PHE  67  -0.680   5.353  -2.589
  544    HE2  PHE  67           HE2      PHE  67  -2.382   2.729   0.355
  545    HZ   PHE  67           HZ       PHE  67  -1.180   4.821  -0.220
  546    H    LYS  68           HN       LYS  68  -4.361   3.668  -2.869
  547    HA   LYS  68           HA       LYS  68  -3.945   5.834  -4.728
  548   1HB   LYS  68          HB2       LYS  68  -6.470   4.556  -4.789
  549   2HB   LYS  68          HB1       LYS  68  -6.723   6.092  -3.958
  550   1HG   LYS  68          HG2       LYS  68  -5.083   6.047  -6.470
  551   2HG   LYS  68          HG1       LYS  68  -6.842   5.990  -6.591
  552   1HD   LYS  68          HD2       LYS  68  -7.068   8.158  -5.970
  553   2HD   LYS  68          HD1       LYS  68  -5.866   8.005  -4.688
  554   1HE   LYS  68          HE2       LYS  68  -4.844   9.498  -6.221
  555   2HE   LYS  68          HE1       LYS  68  -4.137   7.931  -6.658
  556   1HZ   LYS  68          HZ1       LYS  68  -5.459   9.512  -8.383
  557   2HZ   LYS  68          HZ2       LYS  68  -6.707   8.483  -7.864
  558   3HZ   LYS  68          HZ3       LYS  68  -5.300   7.832  -8.560
  559    H    GLU  69           HN       GLU  69  -3.213   7.458  -3.409
  560    HA   GLU  69           HA       GLU  69  -3.300   7.388  -0.570
  561   1HB   GLU  69          HB2       GLU  69  -1.659   8.665  -1.808
  562   2HB   GLU  69          HB1       GLU  69  -2.920   9.628  -2.581
  563   1HG   GLU  69          HG2       GLU  69  -3.556  10.584  -0.416
  564   2HG   GLU  69          HG1       GLU  69  -2.357   9.580   0.399
  565    H    HIS  70           HN       HIS  70  -4.583   8.631   0.925
  566    HA   HIS  70           HA       HIS  70  -7.365   9.052   0.060
  567   1HB   HIS  70          HB2       HIS  70  -6.379   8.018   2.254
  568   2HB   HIS  70          HB1       HIS  70  -6.190   9.696   2.761
  569    HD1  HIS  70           HD1      HIS  70  -8.092  10.061   4.357
  570    HD2  HIS  70           HD2      HIS  70  -9.336   8.149   0.869
  571    HE1  HIS  70           HE1      HIS  70 -10.616   9.902   4.489
  572    H    SER  71           HN       SER  71  -5.946  10.885  -1.355
  573    HA   SER  71           HA       SER  71  -6.214  13.453   0.171
  574   1HB   SER  71          HB2       SER  71  -4.105  12.297  -1.291
  575   2HB   SER  71          HB1       SER  71  -4.737  13.578  -2.327
  576    HG   SER  71           HG       SER  71  -3.222  14.452  -0.928
  577    H    SER  72           HN       SER  72  -8.568  12.386  -0.896
  578    HA   SER  72           HA       SER  72  -9.358  14.486  -2.761
  579   1HB   SER  72          HB2       SER  72  -8.466  13.243  -4.496
  580   2HB   SER  72          HB1       SER  72  -8.656  11.717  -3.635
  581    HG   SER  72           HG       SER  72 -10.140  12.342  -5.505
  582    H    LEU  73           HN       LEU  73 -11.106  14.889  -1.350
  583    HA   LEU  73           HA       LEU  73 -13.185  14.509  -0.281
  584   1HB   LEU  73          HB2       LEU  73 -13.335  12.736  -2.737
  585   2HB   LEU  73          HB1       LEU  73 -14.731  13.257  -1.788
  586    HG   LEU  73           HG       LEU  73 -13.233  15.592  -2.353
  587   1HD1  LEU  73          HD11      LEU  73 -13.630  13.804  -4.770
  588   2HD1  LEU  73          HD12      LEU  73 -12.093  14.407  -4.149
  589   3HD1  LEU  73          HD13      LEU  73 -13.259  15.526  -4.855
  590   1HD2  LEU  73          HD21      LEU  73 -15.835  14.847  -2.270
  591   2HD2  LEU  73          HD22      LEU  73 -15.606  14.922  -4.018
  592   3HD2  LEU  73          HD23      LEU  73 -15.295  16.347  -3.026
  593    H    ALA  74           HN       ALA  74 -12.209  13.359   1.570
  594    HA   ALA  74           HA       ALA  74 -11.580  10.621   1.726
  595   1HB   ALA  74          HB1       ALA  74 -11.070  11.885   3.613
  596   2HB   ALA  74          HB2       ALA  74 -12.531  11.068   4.170
  597   3HB   ALA  74          HB3       ALA  74 -12.619  12.730   3.587
  598    H    PHE  75           HN       PHE  75 -14.751  12.208   1.837
  599    HA   PHE  75           HA       PHE  75 -16.920  11.292   1.629
  600   1HB   PHE  75          HB2       PHE  75 -15.015   9.513   0.297
  601   2HB   PHE  75          HB1       PHE  75 -16.452   8.656   0.857
  602    HD1  PHE  75           HD1      PHE  75 -15.220  11.419  -1.277
  603    HD2  PHE  75           HD2      PHE  75 -18.629   9.093  -0.087
  604    HE1  PHE  75           HE1      PHE  75 -16.523  12.361  -3.166
  605    HE2  PHE  75           HE2      PHE  75 -19.931  10.034  -1.976
  606    HZ   PHE  75           HZ       PHE  75 -18.878  11.669  -3.515
  607    H    TRP  76           HN       TRP  76 -18.374  10.015   2.900
  608    HA   TRP  76           HA       TRP  76 -17.403   9.225   5.511
  609   1HB   TRP  76          HB2       TRP  76 -19.870   9.704   4.107
  610   2HB   TRP  76          HB1       TRP  76 -19.992   8.188   5.005
  611    HD1  TRP  76           HD1      TRP  76 -19.390   8.306   7.656
  612    HE1  TRP  76           HE1      TRP  76 -19.724  10.229   9.343
  613    HE3  TRP  76           HE3      TRP  76 -19.906  12.215   4.428
  614    HZ2  TRP  76           HZ2      TRP  76 -20.153  13.060   9.319
  615    HZ3  TRP  76           HZ3      TRP  76 -20.271  14.516   5.279
  616    HH2  TRP  76           HH2      TRP  76 -20.393  14.943   7.718
  617    H    LYS  77           HN       LYS  77 -17.335   7.639   2.532
  618    HA   LYS  77           HA       LYS  77 -18.007   4.944   3.225
  619   1HB   LYS  77          HB2       LYS  77 -16.595   6.447   1.111
  620   2HB   LYS  77          HB1       LYS  77 -16.059   4.776   1.290
  621   1HG   LYS  77          HG2       LYS  77 -18.994   5.196   1.353
  622   2HG   LYS  77          HG1       LYS  77 -18.210   5.492  -0.199
  623   1HD   LYS  77          HD2       LYS  77 -16.987   3.175   0.526
  624   2HD   LYS  77          HD1       LYS  77 -18.565   2.951   1.281
  625   1HE   LYS  77          HE2       LYS  77 -19.405   2.387  -0.744
  626   2HE   LYS  77          HE1       LYS  77 -19.029   4.024  -1.322
  627   1HZ   LYS  77          HZ1       LYS  77 -17.031   3.380  -2.164
  628   2HZ   LYS  77          HZ2       LYS  77 -17.858   1.907  -2.346
  629   3HZ   LYS  77          HZ3       LYS  77 -16.812   2.140  -1.028
  630    H    THR  78           HN       THR  78 -15.663   3.491   2.591
  631    HA   THR  78           HA       THR  78 -13.847   4.159   4.886
  632    HB   THR  78           HB       THR  78 -14.341   1.332   4.052
  633    HG1  THR  78           HG1      THR  78 -16.192   1.515   5.611
  634   1HG2  THR  78          HG21      THR  78 -12.873   1.516   5.866
  635   2HG2  THR  78          HG22      THR  78 -14.422   1.238   6.665
  636   3HG2  THR  78          HG23      THR  78 -13.758   2.870   6.569
  637    H    ASP  79           HN       ASP  79 -11.836   4.587   4.071
  638    HA   ASP  79           HA       ASP  79 -11.002   3.977   1.396
  639   1HB   ASP  79          HB2       ASP  79 -10.140   5.800   2.849
  640   2HB   ASP  79          HB1       ASP  79  -9.392   4.594   3.896
  641    H    ALA  80           HN       ALA  80  -9.965   2.180   0.581
  642    HA   ALA  80           HA       ALA  80 -10.057  -0.368   1.605
  643   1HB   ALA  80          HB1       ALA  80  -9.317  -0.003  -0.616
  644   2HB   ALA  80          HB2       ALA  80  -7.906  -0.670   0.203
  645   3HB   ALA  80          HB3       ALA  80  -8.014   1.064  -0.093
  646    H    SER  81           HN       SER  81  -7.421   1.971   2.204
  647    HA   SER  81           HA       SER  81  -5.742   0.271   3.756
  648   1HB   SER  81          HB2       SER  81  -4.832   2.293   2.983
  649   2HB   SER  81          HB1       SER  81  -6.234   3.228   3.495
  650    HG   SER  81           HG       SER  81  -4.246   2.022   5.127
  651    H    ASP  82           HN       ASP  82  -8.834   1.555   4.514
  652    HA   ASP  82           HA       ASP  82  -8.369   0.966   7.421
  653   1HB   ASP  82          HB2       ASP  82  -9.919   3.147   6.018
  654   2HB   ASP  82          HB1       ASP  82 -10.142   2.786   7.730
  655    H    VAL  83           HN       VAL  83  -9.454  -0.776   5.218
  656    HA   VAL  83           HA       VAL  83 -12.246  -1.141   6.253
  657    HB   VAL  83           HB       VAL  83 -11.038  -2.053   3.632
  658   1HG1  VAL  83          HG11      VAL  83 -13.829  -1.922   4.773
  659   2HG1  VAL  83          HG12      VAL  83 -12.998  -3.311   4.074
  660   3HG1  VAL  83          HG13      VAL  83 -13.549  -1.997   3.034
  661   1HG2  VAL  83          HG21      VAL  83 -11.059   0.142   3.071
  662   2HG2  VAL  83          HG22      VAL  83 -11.946   0.583   4.528
  663   3HG2  VAL  83          HG23      VAL  83 -12.817   0.016   3.103
  664    H    LYS  84           HN       LYS  84 -12.915  -3.330   6.680
  665    HA   LYS  84           HA       LYS  84 -10.740  -5.090   7.581
  666   1HB   LYS  84          HB2       LYS  84 -13.346  -4.482   8.338
  667   2HB   LYS  84          HB1       LYS  84 -13.491  -6.100   7.651
  668   1HG   LYS  84          HG2       LYS  84 -11.208  -6.349   9.148
  669   2HG   LYS  84          HG1       LYS  84 -12.151  -5.225  10.128
  670   1HD   LYS  84          HD2       LYS  84 -13.170  -7.877   9.066
  671   2HD   LYS  84          HD1       LYS  84 -12.626  -7.591  10.719
  672   1HE   LYS  84          HE2       LYS  84 -14.436  -5.534  10.335
  673   2HE   LYS  84          HE1       LYS  84 -15.186  -6.886   9.464
  674   1HZ   LYS  84          HZ1       LYS  84 -15.128  -8.236  11.332
  675   2HZ   LYS  84          HZ2       LYS  84 -15.549  -6.728  11.990
  676   3HZ   LYS  84          HZ3       LYS  84 -13.953  -7.296  12.113
  677    HA   PRO  85           HA       PRO  85 -10.598  -7.452   3.816
  678   1HB   PRO  85          HB2       PRO  85  -9.825  -9.818   5.261
  679   2HB   PRO  85          HB1       PRO  85  -8.792  -8.720   4.335
  680   1HG   PRO  85          HG2       PRO  85  -8.932  -9.020   7.188
  681   2HG   PRO  85          HG1       PRO  85  -7.903  -7.926   6.259
  682   1HD   PRO  85          HD2       PRO  85 -10.190  -7.252   7.880
  683   2HD   PRO  85          HD1       PRO  85  -9.161  -6.149   6.933
  684    H    CYS  86           HN       CYS  86 -12.175  -8.683   2.766
  685    HA   CYS  86           HA       CYS  86 -14.679  -9.260   3.809
  686   1HB   CYS  86          HB2       CYS  86 -13.381  -9.601   1.438
  687   2HB   CYS  86          HB1       CYS  86 -13.564 -11.279   1.945
  Start of MODEL    8
    1   1H    THR   1          HT1       THR   1  23.001  -3.854  -8.334
    2   2H    THR   1          HT2       THR   1  23.915  -5.047  -9.127
    3   3H    THR   1          HT3       THR   1  23.561  -5.203  -7.473
    4    HA   THR   1           HA       THR   1  21.416  -5.105  -9.519
    5    HB   THR   1           HB       THR   1  22.572  -7.627  -8.355
    6    HG1  THR   1           HG1      THR   1  24.285  -7.413  -9.519
    7   1HG2  THR   1          HG21      THR   1  20.894  -6.825 -10.715
    8   2HG2  THR   1          HG22      THR   1  20.586  -8.069  -9.503
    9   3HG2  THR   1          HG23      THR   1  21.799  -8.339 -10.755
   10    H    LYS   2           HN       LYS   2  21.232  -3.815  -7.059
   11    HA   LYS   2           HA       LYS   2  19.050  -5.235  -5.789
   12   1HB   LYS   2          HB2       LYS   2  20.191  -5.739  -3.679
   13   2HB   LYS   2          HB1       LYS   2  21.062  -6.508  -5.007
   14   1HG   LYS   2          HG2       LYS   2  22.089  -3.862  -4.713
   15   2HG   LYS   2          HG1       LYS   2  22.052  -4.607  -3.113
   16   1HD   LYS   2          HD2       LYS   2  22.985  -6.655  -4.726
   17   2HD   LYS   2          HD1       LYS   2  23.758  -5.226  -5.414
   18   1HE   LYS   2          HE2       LYS   2  23.788  -5.282  -2.464
   19   2HE   LYS   2          HE1       LYS   2  24.724  -6.581  -3.228
   20   1HZ   LYS   2          HZ1       LYS   2  25.982  -4.470  -2.989
   21   2HZ   LYS   2          HZ2       LYS   2  24.869  -3.727  -4.036
   22   3HZ   LYS   2          HZ3       LYS   2  25.847  -4.998  -4.596
   23    H    ALA   3           HN       ALA   3  19.319  -2.635  -6.841
   24    HA   ALA   3           HA       ALA   3  19.897  -0.691  -4.750
   25   1HB   ALA   3          HB1       ALA   3  18.189  -0.194  -7.176
   26   2HB   ALA   3          HB2       ALA   3  19.899  -0.570  -7.382
   27   3HB   ALA   3          HB3       ALA   3  19.414   0.848  -6.452
   28    H    SER   4           HN       SER   4  18.515  -0.154  -3.107
   29    HA   SER   4           HA       SER   4  16.011  -1.320  -2.597
   30   1HB   SER   4          HB2       SER   4  16.760  -0.206  -0.749
   31   2HB   SER   4          HB1       SER   4  17.604   1.002  -1.715
   32    HG   SER   4           HG       SER   4  15.218   1.161  -0.506
   33    H    CYS   5           HN       CYS   5  13.923   0.205  -2.400
   34    HA   CYS   5           HA       CYS   5  13.434   1.279  -5.144
   35   1HB   CYS   5          HB2       CYS   5  11.427   0.667  -2.967
   36   2HB   CYS   5          HB1       CYS   5  11.145   0.756  -4.705
   37    H    LYS   6           HN       LYS   6  11.152   2.830  -4.425
   38    HA   LYS   6           HA       LYS   6  12.210   4.918  -2.573
   39   1HB   LYS   6          HB2       LYS   6  12.966   5.591  -4.757
   40   2HB   LYS   6          HB1       LYS   6  11.403   5.207  -5.479
   41   1HG   LYS   6          HG2       LYS   6  10.670   7.287  -5.043
   42   2HG   LYS   6          HG1       LYS   6  10.971   7.042  -3.322
   43   1HD   LYS   6          HD2       LYS   6  13.338   7.584  -5.050
   44   2HD   LYS   6          HD1       LYS   6  12.250   8.935  -4.729
   45   1HE   LYS   6          HE2       LYS   6  12.680   8.911  -2.432
   46   2HE   LYS   6          HE1       LYS   6  13.160   7.202  -2.440
   47   1HZ   LYS   6          HZ1       LYS   6  14.974   8.033  -4.061
   48   2HZ   LYS   6          HZ2       LYS   6  15.192   8.270  -2.392
   49   3HZ   LYS   6          HZ3       LYS   6  14.670   9.554  -3.375
   50    H    LEU   7           HN       LEU   7  10.543   4.914  -1.078
   51    HA   LEU   7           HA       LEU   7   7.935   4.114  -1.203
   52   1HB   LEU   7          HB2       LEU   7   7.525   6.155   0.357
   53   2HB   LEU   7          HB1       LEU   7   8.758   4.984   0.833
   54    HG   LEU   7           HG       LEU   7   9.789   7.096  -0.928
   55   1HD1  LEU   7          HD11      LEU   7   8.088   7.814   1.334
   56   2HD1  LEU   7          HD12      LEU   7   8.789   8.849   0.090
   57   3HD1  LEU   7          HD13      LEU   7   9.730   8.429   1.523
   58   1HD2  LEU   7          HD21      LEU   7  10.783   6.687   1.839
   59   2HD2  LEU   7          HD22      LEU   7  11.675   6.735   0.319
   60   3HD2  LEU   7          HD23      LEU   7  10.824   5.266   0.797
   61    HA   PRO   8           HA       PRO   8   6.696   6.687  -4.775
   62   1HB   PRO   8          HB2       PRO   8   4.268   5.139  -4.788
   63   2HB   PRO   8          HB1       PRO   8   5.614   5.067  -5.933
   64   1HG   PRO   8          HG2       PRO   8   4.892   3.136  -3.931
   65   2HG   PRO   8          HG1       PRO   8   6.224   3.059  -5.088
   66   1HD   PRO   8          HD2       PRO   8   6.383   3.488  -2.245
   67   2HD   PRO   8          HD1       PRO   8   7.723   3.453  -3.418
   68    H    VAL   9           HN       VAL   9   4.864   5.781  -1.880
   69    HA   VAL   9           HA       VAL   9   3.268   8.306  -2.137
   70    HB   VAL   9           HB       VAL   9   2.710   5.947  -0.331
   71   1HG1  VAL   9          HG11      VAL   9   1.036   7.339   0.262
   72   2HG1  VAL   9          HG12      VAL   9   0.354   7.052  -1.339
   73   3HG1  VAL   9          HG13      VAL   9   1.398   8.446  -1.063
   74   1HG2  VAL   9          HG21      VAL   9   1.035   5.543  -2.428
   75   2HG2  VAL   9          HG22      VAL   9   2.599   4.741  -2.282
   76   3HG2  VAL   9          HG23      VAL   9   2.438   6.186  -3.282
   77    H    LYS  10           HN       LYS  10   2.668   9.147   0.194
   78    HA   LYS  10           HA       LYS  10   5.224   9.368   1.715
   79   1HB   LYS  10          HB2       LYS  10   3.119  11.120   0.872
   80   2HB   LYS  10          HB1       LYS  10   3.161  11.123   2.635
   81   1HG   LYS  10          HG2       LYS  10   5.694  11.390   1.020
   82   2HG   LYS  10          HG1       LYS  10   4.700  12.797   1.394
   83   1HD   LYS  10          HD2       LYS  10   5.100  12.643   3.683
   84   2HD   LYS  10          HD1       LYS  10   5.464  10.918   3.605
   85   1HE   LYS  10          HE2       LYS  10   7.658  11.271   2.955
   86   2HE   LYS  10          HE1       LYS  10   7.274  12.791   2.123
   87   1HZ   LYS  10          HZ1       LYS  10   6.996  12.478   5.055
   88   2HZ   LYS  10          HZ2       LYS  10   7.021  13.917   4.151
   89   3HZ   LYS  10          HZ3       LYS  10   8.442  13.006   4.343
   90    H    LYS  11           HN       LYS  11   2.104   7.919   1.881
   91    HA   LYS  11           HA       LYS  11   2.667   6.963   4.631
   92   1HB   LYS  11          HB2       LYS  11   0.071   8.356   3.910
   93   2HB   LYS  11          HB1       LYS  11   0.599   7.840   5.513
   94   1HG   LYS  11          HG2       LYS  11   2.542   9.425   5.304
   95   2HG   LYS  11          HG1       LYS  11   1.822  10.028   3.811
   96   1HD   LYS  11          HD2       LYS  11  -0.287  10.496   5.142
   97   2HD   LYS  11          HD1       LYS  11   0.646  10.144   6.598
   98   1HE   LYS  11          HE2       LYS  11   1.979  12.047   6.369
   99   2HE   LYS  11          HE1       LYS  11   1.731  12.131   4.615
  100   1HZ   LYS  11          HZ1       LYS  11   0.342  13.581   6.415
  101   2HZ   LYS  11          HZ2       LYS  11  -0.698  12.260   6.173
  102   3HZ   LYS  11          HZ3       LYS  11  -0.205  13.209   4.853
  103    H    ALA  12           HN       ALA  12   2.832   5.206   2.690
  104    HA   ALA  12           HA       ALA  12   0.191   4.085   1.969
  105   1HB   ALA  12          HB1       ALA  12   1.478   3.622   0.168
  106   2HB   ALA  12          HB2       ALA  12   2.267   2.385   1.148
  107   3HB   ALA  12          HB3       ALA  12   2.952   4.007   1.055
  108    H    THR  13           HN       THR  13  -0.770   2.495   3.164
  109    HA   THR  13           HA       THR  13   0.823   1.133   5.292
  110    HB   THR  13           HB       THR  13  -2.161   0.990   4.904
  111    HG1  THR  13           HG1      THR  13  -2.330   2.956   5.976
  112   1HG2  THR  13          HG21      THR  13  -1.042  -0.329   6.689
  113   2HG2  THR  13          HG22      THR  13  -2.141   0.882   7.346
  114   3HG2  THR  13          HG23      THR  13  -0.401   1.169   7.364
  115    H    VAL  14           HN       VAL  14   1.767  -0.678   4.326
  116    HA   VAL  14           HA       VAL  14   0.026  -2.407   2.609
  117    HB   VAL  14           HB       VAL  14   2.215  -3.276   1.814
  118   1HG1  VAL  14          HG11      VAL  14   1.122  -0.701   1.409
  119   2HG1  VAL  14          HG12      VAL  14   2.206  -1.581   0.332
  120   3HG1  VAL  14          HG13      VAL  14   2.866  -0.475   1.536
  121   1HG2  VAL  14          HG21      VAL  14   3.158  -2.415   4.238
  122   2HG2  VAL  14          HG22      VAL  14   3.729  -1.131   3.171
  123   3HG2  VAL  14          HG23      VAL  14   4.186  -2.806   2.860
  124    H    VAL  15           HN       VAL  15   0.875  -4.834   2.820
  125    HA   VAL  15           HA       VAL  15   0.998  -5.495   5.746
  126    HB   VAL  15           HB       VAL  15  -0.246  -7.056   3.458
  127   1HG1  VAL  15          HG11      VAL  15   0.236  -8.546   5.240
  128   2HG1  VAL  15          HG12      VAL  15  -1.456  -8.108   5.478
  129   3HG1  VAL  15          HG13      VAL  15  -0.201  -7.354   6.464
  130   1HG2  VAL  15          HG21      VAL  15  -2.238  -6.111   5.203
  131   2HG2  VAL  15          HG22      VAL  15  -1.931  -5.557   3.557
  132   3HG2  VAL  15          HG23      VAL  15  -1.181  -4.727   4.921
  133    H    TYR  16           HN       TYR  16   3.399  -5.473   5.458
  134    HA   TYR  16           HA       TYR  16   4.552  -7.536   3.686
  135   1HB   TYR  16          HB2       TYR  16   5.492  -5.238   3.994
  136   2HB   TYR  16          HB1       TYR  16   5.811  -5.630   5.682
  137    HD1  TYR  16           HD1      TYR  16   8.222  -5.364   5.517
  138    HD2  TYR  16           HD2      TYR  16   6.133  -8.127   2.974
  139    HE1  TYR  16           HE1      TYR  16  10.378  -6.402   4.870
  140    HE2  TYR  16           HE2      TYR  16   8.289  -9.165   2.331
  141    HH   TYR  16           HH       TYR  16  10.728  -9.288   3.627
  142    H    GLN  17           HN       GLN  17   5.523  -9.441   4.444
  143    HA   GLN  17           HA       GLN  17   5.752 -11.283   5.916
  144   1HB   GLN  17          HB2       GLN  17   6.466  -8.999   7.777
  145   2HB   GLN  17          HB1       GLN  17   7.046 -10.664   7.882
  146   1HG   GLN  17          HG2       GLN  17   7.584  -9.738   5.242
  147   2HG   GLN  17          HG1       GLN  17   8.142  -8.495   6.361
  148   1HE2  GLN  17          HE21      GLN  17  10.362  -9.294   5.534
  149   2HE2  GLN  17          HE22      GLN  17  11.060 -10.618   6.336
  150    H    GLY  18           HN       GLY  18   3.060 -10.315   5.756
  151   1HA   GLY  18          HA2       GLY  18   1.024 -10.480   6.906
  152   2HA   GLY  18          HA1       GLY  18   1.880 -11.535   8.031
  153    H    GLU  19           HN       GLU  19   2.728  -8.162   7.392
  154    HA   GLU  19           HA       GLU  19   1.686  -7.425  10.099
  155   1HB   GLU  19          HB2       GLU  19   4.442  -7.664   9.121
  156   2HB   GLU  19          HB1       GLU  19   4.104  -6.094   9.851
  157   1HG   GLU  19          HG2       GLU  19   3.759  -6.983  11.938
  158   2HG   GLU  19          HG1       GLU  19   3.086  -8.484  11.302
  159    H    ARG  20           HN       ARG  20   0.704  -5.429  10.092
  160    HA   ARG  20           HA       ARG  20   0.585  -3.911   7.571
  161   1HB   ARG  20          HB2       ARG  20  -0.767  -3.947  10.251
  162   2HB   ARG  20          HB1       ARG  20  -0.920  -2.502   9.246
  163   1HG   ARG  20          HG2       ARG  20  -1.825  -3.816   7.409
  164   2HG   ARG  20          HG1       ARG  20  -1.554  -5.312   8.302
  165   1HD   ARG  20          HD2       ARG  20  -3.204  -3.196   9.630
  166   2HD   ARG  20          HD1       ARG  20  -3.949  -4.139   8.325
  167    HE   ARG  20           HE       ARG  20  -2.774  -5.315  10.808
  168   1HH1  ARG  20          HH21      ARG  20  -5.733  -5.213   9.686
  169   2HH1  ARG  20          HH22      ARG  20  -5.926  -6.885   9.274
  170   1HH2  ARG  20          HH11      ARG  20  -2.547  -7.611   9.522
  171   2HH2  ARG  20          HH12      ARG  20  -4.123  -8.240   9.182
  172    H    VAL  21           HN       VAL  21   1.977  -2.237   7.150
  173    HA   VAL  21           HA       VAL  21   2.927  -0.531   9.388
  174    HB   VAL  21           HB       VAL  21   5.291  -0.858   8.549
  175   1HG1  VAL  21          HG11      VAL  21   3.963  -2.235  10.418
  176   2HG1  VAL  21          HG12      VAL  21   5.623  -2.637   9.978
  177   3HG1  VAL  21          HG13      VAL  21   4.283  -3.565   9.304
  178   1HG2  VAL  21          HG21      VAL  21   5.337  -1.786   6.462
  179   2HG2  VAL  21          HG22      VAL  21   3.791  -2.603   6.683
  180   3HG2  VAL  21          HG23      VAL  21   5.265  -3.308   7.349
  181    H    LYS  22           HN       LYS  22   4.141   1.406   8.471
  182    HA   LYS  22           HA       LYS  22   2.930   2.178   5.848
  183   1HB   LYS  22          HB2       LYS  22   2.670   3.359   8.226
  184   2HB   LYS  22          HB1       LYS  22   4.194   4.111   7.750
  185   1HG   LYS  22          HG2       LYS  22   2.527   5.577   6.914
  186   2HG   LYS  22          HG1       LYS  22   3.030   4.636   5.511
  187   1HD   LYS  22          HD2       LYS  22   0.633   4.658   5.489
  188   2HD   LYS  22          HD1       LYS  22   1.113   3.050   6.034
  189   1HE   LYS  22          HE2       LYS  22  -0.487   3.587   7.651
  190   2HE   LYS  22          HE1       LYS  22   0.976   4.214   8.438
  191   1HZ   LYS  22          HZ1       LYS  22  -1.196   5.705   7.859
  192   2HZ   LYS  22          HZ2       LYS  22  -0.207   6.012   6.512
  193   3HZ   LYS  22          HZ3       LYS  22   0.366   6.326   8.080
  194    H    ILE  23           HN       ILE  23   4.396   1.887   4.208
  195    HA   ILE  23           HA       ILE  23   7.139   1.517   4.298
  196    HB   ILE  23           HB       ILE  23   5.627   1.381   2.317
  197   1HG1  ILE  23          HG12      ILE  23   8.070   3.157   2.023
  198   2HG1  ILE  23          HG11      ILE  23   8.039   1.394   1.942
  199   1HG2  ILE  23          HG21      ILE  23   5.940   4.392   2.205
  200   2HG2  ILE  23          HG22      ILE  23   4.499   3.590   2.829
  201   3HG2  ILE  23          HG23      ILE  23   4.965   3.378   1.141
  202   1HD1  ILE  23          HD11      ILE  23   6.554   1.521  -0.037
  203   2HD1  ILE  23          HD12      ILE  23   8.087   2.347  -0.322
  204   3HD1  ILE  23          HD13      ILE  23   6.633   3.282   0.030
  205    H    GLN  24           HN       GLN  24   5.408   4.632   4.353
  206    HA   GLN  24           HA       GLN  24   7.505   6.443   4.004
  207   1HB   GLN  24          HB2       GLN  24   6.080   7.978   5.152
  208   2HB   GLN  24          HB1       GLN  24   4.993   6.792   4.423
  209   1HG   GLN  24          HG2       GLN  24   4.734   5.628   6.516
  210   2HG   GLN  24          HG1       GLN  24   6.012   6.583   7.269
  211   1HE2  GLN  24          HE21      GLN  24   3.319   6.496   8.322
  212   2HE2  GLN  24          HE22      GLN  24   2.647   8.046   8.159
  213    H    GLU  25           HN       GLU  25   6.976   4.245   6.651
  214    HA   GLU  25           HA       GLU  25   9.211   5.540   8.178
  215   1HB   GLU  25          HB2       GLU  25   6.718   4.026   8.945
  216   2HB   GLU  25          HB1       GLU  25   8.064   4.172  10.075
  217   1HG   GLU  25          HG2       GLU  25   7.247   6.692   8.753
  218   2HG   GLU  25          HG1       GLU  25   6.068   6.011   9.873
  219    H    LYS  26           HN       LYS  26   7.702   2.317   7.678
  220    HA   LYS  26           HA       LYS  26   9.869   0.733   8.554
  221   1HB   LYS  26          HB2       LYS  26   7.455   0.136   7.890
  222   2HB   LYS  26          HB1       LYS  26   8.053   0.075   6.228
  223   1HG   LYS  26          HG2       LYS  26   8.443  -2.119   6.782
  224   2HG   LYS  26          HG1       LYS  26   9.940  -1.438   7.416
  225   1HD   LYS  26          HD2       LYS  26   9.167  -1.476   9.636
  226   2HD   LYS  26          HD1       LYS  26   7.477  -1.578   9.143
  227   1HE   LYS  26          HE2       LYS  26   7.587  -3.860   8.752
  228   2HE   LYS  26          HE1       LYS  26   9.309  -3.806   8.325
  229   1HZ   LYS  26          HZ1       LYS  26   9.405  -2.913  10.819
  230   2HZ   LYS  26          HZ2       LYS  26   9.547  -4.560  10.428
  231   3HZ   LYS  26          HZ3       LYS  26   8.057  -3.934  10.952
  232    H    PHE  27           HN       PHE  27   9.464   2.518   5.566
  233    HA   PHE  27           HA       PHE  27  12.149   1.525   4.675
  234   1HB   PHE  27          HB2       PHE  27   9.602   1.906   3.070
  235   2HB   PHE  27          HB1       PHE  27  11.182   1.577   2.351
  236    HD1  PHE  27           HD1      PHE  27   8.237   0.116   3.711
  237    HD2  PHE  27           HD2      PHE  27  12.465  -0.508   3.285
  238    HE1  PHE  27           HE1      PHE  27   7.921  -2.309   4.124
  239    HE2  PHE  27           HE2      PHE  27  12.148  -2.933   3.696
  240    HZ   PHE  27           HZ       PHE  27   9.876  -3.834   4.118
  241    H    LYS  28           HN       LYS  28  11.724   3.938   6.111
  242    HA   LYS  28           HA       LYS  28  11.188   6.302   4.753
  243   1HB   LYS  28          HB2       LYS  28  12.646   5.401   7.052
  244   2HB   LYS  28          HB1       LYS  28  13.607   6.638   6.238
  245   1HG   LYS  28          HG2       LYS  28  12.209   8.268   6.913
  246   2HG   LYS  28          HG1       LYS  28  10.807   7.390   6.304
  247   1HD   LYS  28          HD2       LYS  28  10.241   7.206   8.499
  248   2HD   LYS  28          HD1       LYS  28  11.440   5.913   8.521
  249   1HE   LYS  28          HE2       LYS  28  13.171   7.773   9.023
  250   2HE   LYS  28          HE1       LYS  28  11.764   8.779   9.422
  251   1HZ   LYS  28          HZ1       LYS  28  12.142   6.042  10.499
  252   2HZ   LYS  28          HZ2       LYS  28  11.030   7.219  11.013
  253   3HZ   LYS  28          HZ3       LYS  28  12.690   7.425  11.315
  254    H    ASN  29           HN       ASN  29  14.100   4.279   4.487
  255    HA   ASN  29           HA       ASN  29  15.239   6.162   2.475
  256   1HB   ASN  29          HB2       ASN  29  16.460   3.658   3.652
  257   2HB   ASN  29          HB1       ASN  29  17.298   5.040   2.940
  258   1HD2  ASN  29          HD21      ASN  29  15.622   7.069   4.283
  259   2HD2  ASN  29          HD22      ASN  29  16.060   7.046   5.924
  260    H    GLY  30           HN       GLY  30  12.988   4.837   1.506
  261   1HA   GLY  30          HA2       GLY  30  12.425   3.697  -0.487
  262   2HA   GLY  30          HA1       GLY  30  14.136   3.324  -0.711
  263    H    MET  31           HN       MET  31  12.607   1.250  -1.293
  264    HA   MET  31           HA       MET  31  12.356  -0.431   1.169
  265   1HB   MET  31          HB2       MET  31  11.242  -0.611  -1.647
  266   2HB   MET  31          HB1       MET  31  10.997  -1.858  -0.427
  267   1HG   MET  31          HG2       MET  31  10.362   0.588   0.832
  268   2HG   MET  31          HG1       MET  31   9.600   0.649  -0.758
  269   1HE   MET  31          HE1       MET  31   6.773  -1.636  -0.730
  270   2HE   MET  31          HE2       MET  31   8.199  -1.444  -1.745
  271   3HE   MET  31          HE3       MET  31   7.401  -0.021  -1.083
  272    H    LEU  32           HN       LEU  32  13.084  -2.734   0.913
  273    HA   LEU  32           HA       LEU  32  15.760  -2.867  -0.244
  274   1HB   LEU  32          HB2       LEU  32  13.960  -4.960   1.015
  275   2HB   LEU  32          HB1       LEU  32  15.701  -5.120   0.762
  276    HG   LEU  32           HG       LEU  32  14.380  -2.978   2.455
  277   1HD1  LEU  32          HD11      LEU  32  15.316  -5.716   3.024
  278   2HD1  LEU  32          HD12      LEU  32  14.218  -4.687   3.945
  279   3HD1  LEU  32          HD13      LEU  32  15.963  -4.489   4.112
  280   1HD2  LEU  32          HD21      LEU  32  17.103  -3.279   3.083
  281   2HD2  LEU  32          HD22      LEU  32  16.366  -1.934   2.212
  282   3HD2  LEU  32          HD23      LEU  32  17.034  -3.300   1.321
  283    H    HIS  33           HN       HIS  33  16.404  -4.216  -2.003
  284    HA   HIS  33           HA       HIS  33  14.602  -4.447  -4.210
  285   1HB   HIS  33          HB2       HIS  33  16.995  -4.284  -4.494
  286   2HB   HIS  33          HB1       HIS  33  17.257  -5.730  -3.515
  287    HD1  HIS  33           HD1      HIS  33  14.685  -5.336  -6.281
  288    HD2  HIS  33           HD2      HIS  33  18.177  -7.475  -5.492
  289    HE1  HIS  33           HE1      HIS  33  14.949  -7.000  -8.173
  290    H    GLY  34           HN       GLY  34  13.229  -6.106  -4.812
  291   1HA   GLY  34          HA2       GLY  34  12.286  -8.276  -4.860
  292   2HA   GLY  34          HA1       GLY  34  13.572  -8.822  -3.784
  293    H    ASP  35           HN       ASP  35  12.082  -6.015  -2.603
  294    HA   ASP  35           HA       ASP  35  10.974  -7.411  -0.313
  295   1HB   ASP  35          HB2       ASP  35  11.931  -5.186  -0.145
  296   2HB   ASP  35          HB1       ASP  35  10.807  -4.567  -1.356
  297    H    LYS  36           HN       LYS  36   8.887  -8.165  -0.059
  298    HA   LYS  36           HA       LYS  36   6.935  -7.593  -2.252
  299   1HB   LYS  36          HB2       LYS  36   7.651  -9.866  -0.518
  300   2HB   LYS  36          HB1       LYS  36   5.914  -9.634  -0.718
  301   1HG   LYS  36          HG2       LYS  36   7.038  -9.265  -3.281
  302   2HG   LYS  36          HG1       LYS  36   7.823 -10.695  -2.609
  303   1HD   LYS  36          HD2       LYS  36   5.783 -11.834  -2.316
  304   2HD   LYS  36          HD1       LYS  36   4.837 -10.348  -2.410
  305   1HE   LYS  36          HE2       LYS  36   5.202 -10.156  -4.780
  306   2HE   LYS  36          HE1       LYS  36   6.430 -11.439  -4.752
  307   1HZ   LYS  36          HZ1       LYS  36   4.876 -13.059  -4.397
  308   2HZ   LYS  36          HZ2       LYS  36   3.946 -11.989  -5.334
  309   3HZ   LYS  36          HZ3       LYS  36   3.775 -12.012  -3.643
  310    H    VAL  37           HN       VAL  37   5.201  -6.329  -1.788
  311    HA   VAL  37           HA       VAL  37   4.231  -6.133   1.034
  312    HB   VAL  37           HB       VAL  37   4.161  -3.664   0.752
  313   1HG1  VAL  37          HG11      VAL  37   6.161  -4.781   1.739
  314   2HG1  VAL  37          HG12      VAL  37   6.569  -3.280   0.911
  315   3HG1  VAL  37          HG13      VAL  37   6.893  -4.830   0.136
  316   1HG2  VAL  37          HG21      VAL  37   4.881  -2.586  -1.194
  317   2HG2  VAL  37          HG22      VAL  37   4.083  -4.013  -1.854
  318   3HG2  VAL  37          HG23      VAL  37   5.841  -3.969  -1.722
  319    H    SER  38           HN       SER  38   1.965  -5.759   1.151
  320    HA   SER  38           HA       SER  38   0.536  -5.889  -1.482
  321   1HB   SER  38          HB2       SER  38  -0.808  -6.577   1.082
  322   2HB   SER  38          HB1       SER  38  -0.879  -7.399  -0.477
  323    HG   SER  38           HG       SER  38   0.286  -8.608   1.076
  324    H    PHE  39           HN       PHE  39  -1.107  -4.369  -1.880
  325    HA   PHE  39           HA       PHE  39  -1.266  -2.084   0.032
  326   1HB   PHE  39          HB2       PHE  39  -1.887  -2.538  -2.889
  327   2HB   PHE  39          HB1       PHE  39  -2.411  -1.072  -2.054
  328    HD1  PHE  39           HD1      PHE  39   0.584  -3.135  -2.880
  329    HD2  PHE  39           HD2      PHE  39  -0.891   0.696  -1.614
  330    HE1  PHE  39           HE1      PHE  39   2.854  -2.171  -3.150
  331    HE2  PHE  39           HE2      PHE  39   1.379   1.660  -1.884
  332    HZ   PHE  39           HZ       PHE  39   3.250   0.225  -2.652
  333    H    PHE  40           HN       PHE  40  -3.312  -1.373   0.831
  334    HA   PHE  40           HA       PHE  40  -5.365  -3.454   1.002
  335   1HB   PHE  40          HB2       PHE  40  -4.785  -0.761   2.171
  336   2HB   PHE  40          HB1       PHE  40  -6.447  -1.357   2.262
  337    HD1  PHE  40           HD1      PHE  40  -6.769  -3.791   3.135
  338    HD2  PHE  40           HD2      PHE  40  -3.200  -1.480   3.745
  339    HE1  PHE  40           HE1      PHE  40  -6.138  -5.265   5.027
  340    HE2  PHE  40           HE2      PHE  40  -2.569  -2.953   5.637
  341    HZ   PHE  40           HZ       PHE  40  -4.039  -4.846   6.278
  342    H    CYS  41           HN       CYS  41  -7.212  -3.555  -0.208
  343    HA   CYS  41           HA       CYS  41  -8.059  -1.145  -1.765
  344   1HB   CYS  41          HB2       CYS  41  -6.679  -3.335  -2.793
  345   2HB   CYS  41          HB1       CYS  41  -8.366  -3.713  -3.157
  346    H    LYS  42           HN       LYS  42 -10.344  -1.690  -2.765
  347    HA   LYS  42           HA       LYS  42 -11.902  -3.264  -0.740
  348   1HB   LYS  42          HB2       LYS  42 -13.674  -1.550  -1.127
  349   2HB   LYS  42          HB1       LYS  42 -12.178  -0.852  -0.502
  350   1HG   LYS  42          HG2       LYS  42 -11.510  -0.244  -2.812
  351   2HG   LYS  42          HG1       LYS  42 -13.034  -0.901  -3.411
  352   1HD   LYS  42          HD2       LYS  42 -13.714   1.276  -3.166
  353   2HD   LYS  42          HD1       LYS  42 -13.990   0.753  -1.504
  354   1HE   LYS  42          HE2       LYS  42 -12.030   1.786  -0.715
  355   2HE   LYS  42          HE1       LYS  42 -11.288   1.820  -2.326
  356   1HZ   LYS  42          HZ1       LYS  42 -12.789   3.827  -1.163
  357   2HZ   LYS  42          HZ2       LYS  42 -13.805   3.142  -2.341
  358   3HZ   LYS  42          HZ3       LYS  42 -12.278   3.746  -2.777
  359    H    ASN  43           HN       ASN  43 -13.639  -4.494  -1.533
  360    HA   ASN  43           HA       ASN  43 -13.605  -4.992  -4.484
  361   1HB   ASN  43          HB2       ASN  43 -13.213  -6.703  -2.468
  362   2HB   ASN  43          HB1       ASN  43 -14.979  -6.753  -2.488
  363   1HD2  ASN  43          HD21      ASN  43 -15.696  -6.712  -5.103
  364   2HD2  ASN  43          HD22      ASN  43 -14.969  -7.970  -5.980
  365    H    LYS  44           HN       LYS  44 -15.501  -4.694  -5.672
  366    HA   LYS  44           HA       LYS  44 -17.739  -3.320  -4.309
  367   1HB   LYS  44          HB2       LYS  44 -16.438  -3.216  -6.801
  368   2HB   LYS  44          HB1       LYS  44 -18.047  -3.852  -7.149
  369   1HG   LYS  44          HG2       LYS  44 -19.127  -1.956  -6.285
  370   2HG   LYS  44          HG1       LYS  44 -17.719  -1.469  -5.340
  371   1HD   LYS  44          HD2       LYS  44 -16.787  -1.495  -7.969
  372   2HD   LYS  44          HD1       LYS  44 -18.408  -0.811  -8.097
  373   1HE   LYS  44          HE2       LYS  44 -17.713   0.678  -6.077
  374   2HE   LYS  44          HE1       LYS  44 -16.054   0.222  -6.514
  375   1HZ   LYS  44          HZ1       LYS  44 -16.985   0.737  -8.910
  376   2HZ   LYS  44          HZ2       LYS  44 -16.334   1.964  -7.932
  377   3HZ   LYS  44          HZ3       LYS  44 -18.017   1.764  -8.041
  378    H    GLU  45           HN       GLU  45 -17.178  -6.277  -6.227
  379    HA   GLU  45           HA       GLU  45 -19.945  -7.153  -6.123
  380   1HB   GLU  45          HB2       GLU  45 -18.275  -7.759  -7.865
  381   2HB   GLU  45          HB1       GLU  45 -17.364  -8.661  -6.652
  382   1HG   GLU  45          HG2       GLU  45 -18.751 -10.433  -6.802
  383   2HG   GLU  45          HG1       GLU  45 -20.180  -9.410  -6.654
  384    H    LYS  46           HN       LYS  46 -17.385  -7.196  -3.832
  385    HA   LYS  46           HA       LYS  46 -18.760  -9.377  -2.293
  386   1HB   LYS  46          HB2       LYS  46 -15.900  -8.431  -2.021
  387   2HB   LYS  46          HB1       LYS  46 -16.599  -9.944  -1.437
  388   1HG   LYS  46          HG2       LYS  46 -17.160  -9.946  -4.171
  389   2HG   LYS  46          HG1       LYS  46 -15.516  -9.312  -4.067
  390   1HD   LYS  46          HD2       LYS  46 -14.665 -11.286  -3.310
  391   2HD   LYS  46          HD1       LYS  46 -16.078 -11.622  -2.309
  392   1HE   LYS  46          HE2       LYS  46 -16.334 -11.757  -5.306
  393   2HE   LYS  46          HE1       LYS  46 -15.646 -13.129  -4.416
  394   1HZ   LYS  46          HZ1       LYS  46 -17.634 -12.698  -2.838
  395   2HZ   LYS  46          HZ2       LYS  46 -17.893 -13.563  -4.277
  396   3HZ   LYS  46          HZ3       LYS  46 -18.322 -11.922  -4.178
  397    H    LYS  47           HN       LYS  47 -17.825  -6.047  -2.317
  398    HA   LYS  47           HA       LYS  47 -18.231  -4.331  -0.744
  399   1HB   LYS  47          HB2       LYS  47 -19.674  -6.475   0.824
  400   2HB   LYS  47          HB1       LYS  47 -20.013  -4.744   0.788
  401   1HG   LYS  47          HG2       LYS  47 -20.708  -4.902  -1.558
  402   2HG   LYS  47          HG1       LYS  47 -20.321  -6.622  -1.574
  403   1HD   LYS  47          HD2       LYS  47 -22.058  -7.122  -0.004
  404   2HD   LYS  47          HD1       LYS  47 -22.307  -5.414   0.362
  405   1HE   LYS  47          HE2       LYS  47 -22.765  -5.306  -2.281
  406   2HE   LYS  47          HE1       LYS  47 -23.233  -6.995  -1.998
  407   1HZ   LYS  47          HZ1       LYS  47 -25.128  -5.637  -1.551
  408   2HZ   LYS  47          HZ2       LYS  47 -24.226  -4.592  -0.560
  409   3HZ   LYS  47          HZ3       LYS  47 -24.535  -6.185  -0.058
  410    H    CYS  48           HN       CYS  48 -15.895  -6.204  -0.520
  411    HA   CYS  48           HA       CYS  48 -15.258  -5.650   2.349
  412   1HB   CYS  48          HB2       CYS  48 -13.913  -8.030   1.618
  413   2HB   CYS  48          HB1       CYS  48 -15.235  -7.866   2.769
  414    H    SER  49           HN       SER  49 -12.710  -6.153   2.568
  415    HA   SER  49           HA       SER  49 -11.419  -4.884   0.176
  416   1HB   SER  49          HB2       SER  49  -9.896  -3.867   1.864
  417   2HB   SER  49          HB1       SER  49 -11.579  -3.427   2.134
  418    HG   SER  49           HG       SER  49  -9.863  -4.852   3.698
  419    H    TYR  50           HN       TYR  50  -8.990  -5.363   0.165
  420    HA   TYR  50           HA       TYR  50  -8.170  -7.918   1.380
  421   1HB   TYR  50          HB2       TYR  50  -7.687  -8.755  -1.047
  422   2HB   TYR  50          HB1       TYR  50  -9.346  -8.842  -0.448
  423    HD1  TYR  50           HD1      TYR  50 -11.025  -7.120  -1.139
  424    HD2  TYR  50           HD2      TYR  50  -7.077  -7.264  -2.825
  425    HE1  TYR  50           HE1      TYR  50 -11.764  -5.663  -3.005
  426    HE2  TYR  50           HE2      TYR  50  -7.818  -5.807  -4.689
  427    HH   TYR  50           HH       TYR  50 -10.653  -4.046  -4.626
  428    H    THR  51           HN       THR  51  -5.935  -8.452  -0.142
  429    HA   THR  51           HA       THR  51  -4.422  -5.866   0.003
  430    HB   THR  51           HB       THR  51  -2.492  -7.523   0.474
  431    HG1  THR  51           HG1      THR  51  -3.785  -9.380   1.635
  432   1HG2  THR  51          HG21      THR  51  -3.067  -7.600   2.855
  433   2HG2  THR  51          HG22      THR  51  -4.759  -7.281   2.471
  434   3HG2  THR  51          HG23      THR  51  -3.538  -6.045   2.170
  435    H    GLU  52           HN       GLU  52  -3.017  -5.398  -1.670
  436    HA   GLU  52           HA       GLU  52  -3.179  -7.164  -4.086
  437   1HB   GLU  52          HB2       GLU  52  -2.900  -4.211  -3.564
  438   2HB   GLU  52          HB1       GLU  52  -2.353  -4.878  -5.103
  439   1HG   GLU  52          HG2       GLU  52  -5.071  -5.632  -4.089
  440   2HG   GLU  52          HG1       GLU  52  -4.849  -4.046  -4.828
  441    H    ASP  53           HN       ASP  53  -1.415  -8.493  -3.115
  442    HA   ASP  53           HA       ASP  53   1.064  -7.774  -2.196
  443   1HB   ASP  53          HB2       ASP  53   0.517  -9.831  -4.351
  444   2HB   ASP  53          HB1       ASP  53   1.858  -9.846  -3.199
  445    H    ALA  54           HN       ALA  54   2.949  -6.959  -3.012
  446    HA   ALA  54           HA       ALA  54   3.100  -6.296  -5.926
  447   1HB   ALA  54          HB1       ALA  54   3.873  -4.437  -3.659
  448   2HB   ALA  54          HB2       ALA  54   2.289  -4.392  -4.431
  449   3HB   ALA  54          HB3       ALA  54   3.739  -4.037  -5.370
  450    H    GLN  55           HN       GLN  55   5.485  -5.581  -6.417
  451    HA   GLN  55           HA       GLN  55   7.395  -7.045  -4.632
  452   1HB   GLN  55          HB2       GLN  55   6.468  -8.220  -6.790
  453   2HB   GLN  55          HB1       GLN  55   7.584  -7.145  -7.633
  454   1HG   GLN  55          HG2       GLN  55   8.970  -8.259  -5.400
  455   2HG   GLN  55          HG1       GLN  55   8.182  -9.582  -6.260
  456   1HE2  GLN  55          HE21      GLN  55   8.287  -8.541  -8.920
  457   2HE2  GLN  55          HE22      GLN  55   9.912  -8.444  -9.398
  458    H    CYS  56           HN       CYS  56   9.388  -6.028  -4.414
  459    HA   CYS  56           HA       CYS  56   9.662  -3.341  -5.642
  460   1HB   CYS  56          HB2       CYS  56  10.163  -4.543  -3.144
  461   2HB   CYS  56          HB1       CYS  56  11.752  -4.196  -3.820
  462    H    ILE  57           HN       ILE  57  11.531  -2.782  -6.870
  463    HA   ILE  57           HA       ILE  57  13.360  -5.021  -7.632
  464    HB   ILE  57           HB       ILE  57  11.749  -3.175  -9.417
  465   1HG1  ILE  57          HG12      ILE  57  11.535  -5.803 -10.288
  466   2HG1  ILE  57          HG11      ILE  57  11.557  -5.962  -8.532
  467   1HG2  ILE  57          HG21      ILE  57  14.067  -5.013 -10.061
  468   2HG2  ILE  57          HG22      ILE  57  13.946  -3.284 -10.387
  469   3HG2  ILE  57          HG23      ILE  57  12.938  -4.424 -11.281
  470   1HD1  ILE  57          HD11      ILE  57   9.759  -4.253  -8.379
  471   2HD1  ILE  57          HD12      ILE  57   9.253  -5.664  -9.308
  472   3HD1  ILE  57          HD13      ILE  57   9.707  -4.176 -10.139
  473    H    ASP  58           HN       ASP  58  15.260  -4.089  -8.929
  474    HA   ASP  58           HA       ASP  58  16.860  -2.355  -7.540
  475   1HB   ASP  58          HB2       ASP  58  17.071  -3.705  -9.814
  476   2HB   ASP  58          HB1       ASP  58  16.781  -2.114 -10.526
  477    H    GLY  59           HN       GLY  59  15.698  -0.563  -6.627
  478   1HA   GLY  59          HA2       GLY  59  14.828   1.613  -6.567
  479   2HA   GLY  59          HA1       GLY  59  15.824   1.886  -7.994
  480    H    THR  60           HN       THR  60  13.441  -0.585  -8.345
  481    HA   THR  60           HA       THR  60  11.584   1.375  -9.649
  482    HB   THR  60           HB       THR  60  12.581  -1.262 -10.756
  483    HG1  THR  60           HG1      THR  60  14.182   0.090 -11.152
  484   1HG2  THR  60          HG21      THR  60  11.124   0.743 -12.403
  485   2HG2  THR  60          HG22      THR  60  10.168  -0.191 -11.251
  486   3HG2  THR  60          HG23      THR  60  11.104  -1.019 -12.496
  487    H    ILE  61           HN       ILE  61   9.395   0.836  -9.463
  488    HA   ILE  61           HA       ILE  61   8.570  -1.838  -8.568
  489    HB   ILE  61           HB       ILE  61   9.241  -0.965  -6.455
  490   1HG1  ILE  61          HG12      ILE  61   6.504  -0.061  -6.041
  491   2HG1  ILE  61          HG11      ILE  61   6.561  -1.526  -7.023
  492   1HG2  ILE  61          HG21      ILE  61   9.596   1.343  -6.907
  493   2HG2  ILE  61          HG22      ILE  61   8.301   1.310  -5.711
  494   3HG2  ILE  61          HG23      ILE  61   7.923   1.580  -7.413
  495   1HD1  ILE  61          HD11      ILE  61   6.510  -1.794  -4.440
  496   2HD1  ILE  61          HD12      ILE  61   8.199  -1.294  -4.504
  497   3HD1  ILE  61          HD13      ILE  61   7.679  -2.751  -5.349
  498    H    GLU  62           HN       GLU  62   6.412  -2.197  -9.079
  499    HA   GLU  62           HA       GLU  62   4.992   0.059 -10.430
  500   1HB   GLU  62          HB2       GLU  62   5.532  -2.655 -11.036
  501   2HB   GLU  62          HB1       GLU  62   3.796  -2.555 -10.740
  502   1HG   GLU  62          HG2       GLU  62   3.457  -1.012 -12.469
  503   2HG   GLU  62          HG1       GLU  62   5.145  -0.499 -12.473
  504    H    VAL  63           HN       VAL  63   2.997   0.749  -9.643
  505    HA   VAL  63           HA       VAL  63   2.115  -0.378  -7.047
  506    HB   VAL  63           HB       VAL  63   1.409   2.078  -8.670
  507   1HG1  VAL  63          HG11      VAL  63   0.573   2.058  -5.871
  508   2HG1  VAL  63          HG12      VAL  63  -0.233   0.804  -6.815
  509   3HG1  VAL  63          HG13      VAL  63  -0.349   2.493  -7.311
  510   1HG2  VAL  63          HG21      VAL  63   3.624   1.591  -7.158
  511   2HG2  VAL  63          HG22      VAL  63   2.537   2.250  -5.935
  512   3HG2  VAL  63          HG23      VAL  63   2.924   3.195  -7.373
  513    HA   PRO  64           HA       PRO  64  -1.106  -2.730  -9.015
  514   1HB   PRO  64          HB2       PRO  64  -2.720  -2.581  -6.635
  515   2HB   PRO  64          HB1       PRO  64  -1.732  -3.935  -7.199
  516   1HG   PRO  64          HG2       PRO  64  -1.227  -2.217  -4.966
  517   2HG   PRO  64          HG1       PRO  64  -0.216  -3.535  -5.566
  518   1HD   PRO  64          HD2       PRO  64   0.269  -0.684  -5.758
  519   2HD   PRO  64          HD1       PRO  64   1.314  -2.018  -6.307
  520    H    LYS  65           HN       LYS  65  -2.503  -1.749 -10.436
  521    HA   LYS  65           HA       LYS  65  -3.496   0.846 -10.389
  522   1HB   LYS  65          HB2       LYS  65  -4.283  -1.760 -11.593
  523   2HB   LYS  65          HB1       LYS  65  -5.488  -0.474 -11.662
  524   1HG   LYS  65          HG2       LYS  65  -4.378   0.269 -13.486
  525   2HG   LYS  65          HG1       LYS  65  -3.138   0.825 -12.361
  526   1HD   LYS  65          HD2       LYS  65  -2.921  -2.033 -12.957
  527   2HD   LYS  65          HD1       LYS  65  -2.751  -1.022 -14.393
  528   1HE   LYS  65          HE2       LYS  65  -0.718  -0.253 -13.724
  529   2HE   LYS  65          HE1       LYS  65  -1.288   0.030 -12.066
  530   1HZ   LYS  65          HZ1       LYS  65  -0.727  -2.041 -11.417
  531   2HZ   LYS  65          HZ2       LYS  65   0.361  -1.961 -12.718
  532   3HZ   LYS  65          HZ3       LYS  65  -1.134  -2.747 -12.904
  533    H    CYS  66           HN       CYS  66  -4.845  -2.003  -8.761
  534    HA   CYS  66           HA       CYS  66  -7.392  -1.064  -8.031
  535   1HB   CYS  66          HB2       CYS  66  -6.249  -3.322  -7.656
  536   2HB   CYS  66          HB1       CYS  66  -5.498  -2.598  -6.235
  537    H    PHE  67           HN       PHE  67  -4.241  -0.370  -6.526
  538    HA   PHE  67           HA       PHE  67  -5.356   1.117  -4.290
  539   1HB   PHE  67          HB2       PHE  67  -3.145  -0.039  -4.342
  540   2HB   PHE  67          HB1       PHE  67  -2.590   1.127  -5.544
  541    HD1  PHE  67           HD1      PHE  67  -0.898   2.297  -4.349
  542    HD2  PHE  67           HD2      PHE  67  -4.793   1.787  -2.612
  543    HE1  PHE  67           HE1      PHE  67  -0.298   3.881  -2.537
  544    HE2  PHE  67           HE2      PHE  67  -4.193   3.370  -0.800
  545    HZ   PHE  67           HZ       PHE  67  -1.946   4.418  -0.763
  546    H    LYS  68           HN       LYS  68  -6.172   3.170  -4.413
  547    HA   LYS  68           HA       LYS  68  -5.155   4.969  -6.589
  548   1HB   LYS  68          HB2       LYS  68  -7.979   4.795  -5.493
  549   2HB   LYS  68          HB1       LYS  68  -7.441   5.724  -6.893
  550   1HG   LYS  68          HG2       LYS  68  -6.892   3.687  -8.100
  551   2HG   LYS  68          HG1       LYS  68  -7.256   2.705  -6.679
  552   1HD   LYS  68          HD2       LYS  68  -9.596   3.352  -6.765
  553   2HD   LYS  68          HD1       LYS  68  -9.271   4.487  -8.076
  554   1HE   LYS  68          HE2       LYS  68 -10.123   2.550  -9.172
  555   2HE   LYS  68          HE1       LYS  68  -8.363   2.408  -9.360
  556   1HZ   LYS  68          HZ1       LYS  68  -8.395   1.183  -7.182
  557   2HZ   LYS  68          HZ2       LYS  68  -9.094   0.351  -8.489
  558   3HZ   LYS  68          HZ3       LYS  68 -10.082   1.100  -7.327
  559    H    GLU  69           HN       GLU  69  -3.741   6.057  -5.088
  560    HA   GLU  69           HA       GLU  69  -4.254   6.955  -2.500
  561   1HB   GLU  69          HB2       GLU  69  -2.114   7.242  -3.559
  562   2HB   GLU  69          HB1       GLU  69  -2.815   8.230  -4.842
  563   1HG   GLU  69          HG2       GLU  69  -2.488  10.081  -3.608
  564   2HG   GLU  69          HG1       GLU  69  -3.506   9.414  -2.331
  565    H    HIS  70           HN       HIS  70  -5.856   8.241  -1.680
  566    HA   HIS  70           HA       HIS  70  -6.997  10.386  -3.433
  567   1HB   HIS  70          HB2       HIS  70  -8.206   7.972  -2.713
  568   2HB   HIS  70          HB1       HIS  70  -8.902   9.149  -1.598
  569    HD1  HIS  70           HD1      HIS  70 -11.171   9.463  -2.697
  570    HD2  HIS  70           HD2      HIS  70  -8.017   9.999  -5.368
  571    HE1  HIS  70           HE1      HIS  70 -12.185  10.392  -4.823
  572    H    SER  71           HN       SER  71  -6.938  12.336  -2.387
  573    HA   SER  71           HA       SER  71  -6.115  12.511   0.411
  574   1HB   SER  71          HB2       SER  71  -6.528  14.240  -1.942
  575   2HB   SER  71          HB1       SER  71  -6.878  15.029  -0.402
  576    HG   SER  71           HG       SER  71  -4.743  13.909   0.185
  577    H    SER  72           HN       SER  72  -7.600  14.626   1.396
  578    HA   SER  72           HA       SER  72 -10.159  13.301   2.042
  579   1HB   SER  72          HB2       SER  72  -9.014  15.931   3.017
  580   2HB   SER  72          HB1       SER  72 -10.215  14.927   3.823
  581    HG   SER  72           HG       SER  72  -8.628  13.338   4.084
  582    H    LEU  73           HN       LEU  73  -9.016  15.762  -0.089
  583    HA   LEU  73           HA       LEU  73 -11.270  17.508  -0.210
  584   1HB   LEU  73          HB2       LEU  73  -8.992  16.679  -1.963
  585   2HB   LEU  73          HB1       LEU  73 -10.301  17.605  -2.707
  586    HG   LEU  73           HG       LEU  73  -9.633  18.786  -0.171
  587   1HD1  LEU  73          HD11      LEU  73  -7.425  17.842  -0.366
  588   2HD1  LEU  73          HD12      LEU  73  -7.309  19.536  -0.841
  589   3HD1  LEU  73          HD13      LEU  73  -7.332  18.275  -2.073
  590   1HD2  LEU  73          HD21      LEU  73  -8.816  20.537  -2.121
  591   2HD2  LEU  73          HD22      LEU  73 -10.485  20.360  -1.580
  592   3HD2  LEU  73          HD23      LEU  73  -9.928  19.504  -3.019
  593    H    ALA  74           HN       ALA  74 -10.728  14.293  -1.523
  594    HA   ALA  74           HA       ALA  74 -12.854  14.311  -3.477
  595   1HB   ALA  74          HB1       ALA  74 -10.799  12.620  -2.536
  596   2HB   ALA  74          HB2       ALA  74 -11.876  12.316  -3.900
  597   3HB   ALA  74          HB3       ALA  74 -12.298  11.724  -2.293
  598    H    PHE  75           HN       PHE  75 -12.883  14.318  -0.070
  599    HA   PHE  75           HA       PHE  75 -14.705  14.211   1.438
  600   1HB   PHE  75          HB2       PHE  75 -15.729  14.859  -1.092
  601   2HB   PHE  75          HB1       PHE  75 -16.752  13.542  -0.518
  602    HD1  PHE  75           HD1      PHE  75 -15.380  16.883   0.391
  603    HD2  PHE  75           HD2      PHE  75 -18.323  13.871   1.239
  604    HE1  PHE  75           HE1      PHE  75 -16.537  18.447   1.929
  605    HE2  PHE  75           HE2      PHE  75 -19.480  15.435   2.777
  606    HZ   PHE  75           HZ       PHE  75 -18.586  17.723   3.123
  607    H    TRP  76           HN       TRP  76 -13.562  12.103   1.989
  608    HA   TRP  76           HA       TRP  76 -15.489   9.907   1.982
  609   1HB   TRP  76          HB2       TRP  76 -13.665  10.172  -0.163
  610   2HB   TRP  76          HB1       TRP  76 -13.065   8.847   0.837
  611    HD1  TRP  76           HD1      TRP  76 -14.966   6.936   1.496
  612    HE1  TRP  76           HE1      TRP  76 -16.855   5.981   0.022
  613    HE3  TRP  76           HE3      TRP  76 -15.271  10.613  -2.013
  614    HZ2  TRP  76           HZ2      TRP  76 -18.309   6.694  -2.340
  615    HZ3  TRP  76           HZ3      TRP  76 -16.913  10.460  -3.866
  616    HH2  TRP  76           HH2      TRP  76 -18.433   8.507  -4.032
  617    H    LYS  77           HN       LYS  77 -14.562   8.008   3.232
  618    HA   LYS  77           HA       LYS  77 -12.082   8.525   4.749
  619   1HB   LYS  77          HB2       LYS  77 -14.077   9.814   5.753
  620   2HB   LYS  77          HB1       LYS  77 -14.710   8.234   6.215
  621   1HG   LYS  77          HG2       LYS  77 -12.557   7.767   7.398
  622   2HG   LYS  77          HG1       LYS  77 -12.037   9.413   7.029
  623   1HD   LYS  77          HD2       LYS  77 -13.007   9.942   9.014
  624   2HD   LYS  77          HD1       LYS  77 -14.521   9.847   8.113
  625   1HE   LYS  77          HE2       LYS  77 -15.025   8.342   9.805
  626   2HE   LYS  77          HE1       LYS  77 -14.203   7.224   8.698
  627   1HZ   LYS  77          HZ1       LYS  77 -13.181   7.071  10.856
  628   2HZ   LYS  77          HZ2       LYS  77 -12.953   8.753  10.920
  629   3HZ   LYS  77          HZ3       LYS  77 -12.093   7.820   9.792
  630    H    THR  78           HN       THR  78 -11.554   6.649   6.161
  631    HA   THR  78           HA       THR  78 -11.388   4.327   6.555
  632    HB   THR  78           HB       THR  78 -14.278   4.351   5.647
  633    HG1  THR  78           HG1      THR  78 -14.554   5.644   7.262
  634   1HG2  THR  78          HG21      THR  78 -14.413   2.270   6.522
  635   2HG2  THR  78          HG22      THR  78 -13.467   2.719   7.942
  636   3HG2  THR  78          HG23      THR  78 -12.651   2.266   6.446
  637    H    ASP  79           HN       ASP  79 -10.435   5.167   4.055
  638    HA   ASP  79           HA       ASP  79 -11.559   3.826   1.792
  639   1HB   ASP  79          HB2       ASP  79  -8.777   4.758   2.546
  640   2HB   ASP  79          HB1       ASP  79  -9.170   4.139   0.943
  641    H    ALA  80           HN       ALA  80 -10.033   2.061   0.647
  642    HA   ALA  80           HA       ALA  80 -10.338  -0.425   1.817
  643   1HB   ALA  80          HB1       ALA  80  -8.170   0.690   0.023
  644   2HB   ALA  80          HB2       ALA  80  -9.627  -0.177  -0.460
  645   3HB   ALA  80          HB3       ALA  80  -8.324  -1.034   0.364
  646    H    SER  81           HN       SER  81  -7.598   1.794   2.288
  647    HA   SER  81           HA       SER  81  -5.885   0.118   3.788
  648   1HB   SER  81          HB2       SER  81  -6.387   3.063   4.275
  649   2HB   SER  81          HB1       SER  81  -4.870   2.186   4.453
  650    HG   SER  81           HG       SER  81  -4.731   3.132   2.494
  651    H    ASP  82           HN       ASP  82  -9.000   1.323   4.658
  652    HA   ASP  82           HA       ASP  82  -8.477   0.583   7.522
  653   1HB   ASP  82          HB2       ASP  82 -10.437   2.637   6.485
  654   2HB   ASP  82          HB1       ASP  82  -9.904   2.412   8.150
  655    H    VAL  83           HN       VAL  83  -9.533  -1.125   5.310
  656    HA   VAL  83           HA       VAL  83 -12.329  -1.548   6.322
  657    HB   VAL  83           HB       VAL  83 -11.199  -2.558   3.713
  658   1HG1  VAL  83          HG11      VAL  83 -13.998  -1.681   4.469
  659   2HG1  VAL  83          HG12      VAL  83 -13.425  -3.342   4.631
  660   3HG1  VAL  83          HG13      VAL  83 -13.509  -2.589   3.038
  661   1HG2  VAL  83          HG21      VAL  83 -10.744  -0.166   3.702
  662   2HG2  VAL  83          HG22      VAL  83 -12.367   0.182   4.298
  663   3HG2  VAL  83          HG23      VAL  83 -12.144  -0.473   2.675
  664    H    LYS  84           HN       LYS  84 -12.999  -3.848   6.444
  665    HA   LYS  84           HA       LYS  84 -10.798  -5.556   7.442
  666   1HB   LYS  84          HB2       LYS  84 -13.778  -5.409   7.588
  667   2HB   LYS  84          HB1       LYS  84 -13.037  -6.994   7.810
  668   1HG   LYS  84          HG2       LYS  84 -11.418  -5.527   9.395
  669   2HG   LYS  84          HG1       LYS  84 -12.901  -4.584   9.542
  670   1HD   LYS  84          HD2       LYS  84 -14.142  -6.595  10.204
  671   2HD   LYS  84          HD1       LYS  84 -12.685  -7.572  10.013
  672   1HE   LYS  84          HE2       LYS  84 -11.803  -6.861  12.001
  673   2HE   LYS  84          HE1       LYS  84 -12.393  -5.201  11.777
  674   1HZ   LYS  84          HZ1       LYS  84 -13.839  -5.936  13.373
  675   2HZ   LYS  84          HZ2       LYS  84 -13.803  -7.548  12.837
  676   3HZ   LYS  84          HZ3       LYS  84 -14.699  -6.384  11.983
  677    HA   PRO  85           HA       PRO  85 -10.457  -7.877   3.698
  678   1HB   PRO  85          HB2       PRO  85  -9.945 -10.326   5.122
  679   2HB   PRO  85          HB1       PRO  85  -8.771  -9.249   4.352
  680   1HG   PRO  85          HG2       PRO  85  -9.199  -9.651   7.155
  681   2HG   PRO  85          HG1       PRO  85  -8.060  -8.545   6.383
  682   1HD   PRO  85          HD2       PRO  85 -10.511  -7.896   7.785
  683   2HD   PRO  85          HD1       PRO  85  -9.332  -6.776   7.058
  684    H    CYS  86           HN       CYS  86 -11.945  -9.001   2.454
  685    HA   CYS  86           HA       CYS  86 -14.567  -9.524   3.219
  686   1HB   CYS  86          HB2       CYS  86 -13.205  -9.632   0.943
  687   2HB   CYS  86          HB1       CYS  86 -13.179 -11.363   1.298
  Start of MODEL    9
    1   1H    THR   1          HT1       THR   1  23.299  -3.779  -7.826
    2   2H    THR   1          HT2       THR   1  24.943  -4.111  -7.553
    3   3H    THR   1          HT3       THR   1  24.161  -2.889  -6.668
    4    HA   THR   1           HA       THR   1  23.831  -5.824  -6.424
    5    HB   THR   1           HB       THR   1  24.107  -4.756  -3.960
    6    HG1  THR   1           HG1      THR   1  24.427  -2.694  -4.290
    7   1HG2  THR   1          HG21      THR   1  26.555  -5.154  -4.222
    8   2HG2  THR   1          HG22      THR   1  26.324  -5.249  -5.967
    9   3HG2  THR   1          HG23      THR   1  25.579  -6.450  -4.913
   10    H    LYS   2           HN       LYS   2  21.542  -5.396  -7.347
   11    HA   LYS   2           HA       LYS   2  19.231  -4.970  -7.006
   12   1HB   LYS   2          HB2       LYS   2  20.081  -5.715  -4.190
   13   2HB   LYS   2          HB1       LYS   2  18.499  -5.983  -4.925
   14   1HG   LYS   2          HG2       LYS   2  19.188  -7.913  -5.856
   15   2HG   LYS   2          HG1       LYS   2  20.586  -7.118  -6.581
   16   1HD   LYS   2          HD2       LYS   2  21.980  -7.652  -4.822
   17   2HD   LYS   2          HD1       LYS   2  20.666  -7.659  -3.644
   18   1HE   LYS   2          HE2       LYS   2  20.131  -9.726  -5.554
   19   2HE   LYS   2          HE1       LYS   2  21.804  -9.907  -4.991
   20   1HZ   LYS   2          HZ1       LYS   2  19.324  -9.791  -3.387
   21   2HZ   LYS   2          HZ2       LYS   2  20.828  -9.406  -2.697
   22   3HZ   LYS   2          HZ3       LYS   2  20.559 -10.954  -3.343
   23    H    ALA   3           HN       ALA   3  19.261  -2.643  -7.296
   24    HA   ALA   3           HA       ALA   3  19.857  -0.839  -5.090
   25   1HB   ALA   3          HB1       ALA   3  18.152   0.089  -7.313
   26   2HB   ALA   3          HB2       ALA   3  19.640  -0.705  -7.829
   27   3HB   ALA   3          HB3       ALA   3  19.713   0.702  -6.767
   28    H    SER   4           HN       SER   4  18.469  -0.321  -3.445
   29    HA   SER   4           HA       SER   4  15.911  -1.474  -3.070
   30   1HB   SER   4          HB2       SER   4  16.163   1.113  -1.797
   31   2HB   SER   4          HB1       SER   4  16.253  -0.486  -1.067
   32    HG   SER   4           HG       SER   4  18.218   1.234  -1.523
   33    H    CYS   5           HN       CYS   5  13.995   0.318  -2.587
   34    HA   CYS   5           HA       CYS   5  13.523   1.627  -5.240
   35   1HB   CYS   5          HB2       CYS   5  11.501   0.893  -3.117
   36   2HB   CYS   5          HB1       CYS   5  11.209   1.178  -4.830
   37    H    LYS   6           HN       LYS   6  11.252   3.128  -4.158
   38    HA   LYS   6           HA       LYS   6  12.458   4.968  -2.160
   39   1HB   LYS   6          HB2       LYS   6  12.311   6.859  -3.654
   40   2HB   LYS   6          HB1       LYS   6  13.165   5.586  -4.525
   41   1HG   LYS   6          HG2       LYS   6  10.797   4.908  -5.378
   42   2HG   LYS   6          HG1       LYS   6  10.330   6.533  -4.877
   43   1HD   LYS   6          HD2       LYS   6  11.728   7.563  -6.438
   44   2HD   LYS   6          HD1       LYS   6  12.784   6.156  -6.567
   45   1HE   LYS   6          HE2       LYS   6  10.200   5.289  -7.368
   46   2HE   LYS   6          HE1       LYS   6  10.515   6.823  -8.205
   47   1HZ   LYS   6          HZ1       LYS   6  12.691   6.004  -8.842
   48   2HZ   LYS   6          HZ2       LYS   6  11.487   4.944  -9.404
   49   3HZ   LYS   6          HZ3       LYS   6  12.410   4.539  -8.035
   50    H    LEU   7           HN       LEU   7  10.825   5.223  -0.695
   51    HA   LEU   7           HA       LEU   7   8.192   4.480  -0.760
   52   1HB   LEU   7          HB2       LEU   7   7.839   6.367   0.862
   53   2HB   LEU   7          HB1       LEU   7   9.309   5.440   1.181
   54    HG   LEU   7           HG       LEU   7   9.943   7.516  -0.687
   55   1HD1  LEU   7          HD11      LEU   7   8.407   8.388   1.775
   56   2HD1  LEU   7          HD12      LEU   7   8.044   8.777   0.094
   57   3HD1  LEU   7          HD13      LEU   7   9.474   9.460   0.869
   58   1HD2  LEU   7          HD21      LEU   7  11.766   7.051   0.588
   59   2HD2  LEU   7          HD22      LEU   7  10.784   6.476   1.934
   60   3HD2  LEU   7          HD23      LEU   7  11.082   8.203   1.734
   61    HA   PRO   8           HA       PRO   8   6.947   7.048  -4.339
   62   1HB   PRO   8          HB2       PRO   8   4.515   5.510  -4.351
   63   2HB   PRO   8          HB1       PRO   8   5.861   5.427  -5.496
   64   1HG   PRO   8          HG2       PRO   8   5.121   3.491  -3.519
   65   2HG   PRO   8          HG1       PRO   8   6.484   3.427  -4.640
   66   1HD   PRO   8          HD2       PRO   8   6.547   3.881  -1.782
   67   2HD   PRO   8          HD1       PRO   8   7.922   3.775  -2.906
   68    H    VAL   9           HN       VAL   9   5.120   6.135  -1.442
   69    HA   VAL   9           HA       VAL   9   3.689   8.769  -1.592
   70    HB   VAL   9           HB       VAL   9   2.677   6.207  -0.341
   71   1HG1  VAL   9          HG11      VAL   9   1.383   7.984   0.462
   72   2HG1  VAL   9          HG12      VAL   9   0.474   7.480  -0.962
   73   3HG1  VAL   9          HG13      VAL   9   1.524   8.895  -1.041
   74   1HG2  VAL   9          HG21      VAL   9   2.628   5.431  -2.488
   75   2HG2  VAL   9          HG22      VAL   9   2.823   7.044  -3.175
   76   3HG2  VAL   9          HG23      VAL   9   1.233   6.498  -2.642
   77    H    LYS  10           HN       LYS  10   2.866   9.364   0.727
   78    HA   LYS  10           HA       LYS  10   5.108   8.870   2.654
   79   1HB   LYS  10          HB2       LYS  10   3.070  11.114   2.502
   80   2HB   LYS  10          HB1       LYS  10   4.495  11.065   3.540
   81   1HG   LYS  10          HG2       LYS  10   5.695  10.654   1.170
   82   2HG   LYS  10          HG1       LYS  10   4.299  11.578   0.613
   83   1HD   LYS  10          HD2       LYS  10   4.934  13.488   1.747
   84   2HD   LYS  10          HD1       LYS  10   5.773  12.585   3.009
   85   1HE   LYS  10          HE2       LYS  10   7.583  13.468   1.807
   86   2HE   LYS  10          HE1       LYS  10   7.375  11.905   0.994
   87   1HZ   LYS  10          HZ1       LYS  10   5.940  14.364   0.164
   88   2HZ   LYS  10          HZ2       LYS  10   6.048  12.892  -0.676
   89   3HZ   LYS  10          HZ3       LYS  10   7.416  13.888  -0.523
   90    H    LYS  11           HN       LYS  11   2.255   7.525   2.089
   91    HA   LYS  11           HA       LYS  11   1.746   6.942   4.932
   92   1HB   LYS  11          HB2       LYS  11   0.081   8.727   3.207
   93   2HB   LYS  11          HB1       LYS  11  -0.769   7.639   4.305
   94   1HG   LYS  11          HG2       LYS  11   0.782   8.504   6.142
   95   2HG   LYS  11          HG1       LYS  11   1.258   9.768   5.009
   96   1HD   LYS  11          HD2       LYS  11  -1.615   9.540   5.045
   97   2HD   LYS  11          HD1       LYS  11  -1.016   9.742   6.692
   98   1HE   LYS  11          HE2       LYS  11   0.342  11.502   4.770
   99   2HE   LYS  11          HE1       LYS  11  -1.400  11.814   4.899
  100   1HZ   LYS  11          HZ1       LYS  11   0.360  12.739   6.664
  101   2HZ   LYS  11          HZ2       LYS  11  -0.006  11.245   7.386
  102   3HZ   LYS  11          HZ3       LYS  11  -1.244  12.363   7.068
  103    H    ALA  12           HN       ALA  12   2.572   5.240   2.821
  104    HA   ALA  12           HA       ALA  12   0.158   3.850   1.812
  105   1HB   ALA  12          HB1       ALA  12   3.020   2.955   1.520
  106   2HB   ALA  12          HB2       ALA  12   2.434   4.358   0.627
  107   3HB   ALA  12          HB3       ALA  12   1.688   2.780   0.378
  108    H    THR  13           HN       THR  13  -0.784   2.251   3.025
  109    HA   THR  13           HA       THR  13   0.807   0.958   5.193
  110    HB   THR  13           HB       THR  13  -2.159   0.881   4.570
  111    HG1  THR  13           HG1      THR  13  -1.883   2.373   6.580
  112   1HG2  THR  13          HG21      THR  13  -2.243  -0.597   6.259
  113   2HG2  THR  13          HG22      THR  13  -1.564   0.624   7.335
  114   3HG2  THR  13          HG23      THR  13  -0.495  -0.482   6.470
  115    H    VAL  14           HN       VAL  14   1.947  -0.715   4.166
  116    HA   VAL  14           HA       VAL  14   0.415  -2.570   2.391
  117    HB   VAL  14           HB       VAL  14   2.608  -3.210   1.597
  118   1HG1  VAL  14          HG11      VAL  14   2.606  -0.224   2.132
  119   2HG1  VAL  14          HG12      VAL  14   1.717  -1.010   0.829
  120   3HG1  VAL  14          HG13      VAL  14   3.479  -1.053   0.845
  121   1HG2  VAL  14          HG21      VAL  14   4.515  -1.741   2.874
  122   2HG2  VAL  14          HG22      VAL  14   4.121  -3.404   3.303
  123   3HG2  VAL  14          HG23      VAL  14   3.415  -2.070   4.212
  124    H    VAL  15           HN       VAL  15   1.152  -4.951   2.684
  125    HA   VAL  15           HA       VAL  15   1.381  -5.573   5.612
  126    HB   VAL  15           HB       VAL  15  -0.227  -6.836   3.373
  127   1HG1  VAL  15          HG11      VAL  15  -0.160  -7.798   6.233
  128   2HG1  VAL  15          HG12      VAL  15   0.929  -8.464   5.016
  129   3HG1  VAL  15          HG13      VAL  15  -0.816  -8.618   4.816
  130   1HG2  VAL  15          HG21      VAL  15  -1.509  -5.085   4.219
  131   2HG2  VAL  15          HG22      VAL  15  -0.815  -5.223   5.834
  132   3HG2  VAL  15          HG23      VAL  15  -2.005  -6.402   5.283
  133    H    TYR  16           HN       TYR  16   3.525  -6.215   5.782
  134    HA   TYR  16           HA       TYR  16   4.875  -7.719   3.666
  135   1HB   TYR  16          HB2       TYR  16   5.658  -6.009   5.595
  136   2HB   TYR  16          HB1       TYR  16   5.941  -7.530   6.442
  137    HD1  TYR  16           HD1      TYR  16   6.476  -9.163   3.862
  138    HD2  TYR  16           HD2      TYR  16   8.010  -5.429   5.329
  139    HE1  TYR  16           HE1      TYR  16   8.556  -9.505   2.555
  140    HE2  TYR  16           HE2      TYR  16  10.090  -5.771   4.023
  141    HH   TYR  16           HH       TYR  16  10.609  -8.748   2.140
  142    H    GLN  17           HN       GLN  17   6.237  -9.301   5.938
  143    HA   GLN  17           HA       GLN  17   4.864 -11.783   5.551
  144   1HB   GLN  17          HB2       GLN  17   6.878 -10.836   7.609
  145   2HB   GLN  17          HB1       GLN  17   6.465 -12.531   7.325
  146   1HG   GLN  17          HG2       GLN  17   7.869 -12.622   5.570
  147   2HG   GLN  17          HG1       GLN  17   7.061 -11.248   4.813
  148   1HE2  GLN  17          HE21      GLN  17   9.689 -12.126   7.059
  149   2HE2  GLN  17          HE22      GLN  17  10.502 -10.640   6.950
  150    H    GLY  18           HN       GLY  18   2.717 -10.410   6.296
  151   1HA   GLY  18          HA2       GLY  18   0.905 -10.691   7.796
  152   2HA   GLY  18          HA1       GLY  18   1.977 -11.591   8.869
  153    H    GLU  19           HN       GLU  19   2.710  -8.372   7.619
  154    HA   GLU  19           HA       GLU  19   2.160  -7.230  10.331
  155   1HB   GLU  19          HB2       GLU  19   4.678  -6.752   8.715
  156   2HB   GLU  19          HB1       GLU  19   4.379  -6.303  10.394
  157   1HG   GLU  19          HG2       GLU  19   4.099  -8.779  10.891
  158   2HG   GLU  19          HG1       GLU  19   4.710  -9.092   9.266
  159    H    ARG  20           HN       ARG  20   0.994  -5.361  10.115
  160    HA   ARG  20           HA       ARG  20   0.875  -4.036   7.451
  161   1HB   ARG  20          HB2       ARG  20  -0.761  -3.757   9.992
  162   2HB   ARG  20          HB1       ARG  20  -1.132  -2.969   8.455
  163   1HG   ARG  20          HG2       ARG  20  -2.032  -4.854   7.589
  164   2HG   ARG  20          HG1       ARG  20  -0.707  -5.856   8.183
  165   1HD   ARG  20          HD2       ARG  20  -1.791  -6.351  10.166
  166   2HD   ARG  20          HD1       ARG  20  -2.645  -4.795  10.205
  167    HE   ARG  20           HE       ARG  20  -3.647  -6.055   7.943
  168   1HH1  ARG  20          HH11      ARG  20  -3.963  -6.093  11.316
  169   2HH1  ARG  20          HH12      ARG  20  -5.090  -7.407  11.359
  170   1HH2  ARG  20          HH21      ARG  20  -4.835  -8.084   7.967
  171   2HH2  ARG  20          HH22      ARG  20  -5.584  -8.534   9.463
  172    H    VAL  21           HN       VAL  21   2.174  -2.261   7.163
  173    HA   VAL  21           HA       VAL  21   2.530  -0.356   9.419
  174    HB   VAL  21           HB       VAL  21   4.996  -0.436   9.065
  175   1HG1  VAL  21          HG11      VAL  21   4.128  -3.271   9.524
  176   2HG1  VAL  21          HG12      VAL  21   3.580  -2.019  10.636
  177   3HG1  VAL  21          HG13      VAL  21   5.305  -2.308  10.415
  178   1HG2  VAL  21          HG21      VAL  21   4.661  -2.977   7.517
  179   2HG2  VAL  21          HG22      VAL  21   5.998  -1.826   7.503
  180   3HG2  VAL  21          HG23      VAL  21   4.500  -1.449   6.651
  181    H    LYS  22           HN       LYS  22   3.476   1.716   8.638
  182    HA   LYS  22           HA       LYS  22   2.528   2.342   5.909
  183   1HB   LYS  22          HB2       LYS  22   3.508   3.912   8.303
  184   2HB   LYS  22          HB1       LYS  22   3.117   4.685   6.767
  185   1HG   LYS  22          HG2       LYS  22   1.034   2.828   7.632
  186   2HG   LYS  22          HG1       LYS  22   1.310   4.120   8.800
  187   1HD   LYS  22          HD2       LYS  22   1.376   5.476   6.399
  188   2HD   LYS  22          HD1       LYS  22   0.138   4.253   6.109
  189   1HE   LYS  22          HE2       LYS  22  -1.024   6.122   7.070
  190   2HE   LYS  22          HE1       LYS  22  -0.843   4.958   8.397
  191   1HZ   LYS  22          HZ1       LYS  22   0.149   6.671   9.436
  192   2HZ   LYS  22          HZ2       LYS  22   0.467   7.512   7.995
  193   3HZ   LYS  22          HZ3       LYS  22   1.497   6.257   8.494
  194    H    ILE  23           HN       ILE  23   3.975   2.098   4.255
  195    HA   ILE  23           HA       ILE  23   6.709   1.613   4.341
  196    HB   ILE  23           HB       ILE  23   5.083   1.616   2.384
  197   1HG1  ILE  23          HG12      ILE  23   7.742   3.032   2.001
  198   2HG1  ILE  23          HG11      ILE  23   7.508   1.284   2.066
  199   1HG2  ILE  23          HG21      ILE  23   4.265   3.946   2.813
  200   2HG2  ILE  23          HG22      ILE  23   4.800   3.698   1.150
  201   3HG2  ILE  23          HG23      ILE  23   5.838   4.553   2.292
  202   1HD1  ILE  23          HD11      ILE  23   7.622   2.456  -0.270
  203   2HD1  ILE  23          HD12      ILE  23   5.963   2.936   0.083
  204   3HD1  ILE  23          HD13      ILE  23   6.389   1.226   0.008
  205    H    GLN  24           HN       GLN  24   5.071   4.762   4.473
  206    HA   GLN  24           HA       GLN  24   7.299   6.473   4.151
  207   1HB   GLN  24          HB2       GLN  24   5.845   8.012   5.588
  208   2HB   GLN  24          HB1       GLN  24   5.057   7.319   4.166
  209   1HG   GLN  24          HG2       GLN  24   3.528   6.299   5.458
  210   2HG   GLN  24          HG1       GLN  24   4.798   5.504   6.389
  211   1HE2  GLN  24          HE21      GLN  24   2.627   8.285   6.312
  212   2HE2  GLN  24          HE22      GLN  24   2.967   8.826   7.884
  213    H    GLU  25           HN       GLU  25   6.548   4.304   6.733
  214    HA   GLU  25           HA       GLU  25   8.491   5.682   8.548
  215   1HB   GLU  25          HB2       GLU  25   6.131   3.844   8.912
  216   2HB   GLU  25          HB1       GLU  25   7.330   4.017  10.194
  217   1HG   GLU  25          HG2       GLU  25   6.590   6.612   9.141
  218   2HG   GLU  25          HG1       GLU  25   5.160   5.731   9.680
  219    H    LYS  26           HN       LYS  26   7.455   2.305   7.886
  220    HA   LYS  26           HA       LYS  26   9.864   1.078   8.778
  221   1HB   LYS  26          HB2       LYS  26   7.813  -0.156   8.482
  222   2HB   LYS  26          HB1       LYS  26   7.736   0.285   6.772
  223   1HG   LYS  26          HG2       LYS  26   8.907  -1.570   6.278
  224   2HG   LYS  26          HG1       LYS  26  10.272  -0.912   7.181
  225   1HD   LYS  26          HD2       LYS  26   9.594  -1.987   9.193
  226   2HD   LYS  26          HD1       LYS  26   7.993  -2.352   8.547
  227   1HE   LYS  26          HE2       LYS  26   9.178  -3.784   6.781
  228   2HE   LYS  26          HE1       LYS  26  10.637  -3.619   7.778
  229   1HZ   LYS  26          HZ1       LYS  26   9.439  -4.459   9.671
  230   2HZ   LYS  26          HZ2       LYS  26   9.295  -5.572   8.397
  231   3HZ   LYS  26          HZ3       LYS  26   7.997  -4.545   8.782
  232    H    PHE  27           HN       PHE  27   8.904   2.266   5.562
  233    HA   PHE  27           HA       PHE  27  11.697   1.722   4.603
  234   1HB   PHE  27          HB2       PHE  27   9.007   1.874   3.211
  235   2HB   PHE  27          HB1       PHE  27  10.543   1.760   2.344
  236    HD1  PHE  27           HD1      PHE  27  12.165  -0.094   3.743
  237    HD2  PHE  27           HD2      PHE  27   7.901  -0.177   3.230
  238    HE1  PHE  27           HE1      PHE  27  12.173  -2.553   4.073
  239    HE2  PHE  27           HE2      PHE  27   7.909  -2.634   3.560
  240    HZ   PHE  27           HZ       PHE  27  10.045  -3.823   3.982
  241    H    LYS  28           HN       LYS  28  11.047   4.100   6.108
  242    HA   LYS  28           HA       LYS  28  10.345   6.368   4.570
  243   1HB   LYS  28          HB2       LYS  28  11.297   7.592   6.383
  244   2HB   LYS  28          HB1       LYS  28  10.733   6.079   7.091
  245   1HG   LYS  28          HG2       LYS  28  13.576   6.452   6.119
  246   2HG   LYS  28          HG1       LYS  28  13.081   6.820   7.770
  247   1HD   LYS  28          HD2       LYS  28  12.026   4.397   7.654
  248   2HD   LYS  28          HD1       LYS  28  13.232   4.169   6.387
  249   1HE   LYS  28          HE2       LYS  28  14.501   5.508   8.585
  250   2HE   LYS  28          HE1       LYS  28  13.647   4.082   9.208
  251   1HZ   LYS  28          HZ1       LYS  28  15.618   4.201   6.996
  252   2HZ   LYS  28          HZ2       LYS  28  14.587   2.871   7.227
  253   3HZ   LYS  28          HZ3       LYS  28  15.713   3.295   8.427
  254    H    ASN  29           HN       ASN  29  13.226   4.436   4.496
  255    HA   ASN  29           HA       ASN  29  14.654   6.525   2.892
  256   1HB   ASN  29          HB2       ASN  29  15.441   4.178   4.604
  257   2HB   ASN  29          HB1       ASN  29  16.568   4.795   3.392
  258   1HD2  ASN  29          HD21      ASN  29  17.274   7.087   3.625
  259   2HD2  ASN  29          HD22      ASN  29  17.190   7.847   5.140
  260    H    GLY  30           HN       GLY  30  12.495   4.898   1.762
  261   1HA   GLY  30          HA2       GLY  30  12.281   3.988  -0.440
  262   2HA   GLY  30          HA1       GLY  30  14.018   3.680  -0.454
  263    H    MET  31           HN       MET  31  12.223   1.686  -1.264
  264    HA   MET  31           HA       MET  31  12.004  -0.177   1.056
  265   1HB   MET  31          HB2       MET  31  10.958  -0.237  -1.796
  266   2HB   MET  31          HB1       MET  31  10.605  -1.458  -0.578
  267   1HG   MET  31          HG2       MET  31  10.060   1.037   0.632
  268   2HG   MET  31          HG1       MET  31   9.344   1.102  -0.978
  269   1HE   MET  31          HE1       MET  31   8.779  -1.176  -1.928
  270   2HE   MET  31          HE2       MET  31   7.227  -1.811  -1.389
  271   3HE   MET  31          HE3       MET  31   8.717  -2.617  -0.904
  272    H    LEU  32           HN       LEU  32  12.815  -2.404   0.775
  273    HA   LEU  32           HA       LEU  32  15.465  -2.506  -0.402
  274   1HB   LEU  32          HB2       LEU  32  13.626  -4.635   0.734
  275   2HB   LEU  32          HB1       LEU  32  15.355  -4.840   0.442
  276    HG   LEU  32           HG       LEU  32  14.283  -2.618   2.188
  277   1HD1  LEU  32          HD11      LEU  32  13.620  -4.257   3.616
  278   2HD1  LEU  32          HD12      LEU  32  15.344  -4.475   3.914
  279   3HD1  LEU  32          HD13      LEU  32  14.513  -5.502   2.745
  280   1HD2  LEU  32          HD21      LEU  32  16.864  -3.461   1.221
  281   2HD2  LEU  32          HD22      LEU  32  16.822  -3.605   2.979
  282   3HD2  LEU  32          HD23      LEU  32  16.464  -2.057   2.212
  283    H    HIS  33           HN       HIS  33  16.072  -4.251  -2.009
  284    HA   HIS  33           HA       HIS  33  14.365  -4.116  -4.359
  285   1HB   HIS  33          HB2       HIS  33  16.772  -4.107  -4.558
  286   2HB   HIS  33          HB1       HIS  33  16.898  -5.613  -3.643
  287    HD1  HIS  33           HD1      HIS  33  15.173  -4.411  -6.836
  288    HD2  HIS  33           HD2      HIS  33  17.012  -7.819  -5.292
  289    HE1  HIS  33           HE1      HIS  33  15.165  -6.133  -8.693
  290    H    GLY  34           HN       GLY  34  13.124  -5.785  -5.267
  291   1HA   GLY  34          HA2       GLY  34  11.894  -7.781  -5.345
  292   2HA   GLY  34          HA1       GLY  34  13.174  -8.511  -4.376
  293    H    ASP  35           HN       ASP  35  11.965  -5.738  -2.870
  294    HA   ASP  35           HA       ASP  35  10.937  -7.140  -0.607
  295   1HB   ASP  35          HB2       ASP  35  11.730  -4.664  -1.042
  296   2HB   ASP  35          HB1       ASP  35  10.027  -4.385  -1.406
  297    H    LYS  36           HN       LYS  36   9.015  -8.226  -0.419
  298    HA   LYS  36           HA       LYS  36   6.892  -7.732  -2.452
  299   1HB   LYS  36          HB2       LYS  36   7.618  -9.938  -0.530
  300   2HB   LYS  36          HB1       LYS  36   6.029  -9.898  -1.296
  301   1HG   LYS  36          HG2       LYS  36   7.682  -9.438  -3.437
  302   2HG   LYS  36          HG1       LYS  36   8.660 -10.537  -2.464
  303   1HD   LYS  36          HD2       LYS  36   6.225 -11.745  -2.284
  304   2HD   LYS  36          HD1       LYS  36   6.123 -11.042  -3.900
  305   1HE   LYS  36          HE2       LYS  36   8.180 -12.160  -4.578
  306   2HE   LYS  36          HE1       LYS  36   8.433 -12.765  -2.928
  307   1HZ   LYS  36          HZ1       LYS  36   5.795 -13.303  -3.912
  308   2HZ   LYS  36          HZ2       LYS  36   6.923 -14.363  -3.212
  309   3HZ   LYS  36          HZ3       LYS  36   6.990 -14.024  -4.875
  310    H    VAL  37           HN       VAL  37   5.233  -6.428  -1.851
  311    HA   VAL  37           HA       VAL  37   4.280  -6.510   0.979
  312    HB   VAL  37           HB       VAL  37   4.120  -3.980   0.807
  313   1HG1  VAL  37          HG11      VAL  37   6.723  -5.488   0.745
  314   2HG1  VAL  37          HG12      VAL  37   5.919  -4.722   2.115
  315   3HG1  VAL  37          HG13      VAL  37   6.724  -3.732   0.898
  316   1HG2  VAL  37          HG21      VAL  37   5.609  -2.951  -0.938
  317   2HG2  VAL  37          HG22      VAL  37   4.187  -3.749  -1.613
  318   3HG2  VAL  37          HG23      VAL  37   5.760  -4.544  -1.682
  319    H    SER  38           HN       SER  38   2.026  -6.358   1.128
  320    HA   SER  38           HA       SER  38   0.548  -6.314  -1.459
  321   1HB   SER  38          HB2       SER  38  -0.764  -6.908   1.148
  322   2HB   SER  38          HB1       SER  38  -0.915  -7.740  -0.400
  323    HG   SER  38           HG       SER  38   1.136  -8.640  -0.036
  324    H    PHE  39           HN       PHE  39  -0.985  -4.724  -1.895
  325    HA   PHE  39           HA       PHE  39  -1.106  -2.426   0.002
  326   1HB   PHE  39          HB2       PHE  39  -1.636  -2.878  -2.936
  327   2HB   PHE  39          HB1       PHE  39  -2.181  -1.403  -2.131
  328    HD1  PHE  39           HD1      PHE  39   0.797  -3.449  -2.985
  329    HD2  PHE  39           HD2      PHE  39  -0.634   0.312  -1.483
  330    HE1  PHE  39           HE1      PHE  39   3.083  -2.504  -3.171
  331    HE2  PHE  39           HE2      PHE  39   1.652   1.256  -1.666
  332    HZ   PHE  39           HZ       PHE  39   3.511  -0.152  -2.511
  333    H    PHE  40           HN       PHE  40  -3.113  -1.727   0.844
  334    HA   PHE  40           HA       PHE  40  -5.266  -3.711   0.876
  335   1HB   PHE  40          HB2       PHE  40  -4.567  -1.116   2.190
  336   2HB   PHE  40          HB1       PHE  40  -6.264  -1.612   2.215
  337    HD1  PHE  40           HD1      PHE  40  -6.469  -4.329   2.647
  338    HD2  PHE  40           HD2      PHE  40  -3.352  -1.739   4.070
  339    HE1  PHE  40           HE1      PHE  40  -5.977  -5.928   4.477
  340    HE2  PHE  40           HE2      PHE  40  -2.859  -3.338   5.901
  341    HZ   PHE  40           HZ       PHE  40  -4.172  -5.433   6.104
  342    H    CYS  41           HN       CYS  41  -7.166  -3.614  -0.276
  343    HA   CYS  41           HA       CYS  41  -7.832  -1.109  -1.760
  344   1HB   CYS  41          HB2       CYS  41  -6.908  -3.688  -2.784
  345   2HB   CYS  41          HB1       CYS  41  -8.465  -3.219  -3.475
  346    H    LYS  42           HN       LYS  42 -10.152  -1.239  -2.583
  347    HA   LYS  42           HA       LYS  42 -11.832  -2.754  -0.620
  348   1HB   LYS  42          HB2       LYS  42 -13.536  -1.007  -1.364
  349   2HB   LYS  42          HB1       LYS  42 -12.117  -0.369  -0.527
  350   1HG   LYS  42          HG2       LYS  42 -11.862  -0.632  -3.470
  351   2HG   LYS  42          HG1       LYS  42 -12.999   0.595  -2.907
  352   1HD   LYS  42          HD2       LYS  42 -10.252   0.409  -1.690
  353   2HD   LYS  42          HD1       LYS  42 -10.490   1.256  -3.219
  354   1HE   LYS  42          HE2       LYS  42 -12.571   2.135  -1.498
  355   2HE   LYS  42          HE1       LYS  42 -11.064   2.200  -0.559
  356   1HZ   LYS  42          HZ1       LYS  42 -11.572   4.173  -2.073
  357   2HZ   LYS  42          HZ2       LYS  42 -11.183   3.137  -3.362
  358   3HZ   LYS  42          HZ3       LYS  42 -10.020   3.496  -2.175
  359    H    ASN  43           HN       ASN  43 -13.547  -4.034  -1.379
  360    HA   ASN  43           HA       ASN  43 -13.522  -4.605  -4.325
  361   1HB   ASN  43          HB2       ASN  43 -12.726  -6.356  -2.673
  362   2HB   ASN  43          HB1       ASN  43 -14.370  -6.391  -2.025
  363   1HD2  ASN  43          HD21      ASN  43 -12.343  -7.427  -4.685
  364   2HD2  ASN  43          HD22      ASN  43 -13.547  -8.277  -5.528
  365    H    LYS  44           HN       LYS  44 -15.366  -3.955  -5.346
  366    HA   LYS  44           HA       LYS  44 -17.736  -3.142  -3.826
  367   1HB   LYS  44          HB2       LYS  44 -16.499  -2.556  -6.269
  368   2HB   LYS  44          HB1       LYS  44 -18.003  -3.361  -6.722
  369   1HG   LYS  44          HG2       LYS  44 -18.452  -1.494  -4.547
  370   2HG   LYS  44          HG1       LYS  44 -17.711  -0.683  -5.928
  371   1HD   LYS  44          HD2       LYS  44 -19.517  -2.140  -7.261
  372   2HD   LYS  44          HD1       LYS  44 -20.366  -2.027  -5.719
  373   1HE   LYS  44          HE2       LYS  44 -19.175   0.503  -6.755
  374   2HE   LYS  44          HE1       LYS  44 -20.604  -0.117  -7.605
  375   1HZ   LYS  44          HZ1       LYS  44 -21.654  -0.430  -5.399
  376   2HZ   LYS  44          HZ2       LYS  44 -21.344   1.200  -5.763
  377   3HZ   LYS  44          HZ3       LYS  44 -20.336   0.361  -4.683
  378    H    GLU  45           HN       GLU  45 -16.859  -5.780  -6.055
  379    HA   GLU  45           HA       GLU  45 -19.421  -6.978  -6.333
  380   1HB   GLU  45          HB2       GLU  45 -16.662  -8.241  -6.206
  381   2HB   GLU  45          HB1       GLU  45 -18.089  -8.959  -6.955
  382   1HG   GLU  45          HG2       GLU  45 -17.643  -6.263  -7.938
  383   2HG   GLU  45          HG1       GLU  45 -16.223  -7.277  -8.199
  384    H    LYS  46           HN       LYS  46 -16.820  -7.721  -3.980
  385    HA   LYS  46           HA       LYS  46 -18.703  -9.405  -2.428
  386   1HB   LYS  46          HB2       LYS  46 -15.741  -8.790  -2.307
  387   2HB   LYS  46          HB1       LYS  46 -16.554  -9.829  -1.132
  388   1HG   LYS  46          HG2       LYS  46 -17.359 -11.261  -3.008
  389   2HG   LYS  46          HG1       LYS  46 -16.427 -10.268  -4.129
  390   1HD   LYS  46          HD2       LYS  46 -15.341 -11.931  -1.841
  391   2HD   LYS  46          HD1       LYS  46 -15.100 -12.217  -3.565
  392   1HE   LYS  46          HE2       LYS  46 -14.205  -9.644  -3.362
  393   2HE   LYS  46          HE1       LYS  46 -13.738 -10.290  -1.776
  394   1HZ   LYS  46          HZ1       LYS  46 -13.322 -11.923  -4.186
  395   2HZ   LYS  46          HZ2       LYS  46 -12.480 -11.951  -2.710
  396   3HZ   LYS  46          HZ3       LYS  46 -12.207 -10.696  -3.823
  397    H    LYS  47           HN       LYS  47 -17.584  -6.177  -2.486
  398    HA   LYS  47           HA       LYS  47 -18.059  -4.370  -1.035
  399   1HB   LYS  47          HB2       LYS  47 -19.537  -6.381   0.652
  400   2HB   LYS  47          HB1       LYS  47 -19.907  -4.671   0.415
  401   1HG   LYS  47          HG2       LYS  47 -20.103  -5.463  -2.134
  402   2HG   LYS  47          HG1       LYS  47 -20.490  -7.000  -1.361
  403   1HD   LYS  47          HD2       LYS  47 -22.575  -6.259  -0.973
  404   2HD   LYS  47          HD1       LYS  47 -21.911  -4.981   0.045
  405   1HE   LYS  47          HE2       LYS  47 -21.498  -4.262  -2.711
  406   2HE   LYS  47          HE1       LYS  47 -23.209  -4.667  -2.463
  407   1HZ   LYS  47          HZ1       LYS  47 -23.116  -3.305  -0.406
  408   2HZ   LYS  47          HZ2       LYS  47 -22.898  -2.400  -1.828
  409   3HZ   LYS  47          HZ3       LYS  47 -21.563  -2.791  -0.852
  410    H    CYS  48           HN       CYS  48 -15.667  -6.044  -0.620
  411    HA   CYS  48           HA       CYS  48 -15.212  -5.371   2.254
  412   1HB   CYS  48          HB2       CYS  48 -14.042  -7.894   1.176
  413   2HB   CYS  48          HB1       CYS  48 -14.543  -7.513   2.819
  414    H    SER  49           HN       SER  49 -12.763  -5.621   2.716
  415    HA   SER  49           HA       SER  49 -11.274  -4.397   0.447
  416   1HB   SER  49          HB2       SER  49 -10.129  -3.291   2.104
  417   2HB   SER  49          HB1       SER  49 -11.544  -3.720   3.060
  418    HG   SER  49           HG       SER  49  -9.029  -4.465   3.420
  419    H    TYR  50           HN       TYR  50  -8.955  -5.132   0.262
  420    HA   TYR  50           HA       TYR  50  -8.284  -7.820   1.228
  421   1HB   TYR  50          HB2       TYR  50  -8.159  -8.758  -1.080
  422   2HB   TYR  50          HB1       TYR  50  -9.805  -8.299  -0.637
  423    HD1  TYR  50           HD1      TYR  50 -11.018  -6.762  -1.946
  424    HD2  TYR  50           HD2      TYR  50  -6.759  -7.060  -2.416
  425    HE1  TYR  50           HE1      TYR  50 -11.132  -5.275  -3.929
  426    HE2  TYR  50           HE2      TYR  50  -6.872  -5.572  -4.397
  427    HH   TYR  50           HH       TYR  50  -9.998  -4.354  -5.603
  428    H    THR  51           HN       THR  51  -6.086  -8.472   0.056
  429    HA   THR  51           HA       THR  51  -4.450  -5.966  -0.100
  430    HB   THR  51           HB       THR  51  -2.627  -7.487   0.687
  431    HG1  THR  51           HG1      THR  51  -2.975  -9.548   0.710
  432   1HG2  THR  51          HG21      THR  51  -3.378  -6.585   2.618
  433   2HG2  THR  51          HG22      THR  51  -4.205  -8.122   2.871
  434   3HG2  THR  51          HG23      THR  51  -5.066  -6.767   2.140
  435    H    GLU  52           HN       GLU  52  -2.960  -5.739  -1.766
  436    HA   GLU  52           HA       GLU  52  -3.087  -7.785  -3.963
  437   1HB   GLU  52          HB2       GLU  52  -3.844  -5.109  -3.933
  438   2HB   GLU  52          HB1       GLU  52  -2.234  -5.061  -4.653
  439   1HG   GLU  52          HG2       GLU  52  -3.898  -7.256  -5.672
  440   2HG   GLU  52          HG1       GLU  52  -4.559  -5.657  -6.016
  441    H    ASP  53           HN       ASP  53  -1.228  -8.888  -3.006
  442    HA   ASP  53           HA       ASP  53   1.180  -7.981  -2.091
  443   1HB   ASP  53          HB2       ASP  53   0.713 -10.115  -4.189
  444   2HB   ASP  53          HB1       ASP  53   2.147  -9.995  -3.164
  445    H    ALA  54           HN       ALA  54   3.081  -7.125  -2.928
  446    HA   ALA  54           HA       ALA  54   3.134  -6.395  -5.833
  447   1HB   ALA  54          HB1       ALA  54   3.681  -4.644  -3.414
  448   2HB   ALA  54          HB2       ALA  54   2.333  -4.481  -4.540
  449   3HB   ALA  54          HB3       ALA  54   3.980  -4.154  -5.081
  450    H    GLN  55           HN       GLN  55   5.488  -5.554  -6.349
  451    HA   GLN  55           HA       GLN  55   7.525  -6.973  -4.678
  452   1HB   GLN  55          HB2       GLN  55   6.522  -8.252  -6.726
  453   2HB   GLN  55          HB1       GLN  55   7.507  -7.148  -7.686
  454   1HG   GLN  55          HG2       GLN  55   9.485  -7.841  -6.250
  455   2HG   GLN  55          HG1       GLN  55   8.456  -9.109  -5.583
  456   1HE2  GLN  55          HE21      GLN  55   7.678 -10.799  -7.106
  457   2HE2  GLN  55          HE22      GLN  55   8.503 -11.080  -8.562
  458    H    CYS  56           HN       CYS  56   9.499  -5.868  -4.599
  459    HA   CYS  56           HA       CYS  56   9.607  -3.251  -6.016
  460   1HB   CYS  56          HB2       CYS  56  10.147  -4.171  -3.416
  461   2HB   CYS  56          HB1       CYS  56  11.728  -3.838  -4.116
  462    H    ILE  57           HN       ILE  57  11.495  -2.684  -7.230
  463    HA   ILE  57           HA       ILE  57  13.414  -4.896  -7.845
  464    HB   ILE  57           HB       ILE  57  11.678  -3.263  -9.717
  465   1HG1  ILE  57          HG12      ILE  57  11.816  -6.005 -10.401
  466   2HG1  ILE  57          HG11      ILE  57  11.638  -5.945  -8.647
  467   1HG2  ILE  57          HG21      ILE  57  14.106  -4.959 -10.365
  468   2HG2  ILE  57          HG22      ILE  57  13.925  -3.227 -10.650
  469   3HG2  ILE  57          HG23      ILE  57  12.950  -4.378 -11.563
  470   1HD1  ILE  57          HD11      ILE  57   9.907  -4.239 -10.428
  471   2HD1  ILE  57          HD12      ILE  57   9.607  -4.758  -8.770
  472   3HD1  ILE  57          HD13      ILE  57   9.480  -5.916 -10.093
  473    H    ASP  58           HN       ASP  58  15.263  -3.912  -9.261
  474    HA   ASP  58           HA       ASP  58  16.850  -2.117  -7.989
  475   1HB   ASP  58          HB2       ASP  58  16.939  -3.382 -10.329
  476   2HB   ASP  58          HB1       ASP  58  16.560  -1.771 -10.947
  477    H    GLY  59           HN       GLY  59  15.706  -0.411  -6.934
  478   1HA   GLY  59          HA2       GLY  59  14.653   1.678  -6.731
  479   2HA   GLY  59          HA1       GLY  59  15.643   2.098  -8.127
  480    H    THR  60           HN       THR  60  13.308  -0.450  -8.524
  481    HA   THR  60           HA       THR  60  11.405   1.480  -9.798
  482    HB   THR  60           HB       THR  60  12.289  -1.129 -11.034
  483    HG1  THR  60           HG1      THR  60  13.703   0.093 -12.265
  484   1HG2  THR  60          HG21      THR  60  10.912  -0.581 -12.748
  485   2HG2  THR  60          HG22      THR  60  11.377   1.120 -12.696
  486   3HG2  THR  60          HG23      THR  60  10.155   0.504 -11.582
  487    H    ILE  61           HN       ILE  61   9.302   0.999  -9.291
  488    HA   ILE  61           HA       ILE  61   8.627  -1.789  -8.465
  489    HB   ILE  61           HB       ILE  61   9.041  -0.707  -6.397
  490   1HG1  ILE  61          HG12      ILE  61   6.219   0.056  -6.317
  491   2HG1  ILE  61          HG11      ILE  61   6.471  -1.511  -7.086
  492   1HG2  ILE  61          HG21      ILE  61   9.320   1.564  -6.952
  493   2HG2  ILE  61          HG22      ILE  61   7.856   1.569  -5.970
  494   3HG2  ILE  61          HG23      ILE  61   7.739   1.662  -7.727
  495   1HD1  ILE  61          HD11      ILE  61   7.035  -0.665  -4.277
  496   2HD1  ILE  61          HD12      ILE  61   8.114  -1.852  -5.013
  497   3HD1  ILE  61          HD13      ILE  61   6.388  -2.191  -4.882
  498    H    GLU  62           HN       GLU  62   6.566  -2.403  -9.099
  499    HA   GLU  62           HA       GLU  62   5.059  -0.452 -10.776
  500   1HB   GLU  62          HB2       GLU  62   5.847  -3.133 -11.024
  501   2HB   GLU  62          HB1       GLU  62   4.111  -3.207 -10.719
  502   1HG   GLU  62          HG2       GLU  62   4.153  -1.185 -12.505
  503   2HG   GLU  62          HG1       GLU  62   5.579  -2.075 -13.043
  504    H    VAL  63           HN       VAL  63   4.340   0.533  -8.579
  505    HA   VAL  63           HA       VAL  63   2.807  -0.638  -6.611
  506    HB   VAL  63           HB       VAL  63   2.402   1.946  -8.135
  507   1HG1  VAL  63          HG11      VAL  63   0.344   1.222  -6.890
  508   2HG1  VAL  63          HG12      VAL  63   1.051   2.714  -6.268
  509   3HG1  VAL  63          HG13      VAL  63   1.304   1.195  -5.411
  510   1HG2  VAL  63          HG21      VAL  63   4.323   1.000  -6.216
  511   2HG2  VAL  63          HG22      VAL  63   3.370   2.291  -5.481
  512   3HG2  VAL  63          HG23      VAL  63   4.236   2.583  -6.991
  513    HA   PRO  64           HA       PRO  64  -0.602  -2.565  -8.714
  514   1HB   PRO  64          HB2       PRO  64  -2.274  -2.263  -6.391
  515   2HB   PRO  64          HB1       PRO  64  -1.419  -3.713  -6.936
  516   1HG   PRO  64          HG2       PRO  64  -0.811  -2.068  -4.669
  517   2HG   PRO  64          HG1       PRO  64   0.058  -3.498  -5.234
  518   1HD   PRO  64          HD2       PRO  64   0.896  -0.734  -5.379
  519   2HD   PRO  64          HD1       PRO  64   1.784  -2.180  -5.920
  520    H    LYS  65           HN       LYS  65  -1.766  -1.355 -10.179
  521    HA   LYS  65           HA       LYS  65  -2.507   1.334 -10.001
  522   1HB   LYS  65          HB2       LYS  65  -3.537  -1.087 -11.449
  523   2HB   LYS  65          HB1       LYS  65  -4.405   0.439 -11.615
  524   1HG   LYS  65          HG2       LYS  65  -1.421   0.195 -12.054
  525   2HG   LYS  65          HG1       LYS  65  -2.598   0.028 -13.358
  526   1HD   LYS  65          HD2       LYS  65  -2.913   2.259 -13.477
  527   2HD   LYS  65          HD1       LYS  65  -3.116   2.391 -11.730
  528   1HE   LYS  65          HE2       LYS  65  -1.101   3.448 -11.729
  529   2HE   LYS  65          HE1       LYS  65  -0.389   1.855 -12.049
  530   1HZ   LYS  65          HZ1       LYS  65  -1.240   2.433 -14.467
  531   2HZ   LYS  65          HZ2       LYS  65   0.293   2.921 -13.921
  532   3HZ   LYS  65          HZ3       LYS  65  -1.003   4.020 -13.916
  533    H    CYS  66           HN       CYS  66  -4.233  -1.504  -8.748
  534    HA   CYS  66           HA       CYS  66  -6.763  -0.493  -8.168
  535   1HB   CYS  66          HB2       CYS  66  -5.852  -2.785  -7.708
  536   2HB   CYS  66          HB1       CYS  66  -4.980  -2.121  -6.326
  537    H    PHE  67           HN       PHE  67  -3.715   0.174  -6.486
  538    HA   PHE  67           HA       PHE  67  -4.697   1.480  -4.174
  539   1HB   PHE  67          HB2       PHE  67  -2.353   0.818  -4.637
  540   2HB   PHE  67          HB1       PHE  67  -2.249   2.075  -5.870
  541    HD1  PHE  67           HD1      PHE  67  -2.537   1.408  -2.247
  542    HD2  PHE  67           HD2      PHE  67  -2.095   4.420  -5.277
  543    HE1  PHE  67           HE1      PHE  67  -1.953   3.073  -0.505
  544    HE2  PHE  67           HE2      PHE  67  -1.510   6.086  -3.535
  545    HZ   PHE  67           HZ       PHE  67  -1.439   5.414  -1.150
  546    H    LYS  68           HN       LYS  68  -5.313   3.631  -3.774
  547    HA   LYS  68           HA       LYS  68  -5.367   5.529  -6.077
  548   1HB   LYS  68          HB2       LYS  68  -7.583   4.075  -4.876
  549   2HB   LYS  68          HB1       LYS  68  -7.822   5.816  -4.734
  550   1HG   LYS  68          HG2       LYS  68  -7.677   6.140  -7.081
  551   2HG   LYS  68          HG1       LYS  68  -6.987   4.536  -7.339
  552   1HD   LYS  68          HD2       LYS  68  -9.437   4.101  -6.014
  553   2HD   LYS  68          HD1       LYS  68  -9.771   5.320  -7.245
  554   1HE   LYS  68          HE2       LYS  68  -8.663   3.856  -8.948
  555   2HE   LYS  68          HE1       LYS  68  -8.476   2.609  -7.700
  556   1HZ   LYS  68          HZ1       LYS  68 -11.013   3.232  -7.336
  557   2HZ   LYS  68          HZ2       LYS  68 -10.528   2.030  -8.435
  558   3HZ   LYS  68          HZ3       LYS  68 -10.904   3.591  -8.990
  559    H    GLU  69           HN       GLU  69  -3.701   6.668  -4.834
  560    HA   GLU  69           HA       GLU  69  -3.638   7.438  -2.187
  561   1HB   GLU  69          HB2       GLU  69  -2.421   8.167  -4.554
  562   2HB   GLU  69          HB1       GLU  69  -3.207   9.667  -4.061
  563   1HG   GLU  69          HG2       GLU  69  -2.017   9.781  -2.042
  564   2HG   GLU  69          HG1       GLU  69  -1.625   8.061  -2.068
  565    H    HIS  70           HN       HIS  70  -5.001   9.725  -4.569
  566    HA   HIS  70           HA       HIS  70  -7.466  10.069  -2.999
  567   1HB   HIS  70          HB2       HIS  70  -5.518  11.311  -1.862
  568   2HB   HIS  70          HB1       HIS  70  -5.544  12.390  -3.258
  569    HD1  HIS  70           HD1      HIS  70  -7.234  11.724  -0.064
  570    HD2  HIS  70           HD2      HIS  70  -8.140  13.754  -3.591
  571    HE1  HIS  70           HE1      HIS  70  -9.221  13.208   0.453
  572    H    SER  71           HN       SER  71  -8.789   9.972  -4.812
  573    HA   SER  71           HA       SER  71  -8.709  12.209  -6.701
  574   1HB   SER  71          HB2       SER  71  -6.996  10.836  -7.680
  575   2HB   SER  71          HB1       SER  71  -7.964   9.377  -7.469
  576    HG   SER  71           HG       SER  71  -8.060  11.321  -9.417
  577    H    SER  72           HN       SER  72 -10.748  11.510  -4.971
  578    HA   SER  72           HA       SER  72 -12.983  11.095  -6.761
  579   1HB   SER  72          HB2       SER  72 -11.771   8.815  -5.266
  580   2HB   SER  72          HB1       SER  72 -13.529   8.879  -5.347
  581    HG   SER  72           HG       SER  72 -11.689   8.314  -7.288
  582    H    LEU  73           HN       LEU  73 -13.656  13.014  -5.579
  583    HA   LEU  73           HA       LEU  73 -14.403  12.537  -2.715
  584   1HB   LEU  73          HB2       LEU  73 -13.752  14.993  -4.359
  585   2HB   LEU  73          HB1       LEU  73 -14.462  15.099  -2.745
  586    HG   LEU  73           HG       LEU  73 -11.897  13.609  -3.372
  587   1HD1  LEU  73          HD11      LEU  73 -12.391  16.429  -3.118
  588   2HD1  LEU  73          HD12      LEU  73 -10.853  15.602  -3.358
  589   3HD1  LEU  73          HD13      LEU  73 -11.457  15.883  -1.725
  590   1HD2  LEU  73          HD21      LEU  73 -11.712  13.967  -0.800
  591   2HD2  LEU  73          HD22      LEU  73 -12.804  12.713  -1.387
  592   3HD2  LEU  73          HD23      LEU  73 -13.447  14.271  -0.870
  593    H    ALA  74           HN       ALA  74 -16.019  11.596  -4.974
  594    HA   ALA  74           HA       ALA  74 -18.248  13.508  -5.241
  595   1HB   ALA  74          HB1       ALA  74 -19.109  11.289  -6.453
  596   2HB   ALA  74          HB2       ALA  74 -17.401  10.862  -6.354
  597   3HB   ALA  74          HB3       ALA  74 -17.896  12.326  -7.204
  598    H    PHE  75           HN       PHE  75 -18.461  10.021  -4.559
  599    HA   PHE  75           HA       PHE  75 -20.533  10.629  -2.495
  600   1HB   PHE  75          HB2       PHE  75 -20.272   8.829  -4.672
  601   2HB   PHE  75          HB1       PHE  75 -20.254   7.849  -3.206
  602    HD1  PHE  75           HD1      PHE  75 -22.111  10.687  -4.800
  603    HD2  PHE  75           HD2      PHE  75 -22.271   7.320  -2.138
  604    HE1  PHE  75           HE1      PHE  75 -24.561  10.989  -4.567
  605    HE2  PHE  75           HE2      PHE  75 -24.721   7.622  -1.904
  606    HZ   PHE  75           HZ       PHE  75 -25.867   9.456  -3.118
  607    H    TRP  76           HN       TRP  76 -20.555   8.798  -0.721
  608    HA   TRP  76           HA       TRP  76 -18.420   9.029   1.035
  609   1HB   TRP  76          HB2       TRP  76 -20.776   7.483   0.711
  610   2HB   TRP  76          HB1       TRP  76 -19.487   6.364   1.157
  611    HD1  TRP  76           HD1      TRP  76 -21.110   9.639   2.359
  612    HE1  TRP  76           HE1      TRP  76 -20.771   9.824   4.910
  613    HE3  TRP  76           HE3      TRP  76 -18.158   5.565   3.137
  614    HZ2  TRP  76           HZ2      TRP  76 -19.414   8.417   7.005
  615    HZ3  TRP  76           HZ3      TRP  76 -17.349   5.003   5.412
  616    HH2  TRP  76           HH2      TRP  76 -17.972   6.425   7.347
  617    H    LYS  77           HN       LYS  77 -16.278   8.538   0.715
  618    HA   LYS  77           HA       LYS  77 -15.627   6.033  -0.807
  619   1HB   LYS  77          HB2       LYS  77 -15.195   8.058  -2.127
  620   2HB   LYS  77          HB1       LYS  77 -14.244   8.736  -0.804
  621   1HG   LYS  77          HG2       LYS  77 -12.749   6.688  -0.981
  622   2HG   LYS  77          HG1       LYS  77 -13.597   6.299  -2.477
  623   1HD   LYS  77          HD2       LYS  77 -12.805   8.227  -3.574
  624   2HD   LYS  77          HD1       LYS  77 -12.393   9.030  -2.057
  625   1HE   LYS  77          HE2       LYS  77 -10.726   7.025  -1.744
  626   2HE   LYS  77          HE1       LYS  77 -10.899   6.853  -3.502
  627   1HZ   LYS  77          HZ1       LYS  77 -10.129   8.981  -3.881
  628   2HZ   LYS  77          HZ2       LYS  77  -9.147   8.496  -2.582
  629   3HZ   LYS  77          HZ3       LYS  77 -10.480   9.514  -2.309
  630    H    THR  78           HN       THR  78 -14.595   4.613   0.534
  631    HA   THR  78           HA       THR  78 -13.002   5.722   2.819
  632    HB   THR  78           HB       THR  78 -14.390   3.050   2.472
  633    HG1  THR  78           HG1      THR  78 -16.058   3.953   3.391
  634   1HG2  THR  78          HG21      THR  78 -12.529   4.151   4.458
  635   2HG2  THR  78          HG22      THR  78 -12.983   2.474   4.150
  636   3HG2  THR  78          HG23      THR  78 -14.007   3.494   5.162
  637    H    ASP  79           HN       ASP  79 -10.822   5.408   2.620
  638    HA   ASP  79           HA       ASP  79  -9.603   3.976   0.466
  639   1HB   ASP  79          HB2       ASP  79  -8.889   5.523   2.826
  640   2HB   ASP  79          HB1       ASP  79  -7.764   4.187   2.577
  641    H    ALA  80           HN       ALA  80  -9.025   1.829   0.291
  642    HA   ALA  80           HA       ALA  80 -10.055  -0.268   1.775
  643   1HB   ALA  80          HB1       ALA  80  -8.604  -0.173  -0.370
  644   2HB   ALA  80          HB2       ALA  80  -8.418  -1.583   0.674
  645   3HB   ALA  80          HB3       ALA  80  -7.225  -0.283   0.723
  646    H    SER  81           HN       SER  81  -7.070   1.546   2.447
  647    HA   SER  81           HA       SER  81  -5.956   0.069   4.539
  648   1HB   SER  81          HB2       SER  81  -6.076   2.875   3.643
  649   2HB   SER  81          HB1       SER  81  -5.688   2.690   5.352
  650    HG   SER  81           HG       SER  81  -4.415   1.260   3.255
  651    H    ASP  82           HN       ASP  82  -8.976   1.817   4.507
  652    HA   ASP  82           HA       ASP  82  -9.246   1.420   7.467
  653   1HB   ASP  82          HB2       ASP  82 -10.666   3.318   5.577
  654   2HB   ASP  82          HB1       ASP  82 -10.823   3.298   7.333
  655    H    VAL  83           HN       VAL  83  -9.798  -0.574   5.271
  656    HA   VAL  83           HA       VAL  83 -12.730  -0.955   5.798
  657    HB   VAL  83           HB       VAL  83 -11.197  -1.939   3.386
  658   1HG1  VAL  83          HG11      VAL  83 -14.127  -1.317   3.860
  659   2HG1  VAL  83          HG12      VAL  83 -13.417  -2.932   3.876
  660   3HG1  VAL  83          HG13      VAL  83 -13.437  -1.991   2.384
  661   1HG2  VAL  83          HG21      VAL  83 -10.982   0.552   3.614
  662   2HG2  VAL  83          HG22      VAL  83 -12.742   0.662   3.623
  663   3HG2  VAL  83          HG23      VAL  83 -11.903   0.063   2.192
  664    H    LYS  84           HN       LYS  84 -13.374  -3.129   6.243
  665    HA   LYS  84           HA       LYS  84 -11.233  -4.838   7.329
  666   1HB   LYS  84          HB2       LYS  84 -13.171  -6.111   8.193
  667   2HB   LYS  84          HB1       LYS  84 -13.356  -4.388   8.526
  668   1HG   LYS  84          HG2       LYS  84 -14.486  -4.693   6.001
  669   2HG   LYS  84          HG1       LYS  84 -15.005  -6.138   6.869
  670   1HD   LYS  84          HD2       LYS  84 -16.184  -4.929   8.461
  671   2HD   LYS  84          HD1       LYS  84 -15.184  -3.491   8.260
  672   1HE   LYS  84          HE2       LYS  84 -17.088  -2.782   7.131
  673   2HE   LYS  84          HE1       LYS  84 -16.255  -3.589   5.789
  674   1HZ   LYS  84          HZ1       LYS  84 -17.426  -5.660   7.009
  675   2HZ   LYS  84          HZ2       LYS  84 -18.119  -4.821   5.704
  676   3HZ   LYS  84          HZ3       LYS  84 -18.578  -4.448   7.297
  677    HA   PRO  85           HA       PRO  85 -10.885  -7.335   3.675
  678   1HB   PRO  85          HB2       PRO  85 -10.231  -9.658   5.242
  679   2HB   PRO  85          HB1       PRO  85  -9.129  -8.598   4.353
  680   1HG   PRO  85          HG2       PRO  85  -9.445  -8.811   7.194
  681   2HG   PRO  85          HG1       PRO  85  -8.364  -7.738   6.301
  682   1HD   PRO  85          HD2       PRO  85 -10.763  -7.036   7.752
  683   2HD   PRO  85          HD1       PRO  85  -9.662  -5.953   6.867
  684    H    CYS  86           HN       CYS  86 -12.329  -8.709   2.567
  685    HA   CYS  86           HA       CYS  86 -14.926  -9.196   3.482
  686   1HB   CYS  86          HB2       CYS  86 -13.489  -9.631   1.201
  687   2HB   CYS  86          HB1       CYS  86 -13.735 -11.287   1.755
  Start of MODEL   10
    1   1H    THR   1          HT1       THR   1  22.094  -7.791  -9.863
    2   2H    THR   1          HT2       THR   1  20.891  -6.695 -10.348
    3   3H    THR   1          HT3       THR   1  20.565  -7.835  -9.131
    4    HA   THR   1           HA       THR   1  22.638  -6.619  -8.009
    5    HB   THR   1           HB       THR   1  22.464  -4.219  -8.606
    6    HG1  THR   1           HG1      THR   1  20.428  -3.983  -9.317
    7   1HG2  THR   1          HG21      THR   1  23.583  -4.357 -10.714
    8   2HG2  THR   1          HG22      THR   1  22.764  -5.863 -11.125
    9   3HG2  THR   1          HG23      THR   1  23.984  -5.840  -9.850
   10    H    LYS   2           HN       LYS   2  21.432  -4.221  -6.984
   11    HA   LYS   2           HA       LYS   2  18.667  -4.826  -6.199
   12   1HB   LYS   2          HB2       LYS   2  19.265  -5.158  -3.812
   13   2HB   LYS   2          HB1       LYS   2  20.004  -6.391  -4.835
   14   1HG   LYS   2          HG2       LYS   2  21.754  -4.113  -4.695
   15   2HG   LYS   2          HG1       LYS   2  21.315  -4.609  -3.060
   16   1HD   LYS   2          HD2       LYS   2  21.767  -7.026  -4.318
   17   2HD   LYS   2          HD1       LYS   2  22.994  -5.982  -5.037
   18   1HE   LYS   2          HE2       LYS   2  24.180  -6.531  -3.145
   19   2HE   LYS   2          HE1       LYS   2  23.183  -5.267  -2.396
   20   1HZ   LYS   2          HZ1       LYS   2  22.771  -7.134  -1.088
   21   2HZ   LYS   2          HZ2       LYS   2  22.739  -8.189  -2.419
   22   3HZ   LYS   2          HZ3       LYS   2  21.453  -7.111  -2.155
   23    H    ALA   3           HN       ALA   3  18.483  -2.614  -7.065
   24    HA   ALA   3           HA       ALA   3  19.882  -0.450  -5.625
   25   1HB   ALA   3          HB1       ALA   3  19.704   0.034  -7.881
   26   2HB   ALA   3          HB2       ALA   3  18.219   0.795  -7.308
   27   3HB   ALA   3          HB3       ALA   3  18.164  -0.810  -8.039
   28    H    SER   4           HN       SER   4  17.664  -2.285  -4.504
   29    HA   SER   4           HA       SER   4  15.810  -2.052  -3.048
   30   1HB   SER   4          HB2       SER   4  16.884   0.771  -2.815
   31   2HB   SER   4          HB1       SER   4  16.026  -0.151  -1.584
   32    HG   SER   4           HG       SER   4  18.389  -0.074  -1.409
   33    H    CYS   5           HN       CYS   5  14.252   0.304  -2.556
   34    HA   CYS   5           HA       CYS   5  13.155   0.939  -5.275
   35   1HB   CYS   5          HB2       CYS   5  11.916  -0.305  -2.857
   36   2HB   CYS   5          HB1       CYS   5  10.916   0.803  -3.801
   37    H    LYS   6           HN       LYS   6  11.118   2.616  -4.519
   38    HA   LYS   6           HA       LYS   6  12.348   4.674  -2.732
   39   1HB   LYS   6          HB2       LYS   6  12.621   4.783  -5.401
   40   2HB   LYS   6          HB1       LYS   6  11.020   5.513  -5.272
   41   1HG   LYS   6          HG2       LYS   6  12.575   6.684  -3.225
   42   2HG   LYS   6          HG1       LYS   6  13.590   6.680  -4.670
   43   1HD   LYS   6          HD2       LYS   6  10.941   7.413  -5.454
   44   2HD   LYS   6          HD1       LYS   6  11.396   8.406  -4.069
   45   1HE   LYS   6          HE2       LYS   6  13.606   8.132  -5.960
   46   2HE   LYS   6          HE1       LYS   6  12.172   8.866  -6.707
   47   1HZ   LYS   6          HZ1       LYS   6  12.087  10.532  -5.122
   48   2HZ   LYS   6          HZ2       LYS   6  13.760  10.372  -5.374
   49   3HZ   LYS   6          HZ3       LYS   6  13.033   9.674  -4.005
   50    H    LEU   7           HN       LEU   7  10.764   4.646  -1.134
   51    HA   LEU   7           HA       LEU   7   8.126   3.998  -1.084
   52   1HB   LEU   7          HB2       LEU   7   7.886   5.864   0.588
   53   2HB   LEU   7          HB1       LEU   7   9.344   4.893   0.820
   54    HG   LEU   7           HG       LEU   7   9.982   6.966  -1.029
   55   1HD1  LEU   7          HD11      LEU   7   8.860   8.788  -0.337
   56   2HD1  LEU   7          HD12      LEU   7   9.410   8.522   1.317
   57   3HD1  LEU   7          HD13      LEU   7   7.918   7.771   0.753
   58   1HD2  LEU   7          HD21      LEU   7  11.579   7.588   0.750
   59   2HD2  LEU   7          HD22      LEU   7  11.524   5.837   0.543
   60   3HD2  LEU   7          HD23      LEU   7  10.689   6.592   1.901
   61    HA   PRO   8           HA       PRO   8   6.812   6.695  -4.547
   62   1HB   PRO   8          HB2       PRO   8   4.443   5.064  -4.659
   63   2HB   PRO   8          HB1       PRO   8   5.795   5.104  -5.800
   64   1HG   PRO   8          HG2       PRO   8   5.130   3.016  -3.967
   65   2HG   PRO   8          HG1       PRO   8   6.522   3.096  -5.050
   66   1HD   PRO   8          HD2       PRO   8   6.467   3.400  -2.161
   67   2HD   PRO   8          HD1       PRO   8   7.882   3.363  -3.240
   68    H    VAL   9           HN       VAL   9   5.450   5.877  -1.484
   69    HA   VAL   9           HA       VAL   9   3.612   8.240  -1.676
   70    HB   VAL   9           HB       VAL   9   3.020   5.748  -0.081
   71   1HG1  VAL   9          HG11      VAL   9   1.706   8.264  -0.704
   72   2HG1  VAL   9          HG12      VAL   9   1.268   7.044   0.493
   73   3HG1  VAL   9          HG13      VAL   9   0.705   6.889  -1.172
   74   1HG2  VAL   9          HG21      VAL   9   1.558   5.125  -2.101
   75   2HG2  VAL   9          HG22      VAL   9   3.292   4.852  -2.276
   76   3HG2  VAL   9          HG23      VAL   9   2.541   6.261  -3.024
   77    H    LYS  10           HN       LYS  10   2.945   8.888   0.680
   78    HA   LYS  10           HA       LYS  10   5.349   8.651   2.464
   79   1HB   LYS  10          HB2       LYS  10   4.746  10.986   3.142
   80   2HB   LYS  10          HB1       LYS  10   5.121  10.857   1.423
   81   1HG   LYS  10          HG2       LYS  10   2.326  10.306   1.817
   82   2HG   LYS  10          HG1       LYS  10   2.730  11.834   2.600
   83   1HD   LYS  10          HD2       LYS  10   3.981  12.409   0.416
   84   2HD   LYS  10          HD1       LYS  10   3.089  11.064  -0.297
   85   1HE   LYS  10          HE2       LYS  10   1.200  12.309  -0.442
   86   2HE   LYS  10          HE1       LYS  10   1.333  12.806   1.257
   87   1HZ   LYS  10          HZ1       LYS  10   3.286  13.890  -0.624
   88   2HZ   LYS  10          HZ2       LYS  10   2.581  14.613   0.741
   89   3HZ   LYS  10          HZ3       LYS  10   1.710  14.510  -0.715
   90    H    LYS  11           HN       LYS  11   2.289   7.572   2.167
   91    HA   LYS  11           HA       LYS  11   1.963   7.191   5.067
   92   1HB   LYS  11          HB2       LYS  11   1.010   9.498   4.148
   93   2HB   LYS  11          HB1       LYS  11  -0.331   8.481   3.622
   94   1HG   LYS  11          HG2       LYS  11  -0.571   7.624   5.937
   95   2HG   LYS  11          HG1       LYS  11   0.738   8.689   6.452
   96   1HD   LYS  11          HD2       LYS  11  -0.529  10.649   5.986
   97   2HD   LYS  11          HD1       LYS  11  -1.728   9.747   5.059
   98   1HE   LYS  11          HE2       LYS  11  -2.901   9.871   7.042
   99   2HE   LYS  11          HE1       LYS  11  -1.909   8.456   7.451
  100   1HZ   LYS  11          HZ1       LYS  11  -1.361  11.302   8.086
  101   2HZ   LYS  11          HZ2       LYS  11  -0.169  10.096   8.187
  102   3HZ   LYS  11          HZ3       LYS  11  -1.549  10.014   9.173
  103    H    ALA  12           HN       ALA  12   2.347   5.413   2.824
  104    HA   ALA  12           HA       ALA  12  -0.305   4.247   2.213
  105   1HB   ALA  12          HB1       ALA  12   2.037   2.745   1.372
  106   2HB   ALA  12          HB2       ALA  12   2.205   4.453   0.974
  107   3HB   ALA  12          HB3       ALA  12   0.816   3.544   0.381
  108    H    THR  13           HN       THR  13  -1.115   2.447   3.234
  109    HA   THR  13           HA       THR  13   0.533   1.187   5.384
  110    HB   THR  13           HB       THR  13  -2.415   0.869   4.770
  111    HG1  THR  13           HG1      THR  13  -2.771   2.749   5.656
  112   1HG2  THR  13          HG21      THR  13  -2.482  -0.299   6.694
  113   2HG2  THR  13          HG22      THR  13  -1.562   0.939   7.550
  114   3HG2  THR  13          HG23      THR  13  -0.720  -0.319   6.645
  115    H    VAL  14           HN       VAL  14   1.769  -0.366   4.240
  116    HA   VAL  14           HA       VAL  14   0.319  -2.214   2.409
  117    HB   VAL  14           HB       VAL  14   2.582  -0.913   2.018
  118   1HG1  VAL  14          HG11      VAL  14   3.707  -1.706   4.049
  119   2HG1  VAL  14          HG12      VAL  14   4.552  -2.298   2.619
  120   3HG1  VAL  14          HG13      VAL  14   3.497  -3.378   3.531
  121   1HG2  VAL  14          HG21      VAL  14   1.463  -2.676   0.562
  122   2HG2  VAL  14          HG22      VAL  14   2.483  -3.866   1.368
  123   3HG2  VAL  14          HG23      VAL  14   3.217  -2.577   0.416
  124    H    VAL  15           HN       VAL  15   1.313  -4.588   2.621
  125    HA   VAL  15           HA       VAL  15   1.392  -5.316   5.530
  126    HB   VAL  15           HB       VAL  15  -0.092  -6.617   3.224
  127   1HG1  VAL  15          HG11      VAL  15   0.595  -7.514   5.976
  128   2HG1  VAL  15          HG12      VAL  15   0.299  -8.467   4.523
  129   3HG1  VAL  15          HG13      VAL  15  -1.058  -7.814   5.440
  130   1HG2  VAL  15          HG21      VAL  15  -1.976  -5.563   3.976
  131   2HG2  VAL  15          HG22      VAL  15  -0.824  -4.412   4.654
  132   3HG2  VAL  15          HG23      VAL  15  -1.490  -5.692   5.667
  133    H    TYR  16           HN       TYR  16   3.445  -6.104   5.836
  134    HA   TYR  16           HA       TYR  16   4.902  -7.485   3.677
  135   1HB   TYR  16          HB2       TYR  16   5.647  -5.837   5.657
  136   2HB   TYR  16          HB1       TYR  16   5.837  -7.368   6.513
  137    HD1  TYR  16           HD1      TYR  16   8.068  -5.387   5.618
  138    HD2  TYR  16           HD2      TYR  16   6.435  -8.953   3.866
  139    HE1  TYR  16           HE1      TYR  16  10.211  -5.787   4.430
  140    HE2  TYR  16           HE2      TYR  16   8.576  -9.352   2.679
  141    HH   TYR  16           HH       TYR  16  11.369  -7.194   3.153
  142    H    GLN  17           HN       GLN  17   6.199  -9.178   5.870
  143    HA   GLN  17           HA       GLN  17   4.786 -11.623   5.402
  144   1HB   GLN  17          HB2       GLN  17   6.666 -10.899   7.669
  145   2HB   GLN  17          HB1       GLN  17   6.378 -12.512   7.012
  146   1HG   GLN  17          HG2       GLN  17   7.120 -11.407   4.744
  147   2HG   GLN  17          HG1       GLN  17   7.880 -10.213   5.797
  148   1HE2  GLN  17          HE21      GLN  17   9.752 -10.858   6.998
  149   2HE2  GLN  17          HE22      GLN  17  10.471 -12.388   6.833
  150    H    GLY  18           HN       GLY  18   2.578 -10.554   6.044
  151   1HA   GLY  18          HA2       GLY  18   0.755 -10.669   7.524
  152   2HA   GLY  18          HA1       GLY  18   1.768 -11.645   8.591
  153    H    GLU  19           HN       GLU  19   2.638  -8.420   7.458
  154    HA   GLU  19           HA       GLU  19   2.138  -7.357  10.216
  155   1HB   GLU  19          HB2       GLU  19   4.629  -7.219   8.492
  156   2HB   GLU  19          HB1       GLU  19   4.393  -6.220   9.927
  157   1HG   GLU  19          HG2       GLU  19   3.760  -8.744  10.850
  158   2HG   GLU  19          HG1       GLU  19   5.084  -9.066   9.729
  159    H    ARG  20           HN       ARG  20   0.891  -5.536  10.048
  160    HA   ARG  20           HA       ARG  20   0.744  -4.107   7.445
  161   1HB   ARG  20          HB2       ARG  20  -0.846  -3.808  10.010
  162   2HB   ARG  20          HB1       ARG  20  -1.279  -3.153   8.429
  163   1HG   ARG  20          HG2       ARG  20  -1.490  -5.410   7.515
  164   2HG   ARG  20          HG1       ARG  20  -0.961  -6.106   9.048
  165   1HD   ARG  20          HD2       ARG  20  -3.392  -4.305   8.863
  166   2HD   ARG  20          HD1       ARG  20  -3.496  -6.068   8.681
  167    HE   ARG  20           HE       ARG  20  -2.662  -4.639  11.149
  168   1HH1  ARG  20          HH11      ARG  20  -4.612  -7.061  10.149
  169   2HH1  ARG  20          HH12      ARG  20  -3.998  -8.289  11.204
  170   1HH2  ARG  20          HH21      ARG  20  -1.240  -6.432  12.194
  171   2HH2  ARG  20          HH22      ARG  20  -2.088  -7.933  12.362
  172    H    VAL  21           HN       VAL  21   1.881  -2.211   7.177
  173    HA   VAL  21           HA       VAL  21   2.283  -0.396   9.476
  174    HB   VAL  21           HB       VAL  21   4.782  -0.452   9.065
  175   1HG1  VAL  21          HG11      VAL  21   3.640  -3.152   9.822
  176   2HG1  VAL  21          HG12      VAL  21   3.571  -1.746  10.886
  177   3HG1  VAL  21          HG13      VAL  21   5.131  -2.414  10.407
  178   1HG2  VAL  21          HG21      VAL  21   5.503  -2.683   7.954
  179   2HG2  VAL  21          HG22      VAL  21   4.988  -1.371   6.893
  180   3HG2  VAL  21          HG23      VAL  21   3.883  -2.696   7.257
  181    H    LYS  22           HN       LYS  22   3.732   1.550   8.583
  182    HA   LYS  22           HA       LYS  22   2.496   2.344   6.006
  183   1HB   LYS  22          HB2       LYS  22   2.773   3.605   8.374
  184   2HB   LYS  22          HB1       LYS  22   4.250   4.160   7.584
  185   1HG   LYS  22          HG2       LYS  22   2.525   5.752   7.050
  186   2HG   LYS  22          HG1       LYS  22   2.829   4.808   5.593
  187   1HD   LYS  22          HD2       LYS  22   0.382   5.124   6.126
  188   2HD   LYS  22          HD1       LYS  22   0.880   3.439   5.990
  189   1HE   LYS  22          HE2       LYS  22   0.482   3.018   8.203
  190   2HE   LYS  22          HE1       LYS  22   1.128   4.593   8.709
  191   1HZ   LYS  22          HZ1       LYS  22  -0.850   5.611   8.419
  192   2HZ   LYS  22          HZ2       LYS  22  -1.473   4.051   8.670
  193   3HZ   LYS  22          HZ3       LYS  22  -1.286   4.650   7.091
  194    H    ILE  23           HN       ILE  23   3.664   2.228   4.143
  195    HA   ILE  23           HA       ILE  23   6.387   1.347   4.019
  196    HB   ILE  23           HB       ILE  23   4.527   1.187   2.291
  197   1HG1  ILE  23          HG12      ILE  23   7.105   2.445   1.298
  198   2HG1  ILE  23          HG11      ILE  23   6.954   0.759   1.791
  199   1HG2  ILE  23          HG21      ILE  23   5.383   3.945   1.441
  200   2HG2  ILE  23          HG22      ILE  23   4.078   3.744   2.610
  201   3HG2  ILE  23          HG23      ILE  23   3.931   3.049   0.996
  202   1HD1  ILE  23          HD11      ILE  23   5.544   0.225  -0.006
  203   2HD1  ILE  23          HD12      ILE  23   6.680   1.357  -0.739
  204   3HD1  ILE  23          HD13      ILE  23   5.074   1.906  -0.260
  205    H    GLN  24           HN       GLN  24   4.987   4.480   4.514
  206    HA   GLN  24           HA       GLN  24   7.274   6.018   3.529
  207   1HB   GLN  24          HB2       GLN  24   5.990   7.886   4.504
  208   2HB   GLN  24          HB1       GLN  24   4.925   6.828   3.570
  209   1HG   GLN  24          HG2       GLN  24   3.665   6.477   5.398
  210   2HG   GLN  24          HG1       GLN  24   5.065   5.810   6.238
  211   1HE2  GLN  24          HE21      GLN  24   3.320   7.239   7.817
  212   2HE2  GLN  24          HE22      GLN  24   3.967   8.757   8.210
  213    H    GLU  25           HN       GLU  25   6.558   4.269   6.399
  214    HA   GLU  25           HA       GLU  25   8.558   5.845   7.973
  215   1HB   GLU  25          HB2       GLU  25   6.377   3.882   8.728
  216   2HB   GLU  25          HB1       GLU  25   7.480   4.617   9.889
  217   1HG   GLU  25          HG2       GLU  25   6.669   6.830   9.368
  218   2HG   GLU  25          HG1       GLU  25   5.715   6.215   8.017
  219    H    LYS  26           HN       LYS  26   7.520   2.417   7.739
  220    HA   LYS  26           HA       LYS  26   9.979   1.319   8.686
  221   1HB   LYS  26          HB2       LYS  26   7.713   0.233   8.539
  222   2HB   LYS  26          HB1       LYS  26   7.948   0.102   6.792
  223   1HG   LYS  26          HG2       LYS  26   9.379  -1.644   7.001
  224   2HG   LYS  26          HG1       LYS  26  10.221  -0.902   8.362
  225   1HD   LYS  26          HD2       LYS  26   8.968  -2.012   9.894
  226   2HD   LYS  26          HD1       LYS  26   7.476  -1.763   8.987
  227   1HE   LYS  26          HE2       LYS  26   8.297  -3.549   7.361
  228   2HE   LYS  26          HE1       LYS  26   9.570  -3.912   8.542
  229   1HZ   LYS  26          HZ1       LYS  26   7.768  -5.283   9.131
  230   2HZ   LYS  26          HZ2       LYS  26   6.635  -4.035   8.930
  231   3HZ   LYS  26          HZ3       LYS  26   7.721  -3.998  10.236
  232    H    PHE  27           HN       PHE  27   8.916   2.260   5.447
  233    HA   PHE  27           HA       PHE  27  11.559   1.351   4.356
  234   1HB   PHE  27          HB2       PHE  27   8.898   1.876   2.989
  235   2HB   PHE  27          HB1       PHE  27  10.347   1.231   2.211
  236    HD1  PHE  27           HD1      PHE  27   7.916   0.563   4.971
  237    HD2  PHE  27           HD2      PHE  27  10.802  -1.080   2.247
  238    HE1  PHE  27           HE1      PHE  27   7.279  -1.728   5.679
  239    HE2  PHE  27           HE2      PHE  27  10.166  -3.372   2.955
  240    HZ   PHE  27           HZ       PHE  27   8.405  -3.694   4.671
  241    H    LYS  28           HN       LYS  28  11.269   3.869   5.757
  242    HA   LYS  28           HA       LYS  28  10.750   6.122   4.123
  243   1HB   LYS  28          HB2       LYS  28  11.804   5.486   6.671
  244   2HB   LYS  28          HB1       LYS  28  13.002   6.519   5.891
  245   1HG   LYS  28          HG2       LYS  28  11.690   8.338   6.109
  246   2HG   LYS  28          HG1       LYS  28  10.308   7.495   5.408
  247   1HD   LYS  28          HD2       LYS  28   9.411   7.626   7.487
  248   2HD   LYS  28          HD1       LYS  28  10.514   6.308   7.886
  249   1HE   LYS  28          HE2       LYS  28  11.870   7.664   9.132
  250   2HE   LYS  28          HE1       LYS  28  11.723   9.013   7.988
  251   1HZ   LYS  28          HZ1       LYS  28   9.654   9.612   8.832
  252   2HZ   LYS  28          HZ2       LYS  28  10.543   9.237  10.232
  253   3HZ   LYS  28          HZ3       LYS  28   9.419   8.123   9.610
  254    H    ASN  29           HN       ASN  29  13.602   4.035   4.317
  255    HA   ASN  29           HA       ASN  29  15.054   5.774   2.380
  256   1HB   ASN  29          HB2       ASN  29  15.805   3.398   4.106
  257   2HB   ASN  29          HB1       ASN  29  16.927   4.174   2.983
  258   1HD2  ASN  29          HD21      ASN  29  15.561   4.369   6.152
  259   2HD2  ASN  29          HD22      ASN  29  16.215   5.878   6.577
  260    H    GLY  30           HN       GLY  30  12.829   4.496   1.254
  261   1HA   GLY  30          HA2       GLY  30  12.307   3.211  -0.642
  262   2HA   GLY  30          HA1       GLY  30  14.041   2.984  -0.882
  263    H    MET  31           HN       MET  31  12.263   0.861  -1.309
  264    HA   MET  31           HA       MET  31  12.475  -0.854   1.121
  265   1HB   MET  31          HB2       MET  31  11.122  -1.365  -1.545
  266   2HB   MET  31          HB1       MET  31  10.847  -2.230  -0.034
  267   1HG   MET  31          HG2       MET  31   9.366  -0.685   0.668
  268   2HG   MET  31          HG1       MET  31  10.492   0.629   0.325
  269   1HE   MET  31          HE1       MET  31   6.855  -0.650  -1.082
  270   2HE   MET  31          HE2       MET  31   8.101  -1.814  -0.641
  271   3HE   MET  31          HE3       MET  31   7.670  -1.595  -2.335
  272    H    LEU  32           HN       LEU  32  13.469  -2.974   0.933
  273    HA   LEU  32           HA       LEU  32  15.918  -3.064  -0.538
  274   1HB   LEU  32          HB2       LEU  32  14.182  -5.097   0.873
  275   2HB   LEU  32          HB1       LEU  32  15.746  -5.528   0.174
  276    HG   LEU  32           HG       LEU  32  15.854  -3.086   1.790
  277   1HD1  LEU  32          HD11      LEU  32  14.229  -5.144   2.812
  278   2HD1  LEU  32          HD12      LEU  32  14.914  -3.792   3.713
  279   3HD1  LEU  32          HD13      LEU  32  15.781  -5.325   3.631
  280   1HD2  LEU  32          HD21      LEU  32  17.914  -3.995   2.449
  281   2HD2  LEU  32          HD22      LEU  32  17.700  -4.689   0.842
  282   3HD2  LEU  32          HD23      LEU  32  17.346  -5.655   2.273
  283    H    HIS  33           HN       HIS  33  16.455  -4.620  -2.281
  284    HA   HIS  33           HA       HIS  33  14.520  -4.561  -4.442
  285   1HB   HIS  33          HB2       HIS  33  16.864  -4.342  -4.899
  286   2HB   HIS  33          HB1       HIS  33  17.238  -5.815  -3.999
  287    HD1  HIS  33           HD1      HIS  33  15.232  -4.780  -7.078
  288    HD2  HIS  33           HD2      HIS  33  17.318  -8.070  -5.594
  289    HE1  HIS  33           HE1      HIS  33  15.228  -6.520  -8.919
  290    H    GLY  34           HN       GLY  34  13.313  -6.289  -5.287
  291   1HA   GLY  34          HA2       GLY  34  12.390  -8.454  -5.425
  292   2HA   GLY  34          HA1       GLY  34  13.685  -9.024  -4.376
  293    H    ASP  35           HN       ASP  35  12.470  -6.501  -2.691
  294    HA   ASP  35           HA       ASP  35  11.253  -8.048  -0.655
  295   1HB   ASP  35          HB2       ASP  35  12.011  -5.427  -1.115
  296   2HB   ASP  35          HB1       ASP  35  10.258  -5.299  -0.968
  297    H    LYS  36           HN       LYS  36   8.944  -8.095  -0.025
  298    HA   LYS  36           HA       LYS  36   7.066  -7.815  -2.349
  299   1HB   LYS  36          HB2       LYS  36   7.633 -10.076  -0.457
  300   2HB   LYS  36          HB1       LYS  36   6.010  -9.907  -1.130
  301   1HG   LYS  36          HG2       LYS  36   7.628  -9.542  -3.344
  302   2HG   LYS  36          HG1       LYS  36   8.484 -10.789  -2.435
  303   1HD   LYS  36          HD2       LYS  36   5.511 -10.954  -2.935
  304   2HD   LYS  36          HD1       LYS  36   6.684 -11.592  -4.089
  305   1HE   LYS  36          HE2       LYS  36   7.228 -12.409  -1.312
  306   2HE   LYS  36          HE1       LYS  36   5.685 -13.015  -1.949
  307   1HZ   LYS  36          HZ1       LYS  36   6.722 -13.999  -3.762
  308   2HZ   LYS  36          HZ2       LYS  36   7.802 -14.332  -2.493
  309   3HZ   LYS  36          HZ3       LYS  36   8.137 -13.080  -3.591
  310    H    VAL  37           HN       VAL  37   5.370  -6.498  -1.831
  311    HA   VAL  37           HA       VAL  37   4.402  -6.431   0.998
  312    HB   VAL  37           HB       VAL  37   4.426  -3.957   0.871
  313   1HG1  VAL  37          HG11      VAL  37   7.131  -5.034   0.053
  314   2HG1  VAL  37          HG12      VAL  37   6.433  -5.331   1.646
  315   3HG1  VAL  37          HG13      VAL  37   6.788  -3.681   1.131
  316   1HG2  VAL  37          HG21      VAL  37   5.945  -4.278  -1.723
  317   2HG2  VAL  37          HG22      VAL  37   5.304  -2.794  -1.017
  318   3HG2  VAL  37          HG23      VAL  37   4.204  -3.999  -1.689
  319    H    SER  38           HN       SER  38   2.150  -6.127   1.147
  320    HA   SER  38           HA       SER  38   0.668  -6.042  -1.456
  321   1HB   SER  38          HB2       SER  38  -0.636  -6.810   1.102
  322   2HB   SER  38          HB1       SER  38  -0.774  -7.547  -0.495
  323    HG   SER  38           HG       SER  38   0.697  -8.345   1.535
  324    H    PHE  39           HN       PHE  39  -0.901  -4.457  -1.784
  325    HA   PHE  39           HA       PHE  39  -1.052  -2.271   0.244
  326   1HB   PHE  39          HB2       PHE  39  -1.629  -2.572  -2.703
  327   2HB   PHE  39          HB1       PHE  39  -2.173  -1.149  -1.808
  328    HD1  PHE  39           HD1      PHE  39   0.777  -3.057  -2.960
  329    HD2  PHE  39           HD2      PHE  39  -0.602   0.492  -0.974
  330    HE1  PHE  39           HE1      PHE  39   3.047  -2.076  -3.137
  331    HE2  PHE  39           HE2      PHE  39   1.667   1.475  -1.152
  332    HZ   PHE  39           HZ       PHE  39   3.493   0.189  -2.235
  333    H    PHE  40           HN       PHE  40  -3.227  -1.388   0.751
  334    HA   PHE  40           HA       PHE  40  -5.259  -3.555   0.825
  335   1HB   PHE  40          HB2       PHE  40  -4.633  -1.045   2.333
  336   2HB   PHE  40          HB1       PHE  40  -6.295  -1.650   2.369
  337    HD1  PHE  40           HD1      PHE  40  -6.452  -4.313   2.707
  338    HD2  PHE  40           HD2      PHE  40  -3.176  -1.838   3.970
  339    HE1  PHE  40           HE1      PHE  40  -5.792  -6.034   4.366
  340    HE2  PHE  40           HE2      PHE  40  -2.517  -3.559   5.631
  341    HZ   PHE  40           HZ       PHE  40  -3.826  -5.656   5.829
  342    H    CYS  41           HN       CYS  41  -6.924  -3.536  -0.588
  343    HA   CYS  41           HA       CYS  41  -7.861  -0.915  -1.694
  344   1HB   CYS  41          HB2       CYS  41  -7.279  -3.548  -3.079
  345   2HB   CYS  41          HB1       CYS  41  -8.216  -2.257  -3.840
  346    H    LYS  42           HN       LYS  42 -10.179  -0.906  -2.175
  347    HA   LYS  42           HA       LYS  42 -11.657  -3.028  -0.664
  348   1HB   LYS  42          HB2       LYS  42 -13.437  -1.188  -0.651
  349   2HB   LYS  42          HB1       LYS  42 -11.957  -0.840   0.248
  350   1HG   LYS  42          HG2       LYS  42 -11.107   0.542  -1.521
  351   2HG   LYS  42          HG1       LYS  42 -12.375   0.013  -2.628
  352   1HD   LYS  42          HD2       LYS  42 -13.606   1.770  -1.942
  353   2HD   LYS  42          HD1       LYS  42 -13.719   1.000  -0.359
  354   1HE   LYS  42          HE2       LYS  42 -12.415   2.619   0.541
  355   2HE   LYS  42          HE1       LYS  42 -11.129   2.253  -0.625
  356   1HZ   LYS  42          HZ1       LYS  42 -12.049   4.531  -0.858
  357   2HZ   LYS  42          HZ2       LYS  42 -13.551   3.849  -1.264
  358   3HZ   LYS  42          HZ3       LYS  42 -12.202   3.595  -2.265
  359    H    ASN  43           HN       ASN  43 -13.411  -4.081  -1.632
  360    HA   ASN  43           HA       ASN  43 -13.597  -3.841  -4.600
  361   1HB   ASN  43          HB2       ASN  43 -13.092  -6.000  -3.274
  362   2HB   ASN  43          HB1       ASN  43 -14.797  -5.959  -2.807
  363   1HD2  ASN  43          HD21      ASN  43 -12.601  -6.774  -5.371
  364   2HD2  ASN  43          HD22      ASN  43 -13.773  -7.190  -6.526
  365    H    LYS  44           HN       LYS  44 -15.578  -3.328  -5.591
  366    HA   LYS  44           HA       LYS  44 -17.653  -2.163  -3.831
  367   1HB   LYS  44          HB2       LYS  44 -16.576  -1.242  -6.044
  368   2HB   LYS  44          HB1       LYS  44 -17.737  -2.309  -6.837
  369   1HG   LYS  44          HG2       LYS  44 -19.283  -0.694  -6.568
  370   2HG   LYS  44          HG1       LYS  44 -19.201  -0.995  -4.832
  371   1HD   LYS  44          HD2       LYS  44 -17.147   0.574  -4.853
  372   2HD   LYS  44          HD1       LYS  44 -17.715   1.074  -6.446
  373   1HE   LYS  44          HE2       LYS  44 -19.937   1.033  -4.590
  374   2HE   LYS  44          HE1       LYS  44 -18.626   2.050  -3.959
  375   1HZ   LYS  44          HZ1       LYS  44 -18.453   2.914  -6.332
  376   2HZ   LYS  44          HZ2       LYS  44 -19.782   3.445  -5.415
  377   3HZ   LYS  44          HZ3       LYS  44 -19.984   2.228  -6.583
  378    H    GLU  45           HN       GLU  45 -17.111  -5.048  -5.710
  379    HA   GLU  45           HA       GLU  45 -19.972  -5.738  -5.891
  380   1HB   GLU  45          HB2       GLU  45 -17.348  -6.713  -6.858
  381   2HB   GLU  45          HB1       GLU  45 -18.553  -7.971  -6.577
  382   1HG   GLU  45          HG2       GLU  45 -20.139  -6.297  -7.873
  383   2HG   GLU  45          HG1       GLU  45 -18.615  -5.689  -8.518
  384    H    LYS  46           HN       LYS  46 -17.087  -7.044  -4.207
  385    HA   LYS  46           HA       LYS  46 -18.703  -8.895  -2.615
  386   1HB   LYS  46          HB2       LYS  46 -15.811  -8.013  -2.376
  387   2HB   LYS  46          HB1       LYS  46 -16.518  -9.470  -1.672
  388   1HG   LYS  46          HG2       LYS  46 -16.905 -10.437  -3.822
  389   2HG   LYS  46          HG1       LYS  46 -16.576  -8.913  -4.645
  390   1HD   LYS  46          HD2       LYS  46 -14.277  -9.080  -4.333
  391   2HD   LYS  46          HD1       LYS  46 -14.443 -10.126  -2.922
  392   1HE   LYS  46          HE2       LYS  46 -15.516 -11.234  -5.462
  393   2HE   LYS  46          HE1       LYS  46 -13.751 -11.082  -5.363
  394   1HZ   LYS  46          HZ1       LYS  46 -14.458 -13.170  -4.389
  395   2HZ   LYS  46          HZ2       LYS  46 -15.513 -12.356  -3.334
  396   3HZ   LYS  46          HZ3       LYS  46 -13.832 -12.155  -3.183
  397    H    LYS  47           HN       LYS  47 -17.656  -5.610  -2.330
  398    HA   LYS  47           HA       LYS  47 -18.120  -4.007  -0.662
  399   1HB   LYS  47          HB2       LYS  47 -19.561  -6.243   0.771
  400   2HB   LYS  47          HB1       LYS  47 -19.902  -4.515   0.834
  401   1HG   LYS  47          HG2       LYS  47 -21.003  -4.512  -1.191
  402   2HG   LYS  47          HG1       LYS  47 -20.051  -5.844  -1.840
  403   1HD   LYS  47          HD2       LYS  47 -21.812  -6.435   0.492
  404   2HD   LYS  47          HD1       LYS  47 -22.591  -6.179  -1.069
  405   1HE   LYS  47          HE2       LYS  47 -20.683  -7.837  -1.916
  406   2HE   LYS  47          HE1       LYS  47 -20.729  -8.370  -0.224
  407   1HZ   LYS  47          HZ1       LYS  47 -23.311  -8.144  -0.680
  408   2HZ   LYS  47          HZ2       LYS  47 -22.465  -9.581  -1.007
  409   3HZ   LYS  47          HZ3       LYS  47 -22.817  -8.493  -2.264
  410    H    CYS  48           HN       CYS  48 -15.753  -5.859  -0.519
  411    HA   CYS  48           HA       CYS  48 -15.196  -5.461   2.399
  412   1HB   CYS  48          HB2       CYS  48 -14.037  -7.850   1.061
  413   2HB   CYS  48          HB1       CYS  48 -14.580  -7.654   2.724
  414    H    SER  49           HN       SER  49 -12.675  -6.017   2.671
  415    HA   SER  49           HA       SER  49 -11.257  -4.523   0.500
  416   1HB   SER  49          HB2       SER  49 -10.240  -3.394   2.193
  417   2HB   SER  49          HB1       SER  49 -11.499  -4.074   3.214
  418    HG   SER  49           HG       SER  49  -8.827  -4.705   3.015
  419    H    TYR  50           HN       TYR  50  -8.916  -5.195   0.300
  420    HA   TYR  50           HA       TYR  50  -8.196  -7.931   1.098
  421   1HB   TYR  50          HB2       TYR  50  -7.987  -8.609  -1.351
  422   2HB   TYR  50          HB1       TYR  50  -9.644  -8.422  -0.767
  423    HD1  TYR  50           HD1      TYR  50  -7.033  -7.060  -2.953
  424    HD2  TYR  50           HD2      TYR  50 -10.979  -6.436  -1.376
  425    HE1  TYR  50           HE1      TYR  50  -7.459  -5.349  -4.696
  426    HE2  TYR  50           HE2      TYR  50 -11.405  -4.724  -3.118
  427    HH   TYR  50           HH       TYR  50  -9.336  -4.298  -5.818
  428    H    THR  51           HN       THR  51  -5.957  -8.464   0.084
  429    HA   THR  51           HA       THR  51  -4.373  -5.932  -0.003
  430    HB   THR  51           HB       THR  51  -2.502  -7.648   0.507
  431    HG1  THR  51           HG1      THR  51  -3.699  -9.490   1.638
  432   1HG2  THR  51          HG21      THR  51  -2.819  -7.218   2.734
  433   2HG2  THR  51          HG22      THR  51  -4.502  -7.749   2.704
  434   3HG2  THR  51          HG23      THR  51  -4.072  -6.145   2.108
  435    H    GLU  52           HN       GLU  52  -2.860  -5.594  -1.660
  436    HA   GLU  52           HA       GLU  52  -3.064  -7.437  -4.021
  437   1HB   GLU  52          HB2       GLU  52  -3.612  -4.689  -3.690
  438   2HB   GLU  52          HB1       GLU  52  -2.076  -4.755  -4.558
  439   1HG   GLU  52          HG2       GLU  52  -4.626  -6.195  -5.352
  440   2HG   GLU  52          HG1       GLU  52  -3.951  -4.772  -6.148
  441    H    ASP  53           HN       ASP  53  -1.249  -8.705  -3.191
  442    HA   ASP  53           HA       ASP  53   1.190  -7.917  -2.204
  443   1HB   ASP  53          HB2       ASP  53   0.758  -9.948  -4.407
  444   2HB   ASP  53          HB1       ASP  53   2.070  -9.942  -3.223
  445    H    ALA  54           HN       ALA  54   3.072  -7.054  -2.965
  446    HA   ALA  54           HA       ALA  54   3.309  -6.341  -5.855
  447   1HB   ALA  54          HB1       ALA  54   3.548  -4.531  -3.427
  448   2HB   ALA  54          HB2       ALA  54   2.376  -4.396  -4.739
  449   3HB   ALA  54          HB3       ALA  54   4.082  -4.063  -5.042
  450    H    GLN  55           HN       GLN  55   5.640  -5.812  -6.386
  451    HA   GLN  55           HA       GLN  55   7.542  -6.986  -4.382
  452   1HB   GLN  55          HB2       GLN  55   6.785  -8.510  -6.285
  453   2HB   GLN  55          HB1       GLN  55   7.627  -7.412  -7.380
  454   1HG   GLN  55          HG2       GLN  55   9.714  -8.024  -6.616
  455   2HG   GLN  55          HG1       GLN  55   9.127  -8.396  -4.994
  456   1HE2  GLN  55          HE21      GLN  55  10.533 -10.447  -5.517
  457   2HE2  GLN  55          HE22      GLN  55   9.724 -11.737  -6.268
  458    H    CYS  56           HN       CYS  56   9.634  -6.052  -4.390
  459    HA   CYS  56           HA       CYS  56   9.812  -3.391  -5.692
  460   1HB   CYS  56          HB2       CYS  56  10.293  -3.519  -3.330
  461   2HB   CYS  56          HB1       CYS  56  11.401  -4.867  -3.578
  462    H    ILE  57           HN       ILE  57  11.560  -2.849  -7.088
  463    HA   ILE  57           HA       ILE  57  13.329  -5.091  -7.973
  464    HB   ILE  57           HB       ILE  57  11.469  -3.342  -9.601
  465   1HG1  ILE  57          HG12      ILE  57  11.262  -5.907 -10.516
  466   2HG1  ILE  57          HG11      ILE  57  11.653  -6.190  -8.819
  467   1HG2  ILE  57          HG21      ILE  57  12.532  -4.401 -11.608
  468   2HG2  ILE  57          HG22      ILE  57  13.785  -5.052 -10.552
  469   3HG2  ILE  57          HG23      ILE  57  13.616  -3.308 -10.746
  470   1HD1  ILE  57          HD11      ILE  57   9.556  -4.162  -9.534
  471   2HD1  ILE  57          HD12      ILE  57   9.733  -5.106  -8.055
  472   3HD1  ILE  57          HD13      ILE  57   9.144  -5.876  -9.528
  473    H    ASP  58           HN       ASP  58  15.063  -4.134  -9.511
  474    HA   ASP  58           HA       ASP  58  16.847  -2.454  -8.372
  475   1HB   ASP  58          HB2       ASP  58  16.630  -3.610 -10.757
  476   2HB   ASP  58          HB1       ASP  58  16.242  -1.962 -11.262
  477    H    GLY  59           HN       GLY  59  15.856  -0.784  -7.114
  478   1HA   GLY  59          HA2       GLY  59  14.932   1.332  -6.695
  479   2HA   GLY  59          HA1       GLY  59  15.818   1.794  -8.144
  480    H    THR  60           HN       THR  60  13.329  -0.606  -8.501
  481    HA   THR  60           HA       THR  60  11.397   1.484  -9.411
  482    HB   THR  60           HB       THR  60  12.260  -0.939 -11.010
  483    HG1  THR  60           HG1      THR  60  13.921   0.430 -11.171
  484   1HG2  THR  60          HG21      THR  60   9.947  -0.186 -11.420
  485   2HG2  THR  60          HG22      THR  60  10.978   0.140 -12.813
  486   3HG2  THR  60          HG23      THR  60  10.537   1.450 -11.717
  487    H    ILE  61           HN       ILE  61   9.243   0.881  -9.100
  488    HA   ILE  61           HA       ILE  61   8.597  -1.940  -8.465
  489    HB   ILE  61           HB       ILE  61   9.197  -1.235  -6.301
  490   1HG1  ILE  61          HG12      ILE  61   6.503  -0.253  -5.807
  491   2HG1  ILE  61          HG11      ILE  61   6.490  -1.655  -6.877
  492   1HG2  ILE  61          HG21      ILE  61   8.452   1.006  -5.394
  493   2HG2  ILE  61          HG22      ILE  61   7.906   1.408  -7.022
  494   3HG2  ILE  61          HG23      ILE  61   9.616   1.100  -6.716
  495   1HD1  ILE  61          HD11      ILE  61   6.452  -2.073  -4.313
  496   2HD1  ILE  61          HD12      ILE  61   8.163  -1.649  -4.372
  497   3HD1  ILE  61          HD13      ILE  61   7.563  -3.027  -5.295
  498    H    GLU  62           HN       GLU  62   6.483  -2.415  -9.035
  499    HA   GLU  62           HA       GLU  62   4.901  -0.201 -10.248
  500   1HB   GLU  62          HB2       GLU  62   5.486  -2.959 -10.810
  501   2HB   GLU  62          HB1       GLU  62   3.740  -2.770 -10.644
  502   1HG   GLU  62          HG2       GLU  62   3.628  -1.163 -12.369
  503   2HG   GLU  62          HG1       GLU  62   5.361  -0.839 -12.298
  504    H    VAL  63           HN       VAL  63   3.760   0.734  -8.516
  505    HA   VAL  63           HA       VAL  63   2.562  -0.797  -6.376
  506    HB   VAL  63           HB       VAL  63   3.275   1.640  -6.405
  507   1HG1  VAL  63          HG11      VAL  63   1.926   3.262  -7.482
  508   2HG1  VAL  63          HG12      VAL  63   0.606   2.119  -7.730
  509   3HG1  VAL  63          HG13      VAL  63   2.086   1.974  -8.677
  510   1HG2  VAL  63          HG21      VAL  63   1.453   2.364  -4.956
  511   2HG2  VAL  63          HG22      VAL  63   1.761   0.652  -4.666
  512   3HG2  VAL  63          HG23      VAL  63   0.379   1.145  -5.644
  513    HA   PRO  64           HA       PRO  64  -1.052  -2.268  -8.485
  514   1HB   PRO  64          HB2       PRO  64  -2.630  -2.061  -6.086
  515   2HB   PRO  64          HB1       PRO  64  -1.902  -3.511  -6.792
  516   1HG   PRO  64          HG2       PRO  64  -1.098  -2.121  -4.414
  517   2HG   PRO  64          HG1       PRO  64  -0.367  -3.561  -5.127
  518   1HD   PRO  64          HD2       PRO  64   0.702  -0.883  -5.061
  519   2HD   PRO  64          HD1       PRO  64   1.433  -2.334  -5.789
  520    H    LYS  65           HN       LYS  65  -3.047  -1.385  -9.296
  521    HA   LYS  65           HA       LYS  65  -3.287   1.539  -9.011
  522   1HB   LYS  65          HB2       LYS  65  -3.395   0.103 -11.150
  523   2HB   LYS  65          HB1       LYS  65  -5.017  -0.347 -10.622
  524   1HG   LYS  65          HG2       LYS  65  -5.739   1.537 -11.637
  525   2HG   LYS  65          HG1       LYS  65  -4.962   2.426 -10.326
  526   1HD   LYS  65          HD2       LYS  65  -2.962   2.737 -11.584
  527   2HD   LYS  65          HD1       LYS  65  -3.446   1.542 -12.787
  528   1HE   LYS  65          HE2       LYS  65  -5.478   3.115 -13.221
  529   2HE   LYS  65          HE1       LYS  65  -4.499   4.343 -12.396
  530   1HZ   LYS  65          HZ1       LYS  65  -2.645   3.753 -13.879
  531   2HZ   LYS  65          HZ2       LYS  65  -3.980   4.363 -14.734
  532   3HZ   LYS  65          HZ3       LYS  65  -3.666   2.694 -14.723
  533    H    CYS  66           HN       CYS  66  -5.101  -1.372  -8.112
  534    HA   CYS  66           HA       CYS  66  -7.610  -0.332  -7.449
  535   1HB   CYS  66          HB2       CYS  66  -7.732  -2.208  -5.907
  536   2HB   CYS  66          HB1       CYS  66  -6.784  -2.709  -7.306
  537    H    PHE  67           HN       PHE  67  -4.543   0.312  -5.927
  538    HA   PHE  67           HA       PHE  67  -5.440   1.158  -3.342
  539   1HB   PHE  67          HB2       PHE  67  -3.117   0.729  -3.802
  540   2HB   PHE  67          HB1       PHE  67  -3.104   1.889  -5.128
  541    HD1  PHE  67           HD1      PHE  67  -2.789   4.224  -4.739
  542    HD2  PHE  67           HD2      PHE  67  -3.402   1.545  -1.439
  543    HE1  PHE  67           HE1      PHE  67  -2.165   6.030  -3.158
  544    HE2  PHE  67           HE2      PHE  67  -2.780   3.351   0.142
  545    HZ   PHE  67           HZ       PHE  67  -2.162   5.593  -0.716
  546    H    LYS  68           HN       LYS  68  -6.447   3.044  -2.714
  547    HA   LYS  68           HA       LYS  68  -6.527   5.331  -4.640
  548   1HB   LYS  68          HB2       LYS  68  -8.749   3.715  -3.430
  549   2HB   LYS  68          HB1       LYS  68  -9.025   5.426  -3.757
  550   1HG   LYS  68          HG2       LYS  68  -7.705   4.043  -5.979
  551   2HG   LYS  68          HG1       LYS  68  -9.297   3.380  -5.603
  552   1HD   LYS  68          HD2       LYS  68  -9.405   6.259  -5.493
  553   2HD   LYS  68          HD1       LYS  68  -8.723   5.751  -7.039
  554   1HE   LYS  68          HE2       LYS  68 -10.643   4.270  -7.435
  555   2HE   LYS  68          HE1       LYS  68 -11.323   4.709  -5.854
  556   1HZ   LYS  68          HZ1       LYS  68 -10.605   6.711  -7.923
  557   2HZ   LYS  68          HZ2       LYS  68 -11.503   6.961  -6.503
  558   3HZ   LYS  68          HZ3       LYS  68 -12.164   6.058  -7.781
  559    H    GLU  69           HN       GLU  69  -4.889   6.107  -2.985
  560    HA   GLU  69           HA       GLU  69  -5.381   6.514  -0.245
  561   1HB   GLU  69          HB2       GLU  69  -3.418   7.089  -2.020
  562   2HB   GLU  69          HB1       GLU  69  -4.094   8.703  -1.797
  563   1HG   GLU  69          HG2       GLU  69  -3.206   6.866   0.446
  564   2HG   GLU  69          HG1       GLU  69  -2.279   8.235  -0.170
  565    H    HIS  70           HN       HIS  70  -5.771   9.086  -2.714
  566    HA   HIS  70           HA       HIS  70  -8.362   9.878  -1.512
  567   1HB   HIS  70          HB2       HIS  70  -5.797  11.056  -0.887
  568   2HB   HIS  70          HB1       HIS  70  -6.829  12.251  -1.674
  569    HD1  HIS  70           HD1      HIS  70  -6.799  13.314   0.858
  570    HD2  HIS  70           HD2      HIS  70  -8.948   9.780   0.333
  571    HE1  HIS  70           HE1      HIS  70  -8.351  13.116   2.850
  572    H    SER  71           HN       SER  71  -9.624  11.090  -2.979
  573    HA   SER  71           HA       SER  71  -8.471  12.267  -5.398
  574   1HB   SER  71          HB2       SER  71  -9.728  10.632  -6.880
  575   2HB   SER  71          HB1       SER  71  -8.363   9.931  -6.007
  576    HG   SER  71           HG       SER  71 -10.682   8.954  -5.992
  577    H    SER  72           HN       SER  72  -9.826  13.872  -3.974
  578    HA   SER  72           HA       SER  72 -11.773  15.191  -3.758
  579   1HB   SER  72          HB2       SER  72 -11.339  15.082  -6.256
  580   2HB   SER  72          HB1       SER  72 -12.512  13.771  -6.333
  581    HG   SER  72           HG       SER  72 -12.881  16.475  -6.023
  582    H    LEU  73           HN       LEU  73 -14.334  14.930  -3.878
  583    HA   LEU  73           HA       LEU  73 -16.183  13.861  -2.860
  584   1HB   LEU  73          HB2       LEU  73 -14.787  11.743  -4.501
  585   2HB   LEU  73          HB1       LEU  73 -16.328  11.426  -3.697
  586    HG   LEU  73           HG       LEU  73 -16.972  13.742  -4.878
  587   1HD1  LEU  73          HD11      LEU  73 -14.517  13.665  -5.831
  588   2HD1  LEU  73          HD12      LEU  73 -15.844  14.181  -6.871
  589   3HD1  LEU  73          HD13      LEU  73 -15.214  12.539  -6.996
  590   1HD2  LEU  73          HD21      LEU  73 -17.035  11.576  -6.855
  591   2HD2  LEU  73          HD22      LEU  73 -18.372  12.401  -6.054
  592   3HD2  LEU  73          HD23      LEU  73 -17.559  11.058  -5.253
  593    H    ALA  74           HN       ALA  74 -14.738  14.237  -0.781
  594    HA   ALA  74           HA       ALA  74 -13.337  12.055   0.432
  595   1HB   ALA  74          HB1       ALA  74 -13.634  13.439   2.471
  596   2HB   ALA  74          HB2       ALA  74 -14.851  14.399   1.630
  597   3HB   ALA  74          HB3       ALA  74 -13.172  14.430   1.088
  598    H    PHE  75           HN       PHE  75 -14.211  10.143   1.130
  599    HA   PHE  75           HA       PHE  75 -17.088  10.135   1.992
  600   1HB   PHE  75          HB2       PHE  75 -16.597   8.943  -0.118
  601   2HB   PHE  75          HB1       PHE  75 -15.383   7.971   0.713
  602    HD1  PHE  75           HD1      PHE  75 -18.599   9.047   2.207
  603    HD2  PHE  75           HD2      PHE  75 -16.416   5.810   0.415
  604    HE1  PHE  75           HE1      PHE  75 -20.363   7.458   2.925
  605    HE2  PHE  75           HE2      PHE  75 -18.181   4.222   1.133
  606    HZ   PHE  75           HZ       PHE  75 -20.155   5.047   2.387
  607    H    TRP  76           HN       TRP  76 -16.576  10.469   4.243
  608    HA   TRP  76           HA       TRP  76 -15.872   9.828   6.410
  609   1HB   TRP  76          HB2       TRP  76 -16.977   7.591   4.907
  610   2HB   TRP  76          HB1       TRP  76 -15.872   7.046   6.171
  611    HD1  TRP  76           HD1      TRP  76 -16.407   7.854   8.691
  612    HE1  TRP  76           HE1      TRP  76 -18.650   8.441   9.821
  613    HE3  TRP  76           HE3      TRP  76 -19.285   8.614   4.558
  614    HZ2  TRP  76           HZ2      TRP  76 -21.322   9.146   9.060
  615    HZ3  TRP  76           HZ3      TRP  76 -21.675   9.244   4.780
  616    HH2  TRP  76           HH2      TRP  76 -22.695   9.513   7.025
  617    H    LYS  77           HN       LYS  77 -14.289   7.865   7.407
  618    HA   LYS  77           HA       LYS  77 -11.719   8.149   5.880
  619   1HB   LYS  77          HB2       LYS  77 -12.552   8.780   8.580
  620   2HB   LYS  77          HB1       LYS  77 -11.225   7.618   8.611
  621   1HG   LYS  77          HG2       LYS  77 -11.019   9.951   6.749
  622   2HG   LYS  77          HG1       LYS  77 -10.744  10.228   8.469
  623   1HD   LYS  77          HD2       LYS  77  -9.371   7.829   7.653
  624   2HD   LYS  77          HD1       LYS  77  -8.916   9.160   6.588
  625   1HE   LYS  77          HE2       LYS  77  -7.996  10.419   8.331
  626   2HE   LYS  77          HE1       LYS  77  -8.989   9.618   9.564
  627   1HZ   LYS  77          HZ1       LYS  77  -6.879   8.278   7.955
  628   2HZ   LYS  77          HZ2       LYS  77  -7.795   7.576   9.202
  629   3HZ   LYS  77          HZ3       LYS  77  -6.677   8.806   9.554
  630    H    THR  78           HN       THR  78 -13.654   5.949   5.578
  631    HA   THR  78           HA       THR  78 -12.108   3.690   6.807
  632    HB   THR  78           HB       THR  78 -14.820   3.318   5.626
  633    HG1  THR  78           HG1      THR  78 -15.819   4.338   7.289
  634   1HG2  THR  78          HG21      THR  78 -15.076   1.815   7.492
  635   2HG2  THR  78          HG22      THR  78 -13.652   2.483   8.291
  636   3HG2  THR  78          HG23      THR  78 -13.473   1.542   6.810
  637    H    ASP  79           HN       ASP  79 -10.679   4.313   4.773
  638    HA   ASP  79           HA       ASP  79 -11.742   3.391   2.187
  639   1HB   ASP  79          HB2       ASP  79  -9.416   4.816   3.297
  640   2HB   ASP  79          HB1       ASP  79  -9.018   3.760   1.941
  641    H    ALA  80           HN       ALA  80  -9.970   1.893   0.982
  642    HA   ALA  80           HA       ALA  80 -10.186  -0.734   1.812
  643   1HB   ALA  80          HB1       ALA  80  -8.218  -1.123   0.399
  644   2HB   ALA  80          HB2       ALA  80  -7.765   0.575   0.533
  645   3HB   ALA  80          HB3       ALA  80  -9.236   0.119  -0.328
  646    H    SER  81           HN       SER  81  -7.485   1.462   2.647
  647    HA   SER  81           HA       SER  81  -6.029  -0.357   4.282
  648   1HB   SER  81          HB2       SER  81  -6.079   2.434   3.561
  649   2HB   SER  81          HB1       SER  81  -5.777   2.286   5.291
  650    HG   SER  81           HG       SER  81  -4.285   0.475   4.366
  651    H    ASP  82           HN       ASP  82  -9.067   1.148   4.825
  652    HA   ASP  82           HA       ASP  82  -8.888   0.489   7.745
  653   1HB   ASP  82          HB2       ASP  82 -10.588   2.607   6.406
  654   2HB   ASP  82          HB1       ASP  82 -10.314   2.403   8.135
  655    H    VAL  83           HN       VAL  83  -9.835  -1.143   5.359
  656    HA   VAL  83           HA       VAL  83 -12.687  -1.533   6.214
  657    HB   VAL  83           HB       VAL  83 -11.338  -2.295   3.607
  658   1HG1  VAL  83          HG11      VAL  83 -13.252  -3.446   3.305
  659   2HG1  VAL  83          HG12      VAL  83 -14.100  -1.900   3.290
  660   3HG1  VAL  83          HG13      VAL  83 -13.937  -2.801   4.797
  661   1HG2  VAL  83          HG21      VAL  83 -11.527  -0.142   2.966
  662   2HG2  VAL  83          HG22      VAL  83 -12.100   0.283   4.578
  663   3HG2  VAL  83          HG23      VAL  83 -13.252  -0.184   3.327
  664    H    LYS  84           HN       LYS  84 -13.380  -3.741   6.514
  665    HA   LYS  84           HA       LYS  84 -11.255  -5.537   7.445
  666   1HB   LYS  84          HB2       LYS  84 -13.170  -6.868   8.207
  667   2HB   LYS  84          HB1       LYS  84 -13.436  -5.169   8.601
  668   1HG   LYS  84          HG2       LYS  84 -15.319  -5.144   7.373
  669   2HG   LYS  84          HG1       LYS  84 -14.427  -5.685   5.951
  670   1HD   LYS  84          HD2       LYS  84 -15.726  -7.546   6.138
  671   2HD   LYS  84          HD1       LYS  84 -14.563  -8.005   7.382
  672   1HE   LYS  84          HE2       LYS  84 -16.076  -6.683   9.020
  673   2HE   LYS  84          HE1       LYS  84 -17.303  -6.782   7.740
  674   1HZ   LYS  84          HZ1       LYS  84 -16.053  -8.938   9.285
  675   2HZ   LYS  84          HZ2       LYS  84 -16.467  -9.255   7.668
  676   3HZ   LYS  84          HZ3       LYS  84 -17.661  -8.772   8.775
  677    HA   PRO  85           HA       PRO  85 -10.795  -7.860   3.710
  678   1HB   PRO  85          HB2       PRO  85 -10.389 -10.314   5.158
  679   2HB   PRO  85          HB1       PRO  85  -9.165  -9.259   4.439
  680   1HG   PRO  85          HG2       PRO  85  -9.720  -9.649   7.221
  681   2HG   PRO  85          HG1       PRO  85  -8.532  -8.562   6.497
  682   1HD   PRO  85          HD2       PRO  85 -11.028  -7.871   7.793
  683   2HD   PRO  85          HD1       PRO  85  -9.799  -6.774   7.114
  684    H    CYS  86           HN       CYS  86 -12.308  -8.889   2.395
  685    HA   CYS  86           HA       CYS  86 -14.954  -9.417   3.117
  686   1HB   CYS  86          HB2       CYS  86 -13.449  -9.562   0.856
  687   2HB   CYS  86          HB1       CYS  86 -13.714 -11.279   1.162
  Start of MODEL   11
    1   1H    THR   1          HT1       THR   1  23.037  -5.420  -9.367
    2   2H    THR   1          HT2       THR   1  24.457  -4.520  -9.609
    3   3H    THR   1          HT3       THR   1  22.940  -3.819  -9.916
    4    HA   THR   1           HA       THR   1  24.129  -4.508  -7.286
    5    HB   THR   1           HB       THR   1  24.685  -2.373  -8.467
    6    HG1  THR   1           HG1      THR   1  24.178  -2.664  -6.076
    7   1HG2  THR   1          HG21      THR   1  21.888  -2.468  -9.050
    8   2HG2  THR   1          HG22      THR   1  23.080  -1.299  -9.615
    9   3HG2  THR   1          HG23      THR   1  22.205  -1.010  -8.111
   10    H    LYS   2           HN       LYS   2  22.476  -3.333  -5.607
   11    HA   LYS   2           HA       LYS   2  19.717  -4.330  -6.237
   12   1HB   LYS   2          HB2       LYS   2  19.657  -5.126  -3.894
   13   2HB   LYS   2          HB1       LYS   2  21.003  -5.858  -4.767
   14   1HG   LYS   2          HG2       LYS   2  22.384  -5.069  -3.174
   15   2HG   LYS   2          HG1       LYS   2  22.003  -3.436  -3.725
   16   1HD   LYS   2          HD2       LYS   2  19.819  -3.849  -2.241
   17   2HD   LYS   2          HD1       LYS   2  20.906  -4.958  -1.402
   18   1HE   LYS   2          HE2       LYS   2  22.583  -3.048  -1.262
   19   2HE   LYS   2          HE1       LYS   2  21.281  -1.979  -1.823
   20   1HZ   LYS   2          HZ1       LYS   2  19.890  -2.746  -0.023
   21   2HZ   LYS   2          HZ2       LYS   2  21.345  -2.142   0.613
   22   3HZ   LYS   2          HZ3       LYS   2  21.093  -3.819   0.504
   23    H    ALA   3           HN       ALA   3  19.450  -1.951  -6.793
   24    HA   ALA   3           HA       ALA   3  19.653   0.042  -4.682
   25   1HB   ALA   3          HB1       ALA   3  19.748   0.275  -7.254
   26   2HB   ALA   3          HB2       ALA   3  18.826   1.495  -6.375
   27   3HB   ALA   3          HB3       ALA   3  17.988   0.182  -7.201
   28    H    SER   4           HN       SER   4  18.187   0.297  -3.047
   29    HA   SER   4           HA       SER   4  15.836  -1.258  -2.709
   30   1HB   SER   4          HB2       SER   4  15.889  -0.186  -0.703
   31   2HB   SER   4          HB1       SER   4  17.357   0.585  -1.293
   32    HG   SER   4           HG       SER   4  16.213   2.350  -1.859
   33    H    CYS   5           HN       CYS   5  13.854   0.716  -2.070
   34    HA   CYS   5           HA       CYS   5  13.115   1.655  -4.823
   35   1HB   CYS   5          HB2       CYS   5  11.283   0.933  -2.523
   36   2HB   CYS   5          HB1       CYS   5  10.844   1.137  -4.221
   37    H    LYS   6           HN       LYS   6  11.017   3.313  -4.195
   38    HA   LYS   6           HA       LYS   6  12.077   5.284  -2.209
   39   1HB   LYS   6          HB2       LYS   6  11.773   5.486  -5.163
   40   2HB   LYS   6          HB1       LYS   6  11.280   6.900  -4.230
   41   1HG   LYS   6          HG2       LYS   6  13.954   5.514  -3.899
   42   2HG   LYS   6          HG1       LYS   6  13.702   6.932  -4.919
   43   1HD   LYS   6          HD2       LYS   6  12.774   8.117  -2.889
   44   2HD   LYS   6          HD1       LYS   6  13.303   6.738  -1.923
   45   1HE   LYS   6          HE2       LYS   6  15.144   8.386  -3.695
   46   2HE   LYS   6          HE1       LYS   6  15.002   8.574  -1.935
   47   1HZ   LYS   6          HZ1       LYS   6  15.274   5.970  -2.048
   48   2HZ   LYS   6          HZ2       LYS   6  16.626   6.999  -2.002
   49   3HZ   LYS   6          HZ3       LYS   6  16.102   6.344  -3.480
   50    H    LEU   7           HN       LEU   7  10.367   5.435  -0.792
   51    HA   LEU   7           HA       LEU   7   7.732   4.756  -0.960
   52   1HB   LEU   7          HB2       LEU   7   7.372   6.870   0.504
   53   2HB   LEU   7          HB1       LEU   7   8.558   5.682   1.055
   54    HG   LEU   7           HG       LEU   7   9.723   7.640  -0.776
   55   1HD1  LEU   7          HD11      LEU   7   9.559   9.587   0.608
   56   2HD1  LEU   7          HD12      LEU   7   8.779   8.681   1.905
   57   3HD1  LEU   7          HD13      LEU   7   7.911   8.995   0.403
   58   1HD2  LEU   7          HD21      LEU   7  11.097   7.862   1.528
   59   2HD2  LEU   7          HD22      LEU   7  11.322   6.501   0.428
   60   3HD2  LEU   7          HD23      LEU   7  10.283   6.329   1.843
   61    HA   PRO   8           HA       PRO   8   6.739   7.343  -4.604
   62   1HB   PRO   8          HB2       PRO   8   4.477   5.608  -4.990
   63   2HB   PRO   8          HB1       PRO   8   5.962   5.691  -5.948
   64   1HG   PRO   8          HG2       PRO   8   5.155   3.582  -4.222
   65   2HG   PRO   8          HG1       PRO   8   6.707   3.749  -5.050
   66   1HD   PRO   8          HD2       PRO   8   6.098   4.115  -2.209
   67   2HD   PRO   8          HD1       PRO   8   7.687   4.028  -3.006
   68    H    VAL   9           HN       VAL   9   4.648   6.159  -1.995
   69    HA   VAL   9           HA       VAL   9   2.801   8.472  -2.436
   70    HB   VAL   9           HB       VAL   9   2.491   5.949  -0.785
   71   1HG1  VAL   9          HG11      VAL   9   0.114   7.324  -1.817
   72   2HG1  VAL   9          HG12      VAL   9   1.050   8.308  -0.692
   73   3HG1  VAL   9          HG13      VAL   9   0.448   6.728  -0.191
   74   1HG2  VAL   9          HG21      VAL   9   0.822   6.082  -3.128
   75   2HG2  VAL   9          HG22      VAL   9   2.018   4.858  -2.701
   76   3HG2  VAL   9          HG23      VAL   9   2.507   6.291  -3.606
   77    H    LYS  10           HN       LYS  10   4.911   6.931  -0.048
   78    HA   LYS  10           HA       LYS  10   5.881   7.867   1.897
   79   1HB   LYS  10          HB2       LYS  10   6.254  10.081   1.595
   80   2HB   LYS  10          HB1       LYS  10   5.168  10.006   0.213
   81   1HG   LYS  10          HG2       LYS  10   3.249  10.495   1.726
   82   2HG   LYS  10          HG1       LYS  10   4.376  10.638   3.074
   83   1HD   LYS  10          HD2       LYS  10   4.059  12.867   2.348
   84   2HD   LYS  10          HD1       LYS  10   5.597  12.392   1.626
   85   1HE   LYS  10          HE2       LYS  10   4.768  12.743  -0.449
   86   2HE   LYS  10          HE1       LYS  10   3.411  11.644  -0.125
   87   1HZ   LYS  10          HZ1       LYS  10   2.639  13.628   1.370
   88   2HZ   LYS  10          HZ2       LYS  10   2.302  13.626  -0.296
   89   3HZ   LYS  10          HZ3       LYS  10   3.597  14.543   0.311
   90    H    LYS  11           HN       LYS  11   2.780   7.017   1.458
   91    HA   LYS  11           HA       LYS  11   2.180   7.121   4.336
   92   1HB   LYS  11          HB2       LYS  11   1.143   9.029   2.371
   93   2HB   LYS  11          HB1       LYS  11  -0.145   8.202   3.249
   94   1HG   LYS  11          HG2       LYS  11   1.415   8.734   5.337
   95   2HG   LYS  11          HG1       LYS  11   1.985  10.030   4.284
   96   1HD   LYS  11          HD2       LYS  11  -0.049  11.118   4.284
   97   2HD   LYS  11          HD1       LYS  11  -0.965   9.628   4.512
   98   1HE   LYS  11          HE2       LYS  11   0.644   9.912   6.829
   99   2HE   LYS  11          HE1       LYS  11  -0.082  11.502   6.521
  100   1HZ   LYS  11          HZ1       LYS  11  -1.430   9.615   7.738
  101   2HZ   LYS  11          HZ2       LYS  11  -1.752   9.128   6.142
  102   3HZ   LYS  11          HZ3       LYS  11  -2.189  10.686   6.663
  103    H    ALA  12           HN       ALA  12   2.467   5.152   2.044
  104    HA   ALA  12           HA       ALA  12  -0.264   4.042   1.767
  105   1HB   ALA  12          HB1       ALA  12   0.699   2.773   0.048
  106   2HB   ALA  12          HB2       ALA  12   2.285   2.763   0.816
  107   3HB   ALA  12          HB3       ALA  12   1.697   4.227   0.029
  108    H    THR  13           HN       THR  13  -0.992   2.259   2.914
  109    HA   THR  13           HA       THR  13   0.869   1.079   4.942
  110    HB   THR  13           HB       THR  13  -2.152   0.927   4.738
  111    HG1  THR  13           HG1      THR  13  -2.023   2.978   5.157
  112   1HG2  THR  13          HG21      THR  13  -1.411  -0.701   6.270
  113   2HG2  THR  13          HG22      THR  13  -1.778   0.688   7.293
  114   3HG2  THR  13          HG23      THR  13  -0.105   0.326   6.864
  115    H    VAL  14           HN       VAL  14   1.849  -0.671   3.914
  116    HA   VAL  14           HA       VAL  14   0.128  -2.518   2.317
  117    HB   VAL  14           HB       VAL  14   2.208  -3.201   1.318
  118   1HG1  VAL  14          HG11      VAL  14   2.392  -0.225   1.877
  119   2HG1  VAL  14          HG12      VAL  14   1.330  -0.949   0.669
  120   3HG1  VAL  14          HG13      VAL  14   3.080  -1.078   0.495
  121   1HG2  VAL  14          HG21      VAL  14   3.284  -2.174   3.869
  122   2HG2  VAL  14          HG22      VAL  14   4.264  -1.785   2.456
  123   3HG2  VAL  14          HG23      VAL  14   3.889  -3.466   2.834
  124    H    VAL  15           HN       VAL  15   1.156  -4.906   2.540
  125    HA   VAL  15           HA       VAL  15   1.358  -5.508   5.475
  126    HB   VAL  15           HB       VAL  15  -0.030  -6.997   3.222
  127   1HG1  VAL  15          HG11      VAL  15  -0.473  -7.734   6.061
  128   2HG1  VAL  15          HG12      VAL  15   1.103  -8.164   5.397
  129   3HG1  VAL  15          HG13      VAL  15  -0.369  -8.764   4.632
  130   1HG2  VAL  15          HG21      VAL  15  -0.904  -4.792   4.602
  131   2HG2  VAL  15          HG22      VAL  15  -1.522  -6.102   5.609
  132   3HG2  VAL  15          HG23      VAL  15  -1.968  -6.014   3.906
  133    H    TYR  16           HN       TYR  16   3.345  -6.367   5.922
  134    HA   TYR  16           HA       TYR  16   5.025  -7.494   3.787
  135   1HB   TYR  16          HB2       TYR  16   5.520  -6.015   5.967
  136   2HB   TYR  16          HB1       TYR  16   5.722  -7.611   6.691
  137    HD1  TYR  16           HD1      TYR  16   7.851  -5.361   6.053
  138    HD2  TYR  16           HD2      TYR  16   6.662  -8.994   4.094
  139    HE1  TYR  16           HE1      TYR  16  10.099  -5.542   5.025
  140    HE2  TYR  16           HE2      TYR  16   8.912  -9.175   3.065
  141    HH   TYR  16           HH       TYR  16  10.789  -7.578   2.459
  142    H    GLN  17           HN       GLN  17   2.749  -9.082   4.062
  143    HA   GLN  17           HA       GLN  17   2.121 -11.335   4.337
  144   1HB   GLN  17          HB2       GLN  17   5.110 -11.589   4.778
  145   2HB   GLN  17          HB1       GLN  17   4.015 -12.898   4.328
  146   1HG   GLN  17          HG2       GLN  17   3.966 -10.476   2.604
  147   2HG   GLN  17          HG1       GLN  17   5.404 -11.490   2.499
  148   1HE2  GLN  17          HE21      GLN  17   4.503 -11.944   0.225
  149   2HE2  GLN  17          HE22      GLN  17   3.350 -13.178   0.068
  150    H    GLY  18           HN       GLY  18   1.902  -9.679   6.687
  151   1HA   GLY  18          HA2       GLY  18   1.152 -11.165   8.739
  152   2HA   GLY  18          HA1       GLY  18   2.887 -11.443   8.871
  153    H    GLU  19           HN       GLU  19   3.053  -8.478   7.777
  154    HA   GLU  19           HA       GLU  19   2.466  -7.165  10.409
  155   1HB   GLU  19          HB2       GLU  19   4.943  -6.890   8.676
  156   2HB   GLU  19          HB1       GLU  19   4.666  -6.080  10.219
  157   1HG   GLU  19          HG2       GLU  19   5.423  -7.880  11.331
  158   2HG   GLU  19          HG1       GLU  19   4.208  -8.896  10.553
  159    H    ARG  20           HN       ARG  20   1.094  -5.478  10.040
  160    HA   ARG  20           HA       ARG  20   1.000  -4.227   7.342
  161   1HB   ARG  20          HB2       ARG  20  -0.756  -3.860   9.789
  162   2HB   ARG  20          HB1       ARG  20  -1.141  -3.376   8.135
  163   1HG   ARG  20          HG2       ARG  20  -1.379  -5.610   7.411
  164   2HG   ARG  20          HG1       ARG  20  -0.516  -6.249   8.809
  165   1HD   ARG  20          HD2       ARG  20  -2.397  -5.439  10.272
  166   2HD   ARG  20          HD1       ARG  20  -3.284  -4.998   8.799
  167    HE   ARG  20           HE       ARG  20  -2.936  -7.457   8.117
  168   1HH1  ARG  20          HH11      ARG  20  -1.640  -7.318  11.116
  169   2HH1  ARG  20          HH12      ARG  20  -2.739  -8.416  11.881
  170   1HH2  ARG  20          HH21      ARG  20  -4.952  -8.478   9.212
  171   2HH2  ARG  20          HH22      ARG  20  -4.615  -9.073  10.803
  172    H    VAL  21           HN       VAL  21   1.933  -2.232   7.012
  173    HA   VAL  21           HA       VAL  21   2.138  -0.285   9.216
  174    HB   VAL  21           HB       VAL  21   4.696  -0.205   8.752
  175   1HG1  VAL  21          HG11      VAL  21   5.094  -1.748  10.522
  176   2HG1  VAL  21          HG12      VAL  21   3.688  -2.721  10.091
  177   3HG1  VAL  21          HG13      VAL  21   3.470  -1.124  10.809
  178   1HG2  VAL  21          HG21      VAL  21   4.411  -3.103   8.072
  179   2HG2  VAL  21          HG22      VAL  21   5.703  -1.975   7.658
  180   3HG2  VAL  21          HG23      VAL  21   4.178  -1.931   6.775
  181    H    LYS  22           HN       LYS  22   3.272   1.763   8.349
  182    HA   LYS  22           HA       LYS  22   2.333   2.226   5.566
  183   1HB   LYS  22          HB2       LYS  22   2.983   3.877   7.994
  184   2HB   LYS  22          HB1       LYS  22   2.921   4.648   6.409
  185   1HG   LYS  22          HG2       LYS  22   0.654   2.859   6.878
  186   2HG   LYS  22          HG1       LYS  22   0.739   4.172   8.053
  187   1HD   LYS  22          HD2       LYS  22   1.330   5.218   5.443
  188   2HD   LYS  22          HD1       LYS  22  -0.179   4.307   5.369
  189   1HE   LYS  22          HE2       LYS  22   0.129   6.076   7.737
  190   2HE   LYS  22          HE1       LYS  22  -0.087   6.892   6.176
  191   1HZ   LYS  22          HZ1       LYS  22  -1.795   4.731   7.294
  192   2HZ   LYS  22          HZ2       LYS  22  -1.951   5.370   5.727
  193   3HZ   LYS  22          HZ3       LYS  22  -2.238   6.355   7.082
  194    H    ILE  23           HN       ILE  23   3.802   2.315   3.925
  195    HA   ILE  23           HA       ILE  23   6.562   1.817   4.149
  196    HB   ILE  23           HB       ILE  23   5.204   1.659   2.097
  197   1HG1  ILE  23          HG12      ILE  23   7.447   3.692   1.848
  198   2HG1  ILE  23          HG11      ILE  23   7.657   1.940   1.883
  199   1HG2  ILE  23          HG21      ILE  23   4.526   3.701   0.908
  200   2HG2  ILE  23          HG22      ILE  23   5.209   4.690   2.199
  201   3HG2  ILE  23          HG23      ILE  23   3.812   3.663   2.520
  202   1HD1  ILE  23          HD11      ILE  23   6.335   3.626  -0.242
  203   2HD1  ILE  23          HD12      ILE  23   6.017   1.897  -0.114
  204   3HD1  ILE  23          HD13      ILE  23   7.656   2.470  -0.423
  205    H    GLN  24           HN       GLN  24   4.792   4.831   4.515
  206    HA   GLN  24           HA       GLN  24   6.756   6.778   4.099
  207   1HB   GLN  24          HB2       GLN  24   5.372   8.139   5.468
  208   2HB   GLN  24          HB1       GLN  24   4.276   6.914   4.824
  209   1HG   GLN  24          HG2       GLN  24   4.438   5.621   6.882
  210   2HG   GLN  24          HG1       GLN  24   5.649   6.731   7.522
  211   1HE2  GLN  24          HE21      GLN  24   2.287   6.118   7.384
  212   2HE2  GLN  24          HE22      GLN  24   1.752   7.621   7.965
  213    H    GLU  25           HN       GLU  25   6.468   4.477   6.753
  214    HA   GLU  25           HA       GLU  25   8.937   5.652   7.992
  215   1HB   GLU  25          HB2       GLU  25   6.547   4.173   9.116
  216   2HB   GLU  25          HB1       GLU  25   8.002   4.487  10.060
  217   1HG   GLU  25          HG2       GLU  25   7.130   6.901   8.720
  218   2HG   GLU  25          HG1       GLU  25   5.819   6.227   9.690
  219    H    LYS  26           HN       LYS  26   7.196   2.524   7.704
  220    HA   LYS  26           HA       LYS  26   9.176   0.720   8.382
  221   1HB   LYS  26          HB2       LYS  26   6.824   0.279   7.612
  222   2HB   LYS  26          HB1       LYS  26   7.371   0.536   5.953
  223   1HG   LYS  26          HG2       LYS  26   7.529  -1.794   6.187
  224   2HG   LYS  26          HG1       LYS  26   9.175  -1.261   6.528
  225   1HD   LYS  26          HD2       LYS  26   7.720  -1.130   8.971
  226   2HD   LYS  26          HD1       LYS  26   7.384  -2.701   8.242
  227   1HE   LYS  26          HE2       LYS  26   9.733  -3.234   8.109
  228   2HE   LYS  26          HE1       LYS  26  10.189  -1.579   8.558
  229   1HZ   LYS  26          HZ1       LYS  26   9.014  -3.695  10.220
  230   2HZ   LYS  26          HZ2       LYS  26   8.616  -2.080  10.568
  231   3HZ   LYS  26          HZ3       LYS  26  10.238  -2.585  10.600
  232    H    PHE  27           HN       PHE  27   9.022   2.685   5.457
  233    HA   PHE  27           HA       PHE  27  11.778   1.756   4.758
  234   1HB   PHE  27          HB2       PHE  27   9.348   1.950   2.950
  235   2HB   PHE  27          HB1       PHE  27  10.995   1.654   2.378
  236    HD1  PHE  27           HD1      PHE  27  12.229  -0.235   3.992
  237    HD2  PHE  27           HD2      PHE  27   8.039   0.033   3.078
  238    HE1  PHE  27           HE1      PHE  27  11.967  -2.650   4.488
  239    HE2  PHE  27           HE2      PHE  27   7.778  -2.383   3.574
  240    HZ   PHE  27           HZ       PHE  27   9.741  -3.724   4.280
  241    H    LYS  28           HN       LYS  28  11.090   4.199   6.061
  242    HA   LYS  28           HA       LYS  28  10.566   6.443   4.465
  243   1HB   LYS  28          HB2       LYS  28  11.930   7.628   6.206
  244   2HB   LYS  28          HB1       LYS  28  10.771   6.489   6.891
  245   1HG   LYS  28          HG2       LYS  28  12.777   6.029   8.054
  246   2HG   LYS  28          HG1       LYS  28  12.703   4.775   6.815
  247   1HD   LYS  28          HD2       LYS  28  14.630   5.490   5.923
  248   2HD   LYS  28          HD1       LYS  28  13.964   7.111   5.716
  249   1HE   LYS  28          HE2       LYS  28  14.529   6.708   8.508
  250   2HE   LYS  28          HE1       LYS  28  15.975   6.306   7.561
  251   1HZ   LYS  28          HZ1       LYS  28  14.415   8.647   6.757
  252   2HZ   LYS  28          HZ2       LYS  28  16.089   8.377   6.658
  253   3HZ   LYS  28          HZ3       LYS  28  15.379   8.793   8.145
  254    H    ASN  29           HN       ASN  29  13.468   4.472   4.593
  255    HA   ASN  29           HA       ASN  29  14.924   6.423   2.860
  256   1HB   ASN  29          HB2       ASN  29  15.605   4.190   4.727
  257   2HB   ASN  29          HB1       ASN  29  16.714   4.487   3.385
  258   1HD2  ASN  29          HD21      ASN  29  17.764   4.998   5.868
  259   2HD2  ASN  29          HD22      ASN  29  17.850   6.668   6.163
  260    H    GLY  30           HN       GLY  30  12.659   4.680   1.937
  261   1HA   GLY  30          HA2       GLY  30  12.352   3.758  -0.260
  262   2HA   GLY  30          HA1       GLY  30  14.088   3.457  -0.348
  263    H    MET  31           HN       MET  31  12.251   1.446  -1.021
  264    HA   MET  31           HA       MET  31  12.165  -0.374   1.340
  265   1HB   MET  31          HB2       MET  31  11.022  -0.634  -1.464
  266   2HB   MET  31          HB1       MET  31  10.620  -1.646  -0.076
  267   1HG   MET  31          HG2       MET  31  10.170   0.896   0.896
  268   2HG   MET  31          HG1       MET  31   9.646   1.034  -0.781
  269   1HE   MET  31          HE1       MET  31   7.981   0.044  -1.867
  270   2HE   MET  31          HE2       MET  31   6.691  -0.999  -1.275
  271   3HE   MET  31          HE3       MET  31   8.262  -1.691  -1.670
  272    H    LEU  32           HN       LEU  32  13.139  -2.488   1.194
  273    HA   LEU  32           HA       LEU  32  15.662  -2.624  -0.173
  274   1HB   LEU  32          HB2       LEU  32  13.940  -4.814   1.027
  275   2HB   LEU  32          HB1       LEU  32  15.686  -4.889   0.763
  276    HG   LEU  32           HG       LEU  32  15.084  -2.496   2.224
  277   1HD1  LEU  32          HD11      LEU  32  14.267  -3.709   4.325
  278   2HD1  LEU  32          HD12      LEU  32  13.824  -5.044   3.261
  279   3HD1  LEU  32          HD13      LEU  32  13.068  -3.464   3.056
  280   1HD2  LEU  32          HD21      LEU  32  16.475  -3.825   3.969
  281   2HD2  LEU  32          HD22      LEU  32  17.235  -3.460   2.419
  282   3HD2  LEU  32          HD23      LEU  32  16.581  -5.070   2.724
  283    H    HIS  33           HN       HIS  33  16.259  -4.066  -1.929
  284    HA   HIS  33           HA       HIS  33  14.397  -4.140  -4.124
  285   1HB   HIS  33          HB2       HIS  33  16.967  -4.059  -4.081
  286   2HB   HIS  33          HB1       HIS  33  16.902  -5.799  -3.786
  287    HD1  HIS  33           HD1      HIS  33  14.886  -6.876  -5.625
  288    HD2  HIS  33           HD2      HIS  33  17.331  -3.706  -6.790
  289    HE1  HIS  33           HE1      HIS  33  14.883  -6.862  -8.158
  290    H    GLY  34           HN       GLY  34  13.025  -5.780  -4.785
  291   1HA   GLY  34          HA2       GLY  34  12.135  -7.979  -4.926
  292   2HA   GLY  34          HA1       GLY  34  13.361  -8.518  -3.779
  293    H    ASP  35           HN       ASP  35  12.308  -5.950  -2.207
  294    HA   ASP  35           HA       ASP  35  10.920  -7.236  -0.158
  295   1HB   ASP  35          HB2       ASP  35  11.267  -4.505  -1.203
  296   2HB   ASP  35          HB1       ASP  35   9.803  -4.714  -0.243
  297    H    LYS  36           HN       LYS  36   8.978  -8.300  -0.158
  298    HA   LYS  36           HA       LYS  36   7.010  -7.680  -2.319
  299   1HB   LYS  36          HB2       LYS  36   7.779 -10.029  -0.651
  300   2HB   LYS  36          HB1       LYS  36   6.093  -9.923  -1.161
  301   1HG   LYS  36          HG2       LYS  36   7.771  -9.266  -3.395
  302   2HG   LYS  36          HG1       LYS  36   8.323 -10.792  -2.702
  303   1HD   LYS  36          HD2       LYS  36   5.521 -10.954  -2.672
  304   2HD   LYS  36          HD1       LYS  36   5.919 -10.244  -4.235
  305   1HE   LYS  36          HE2       LYS  36   7.778 -12.174  -4.226
  306   2HE   LYS  36          HE1       LYS  36   6.587 -12.955  -3.166
  307   1HZ   LYS  36          HZ1       LYS  36   6.057 -11.780  -5.846
  308   2HZ   LYS  36          HZ2       LYS  36   4.865 -12.408  -4.809
  309   3HZ   LYS  36          HZ3       LYS  36   6.055 -13.432  -5.459
  310    H    VAL  37           HN       VAL  37   5.286  -6.458  -1.742
  311    HA   VAL  37           HA       VAL  37   4.169  -6.717   1.016
  312    HB   VAL  37           HB       VAL  37   4.028  -4.208   1.058
  313   1HG1  VAL  37          HG11      VAL  37   5.858  -5.251   2.237
  314   2HG1  VAL  37          HG12      VAL  37   6.515  -3.865   1.366
  315   3HG1  VAL  37          HG13      VAL  37   6.753  -5.495   0.737
  316   1HG2  VAL  37          HG21      VAL  37   4.870  -4.596  -1.676
  317   2HG2  VAL  37          HG22      VAL  37   6.045  -3.588  -0.833
  318   3HG2  VAL  37          HG23      VAL  37   4.349  -3.109  -0.884
  319    H    SER  38           HN       SER  38   1.895  -6.297   1.095
  320    HA   SER  38           HA       SER  38   0.570  -6.238  -1.585
  321   1HB   SER  38          HB2       SER  38  -0.805  -6.888   0.998
  322   2HB   SER  38          HB1       SER  38  -1.059  -7.579  -0.605
  323    HG   SER  38           HG       SER  38   0.146  -8.837   1.103
  324    H    PHE  39           HN       PHE  39  -1.059  -4.692  -2.002
  325    HA   PHE  39           HA       PHE  39  -1.136  -2.369  -0.128
  326   1HB   PHE  39          HB2       PHE  39  -1.652  -2.845  -3.060
  327   2HB   PHE  39          HB1       PHE  39  -2.247  -1.378  -2.277
  328    HD1  PHE  39           HD1      PHE  39  -0.739   0.351  -1.524
  329    HD2  PHE  39           HD2      PHE  39   0.777  -3.317  -3.169
  330    HE1  PHE  39           HE1      PHE  39   1.523   1.356  -1.681
  331    HE2  PHE  39           HE2      PHE  39   3.038  -2.311  -3.327
  332    HZ   PHE  39           HZ       PHE  39   3.411   0.026  -2.583
  333    H    PHE  40           HN       PHE  40  -3.083  -1.756   0.841
  334    HA   PHE  40           HA       PHE  40  -5.281  -3.688   0.789
  335   1HB   PHE  40          HB2       PHE  40  -4.464  -1.238   2.280
  336   2HB   PHE  40          HB1       PHE  40  -6.180  -1.656   2.301
  337    HD1  PHE  40           HD1      PHE  40  -6.687  -4.233   2.717
  338    HD2  PHE  40           HD2      PHE  40  -3.073  -2.221   3.876
  339    HE1  PHE  40           HE1      PHE  40  -6.248  -5.994   4.407
  340    HE2  PHE  40           HE2      PHE  40  -2.634  -3.983   5.566
  341    HZ   PHE  40           HZ       PHE  40  -4.222  -5.870   5.830
  342    H    CYS  41           HN       CYS  41  -7.192  -3.491  -0.311
  343    HA   CYS  41           HA       CYS  41  -7.876  -0.874  -1.583
  344   1HB   CYS  41          HB2       CYS  41  -7.035  -3.396  -2.814
  345   2HB   CYS  41          HB1       CYS  41  -8.599  -2.845  -3.424
  346    H    LYS  42           HN       LYS  42 -10.239  -1.254  -2.633
  347    HA   LYS  42           HA       LYS  42 -11.860  -2.741  -0.585
  348   1HB   LYS  42          HB2       LYS  42 -13.549  -0.942  -1.034
  349   2HB   LYS  42          HB1       LYS  42 -12.029  -0.318  -0.388
  350   1HG   LYS  42          HG2       LYS  42 -11.913  -0.490  -3.279
  351   2HG   LYS  42          HG1       LYS  42 -13.296   0.480  -2.768
  352   1HD   LYS  42          HD2       LYS  42 -10.562   0.896  -1.560
  353   2HD   LYS  42          HD1       LYS  42 -11.031   1.695  -3.060
  354   1HE   LYS  42          HE2       LYS  42 -13.173   1.993  -1.164
  355   2HE   LYS  42          HE1       LYS  42 -11.654   2.519  -0.411
  356   1HZ   LYS  42          HZ1       LYS  42 -12.972   3.526  -2.831
  357   2HZ   LYS  42          HZ2       LYS  42 -11.274   3.539  -2.780
  358   3HZ   LYS  42          HZ3       LYS  42 -12.169   4.382  -1.608
  359    H    ASN  43           HN       ASN  43 -13.659  -3.898  -1.350
  360    HA   ASN  43           HA       ASN  43 -13.709  -4.378  -4.308
  361   1HB   ASN  43          HB2       ASN  43 -13.154  -6.165  -2.479
  362   2HB   ASN  43          HB1       ASN  43 -14.895  -6.152  -2.177
  363   1HD2  ASN  43          HD21      ASN  43 -13.674  -8.497  -3.206
  364   2HD2  ASN  43          HD22      ASN  43 -14.177  -8.724  -4.811
  365    H    LYS  44           HN       LYS  44 -15.461  -3.455  -5.309
  366    HA   LYS  44           HA       LYS  44 -17.747  -2.462  -3.788
  367   1HB   LYS  44          HB2       LYS  44 -18.481  -1.753  -6.056
  368   2HB   LYS  44          HB1       LYS  44 -16.801  -1.312  -5.747
  369   1HG   LYS  44          HG2       LYS  44 -16.305  -2.379  -7.675
  370   2HG   LYS  44          HG1       LYS  44 -16.616  -3.880  -6.799
  371   1HD   LYS  44          HD2       LYS  44 -18.923  -3.901  -7.513
  372   2HD   LYS  44          HD1       LYS  44 -18.770  -2.289  -8.214
  373   1HE   LYS  44          HE2       LYS  44 -16.732  -3.637  -9.486
  374   2HE   LYS  44          HE1       LYS  44 -17.980  -4.892  -9.345
  375   1HZ   LYS  44          HZ1       LYS  44 -19.527  -2.898  -9.992
  376   2HZ   LYS  44          HZ2       LYS  44 -18.726  -3.797 -11.191
  377   3HZ   LYS  44          HZ3       LYS  44 -18.109  -2.293 -10.699
  378    H    GLU  45           HN       GLU  45 -17.007  -5.348  -5.646
  379    HA   GLU  45           HA       GLU  45 -19.773  -6.190  -6.012
  380   1HB   GLU  45          HB2       GLU  45 -17.433  -6.796  -7.171
  381   2HB   GLU  45          HB1       GLU  45 -17.473  -8.098  -5.981
  382   1HG   GLU  45          HG2       GLU  45 -19.568  -8.913  -6.811
  383   2HG   GLU  45          HG1       GLU  45 -19.801  -7.479  -7.811
  384    H    LYS  46           HN       LYS  46 -17.117  -7.368  -3.904
  385    HA   LYS  46           HA       LYS  46 -19.021  -8.921  -2.278
  386   1HB   LYS  46          HB2       LYS  46 -16.054  -8.370  -1.968
  387   2HB   LYS  46          HB1       LYS  46 -16.965  -9.653  -1.167
  388   1HG   LYS  46          HG2       LYS  46 -17.448  -9.782  -4.001
  389   2HG   LYS  46          HG1       LYS  46 -15.708  -9.761  -3.708
  390   1HD   LYS  46          HD2       LYS  46 -15.726 -11.782  -2.629
  391   2HD   LYS  46          HD1       LYS  46 -17.317 -11.504  -1.918
  392   1HE   LYS  46          HE2       LYS  46 -18.211 -12.826  -3.523
  393   2HE   LYS  46          HE1       LYS  46 -17.683 -11.650  -4.743
  394   1HZ   LYS  46          HZ1       LYS  46 -15.389 -12.697  -4.392
  395   2HZ   LYS  46          HZ2       LYS  46 -16.523 -13.570  -5.310
  396   3HZ   LYS  46          HZ3       LYS  46 -16.226 -13.996  -3.692
  397    H    LYS  47           HN       LYS  47 -17.730  -5.742  -2.289
  398    HA   LYS  47           HA       LYS  47 -18.093  -3.950  -0.787
  399   1HB   LYS  47          HB2       LYS  47 -19.606  -5.914   0.928
  400   2HB   LYS  47          HB1       LYS  47 -19.909  -4.189   0.708
  401   1HG   LYS  47          HG2       LYS  47 -20.079  -5.360  -1.867
  402   2HG   LYS  47          HG1       LYS  47 -20.989  -6.409  -0.781
  403   1HD   LYS  47          HD2       LYS  47 -22.445  -4.680  -0.128
  404   2HD   LYS  47          HD1       LYS  47 -21.343  -3.420  -0.687
  405   1HE   LYS  47          HE2       LYS  47 -21.738  -4.090  -3.031
  406   2HE   LYS  47          HE1       LYS  47 -22.836  -5.371  -2.480
  407   1HZ   LYS  47          HZ1       LYS  47 -24.018  -3.298  -3.038
  408   2HZ   LYS  47          HZ2       LYS  47 -23.140  -2.485  -1.831
  409   3HZ   LYS  47          HZ3       LYS  47 -24.213  -3.733  -1.411
  410    H    CYS  48           HN       CYS  48 -15.826  -5.871  -0.509
  411    HA   CYS  48           HA       CYS  48 -15.193  -5.296   2.359
  412   1HB   CYS  48          HB2       CYS  48 -13.963  -7.748   1.374
  413   2HB   CYS  48          HB1       CYS  48 -14.894  -7.482   2.842
  414    H    SER  49           HN       SER  49 -12.728  -5.555   2.691
  415    HA   SER  49           HA       SER  49 -11.349  -4.366   0.321
  416   1HB   SER  49          HB2       SER  49  -9.676  -3.864   2.294
  417   2HB   SER  49          HB1       SER  49 -11.157  -2.923   2.143
  418    HG   SER  49           HG       SER  49 -10.371  -4.461   4.158
  419    H    TYR  50           HN       TYR  50  -8.989  -5.011   0.148
  420    HA   TYR  50           HA       TYR  50  -8.270  -7.666   1.226
  421   1HB   TYR  50          HB2       TYR  50  -7.928  -8.458  -1.199
  422   2HB   TYR  50          HB1       TYR  50  -9.599  -8.345  -0.637
  423    HD1  TYR  50           HD1      TYR  50 -11.139  -6.835  -1.641
  424    HD2  TYR  50           HD2      TYR  50  -6.954  -6.567  -2.568
  425    HE1  TYR  50           HE1      TYR  50 -11.646  -5.235  -3.468
  426    HE2  TYR  50           HE2      TYR  50  -7.460  -4.967  -4.394
  427    HH   TYR  50           HH       TYR  50  -9.067  -3.615  -5.259
  428    H    THR  51           HN       THR  51  -6.079  -8.289  -0.144
  429    HA   THR  51           HA       THR  51  -4.432  -5.779  -0.182
  430    HB   THR  51           HB       THR  51  -2.605  -7.349   0.605
  431    HG1  THR  51           HG1      THR  51  -3.868  -9.258   1.657
  432   1HG2  THR  51          HG21      THR  51  -3.461  -7.467   2.920
  433   2HG2  THR  51          HG22      THR  51  -5.090  -7.140   2.329
  434   3HG2  THR  51          HG23      THR  51  -3.835  -5.912   2.177
  435    H    GLU  52           HN       GLU  52  -2.910  -5.593  -1.845
  436    HA   GLU  52           HA       GLU  52  -3.097  -7.639  -4.032
  437   1HB   GLU  52          HB2       GLU  52  -3.324  -4.741  -3.878
  438   2HB   GLU  52          HB1       GLU  52  -2.074  -5.218  -5.029
  439   1HG   GLU  52          HG2       GLU  52  -4.937  -6.217  -4.998
  440   2HG   GLU  52          HG1       GLU  52  -4.247  -5.084  -6.160
  441    H    ASP  53           HN       ASP  53  -1.308  -8.901  -3.241
  442    HA   ASP  53           HA       ASP  53   1.131  -8.194  -2.220
  443   1HB   ASP  53          HB2       ASP  53   0.626 -10.123  -4.502
  444   2HB   ASP  53          HB1       ASP  53   2.008 -10.166  -3.404
  445    H    ALA  54           HN       ALA  54   3.053  -7.324  -2.965
  446    HA   ALA  54           HA       ALA  54   3.221  -6.458  -5.819
  447   1HB   ALA  54          HB1       ALA  54   3.293  -4.241  -5.242
  448   2HB   ALA  54          HB2       ALA  54   4.183  -4.561  -3.754
  449   3HB   ALA  54          HB3       ALA  54   2.436  -4.794  -3.803
  450    H    GLN  55           HN       GLN  55   5.558  -5.630  -6.240
  451    HA   GLN  55           HA       GLN  55   7.541  -7.021  -4.484
  452   1HB   GLN  55          HB2       GLN  55   6.710  -8.331  -6.545
  453   2HB   GLN  55          HB1       GLN  55   7.586  -7.138  -7.504
  454   1HG   GLN  55          HG2       GLN  55   9.626  -7.671  -6.070
  455   2HG   GLN  55          HG1       GLN  55   8.716  -9.045  -5.446
  456   1HE2  GLN  55          HE21      GLN  55  11.173  -8.987  -7.243
  457   2HE2  GLN  55          HE22      GLN  55  10.730  -9.894  -8.607
  458    H    CYS  56           HN       CYS  56   9.471  -5.880  -4.273
  459    HA   CYS  56           HA       CYS  56   9.605  -3.230  -5.627
  460   1HB   CYS  56          HB2       CYS  56   9.998  -4.208  -3.018
  461   2HB   CYS  56          HB1       CYS  56  11.609  -3.804  -3.606
  462    H    ILE  57           HN       ILE  57  11.388  -2.689  -6.930
  463    HA   ILE  57           HA       ILE  57  13.484  -4.798  -7.316
  464    HB   ILE  57           HB       ILE  57  12.123  -3.175  -9.489
  465   1HG1  ILE  57          HG12      ILE  57  11.408  -5.867  -9.751
  466   2HG1  ILE  57          HG11      ILE  57  11.229  -5.535  -8.029
  467   1HG2  ILE  57          HG21      ILE  57  14.080  -3.908 -10.466
  468   2HG2  ILE  57          HG22      ILE  57  13.092  -5.346 -10.720
  469   3HG2  ILE  57          HG23      ILE  57  14.231  -5.286  -9.376
  470   1HD1  ILE  57          HD11      ILE  57   9.772  -3.657  -8.476
  471   2HD1  ILE  57          HD12      ILE  57   9.163  -5.042  -9.384
  472   3HD1  ILE  57          HD13      ILE  57  10.074  -3.778 -10.209
  473    H    ASP  58           HN       ASP  58  15.300  -3.755  -8.779
  474    HA   ASP  58           HA       ASP  58  16.786  -1.872  -7.478
  475   1HB   ASP  58          HB2       ASP  58  17.031  -3.200  -9.760
  476   2HB   ASP  58          HB1       ASP  58  16.562  -1.646 -10.459
  477    H    GLY  59           HN       GLY  59  15.532  -0.188  -6.514
  478   1HA   GLY  59          HA2       GLY  59  14.414   1.875  -6.409
  479   2HA   GLY  59          HA1       GLY  59  15.394   2.272  -7.816
  480    H    THR  60           HN       THR  60  13.192  -0.387  -8.183
  481    HA   THR  60           HA       THR  60  11.185   1.433  -9.455
  482    HB   THR  60           HB       THR  60  12.196  -1.091 -10.750
  483    HG1  THR  60           HG1      THR  60  13.053   1.469 -11.506
  484   1HG2  THR  60          HG21      THR  60  10.653   1.340 -11.654
  485   2HG2  THR  60          HG22      THR  60  10.127  -0.343 -11.660
  486   3HG2  THR  60          HG23      THR  60  11.369   0.196 -12.789
  487    H    ILE  61           HN       ILE  61   9.174   0.872  -8.813
  488    HA   ILE  61           HA       ILE  61   8.608  -1.987  -8.158
  489    HB   ILE  61           HB       ILE  61   8.961  -1.009  -6.035
  490   1HG1  ILE  61          HG12      ILE  61   6.177  -0.265  -5.811
  491   2HG1  ILE  61          HG11      ILE  61   6.336  -1.700  -6.825
  492   1HG2  ILE  61          HG21      ILE  61   9.212   1.269  -6.284
  493   2HG2  ILE  61          HG22      ILE  61   7.582   1.246  -5.612
  494   3HG2  ILE  61          HG23      ILE  61   7.816   1.412  -7.352
  495   1HD1  ILE  61          HD11      ILE  61   6.215  -2.600  -4.656
  496   2HD1  ILE  61          HD12      ILE  61   7.202  -1.312  -3.967
  497   3HD1  ILE  61          HD13      ILE  61   7.949  -2.554  -4.971
  498    H    GLU  62           HN       GLU  62   6.598  -2.661  -8.861
  499    HA   GLU  62           HA       GLU  62   5.044  -0.756 -10.520
  500   1HB   GLU  62          HB2       GLU  62   5.595  -3.629 -10.361
  501   2HB   GLU  62          HB1       GLU  62   3.889  -3.282 -10.653
  502   1HG   GLU  62          HG2       GLU  62   5.822  -1.674 -12.229
  503   2HG   GLU  62          HG1       GLU  62   5.734  -3.389 -12.635
  504    H    VAL  63           HN       VAL  63   4.445   0.236  -8.217
  505    HA   VAL  63           HA       VAL  63   2.764  -0.967  -6.351
  506    HB   VAL  63           HB       VAL  63   2.729   1.795  -7.594
  507   1HG1  VAL  63          HG11      VAL  63   1.366   0.763  -5.090
  508   2HG1  VAL  63          HG12      VAL  63   0.576   1.418  -6.523
  509   3HG1  VAL  63          HG13      VAL  63   1.546   2.471  -5.492
  510   1HG2  VAL  63          HG21      VAL  63   4.113   0.491  -5.258
  511   2HG2  VAL  63          HG22      VAL  63   3.820   2.230  -5.258
  512   3HG2  VAL  63          HG23      VAL  63   4.803   1.502  -6.528
  513    HA   PRO  64           HA       PRO  64  -0.729  -2.225  -8.826
  514   1HB   PRO  64          HB2       PRO  64  -2.399  -2.230  -6.479
  515   2HB   PRO  64          HB1       PRO  64  -1.671  -3.616  -7.303
  516   1HG   PRO  64          HG2       PRO  64  -0.942  -2.512  -4.761
  517   2HG   PRO  64          HG1       PRO  64  -0.193  -3.870  -5.605
  518   1HD   PRO  64          HD2       PRO  64   0.876  -1.211  -5.208
  519   2HD   PRO  64          HD1       PRO  64   1.645  -2.592  -6.026
  520    H    LYS  65           HN       LYS  65  -1.754  -0.666 -10.037
  521    HA   LYS  65           HA       LYS  65  -2.276   1.995  -9.364
  522   1HB   LYS  65          HB2       LYS  65  -4.117   1.702 -11.159
  523   2HB   LYS  65          HB1       LYS  65  -2.470   1.277 -11.622
  524   1HG   LYS  65          HG2       LYS  65  -3.753  -0.998 -10.394
  525   2HG   LYS  65          HG1       LYS  65  -4.752  -0.387 -11.713
  526   1HD   LYS  65          HD2       LYS  65  -2.092  -0.292 -12.654
  527   2HD   LYS  65          HD1       LYS  65  -2.267  -1.855 -11.858
  528   1HE   LYS  65          HE2       LYS  65  -4.614  -1.781 -13.219
  529   2HE   LYS  65          HE1       LYS  65  -3.586  -0.839 -14.318
  530   1HZ   LYS  65          HZ1       LYS  65  -1.890  -2.590 -14.112
  531   2HZ   LYS  65          HZ2       LYS  65  -3.329  -3.172 -14.804
  532   3HZ   LYS  65          HZ3       LYS  65  -2.963  -3.514 -13.180
  533    H    CYS  66           HN       CYS  66  -4.126  -0.877  -8.512
  534    HA   CYS  66           HA       CYS  66  -6.645   0.093  -7.851
  535   1HB   CYS  66          HB2       CYS  66  -5.698  -2.236  -7.593
  536   2HB   CYS  66          HB1       CYS  66  -4.916  -1.692  -6.108
  537    H    PHE  67           HN       PHE  67  -3.619   0.546  -6.040
  538    HA   PHE  67           HA       PHE  67  -4.473   1.580  -3.613
  539   1HB   PHE  67          HB2       PHE  67  -2.133   1.279  -4.367
  540   2HB   PHE  67          HB1       PHE  67  -2.309   2.659  -5.451
  541    HD1  PHE  67           HD1      PHE  67  -1.960   4.862  -4.668
  542    HD2  PHE  67           HD2      PHE  67  -2.520   1.661  -1.859
  543    HE1  PHE  67           HE1      PHE  67  -1.382   6.394  -2.806
  544    HE2  PHE  67           HE2      PHE  67  -1.943   3.193   0.003
  545    HZ   PHE  67           HZ       PHE  67  -1.373   5.559  -0.470
  546    H    LYS  68           HN       LYS  68  -4.689   3.905  -2.931
  547    HA   LYS  68           HA       LYS  68  -5.775   5.690  -5.069
  548   1HB   LYS  68          HB2       LYS  68  -7.085   4.795  -2.485
  549   2HB   LYS  68          HB1       LYS  68  -7.664   6.170  -3.428
  550   1HG   LYS  68          HG2       LYS  68  -7.226   3.871  -5.139
  551   2HG   LYS  68          HG1       LYS  68  -8.326   3.465  -3.821
  552   1HD   LYS  68          HD2       LYS  68  -9.707   4.330  -5.565
  553   2HD   LYS  68          HD1       LYS  68  -9.568   5.629  -4.380
  554   1HE   LYS  68          HE2       LYS  68  -8.191   6.917  -5.747
  555   2HE   LYS  68          HE1       LYS  68  -7.558   5.501  -6.610
  556   1HZ   LYS  68          HZ1       LYS  68  -9.535   7.076  -7.538
  557   2HZ   LYS  68          HZ2       LYS  68 -10.422   5.838  -6.787
  558   3HZ   LYS  68          HZ3       LYS  68  -9.298   5.463  -8.005
  559    H    GLU  69           HN       GLU  69  -4.190   7.285  -4.889
  560    HA   GLU  69           HA       GLU  69  -2.887   8.084  -2.469
  561   1HB   GLU  69          HB2       GLU  69  -1.969   8.530  -4.662
  562   2HB   GLU  69          HB1       GLU  69  -3.404   9.445  -5.128
  563   1HG   GLU  69          HG2       GLU  69  -2.343  11.296  -4.401
  564   2HG   GLU  69          HG1       GLU  69  -2.531  10.665  -2.764
  565    H    HIS  70           HN       HIS  70  -5.263  10.009  -4.345
  566    HA   HIS  70           HA       HIS  70  -6.347  11.022  -1.736
  567   1HB   HIS  70          HB2       HIS  70  -5.012  12.358  -3.937
  568   2HB   HIS  70          HB1       HIS  70  -6.638  13.007  -3.722
  569    HD1  HIS  70           HD1      HIS  70  -6.310  15.103  -2.386
  570    HD2  HIS  70           HD2      HIS  70  -4.100  11.923  -0.843
  571    HE1  HIS  70           HE1      HIS  70  -5.264  15.934  -0.235
  572    H    SER  71           HN       SER  71  -8.225   9.679  -1.841
  573    HA   SER  71           HA       SER  71  -9.914   9.840  -4.290
  574   1HB   SER  71          HB2       SER  71  -9.206   7.747  -2.799
  575   2HB   SER  71          HB1       SER  71 -10.595   8.257  -1.837
  576    HG   SER  71           HG       SER  71 -11.564   8.373  -4.145
  577    H    SER  72           HN       SER  72 -11.979  10.781  -4.238
  578    HA   SER  72           HA       SER  72 -12.715  12.212  -1.702
  579   1HB   SER  72          HB2       SER  72 -13.685  13.194  -4.328
  580   2HB   SER  72          HB1       SER  72 -13.047  14.099  -2.957
  581    HG   SER  72           HG       SER  72 -11.789  13.202  -5.181
  582    H    LEU  73           HN       LEU  73 -13.712   9.691  -1.856
  583    HA   LEU  73           HA       LEU  73 -16.179   9.439  -3.349
  584   1HB   LEU  73          HB2       LEU  73 -14.887   8.030  -1.010
  585   2HB   LEU  73          HB1       LEU  73 -16.454   7.521  -1.648
  586    HG   LEU  73           HG       LEU  73 -14.144   7.912  -3.531
  587   1HD1  LEU  73          HD11      LEU  73 -13.966   6.195  -1.342
  588   2HD1  LEU  73          HD12      LEU  73 -13.025   6.079  -2.831
  589   3HD1  LEU  73          HD13      LEU  73 -14.515   5.151  -2.654
  590   1HD2  LEU  73          HD21      LEU  73 -15.407   6.551  -4.954
  591   2HD2  LEU  73          HD22      LEU  73 -16.672   7.413  -4.077
  592   3HD2  LEU  73          HD23      LEU  73 -16.248   5.765  -3.617
  593    H    ALA  74           HN       ALA  74 -18.132   8.687  -1.639
  594    HA   ALA  74           HA       ALA  74 -19.249  11.116  -0.662
  595   1HB   ALA  74          HB1       ALA  74 -21.046   9.750  -0.296
  596   2HB   ALA  74          HB2       ALA  74 -20.087   8.573   0.600
  597   3HB   ALA  74          HB3       ALA  74 -20.075   8.562  -1.164
  598    H    PHE  75           HN       PHE  75 -20.147  10.039   1.963
  599    HA   PHE  75           HA       PHE  75 -17.782  10.906   3.549
  600   1HB   PHE  75          HB2       PHE  75 -20.371  11.671   3.566
  601   2HB   PHE  75          HB1       PHE  75 -20.451  10.376   4.760
  602    HD1  PHE  75           HD1      PHE  75 -18.383  13.371   3.851
  603    HD2  PHE  75           HD2      PHE  75 -19.854  10.819   6.977
  604    HE1  PHE  75           HE1      PHE  75 -17.373  14.869   5.550
  605    HE2  PHE  75           HE2      PHE  75 -18.845  12.316   8.675
  606    HZ   PHE  75           HZ       PHE  75 -17.604  14.342   7.962
  607    H    TRP  76           HN       TRP  76 -16.626   8.833   3.427
  608    HA   TRP  76           HA       TRP  76 -17.956   6.549   4.830
  609   1HB   TRP  76          HB2       TRP  76 -16.153   6.900   2.591
  610   2HB   TRP  76          HB1       TRP  76 -15.455   5.800   3.782
  611    HD1  TRP  76           HD1      TRP  76 -16.956   3.665   4.490
  612    HE1  TRP  76           HE1      TRP  76 -18.715   2.338   3.146
  613    HE3  TRP  76           HE3      TRP  76 -17.964   7.041   0.811
  614    HZ2  TRP  76           HZ2      TRP  76 -20.340   2.677   0.812
  615    HZ3  TRP  76           HZ3      TRP  76 -19.622   6.523  -0.959
  616    HH2  TRP  76           HH2      TRP  76 -20.811   4.348  -0.962
  617    H    LYS  77           HN       LYS  77 -16.258   5.235   6.186
  618    HA   LYS  77           HA       LYS  77 -14.417   7.106   7.633
  619   1HB   LYS  77          HB2       LYS  77 -16.883   5.888   8.498
  620   2HB   LYS  77          HB1       LYS  77 -15.549   5.274   9.477
  621   1HG   LYS  77          HG2       LYS  77 -14.810   7.615   9.891
  622   2HG   LYS  77          HG1       LYS  77 -16.208   8.193   8.984
  623   1HD   LYS  77          HD2       LYS  77 -16.620   6.280  11.261
  624   2HD   LYS  77          HD1       LYS  77 -16.356   7.990  11.602
  625   1HE   LYS  77          HE2       LYS  77 -18.283   7.577   9.431
  626   2HE   LYS  77          HE1       LYS  77 -18.810   6.863  10.969
  627   1HZ   LYS  77          HZ1       LYS  77 -18.690   8.864  12.054
  628   2HZ   LYS  77          HZ2       LYS  77 -19.175   9.396  10.515
  629   3HZ   LYS  77          HZ3       LYS  77 -17.546   9.514  10.984
  630    H    THR  78           HN       THR  78 -14.200   4.682   5.673
  631    HA   THR  78           HA       THR  78 -12.000   3.374   7.164
  632    HB   THR  78           HB       THR  78 -13.384   1.216   6.074
  633    HG1  THR  78           HG1      THR  78 -15.201   2.942   7.392
  634   1HG2  THR  78          HG21      THR  78 -14.009   1.942   8.879
  635   2HG2  THR  78          HG22      THR  78 -12.297   1.888   8.461
  636   3HG2  THR  78          HG23      THR  78 -13.306   0.461   8.227
  637    H    ASP  79           HN       ASP  79 -10.546   4.114   5.553
  638    HA   ASP  79           HA       ASP  79 -11.084   3.821   2.709
  639   1HB   ASP  79          HB2       ASP  79  -9.214   5.065   4.456
  640   2HB   ASP  79          HB1       ASP  79  -8.290   4.029   3.368
  641    H    ALA  80           HN       ALA  80  -9.687   2.416   1.299
  642    HA   ALA  80           HA       ALA  80  -9.877  -0.299   1.712
  643   1HB   ALA  80          HB1       ALA  80  -7.850   1.437   0.312
  644   2HB   ALA  80          HB2       ALA  80  -9.152   0.477  -0.390
  645   3HB   ALA  80          HB3       ALA  80  -7.714  -0.320   0.246
  646    H    SER  81           HN       SER  81  -7.049   1.693   2.653
  647    HA   SER  81           HA       SER  81  -5.576  -0.459   3.863
  648   1HB   SER  81          HB2       SER  81  -4.749   1.877   5.077
  649   2HB   SER  81          HB1       SER  81  -4.171   1.289   3.521
  650    HG   SER  81           HG       SER  81  -5.151   3.520   3.723
  651    H    ASP  82           HN       ASP  82  -8.421   1.099   4.904
  652    HA   ASP  82           HA       ASP  82  -7.914   0.182   7.717
  653   1HB   ASP  82          HB2       ASP  82  -9.538   2.574   6.814
  654   2HB   ASP  82          HB1       ASP  82  -9.093   2.161   8.470
  655    H    VAL  83           HN       VAL  83  -9.280  -1.185   5.418
  656    HA   VAL  83           HA       VAL  83 -12.086  -1.267   6.469
  657    HB   VAL  83           HB       VAL  83 -10.906  -2.140   3.816
  658   1HG1  VAL  83          HG11      VAL  83 -13.745  -1.957   4.853
  659   2HG1  VAL  83          HG12      VAL  83 -12.906  -3.399   4.281
  660   3HG1  VAL  83          HG13      VAL  83 -13.348  -2.126   3.144
  661   1HG2  VAL  83          HG21      VAL  83 -12.753   0.023   3.588
  662   2HG2  VAL  83          HG22      VAL  83 -11.032   0.024   3.209
  663   3HG2  VAL  83          HG23      VAL  83 -11.577   0.454   4.830
  664    H    LYS  84           HN       LYS  84 -13.074  -3.473   6.521
  665    HA   LYS  84           HA       LYS  84 -11.179  -5.444   7.611
  666   1HB   LYS  84          HB2       LYS  84 -13.233  -6.582   8.269
  667   2HB   LYS  84          HB1       LYS  84 -13.418  -4.859   8.596
  668   1HG   LYS  84          HG2       LYS  84 -14.555  -4.623   6.368
  669   2HG   LYS  84          HG1       LYS  84 -14.496  -6.378   6.206
  670   1HD   LYS  84          HD2       LYS  84 -15.858  -6.670   8.188
  671   2HD   LYS  84          HD1       LYS  84 -15.797  -4.942   8.537
  672   1HE   LYS  84          HE2       LYS  84 -16.837  -4.678   6.140
  673   2HE   LYS  84          HE1       LYS  84 -17.315  -6.373   6.366
  674   1HZ   LYS  84          HZ1       LYS  84 -18.493  -5.869   8.293
  675   2HZ   LYS  84          HZ2       LYS  84 -18.881  -4.576   7.260
  676   3HZ   LYS  84          HZ3       LYS  84 -17.733  -4.366   8.494
  677    HA   PRO  85           HA       PRO  85 -10.699  -7.515   3.688
  678   1HB   PRO  85          HB2       PRO  85 -10.060  -9.970   5.049
  679   2HB   PRO  85          HB1       PRO  85  -8.950  -8.833   4.274
  680   1HG   PRO  85          HG2       PRO  85  -9.323  -9.293   7.085
  681   2HG   PRO  85          HG1       PRO  85  -8.210  -8.165   6.306
  682   1HD   PRO  85          HD2       PRO  85 -10.608  -7.541   7.776
  683   2HD   PRO  85          HD1       PRO  85  -9.501  -6.407   6.964
  684    H    CYS  86           HN       CYS  86 -12.232  -8.601   2.455
  685    HA   CYS  86           HA       CYS  86 -14.798  -9.242   3.250
  686   1HB   CYS  86          HB2       CYS  86 -13.362  -9.407   0.966
  687   2HB   CYS  86          HB1       CYS  86 -13.484 -11.122   1.351
  Start of MODEL   12
    1   1H    THR   1          HT1       THR   1  23.147  -3.881 -10.382
    2   2H    THR   1          HT2       THR   1  24.834  -3.913 -10.187
    3   3H    THR   1          HT3       THR   1  23.961  -2.499  -9.830
    4    HA   THR   1           HA       THR   1  24.133  -5.010  -8.285
    5    HB   THR   1           HB       THR   1  24.389  -3.183  -6.512
    6    HG1  THR   1           HG1      THR   1  23.909  -1.272  -7.188
    7   1HG2  THR   1          HG21      THR   1  26.695  -2.770  -7.083
    8   2HG2  THR   1          HG22      THR   1  26.373  -3.051  -8.795
    9   3HG2  THR   1          HG23      THR   1  26.290  -4.390  -7.650
   10    H    LYS   2           HN       LYS   2  22.494  -5.387  -6.672
   11    HA   LYS   2           HA       LYS   2  19.792  -4.783  -7.482
   12   1HB   LYS   2          HB2       LYS   2  21.143  -6.005  -5.073
   13   2HB   LYS   2          HB1       LYS   2  19.391  -5.804  -5.126
   14   1HG   LYS   2          HG2       LYS   2  19.811  -6.916  -7.565
   15   2HG   LYS   2          HG1       LYS   2  21.127  -7.659  -6.656
   16   1HD   LYS   2          HD2       LYS   2  18.927  -7.803  -4.935
   17   2HD   LYS   2          HD1       LYS   2  18.271  -8.198  -6.524
   18   1HE   LYS   2          HE2       LYS   2  20.148  -9.855  -6.819
   19   2HE   LYS   2          HE1       LYS   2  20.609  -9.549  -5.133
   20   1HZ   LYS   2          HZ1       LYS   2  18.229 -10.002  -4.555
   21   2HZ   LYS   2          HZ2       LYS   2  19.099 -11.357  -5.099
   22   3HZ   LYS   2          HZ3       LYS   2  18.010 -10.569  -6.139
   23    H    ALA   3           HN       ALA   3  19.283  -2.578  -7.426
   24    HA   ALA   3           HA       ALA   3  20.024  -0.937  -5.082
   25   1HB   ALA   3          HB1       ALA   3  19.938  -0.380  -7.666
   26   2HB   ALA   3          HB2       ALA   3  19.477   0.847  -6.486
   27   3HB   ALA   3          HB3       ALA   3  18.234  -0.073  -7.333
   28    H    SER   4           HN       SER   4  18.529  -0.167  -3.562
   29    HA   SER   4           HA       SER   4  16.202  -1.703  -2.969
   30   1HB   SER   4          HB2       SER   4  17.013   1.116  -2.189
   31   2HB   SER   4          HB1       SER   4  15.800   0.148  -1.354
   32    HG   SER   4           HG       SER   4  18.550  -0.484  -1.707
   33    H    CYS   5           HN       CYS   5  14.315   0.460  -2.444
   34    HA   CYS   5           HA       CYS   5  13.469   1.129  -5.246
   35   1HB   CYS   5          HB2       CYS   5  12.067  -0.088  -2.895
   36   2HB   CYS   5          HB1       CYS   5  11.126   0.934  -3.986
   37    H    LYS   6           HN       LYS   6  11.325   2.732  -4.680
   38    HA   LYS   6           HA       LYS   6  12.348   4.875  -2.858
   39   1HB   LYS   6          HB2       LYS   6  13.058   5.523  -5.045
   40   2HB   LYS   6          HB1       LYS   6  11.536   5.006  -5.771
   41   1HG   LYS   6          HG2       LYS   6  10.401   6.890  -5.076
   42   2HG   LYS   6          HG1       LYS   6  11.407   7.095  -3.642
   43   1HD   LYS   6          HD2       LYS   6  13.318   7.642  -5.297
   44   2HD   LYS   6          HD1       LYS   6  12.040   7.845  -6.496
   45   1HE   LYS   6          HE2       LYS   6  12.498  10.025  -5.502
   46   2HE   LYS   6          HE1       LYS   6  10.925   9.473  -4.891
   47   1HZ   LYS   6          HZ1       LYS   6  12.918  10.211  -3.289
   48   2HZ   LYS   6          HZ2       LYS   6  13.265   8.554  -3.430
   49   3HZ   LYS   6          HZ3       LYS   6  11.752   9.062  -2.846
   50    H    LEU   7           HN       LEU   7  10.702   4.736  -1.326
   51    HA   LEU   7           HA       LEU   7   8.091   3.957  -1.423
   52   1HB   LEU   7          HB2       LEU   7   7.701   5.761   0.290
   53   2HB   LEU   7          HB1       LEU   7   9.180   4.833   0.564
   54    HG   LEU   7           HG       LEU   7   9.835   6.976  -1.193
   55   1HD1  LEU   7          HD11      LEU   7   9.237   8.912   0.229
   56   2HD1  LEU   7          HD12      LEU   7   8.312   7.844   1.285
   57   3HD1  LEU   7          HD13      LEU   7   7.798   8.097  -0.384
   58   1HD2  LEU   7          HD21      LEU   7  10.414   6.407   1.730
   59   2HD2  LEU   7          HD22      LEU   7  11.236   7.656   0.794
   60   3HD2  LEU   7          HD23      LEU   7  11.408   5.959   0.344
   61    HA   PRO   8           HA       PRO   8   6.823   6.697  -4.863
   62   1HB   PRO   8          HB2       PRO   8   4.487   5.032  -5.075
   63   2HB   PRO   8          HB1       PRO   8   5.872   5.113  -6.173
   64   1HG   PRO   8          HG2       PRO   8   5.185   2.985  -4.392
   65   2HG   PRO   8          HG1       PRO   8   6.605   3.103  -5.437
   66   1HD   PRO   8          HD2       PRO   8   6.475   3.351  -2.547
   67   2HD   PRO   8          HD1       PRO   8   7.916   3.369  -3.593
   68    H    VAL   9           HN       VAL   9   5.487   5.948  -1.806
   69    HA   VAL   9           HA       VAL   9   3.584   8.246  -2.065
   70    HB   VAL   9           HB       VAL   9   2.938   5.709  -0.560
   71   1HG1  VAL   9          HG11      VAL   9   1.107   6.907  -0.045
   72   2HG1  VAL   9          HG12      VAL   9   0.691   6.952  -1.757
   73   3HG1  VAL   9          HG13      VAL   9   1.665   8.243  -1.052
   74   1HG2  VAL   9          HG21      VAL   9   1.620   5.042  -2.601
   75   2HG2  VAL   9          HG22      VAL   9   3.366   4.985  -2.842
   76   3HG2  VAL   9          HG23      VAL   9   2.431   6.334  -3.486
   77    H    LYS  10           HN       LYS  10   2.872   8.990   0.192
   78    HA   LYS  10           HA       LYS  10   5.173   8.731   2.096
   79   1HB   LYS  10          HB2       LYS  10   4.823  11.004   2.610
   80   2HB   LYS  10          HB1       LYS  10   4.467  10.944   0.885
   81   1HG   LYS  10          HG2       LYS  10   2.010  10.398   1.804
   82   2HG   LYS  10          HG1       LYS  10   2.609  11.303   3.195
   83   1HD   LYS  10          HD2       LYS  10   3.026  13.244   1.892
   84   2HD   LYS  10          HD1       LYS  10   2.892  12.351   0.376
   85   1HE   LYS  10          HE2       LYS  10   0.452  11.867   1.064
   86   2HE   LYS  10          HE1       LYS  10   0.673  13.149   2.272
   87   1HZ   LYS  10          HZ1       LYS  10   1.725  14.387   0.248
   88   2HZ   LYS  10          HZ2       LYS  10   0.039  14.381   0.463
   89   3HZ   LYS  10          HZ3       LYS  10   0.759  13.328  -0.659
   90    H    LYS  11           HN       LYS  11   2.126   7.573   1.650
   91    HA   LYS  11           HA       LYS  11   1.754   7.075   4.545
   92   1HB   LYS  11          HB2       LYS  11   0.632   9.292   3.514
   93   2HB   LYS  11          HB1       LYS  11  -0.612   8.128   3.059
   94   1HG   LYS  11          HG2       LYS  11  -0.767   7.371   5.402
   95   2HG   LYS  11          HG1       LYS  11   0.473   8.539   5.861
   96   1HD   LYS  11          HD2       LYS  11  -1.594   9.867   4.351
   97   2HD   LYS  11          HD1       LYS  11  -2.316   8.979   5.694
   98   1HE   LYS  11          HE2       LYS  11  -1.595  10.570   7.133
   99   2HE   LYS  11          HE1       LYS  11   0.080  10.272   6.629
  100   1HZ   LYS  11          HZ1       LYS  11  -1.877  11.930   5.127
  101   2HZ   LYS  11          HZ2       LYS  11  -0.249  11.677   4.715
  102   3HZ   LYS  11          HZ3       LYS  11  -0.647  12.550   6.116
  103    H    ALA  12           HN       ALA  12   2.382   5.333   2.327
  104    HA   ALA  12           HA       ALA  12  -0.141   3.965   1.605
  105   1HB   ALA  12          HB1       ALA  12   1.239   3.852  -0.212
  106   2HB   ALA  12          HB2       ALA  12   1.924   2.461   0.627
  107   3HB   ALA  12          HB3       ALA  12   2.695   4.041   0.766
  108    H    THR  13           HN       THR  13  -0.935   2.306   2.828
  109    HA   THR  13           HA       THR  13   0.853   1.035   4.856
  110    HB   THR  13           HB       THR  13  -2.141   0.753   4.600
  111    HG1  THR  13           HG1      THR  13  -2.362   2.762   5.105
  112   1HG2  THR  13          HG21      THR  13  -1.873  -0.356   6.533
  113   2HG2  THR  13          HG22      THR  13  -1.169   1.088   7.260
  114   3HG2  THR  13          HG23      THR  13  -0.132  -0.086   6.450
  115    H    VAL  14           HN       VAL  14   1.698  -0.922   4.232
  116    HA   VAL  14           HA       VAL  14   0.089  -2.607   2.341
  117    HB   VAL  14           HB       VAL  14   2.248  -3.389   1.515
  118   1HG1  VAL  14          HG11      VAL  14   1.984  -0.395   1.852
  119   2HG1  VAL  14          HG12      VAL  14   1.552  -1.372   0.450
  120   3HG1  VAL  14          HG13      VAL  14   3.248  -1.121   0.860
  121   1HG2  VAL  14          HG21      VAL  14   4.244  -1.938   2.610
  122   2HG2  VAL  14          HG22      VAL  14   3.777  -3.523   3.228
  123   3HG2  VAL  14          HG23      VAL  14   3.181  -2.061   4.013
  124    H    VAL  15           HN       VAL  15   0.769  -5.023   2.585
  125    HA   VAL  15           HA       VAL  15   0.824  -5.686   5.508
  126    HB   VAL  15           HB       VAL  15  -0.360  -7.012   3.056
  127   1HG1  VAL  15          HG11      VAL  15   0.446  -8.845   4.327
  128   2HG1  VAL  15          HG12      VAL  15  -1.238  -8.674   4.820
  129   3HG1  VAL  15          HG13      VAL  15   0.051  -8.062   5.858
  130   1HG2  VAL  15          HG21      VAL  15  -2.056  -5.641   3.710
  131   2HG2  VAL  15          HG22      VAL  15  -1.336  -5.361   5.296
  132   3HG2  VAL  15          HG23      VAL  15  -2.292  -6.815   5.005
  133    H    TYR  16           HN       TYR  16   3.136  -5.844   5.700
  134    HA   TYR  16           HA       TYR  16   4.662  -7.521   3.832
  135   1HB   TYR  16          HB2       TYR  16   5.295  -5.374   5.236
  136   2HB   TYR  16          HB1       TYR  16   5.637  -6.553   6.503
  137    HD1  TYR  16           HD1      TYR  16   6.886  -8.775   5.443
  138    HD2  TYR  16           HD2      TYR  16   7.148  -4.746   3.978
  139    HE1  TYR  16           HE1      TYR  16   9.053  -9.308   4.362
  140    HE2  TYR  16           HE2      TYR  16   9.316  -5.280   2.898
  141    HH   TYR  16           HH       TYR  16  10.735  -6.920   2.343
  142    H    GLN  17           HN       GLN  17   4.257  -9.712   4.014
  143    HA   GLN  17           HA       GLN  17   4.138 -11.851   4.997
  144   1HB   GLN  17          HB2       GLN  17   5.687 -10.323   7.110
  145   2HB   GLN  17          HB1       GLN  17   5.610 -12.082   6.984
  146   1HG   GLN  17          HG2       GLN  17   6.488 -10.421   4.631
  147   2HG   GLN  17          HG1       GLN  17   7.635 -10.855   5.899
  148   1HE2  GLN  17          HE21      GLN  17   8.398 -11.998   3.639
  149   2HE2  GLN  17          HE22      GLN  17   7.917 -13.620   3.508
  150    H    GLY  18           HN       GLY  18   2.045  -9.748   5.644
  151   1HA   GLY  18          HA2       GLY  18  -0.019 -10.172   6.821
  152   2HA   GLY  18          HA1       GLY  18   0.863 -11.216   7.935
  153    H    GLU  19           HN       GLU  19   2.537  -8.322   7.348
  154    HA   GLU  19           HA       GLU  19   1.610  -7.262   9.991
  155   1HB   GLU  19          HB2       GLU  19   4.171  -7.256   8.423
  156   2HB   GLU  19          HB1       GLU  19   3.891  -5.979   9.605
  157   1HG   GLU  19          HG2       GLU  19   3.125  -8.356  10.895
  158   2HG   GLU  19          HG1       GLU  19   4.627  -8.745  10.056
  159    H    ARG  20           HN       ARG  20   0.448  -5.381   9.957
  160    HA   ARG  20           HA       ARG  20   0.193  -3.884   7.414
  161   1HB   ARG  20          HB2       ARG  20  -1.180  -3.787  10.113
  162   2HB   ARG  20          HB1       ARG  20  -1.615  -2.738   8.759
  163   1HG   ARG  20          HG2       ARG  20  -1.795  -4.984   7.420
  164   2HG   ARG  20          HG1       ARG  20  -1.929  -5.718   9.018
  165   1HD   ARG  20          HD2       ARG  20  -3.697  -3.464   7.997
  166   2HD   ARG  20          HD1       ARG  20  -4.175  -5.170   8.106
  167    HE   ARG  20           HE       ARG  20  -3.302  -3.602  10.506
  168   1HH1  ARG  20          HH11      ARG  20  -6.242  -4.116   9.447
  169   2HH1  ARG  20          HH12      ARG  20  -6.741  -5.309  10.599
  170   1HH2  ARG  20          HH21      ARG  20  -3.530  -5.912  11.763
  171   2HH2  ARG  20          HH22      ARG  20  -5.206  -6.326  11.910
  172    H    VAL  21           HN       VAL  21   1.604  -2.214   7.068
  173    HA   VAL  21           HA       VAL  21   2.157  -0.307   9.269
  174    HB   VAL  21           HB       VAL  21   4.626  -0.572   8.841
  175   1HG1  VAL  21          HG11      VAL  21   3.206  -1.823  10.635
  176   2HG1  VAL  21          HG12      VAL  21   4.844  -2.392  10.313
  177   3HG1  VAL  21          HG13      VAL  21   3.462  -3.240   9.617
  178   1HG2  VAL  21          HG21      VAL  21   4.961  -3.042   7.797
  179   2HG2  VAL  21          HG22      VAL  21   4.987  -1.581   6.809
  180   3HG2  VAL  21          HG23      VAL  21   3.517  -2.550   6.913
  181    H    LYS  22           HN       LYS  22   3.417   1.612   8.373
  182    HA   LYS  22           HA       LYS  22   2.448   2.218   5.630
  183   1HB   LYS  22          HB2       LYS  22   2.348   3.589   7.948
  184   2HB   LYS  22          HB1       LYS  22   3.887   4.195   7.336
  185   1HG   LYS  22          HG2       LYS  22   2.183   5.674   6.505
  186   2HG   LYS  22          HG1       LYS  22   2.704   4.679   5.144
  187   1HD   LYS  22          HD2       LYS  22   0.384   4.522   4.963
  188   2HD   LYS  22          HD1       LYS  22   0.757   3.092   5.927
  189   1HE   LYS  22          HE2       LYS  22  -0.181   3.973   7.840
  190   2HE   LYS  22          HE1       LYS  22   0.282   5.635   7.423
  191   1HZ   LYS  22          HZ1       LYS  22  -2.192   4.574   7.068
  192   2HZ   LYS  22          HZ2       LYS  22  -1.508   4.429   5.520
  193   3HZ   LYS  22          HZ3       LYS  22  -1.594   5.948   6.274
  194    H    ILE  23           HN       ILE  23   3.849   2.289   3.917
  195    HA   ILE  23           HA       ILE  23   6.600   1.470   4.166
  196    HB   ILE  23           HB       ILE  23   5.106   1.103   2.213
  197   1HG1  ILE  23          HG12      ILE  23   7.607   2.745   1.705
  198   2HG1  ILE  23          HG11      ILE  23   7.500   0.987   1.819
  199   1HG2  ILE  23          HG21      ILE  23   4.054   3.414   2.425
  200   2HG2  ILE  23          HG22      ILE  23   4.459   2.915   0.782
  201   3HG2  ILE  23          HG23      ILE  23   5.500   4.050   1.641
  202   1HD1  ILE  23          HD11      ILE  23   6.004   2.610  -0.254
  203   2HD1  ILE  23          HD12      ILE  23   6.194   0.858  -0.199
  204   3HD1  ILE  23          HD13      ILE  23   7.584   1.886  -0.547
  205    H    GLN  24           HN       GLN  24   5.009   4.615   4.019
  206    HA   GLN  24           HA       GLN  24   7.222   6.251   3.315
  207   1HB   GLN  24          HB2       GLN  24   5.871   8.017   4.394
  208   2HB   GLN  24          HB1       GLN  24   4.852   6.943   3.431
  209   1HG   GLN  24          HG2       GLN  24   3.704   6.255   5.247
  210   2HG   GLN  24          HG1       GLN  24   5.185   5.975   6.163
  211   1HE2  GLN  24          HE21      GLN  24   2.870   7.198   7.360
  212   2HE2  GLN  24          HE22      GLN  24   3.262   8.806   7.740
  213    H    GLU  25           HN       GLU  25   6.570   4.499   6.242
  214    HA   GLU  25           HA       GLU  25   8.695   6.048   7.681
  215   1HB   GLU  25          HB2       GLU  25   6.296   4.420   8.514
  216   2HB   GLU  25          HB1       GLU  25   7.573   4.808   9.667
  217   1HG   GLU  25          HG2       GLU  25   6.776   7.148   8.126
  218   2HG   GLU  25          HG1       GLU  25   5.408   6.441   8.984
  219    H    LYS  26           HN       LYS  26   7.431   2.692   7.806
  220    HA   LYS  26           HA       LYS  26   9.715   1.404   8.754
  221   1HB   LYS  26          HB2       LYS  26   7.458   0.426   8.347
  222   2HB   LYS  26          HB1       LYS  26   7.796   0.439   6.613
  223   1HG   LYS  26          HG2       LYS  26   9.175  -1.365   6.741
  224   2HG   LYS  26          HG1       LYS  26   9.888  -0.830   8.264
  225   1HD   LYS  26          HD2       LYS  26   8.063  -1.697   9.535
  226   2HD   LYS  26          HD1       LYS  26   7.079  -1.935   8.091
  227   1HE   LYS  26          HE2       LYS  26   9.621  -3.338   7.856
  228   2HE   LYS  26          HE1       LYS  26   8.716  -3.866   9.290
  229   1HZ   LYS  26          HZ1       LYS  26   7.444  -3.492   6.639
  230   2HZ   LYS  26          HZ2       LYS  26   6.806  -4.281   8.001
  231   3HZ   LYS  26          HZ3       LYS  26   8.087  -4.982   7.133
  232    H    PHE  27           HN       PHE  27   9.020   2.454   5.440
  233    HA   PHE  27           HA       PHE  27  11.762   1.544   4.622
  234   1HB   PHE  27          HB2       PHE  27   9.137   1.929   3.164
  235   2HB   PHE  27          HB1       PHE  27  10.666   1.704   2.307
  236    HD1  PHE  27           HD1      PHE  27  12.160  -0.276   3.558
  237    HD2  PHE  27           HD2      PHE  27   7.877  -0.018   3.348
  238    HE1  PHE  27           HE1      PHE  27  11.995  -2.726   3.904
  239    HE2  PHE  27           HE2      PHE  27   7.713  -2.469   3.692
  240    HZ   PHE  27           HZ       PHE  27   9.772  -3.822   3.971
  241    H    LYS  28           HN       LYS  28  11.255   4.054   6.027
  242    HA   LYS  28           HA       LYS  28  10.877   6.386   4.613
  243   1HB   LYS  28          HB2       LYS  28  12.226   5.507   6.961
  244   2HB   LYS  28          HB1       LYS  28  13.311   6.620   6.127
  245   1HG   LYS  28          HG2       LYS  28  12.059   8.383   6.749
  246   2HG   LYS  28          HG1       LYS  28  10.616   7.649   6.046
  247   1HD   LYS  28          HD2       LYS  28   9.882   7.541   8.195
  248   2HD   LYS  28          HD1       LYS  28  10.947   6.140   8.311
  249   1HE   LYS  28          HE2       LYS  28  11.479   7.622  10.163
  250   2HE   LYS  28          HE1       LYS  28  12.808   7.744   8.991
  251   1HZ   LYS  28          HZ1       LYS  28  10.454   9.496   8.736
  252   2HZ   LYS  28          HZ2       LYS  28  12.041   9.746   8.183
  253   3HZ   LYS  28          HZ3       LYS  28  11.680   9.901   9.835
  254    H    ASN  29           HN       ASN  29  13.713   4.255   4.407
  255    HA   ASN  29           HA       ASN  29  14.922   6.051   2.353
  256   1HB   ASN  29          HB2       ASN  29  15.854   3.824   4.152
  257   2HB   ASN  29          HB1       ASN  29  16.811   4.268   2.735
  258   1HD2  ASN  29          HD21      ASN  29  15.143   5.924   5.486
  259   2HD2  ASN  29          HD22      ASN  29  16.367   7.078   5.718
  260    H    GLY  30           HN       GLY  30  12.653   4.803   1.392
  261   1HA   GLY  30          HA2       GLY  30  11.962   3.520  -0.450
  262   2HA   GLY  30          HA1       GLY  30  13.667   3.286  -0.835
  263    H    MET  31           HN       MET  31  12.039   1.137  -1.220
  264    HA   MET  31           HA       MET  31  12.249  -0.579   1.210
  265   1HB   MET  31          HB2       MET  31  10.983  -1.117  -1.499
  266   2HB   MET  31          HB1       MET  31  10.694  -2.000   0.001
  267   1HG   MET  31          HG2       MET  31   9.684  -0.029   1.018
  268   2HG   MET  31          HG1       MET  31  10.072   0.940  -0.404
  269   1HE   MET  31          HE1       MET  31   9.148  -2.760  -1.220
  270   2HE   MET  31          HE2       MET  31   7.481  -2.829  -0.656
  271   3HE   MET  31          HE3       MET  31   8.777  -2.498   0.490
  272    H    LEU  32           HN       LEU  32  13.312  -2.685   1.018
  273    HA   LEU  32           HA       LEU  32  15.773  -2.639  -0.500
  274   1HB   LEU  32          HB2       LEU  32  14.277  -4.608   1.222
  275   2HB   LEU  32          HB1       LEU  32  15.758  -5.092   0.390
  276    HG   LEU  32           HG       LEU  32  15.711  -2.552   1.999
  277   1HD1  LEU  32          HD11      LEU  32  15.783  -3.607   4.012
  278   2HD1  LEU  32          HD12      LEU  32  16.728  -4.953   3.376
  279   3HD1  LEU  32          HD13      LEU  32  14.978  -4.928   3.164
  280   1HD2  LEU  32          HD21      LEU  32  17.635  -3.096   0.525
  281   2HD2  LEU  32          HD22      LEU  32  17.854  -4.616   1.392
  282   3HD2  LEU  32          HD23      LEU  32  18.103  -3.082   2.225
  283    H    HIS  33           HN       HIS  33  16.373  -4.262  -2.148
  284    HA   HIS  33           HA       HIS  33  14.455  -4.503  -4.269
  285   1HB   HIS  33          HB2       HIS  33  16.880  -4.376  -4.581
  286   2HB   HIS  33          HB1       HIS  33  17.086  -5.899  -3.712
  287    HD1  HIS  33           HD1      HIS  33  16.475  -4.541  -7.052
  288    HD2  HIS  33           HD2      HIS  33  15.791  -8.172  -5.123
  289    HE1  HIS  33           HE1      HIS  33  16.025  -6.245  -8.871
  290    H    GLY  34           HN       GLY  34  13.261  -6.309  -4.974
  291   1HA   GLY  34          HA2       GLY  34  12.263  -8.438  -4.880
  292   2HA   GLY  34          HA1       GLY  34  13.544  -8.933  -3.775
  293    H    ASP  35           HN       ASP  35  12.093  -6.108  -2.639
  294    HA   ASP  35           HA       ASP  35  10.950  -7.432  -0.339
  295   1HB   ASP  35          HB2       ASP  35  11.363  -4.732  -1.417
  296   2HB   ASP  35          HB1       ASP  35   9.889  -4.873  -0.460
  297    H    LYS  36           HN       LYS  36   8.852  -8.153  -0.031
  298    HA   LYS  36           HA       LYS  36   6.905  -7.658  -2.259
  299   1HB   LYS  36          HB2       LYS  36   7.523  -9.950  -0.420
  300   2HB   LYS  36          HB1       LYS  36   5.908  -9.812  -1.117
  301   1HG   LYS  36          HG2       LYS  36   7.548  -9.332  -3.290
  302   2HG   LYS  36          HG1       LYS  36   8.430 -10.575  -2.403
  303   1HD   LYS  36          HD2       LYS  36   6.286 -11.897  -2.281
  304   2HD   LYS  36          HD1       LYS  36   5.562 -10.710  -3.368
  305   1HE   LYS  36          HE2       LYS  36   8.108 -11.565  -4.438
  306   2HE   LYS  36          HE1       LYS  36   7.078 -12.975  -4.116
  307   1HZ   LYS  36          HZ1       LYS  36   5.252 -11.856  -5.232
  308   2HZ   LYS  36          HZ2       LYS  36   6.578 -12.006  -6.283
  309   3HZ   LYS  36          HZ3       LYS  36   6.234 -10.511  -5.551
  310    H    VAL  37           HN       VAL  37   5.248  -6.340  -1.713
  311    HA   VAL  37           HA       VAL  37   4.166  -6.433   1.070
  312    HB   VAL  37           HB       VAL  37   4.318  -4.044   1.246
  313   1HG1  VAL  37          HG11      VAL  37   6.501  -5.550   1.264
  314   2HG1  VAL  37          HG12      VAL  37   6.624  -3.794   1.371
  315   3HG1  VAL  37          HG13      VAL  37   6.899  -4.605  -0.170
  316   1HG2  VAL  37          HG21      VAL  37   5.249  -4.032  -1.644
  317   2HG2  VAL  37          HG22      VAL  37   5.001  -2.619  -0.619
  318   3HG2  VAL  37          HG23      VAL  37   3.623  -3.599  -1.116
  319    H    SER  38           HN       SER  38   1.914  -6.338   1.075
  320    HA   SER  38           HA       SER  38   0.583  -6.086  -1.582
  321   1HB   SER  38          HB2       SER  38  -0.888  -6.888   0.875
  322   2HB   SER  38          HB1       SER  38  -0.914  -7.609  -0.735
  323    HG   SER  38           HG       SER  38   0.629  -8.912  -0.146
  324    H    PHE  39           HN       PHE  39  -1.069  -4.555  -1.924
  325    HA   PHE  39           HA       PHE  39  -1.220  -2.345   0.073
  326   1HB   PHE  39          HB2       PHE  39  -1.834  -2.675  -2.868
  327   2HB   PHE  39          HB1       PHE  39  -2.334  -1.236  -1.975
  328    HD1  PHE  39           HD1      PHE  39  -0.712   0.375  -1.165
  329    HD2  PHE  39           HD2      PHE  39   0.552  -3.199  -3.183
  330    HE1  PHE  39           HE1      PHE  39   1.571   1.314  -1.395
  331    HE2  PHE  39           HE2      PHE  39   2.836  -2.260  -3.415
  332    HZ   PHE  39           HZ       PHE  39   3.345  -0.004  -2.521
  333    H    PHE  40           HN       PHE  40  -3.242  -1.733   0.971
  334    HA   PHE  40           HA       PHE  40  -5.347  -3.792   0.860
  335   1HB   PHE  40          HB2       PHE  40  -4.630  -1.392   2.489
  336   2HB   PHE  40          HB1       PHE  40  -6.322  -1.903   2.496
  337    HD1  PHE  40           HD1      PHE  40  -3.442  -2.207   4.315
  338    HD2  PHE  40           HD2      PHE  40  -6.413  -4.706   2.477
  339    HE1  PHE  40           HE1      PHE  40  -2.881  -4.035   5.893
  340    HE2  PHE  40           HE2      PHE  40  -5.853  -6.534   4.056
  341    HZ   PHE  40           HZ       PHE  40  -4.087  -6.197   5.765
  342    H    CYS  41           HN       CYS  41  -7.223  -3.607  -0.297
  343    HA   CYS  41           HA       CYS  41  -7.952  -0.932  -1.432
  344   1HB   CYS  41          HB2       CYS  41  -6.746  -2.931  -2.841
  345   2HB   CYS  41          HB1       CYS  41  -8.443  -3.360  -3.067
  346    H    LYS  42           HN       LYS  42 -10.314  -1.144  -2.378
  347    HA   LYS  42           HA       LYS  42 -11.934  -2.752  -0.431
  348   1HB   LYS  42          HB2       LYS  42 -13.613  -0.902  -0.826
  349   2HB   LYS  42          HB1       LYS  42 -12.108  -0.375  -0.068
  350   1HG   LYS  42          HG2       LYS  42 -12.003  -0.342  -3.001
  351   2HG   LYS  42          HG1       LYS  42 -13.219   0.748  -2.332
  352   1HD   LYS  42          HD2       LYS  42 -10.283   0.664  -1.573
  353   2HD   LYS  42          HD1       LYS  42 -11.077   1.919  -2.524
  354   1HE   LYS  42          HE2       LYS  42 -12.686   1.950  -0.348
  355   2HE   LYS  42          HE1       LYS  42 -11.165   1.444   0.412
  356   1HZ   LYS  42          HZ1       LYS  42 -11.704   3.980  -0.131
  357   2HZ   LYS  42          HZ2       LYS  42 -10.988   3.537  -1.607
  358   3HZ   LYS  42          HZ3       LYS  42 -10.126   3.357  -0.153
  359    H    ASN  43           HN       ASN  43 -13.660  -3.936  -1.226
  360    HA   ASN  43           HA       ASN  43 -13.841  -4.194  -4.206
  361   1HB   ASN  43          HB2       ASN  43 -13.157  -6.110  -2.606
  362   2HB   ASN  43          HB1       ASN  43 -14.851  -6.123  -2.108
  363   1HD2  ASN  43          HD21      ASN  43 -12.647  -6.895  -4.748
  364   2HD2  ASN  43          HD22      ASN  43 -13.803  -7.647  -5.738
  365    H    LYS  44           HN       LYS  44 -15.619  -3.147  -5.025
  366    HA   LYS  44           HA       LYS  44 -17.877  -2.368  -3.356
  367   1HB   LYS  44          HB2       LYS  44 -16.854  -1.182  -5.381
  368   2HB   LYS  44          HB1       LYS  44 -17.663  -2.392  -6.377
  369   1HG   LYS  44          HG2       LYS  44 -19.779  -1.699  -4.955
  370   2HG   LYS  44          HG1       LYS  44 -18.860  -0.215  -4.697
  371   1HD   LYS  44          HD2       LYS  44 -18.525  -0.584  -7.387
  372   2HD   LYS  44          HD1       LYS  44 -20.151  -1.227  -7.154
  373   1HE   LYS  44          HE2       LYS  44 -20.590   1.058  -7.493
  374   2HE   LYS  44          HE1       LYS  44 -20.480   0.987  -5.722
  375   1HZ   LYS  44          HZ1       LYS  44 -18.944   2.607  -6.160
  376   2HZ   LYS  44          HZ2       LYS  44 -18.509   1.960  -7.669
  377   3HZ   LYS  44          HZ3       LYS  44 -17.943   1.241  -6.238
  378    H    GLU  45           HN       GLU  45 -17.120  -5.089  -5.418
  379    HA   GLU  45           HA       GLU  45 -19.839  -5.963  -5.905
  380   1HB   GLU  45          HB2       GLU  45 -17.200  -7.465  -5.876
  381   2HB   GLU  45          HB1       GLU  45 -18.683  -8.005  -6.664
  382   1HG   GLU  45          HG2       GLU  45 -17.851  -5.282  -7.416
  383   2HG   GLU  45          HG1       GLU  45 -16.712  -6.540  -7.897
  384    H    LYS  46           HN       LYS  46 -17.372  -6.786  -3.461
  385    HA   LYS  46           HA       LYS  46 -19.428  -8.425  -2.028
  386   1HB   LYS  46          HB2       LYS  46 -16.402  -8.339  -1.840
  387   2HB   LYS  46          HB1       LYS  46 -17.452  -9.470  -0.982
  388   1HG   LYS  46          HG2       LYS  46 -17.979 -10.657  -2.898
  389   2HG   LYS  46          HG1       LYS  46 -17.715  -9.271  -3.955
  390   1HD   LYS  46          HD2       LYS  46 -15.220  -9.492  -3.179
  391   2HD   LYS  46          HD1       LYS  46 -15.692 -11.136  -2.747
  392   1HE   LYS  46          HE2       LYS  46 -16.577 -10.236  -5.436
  393   2HE   LYS  46          HE1       LYS  46 -14.828 -10.471  -5.235
  394   1HZ   LYS  46          HZ1       LYS  46 -16.114 -12.533  -5.813
  395   2HZ   LYS  46          HZ2       LYS  46 -16.846 -12.426  -4.284
  396   3HZ   LYS  46          HZ3       LYS  46 -15.166 -12.646  -4.411
  397    H    LYS  47           HN       LYS  47 -17.979  -5.399  -1.982
  398    HA   LYS  47           HA       LYS  47 -18.024  -3.672  -0.379
  399   1HB   LYS  47          HB2       LYS  47 -19.608  -5.638   1.281
  400   2HB   LYS  47          HB1       LYS  47 -19.714  -3.876   1.297
  401   1HG   LYS  47          HG2       LYS  47 -20.196  -4.502  -1.359
  402   2HG   LYS  47          HG1       LYS  47 -21.015  -5.800  -0.491
  403   1HD   LYS  47          HD2       LYS  47 -21.767  -3.675   1.019
  404   2HD   LYS  47          HD1       LYS  47 -21.620  -2.898  -0.557
  405   1HE   LYS  47          HE2       LYS  47 -23.687  -3.718  -1.023
  406   2HE   LYS  47          HE1       LYS  47 -22.943  -5.330  -1.074
  407   1HZ   LYS  47          HZ1       LYS  47 -23.080  -5.176   1.472
  408   2HZ   LYS  47          HZ2       LYS  47 -24.500  -5.538   0.614
  409   3HZ   LYS  47          HZ3       LYS  47 -24.237  -3.967   1.202
  410    H    CYS  48           HN       CYS  48 -15.905  -5.826  -0.296
  411    HA   CYS  48           HA       CYS  48 -15.105  -5.419   2.572
  412   1HB   CYS  48          HB2       CYS  48 -14.107  -7.783   1.059
  413   2HB   CYS  48          HB1       CYS  48 -14.485  -7.633   2.771
  414    H    SER  49           HN       SER  49 -12.583  -5.951   2.667
  415    HA   SER  49           HA       SER  49 -11.314  -4.530   0.355
  416   1HB   SER  49          HB2       SER  49  -9.547  -4.235   2.342
  417   2HB   SER  49          HB1       SER  49 -10.938  -3.166   2.185
  418    HG   SER  49           HG       SER  49 -10.332  -4.927   4.136
  419    H    TYR  50           HN       TYR  50  -8.959  -5.198   0.094
  420    HA   TYR  50           HA       TYR  50  -8.287  -7.937   0.976
  421   1HB   TYR  50          HB2       TYR  50  -7.918  -8.485  -1.550
  422   2HB   TYR  50          HB1       TYR  50  -9.564  -8.534  -0.915
  423    HD1  TYR  50           HD1      TYR  50  -7.253  -6.863  -3.172
  424    HD2  TYR  50           HD2      TYR  50 -11.116  -6.603  -1.312
  425    HE1  TYR  50           HE1      TYR  50  -7.935  -5.152  -4.831
  426    HE2  TYR  50           HE2      TYR  50 -11.796  -4.891  -2.971
  427    HH   TYR  50           HH       TYR  50 -11.227  -4.072  -5.106
  428    H    THR  51           HN       THR  51  -6.111  -8.428  -0.641
  429    HA   THR  51           HA       THR  51  -4.438  -5.960  -0.280
  430    HB   THR  51           HB       THR  51  -2.620  -7.728   0.183
  431    HG1  THR  51           HG1      THR  51  -4.837  -9.347   0.801
  432   1HG2  THR  51          HG21      THR  51  -4.910  -6.932   1.909
  433   2HG2  THR  51          HG22      THR  51  -3.185  -6.634   2.119
  434   3HG2  THR  51          HG23      THR  51  -3.862  -8.214   2.518
  435    H    GLU  52           HN       GLU  52  -2.910  -5.523  -1.865
  436    HA   GLU  52           HA       GLU  52  -3.030  -7.204  -4.351
  437   1HB   GLU  52          HB2       GLU  52  -3.105  -4.306  -3.741
  438   2HB   GLU  52          HB1       GLU  52  -2.072  -4.747  -5.101
  439   1HG   GLU  52          HG2       GLU  52  -4.929  -5.708  -4.812
  440   2HG   GLU  52          HG1       GLU  52  -4.484  -4.259  -5.714
  441    H    ASP  53           HN       ASP  53  -1.273  -8.516  -3.351
  442    HA   ASP  53           HA       ASP  53   1.148  -7.809  -2.310
  443   1HB   ASP  53          HB2       ASP  53   0.706  -9.758  -4.585
  444   2HB   ASP  53          HB1       ASP  53   2.027  -9.811  -3.413
  445    H    ALA  54           HN       ALA  54   3.107  -6.999  -3.020
  446    HA   ALA  54           HA       ALA  54   3.386  -6.180  -5.878
  447   1HB   ALA  54          HB1       ALA  54   3.859  -3.919  -5.242
  448   2HB   ALA  54          HB2       ALA  54   3.984  -4.353  -3.537
  449   3HB   ALA  54          HB3       ALA  54   2.412  -4.367  -4.338
  450    H    GLN  55           HN       GLN  55   5.765  -5.451  -6.249
  451    HA   GLN  55           HA       GLN  55   7.629  -6.770  -4.315
  452   1HB   GLN  55          HB2       GLN  55   6.776  -8.141  -6.388
  453   2HB   GLN  55          HB1       GLN  55   7.918  -7.139  -7.284
  454   1HG   GLN  55          HG2       GLN  55   9.388  -7.919  -5.071
  455   2HG   GLN  55          HG1       GLN  55   8.438  -9.359  -5.442
  456   1HE2  GLN  55          HE21      GLN  55   8.266  -8.910  -8.323
  457   2HE2  GLN  55          HE22      GLN  55   9.820  -9.155  -8.961
  458    H    CYS  56           HN       CYS  56   9.736  -5.872  -4.304
  459    HA   CYS  56           HA       CYS  56   9.997  -3.245  -5.699
  460   1HB   CYS  56          HB2       CYS  56  10.248  -3.092  -3.335
  461   2HB   CYS  56          HB1       CYS  56  11.234  -4.551  -3.271
  462    H    ILE  57           HN       ILE  57  11.829  -2.837  -7.016
  463    HA   ILE  57           HA       ILE  57  13.750  -5.084  -7.431
  464    HB   ILE  57           HB       ILE  57  11.856  -3.782  -9.378
  465   1HG1  ILE  57          HG12      ILE  57  12.728  -6.662  -9.277
  466   2HG1  ILE  57          HG11      ILE  57  11.561  -6.053  -8.102
  467   1HG2  ILE  57          HG21      ILE  57  14.108  -3.530 -10.359
  468   2HG2  ILE  57          HG22      ILE  57  13.172  -4.744 -11.232
  469   3HG2  ILE  57          HG23      ILE  57  14.417  -5.245 -10.089
  470   1HD1  ILE  57          HD11      ILE  57  10.259  -5.126 -10.106
  471   2HD1  ILE  57          HD12      ILE  57  10.250  -6.880  -9.908
  472   3HD1  ILE  57          HD13      ILE  57  11.302  -6.133 -11.110
  473    H    ASP  58           HN       ASP  58  15.553  -4.291  -8.960
  474    HA   ASP  58           HA       ASP  58  17.246  -2.443  -8.026
  475   1HB   ASP  58          HB2       ASP  58  17.184  -3.859 -10.221
  476   2HB   ASP  58          HB1       ASP  58  16.613  -2.362 -10.964
  477    H    GLY  59           HN       GLY  59  16.189  -0.665  -6.969
  478   1HA   GLY  59          HA2       GLY  59  15.213   1.466  -6.807
  479   2HA   GLY  59          HA1       GLY  59  16.153   1.787  -8.261
  480    H    THR  60           HN       THR  60  13.710  -0.677  -8.480
  481    HA   THR  60           HA       THR  60  11.820   1.293  -9.703
  482    HB   THR  60           HB       THR  60  12.638  -1.346 -10.934
  483    HG1  THR  60           HG1      THR  60  13.523   1.301 -11.398
  484   1HG2  THR  60          HG21      THR  60  11.440   0.898 -12.474
  485   2HG2  THR  60          HG22      THR  60  10.375   0.038 -11.362
  486   3HG2  THR  60          HG23      THR  60  11.201  -0.841 -12.649
  487    H    ILE  61           HN       ILE  61   9.697   0.839  -9.226
  488    HA   ILE  61           HA       ILE  61   8.943  -1.892  -8.348
  489    HB   ILE  61           HB       ILE  61   9.580  -0.966  -6.271
  490   1HG1  ILE  61          HG12      ILE  61   6.876   0.064  -5.904
  491   2HG1  ILE  61          HG11      ILE  61   6.883  -1.459  -6.796
  492   1HG2  ILE  61          HG21      ILE  61   8.184   1.589  -7.121
  493   2HG2  ILE  61          HG22      ILE  61   9.929   1.339  -7.082
  494   3HG2  ILE  61          HG23      ILE  61   9.004   1.331  -5.580
  495   1HD1  ILE  61          HD11      ILE  61   7.120  -2.498  -4.808
  496   2HD1  ILE  61          HD12      ILE  61   7.441  -0.976  -3.979
  497   3HD1  ILE  61          HD13      ILE  61   8.758  -1.848  -4.763
  498    H    GLU  62           HN       GLU  62   6.826  -2.349  -8.885
  499    HA   GLU  62           HA       GLU  62   5.285  -0.159 -10.214
  500   1HB   GLU  62          HB2       GLU  62   4.061  -2.196 -11.179
  501   2HB   GLU  62          HB1       GLU  62   5.750  -2.020 -11.653
  502   1HG   GLU  62          HG2       GLU  62   6.443  -3.810 -10.367
  503   2HG   GLU  62          HG1       GLU  62   5.152  -3.598  -9.185
  504    H    VAL  63           HN       VAL  63   3.918   0.752  -8.687
  505    HA   VAL  63           HA       VAL  63   2.787  -0.818  -6.495
  506    HB   VAL  63           HB       VAL  63   2.393   2.004  -7.524
  507   1HG1  VAL  63          HG11      VAL  63   1.141   2.486  -5.555
  508   2HG1  VAL  63          HG12      VAL  63   1.547   0.931  -4.828
  509   3HG1  VAL  63          HG13      VAL  63   0.440   1.003  -6.200
  510   1HG2  VAL  63          HG21      VAL  63   3.581   1.881  -4.950
  511   2HG2  VAL  63          HG22      VAL  63   4.344   2.374  -6.462
  512   3HG2  VAL  63          HG23      VAL  63   4.412   0.688  -5.948
  513    HA   PRO  64           HA       PRO  64  -0.853  -2.214  -8.590
  514   1HB   PRO  64          HB2       PRO  64  -2.415  -2.035  -6.179
  515   2HB   PRO  64          HB1       PRO  64  -1.694  -3.478  -6.906
  516   1HG   PRO  64          HG2       PRO  64  -0.884  -2.137  -4.510
  517   2HG   PRO  64          HG1       PRO  64  -0.139  -3.549  -5.263
  518   1HD   PRO  64          HD2       PRO  64   0.880  -0.842  -5.152
  519   2HD   PRO  64          HD1       PRO  64   1.652  -2.277  -5.868
  520    H    LYS  65           HN       LYS  65  -2.303  -1.000  -9.763
  521    HA   LYS  65           HA       LYS  65  -2.746   1.792  -9.271
  522   1HB   LYS  65          HB2       LYS  65  -2.877   0.404 -11.432
  523   2HB   LYS  65          HB1       LYS  65  -4.487  -0.077 -10.895
  524   1HG   LYS  65          HG2       LYS  65  -5.310   2.138 -10.992
  525   2HG   LYS  65          HG1       LYS  65  -3.687   2.829 -11.035
  526   1HD   LYS  65          HD2       LYS  65  -4.711   2.916 -13.269
  527   2HD   LYS  65          HD1       LYS  65  -3.328   1.819 -13.270
  528   1HE   LYS  65          HE2       LYS  65  -4.840   0.398 -14.278
  529   2HE   LYS  65          HE1       LYS  65  -5.325   0.085 -12.599
  530   1HZ   LYS  65          HZ1       LYS  65  -6.741   2.188 -12.894
  531   2HZ   LYS  65          HZ2       LYS  65  -7.299   0.745 -13.598
  532   3HZ   LYS  65          HZ3       LYS  65  -6.546   1.926 -14.559
  533    H    CYS  66           HN       CYS  66  -4.192  -1.015  -7.901
  534    HA   CYS  66           HA       CYS  66  -6.862  -0.129  -7.424
  535   1HB   CYS  66          HB2       CYS  66  -5.563  -2.400  -7.042
  536   2HB   CYS  66          HB1       CYS  66  -5.301  -1.741  -5.427
  537    H    PHE  67           HN       PHE  67  -3.818   0.666  -5.841
  538    HA   PHE  67           HA       PHE  67  -4.525   1.619  -3.347
  539   1HB   PHE  67          HB2       PHE  67  -2.278   1.704  -4.375
  540   2HB   PHE  67          HB1       PHE  67  -2.816   3.000  -5.443
  541    HD1  PHE  67           HD1      PHE  67  -2.346   2.090  -1.855
  542    HD2  PHE  67           HD2      PHE  67  -2.839   5.254  -4.718
  543    HE1  PHE  67           HE1      PHE  67  -1.824   3.761  -0.098
  544    HE2  PHE  67           HE2      PHE  67  -2.317   6.925  -2.961
  545    HZ   PHE  67           HZ       PHE  67  -1.809   6.179  -0.651
  546    H    LYS  68           HN       LYS  68  -5.141   3.822  -2.607
  547    HA   LYS  68           HA       LYS  68  -6.441   5.620  -4.544
  548   1HB   LYS  68          HB2       LYS  68  -7.909   3.524  -3.765
  549   2HB   LYS  68          HB1       LYS  68  -8.199   4.560  -2.366
  550   1HG   LYS  68          HG2       LYS  68  -9.927   5.184  -3.824
  551   2HG   LYS  68          HG1       LYS  68  -8.696   6.406  -4.147
  552   1HD   LYS  68          HD2       LYS  68  -8.920   5.794  -6.319
  553   2HD   LYS  68          HD1       LYS  68  -7.972   4.377  -5.866
  554   1HE   LYS  68          HE2       LYS  68 -10.579   3.727  -5.073
  555   2HE   LYS  68          HE1       LYS  68 -10.773   4.518  -6.651
  556   1HZ   LYS  68          HZ1       LYS  68 -10.265   2.172  -6.937
  557   2HZ   LYS  68          HZ2       LYS  68  -8.844   2.345  -6.020
  558   3HZ   LYS  68          HZ3       LYS  68  -8.990   3.126  -7.521
  559    H    GLU  69           HN       GLU  69  -5.252   7.365  -3.705
  560    HA   GLU  69           HA       GLU  69  -4.661   7.861  -0.966
  561   1HB   GLU  69          HB2       GLU  69  -4.235   9.013  -3.481
  562   2HB   GLU  69          HB1       GLU  69  -5.109  10.252  -2.579
  563   1HG   GLU  69          HG2       GLU  69  -3.481  10.031  -0.722
  564   2HG   GLU  69          HG1       GLU  69  -2.591   8.832  -1.659
  565    H    HIS  70           HN       HIS  70  -5.649  10.427  -0.427
  566    HA   HIS  70           HA       HIS  70  -8.566   9.872  -0.014
  567   1HB   HIS  70          HB2       HIS  70  -6.423  10.448   1.733
  568   2HB   HIS  70          HB1       HIS  70  -7.415  11.907   1.693
  569    HD1  HIS  70           HD1      HIS  70  -7.192   9.589   4.018
  570    HD2  HIS  70           HD2      HIS  70 -10.362  10.294   1.403
  571    HE1  HIS  70           HE1      HIS  70  -9.255   8.605   5.110
  572    H    SER  71           HN       SER  71  -9.917  11.224  -1.121
  573    HA   SER  71           HA       SER  71  -8.891  13.556  -2.555
  574   1HB   SER  71          HB2       SER  71 -11.454  12.038  -2.250
  575   2HB   SER  71          HB1       SER  71 -11.531  13.670  -2.920
  576    HG   SER  71           HG       SER  71 -11.201  11.943  -4.479
  577    H    SER  72           HN       SER  72 -10.462  15.606  -2.363
  578    HA   SER  72           HA       SER  72 -10.194  16.572   0.397
  579   1HB   SER  72          HB2       SER  72 -11.550  18.042  -1.845
  580   2HB   SER  72          HB1       SER  72 -10.471  18.668  -0.600
  581    HG   SER  72           HG       SER  72  -9.140  18.541  -2.273
  582    H    LEU  73           HN       LEU  73 -12.880  16.020  -1.904
  583    HA   LEU  73           HA       LEU  73 -15.074  16.898  -0.447
  584   1HB   LEU  73          HB2       LEU  73 -14.562  14.522  -2.231
  585   2HB   LEU  73          HB1       LEU  73 -16.173  14.811  -1.566
  586    HG   LEU  73           HG       LEU  73 -14.655  17.002  -2.978
  587   1HD1  LEU  73          HD11      LEU  73 -16.725  15.670  -4.558
  588   2HD1  LEU  73          HD12      LEU  73 -15.363  14.607  -4.204
  589   3HD1  LEU  73          HD13      LEU  73 -15.093  16.145  -5.025
  590   1HD2  LEU  73          HD21      LEU  73 -17.510  16.950  -3.338
  591   2HD2  LEU  73          HD22      LEU  73 -16.530  18.164  -2.515
  592   3HD2  LEU  73          HD23      LEU  73 -17.144  16.772  -1.621
  593    H    ALA  74           HN       ALA  74 -16.550  15.765   1.034
  594    HA   ALA  74           HA       ALA  74 -15.096  14.129   3.017
  595   1HB   ALA  74          HB1       ALA  74 -17.351  14.454   4.210
  596   2HB   ALA  74          HB2       ALA  74 -17.804  15.466   2.839
  597   3HB   ALA  74          HB3       ALA  74 -16.436  15.919   3.857
  598    H    PHE  75           HN       PHE  75 -15.668  12.865   0.430
  599    HA   PHE  75           HA       PHE  75 -17.827  10.919   1.113
  600   1HB   PHE  75          HB2       PHE  75 -17.073  12.301  -1.196
  601   2HB   PHE  75          HB1       PHE  75 -16.506  10.656  -1.478
  602    HD1  PHE  75           HD1      PHE  75 -18.037   9.450  -2.758
  603    HD2  PHE  75           HD2      PHE  75 -19.481  12.108   0.293
  604    HE1  PHE  75           HE1      PHE  75 -20.362   8.727  -3.229
  605    HE2  PHE  75           HE2      PHE  75 -21.806  11.385  -0.179
  606    HZ   PHE  75           HZ       PHE  75 -22.246   9.695  -1.940
  607    H    TRP  76           HN       TRP  76 -16.918   8.726  -0.342
  608    HA   TRP  76           HA       TRP  76 -15.502   6.841  -0.150
  609   1HB   TRP  76          HB2       TRP  76 -13.913   9.256  -0.298
  610   2HB   TRP  76          HB1       TRP  76 -13.085   8.030   0.665
  611    HD1  TRP  76           HD1      TRP  76 -12.720   5.612  -0.507
  612    HE1  TRP  76           HE1      TRP  76 -12.395   5.000  -2.992
  613    HE3  TRP  76           HE3      TRP  76 -14.517   9.850  -2.687
  614    HZ2  TRP  76           HZ2      TRP  76 -12.847   6.163  -5.569
  615    HZ3  TRP  76           HZ3      TRP  76 -14.565  10.079  -5.157
  616    HH2  TRP  76           HH2      TRP  76 -13.734   8.240  -6.599
  617    H    LYS  77           HN       LYS  77 -13.809   8.799   2.272
  618    HA   LYS  77           HA       LYS  77 -13.529   8.466   4.595
  619   1HB   LYS  77          HB2       LYS  77 -16.144   8.638   4.101
  620   2HB   LYS  77          HB1       LYS  77 -16.113   6.952   4.621
  621   1HG   LYS  77          HG2       LYS  77 -15.347   7.494   6.770
  622   2HG   LYS  77          HG1       LYS  77 -14.728   9.063   6.257
  623   1HD   LYS  77          HD2       LYS  77 -16.774  10.078   6.417
  624   2HD   LYS  77          HD1       LYS  77 -17.645   8.629   5.909
  625   1HE   LYS  77          HE2       LYS  77 -16.258   8.407   8.524
  626   2HE   LYS  77          HE1       LYS  77 -17.643   9.516   8.479
  627   1HZ   LYS  77          HZ1       LYS  77 -18.156   7.072   8.877
  628   2HZ   LYS  77          HZ2       LYS  77 -17.753   6.830   7.244
  629   3HZ   LYS  77          HZ3       LYS  77 -19.045   7.851   7.662
  630    H    THR  78           HN       THR  78 -12.804   6.809   6.044
  631    HA   THR  78           HA       THR  78 -11.861   4.704   6.561
  632    HB   THR  78           HB       THR  78 -14.048   3.512   4.876
  633    HG1  THR  78           HG1      THR  78 -15.564   4.228   6.231
  634   1HG2  THR  78          HG21      THR  78 -14.155   1.909   6.646
  635   2HG2  THR  78          HG22      THR  78 -13.211   2.936   7.723
  636   3HG2  THR  78          HG23      THR  78 -12.440   2.176   6.331
  637    H    ASP  79           HN       ASP  79  -9.921   4.707   5.365
  638    HA   ASP  79           HA       ASP  79  -9.867   4.231   2.484
  639   1HB   ASP  79          HB2       ASP  79  -8.245   5.593   3.871
  640   2HB   ASP  79          HB1       ASP  79  -7.644   4.076   4.540
  641    H    ALA  80           HN       ALA  80  -9.042   2.310   1.462
  642    HA   ALA  80           HA       ALA  80  -9.952  -0.181   2.227
  643   1HB   ALA  80          HB1       ALA  80  -8.856   0.493   0.078
  644   2HB   ALA  80          HB2       ALA  80  -8.253  -1.045   0.696
  645   3HB   ALA  80          HB3       ALA  80  -7.295   0.422   0.893
  646    H    SER  81           HN       SER  81  -6.691   1.102   2.977
  647    HA   SER  81           HA       SER  81  -5.640  -1.037   4.439
  648   1HB   SER  81          HB2       SER  81  -4.059   0.527   5.042
  649   2HB   SER  81          HB1       SER  81  -4.881   1.467   3.801
  650    HG   SER  81           HG       SER  81  -4.572   2.453   5.970
  651    H    ASP  82           HN       ASP  82  -8.268   1.073   5.319
  652    HA   ASP  82           HA       ASP  82  -8.174   0.105   8.145
  653   1HB   ASP  82          HB2       ASP  82  -9.647   2.360   6.757
  654   2HB   ASP  82          HB1       ASP  82  -9.774   2.003   8.479
  655    H    VAL  83           HN       VAL  83  -9.153  -1.467   5.755
  656    HA   VAL  83           HA       VAL  83 -11.991  -1.863   6.651
  657    HB   VAL  83           HB       VAL  83 -10.827  -2.530   3.942
  658   1HG1  VAL  83          HG11      VAL  83 -13.658  -1.830   4.752
  659   2HG1  VAL  83          HG12      VAL  83 -13.048  -3.486   4.719
  660   3HG1  VAL  83          HG13      VAL  83 -13.119  -2.542   3.231
  661   1HG2  VAL  83          HG21      VAL  83 -10.429  -0.209   4.036
  662   2HG2  VAL  83          HG22      VAL  83 -11.862   0.088   5.021
  663   3HG2  VAL  83          HG23      VAL  83 -12.033  -0.306   3.310
  664    H    LYS  84           HN       LYS  84 -12.694  -4.096   6.750
  665    HA   LYS  84           HA       LYS  84 -10.510  -5.980   7.381
  666   1HB   LYS  84          HB2       LYS  84 -13.532  -5.990   7.606
  667   2HB   LYS  84          HB1       LYS  84 -12.536  -7.366   8.082
  668   1HG   LYS  84          HG2       LYS  84 -12.210  -6.380  10.078
  669   2HG   LYS  84          HG1       LYS  84 -11.338  -5.088   9.252
  670   1HD   LYS  84          HD2       LYS  84 -14.181  -4.729   8.901
  671   2HD   LYS  84          HD1       LYS  84 -13.804  -4.880  10.616
  672   1HE   LYS  84          HE2       LYS  84 -11.848  -3.199   9.253
  673   2HE   LYS  84          HE1       LYS  84 -13.495  -2.564   9.085
  674   1HZ   LYS  84          HZ1       LYS  84 -13.830  -2.685  11.410
  675   2HZ   LYS  84          HZ2       LYS  84 -12.331  -1.918  11.193
  676   3HZ   LYS  84          HZ3       LYS  84 -12.393  -3.552  11.655
  677    HA   PRO  85           HA       PRO  85 -10.571  -8.023   3.460
  678   1HB   PRO  85          HB2       PRO  85 -10.103 -10.596   4.660
  679   2HB   PRO  85          HB1       PRO  85  -8.928  -9.528   3.880
  680   1HG   PRO  85          HG2       PRO  85  -9.184 -10.113   6.676
  681   2HG   PRO  85          HG1       PRO  85  -8.027  -9.032   5.894
  682   1HD   PRO  85          HD2       PRO  85 -10.300  -8.316   7.530
  683   2HD   PRO  85          HD1       PRO  85  -9.121  -7.228   6.757
  684    H    CYS  86           HN       CYS  86 -12.245  -8.936   2.256
  685    HA   CYS  86           HA       CYS  86 -14.819  -9.390   3.216
  686   1HB   CYS  86          HB2       CYS  86 -13.588  -9.501   0.811
  687   2HB   CYS  86          HB1       CYS  86 -13.832 -11.226   1.089
  Start of MODEL   13
    1   1H    THR   1          HT1       THR   1  23.011  -7.840  -8.510
    2   2H    THR   1          HT2       THR   1  23.322  -7.610  -6.856
    3   3H    THR   1          HT3       THR   1  24.518  -7.246  -8.006
    4    HA   THR   1           HA       THR   1  23.568  -5.183  -7.295
    5    HB   THR   1           HB       THR   1  22.654  -4.514  -9.558
    6    HG1  THR   1           HG1      THR   1  22.967  -6.479 -11.034
    7   1HG2  THR   1          HG21      THR   1  25.191  -5.248  -8.831
    8   2HG2  THR   1          HG22      THR   1  24.770  -4.508 -10.375
    9   3HG2  THR   1          HG23      THR   1  24.923  -6.260 -10.249
   10    H    LYS   2           HN       LYS   2  21.723  -3.987  -6.702
   11    HA   LYS   2           HA       LYS   2  19.014  -4.690  -7.290
   12   1HB   LYS   2          HB2       LYS   2  18.551  -5.599  -4.907
   13   2HB   LYS   2          HB1       LYS   2  19.336  -6.687  -6.051
   14   1HG   LYS   2          HG2       LYS   2  21.345  -6.623  -4.946
   15   2HG   LYS   2          HG1       LYS   2  21.126  -4.951  -4.429
   16   1HD   LYS   2          HD2       LYS   2  19.113  -6.147  -3.053
   17   2HD   LYS   2          HD1       LYS   2  20.288  -7.463  -3.101
   18   1HE   LYS   2          HE2       LYS   2  20.996  -4.641  -2.228
   19   2HE   LYS   2          HE1       LYS   2  20.561  -5.941  -1.100
   20   1HZ   LYS   2          HZ1       LYS   2  22.931  -5.659  -2.773
   21   2HZ   LYS   2          HZ2       LYS   2  22.284  -7.225  -2.637
   22   3HZ   LYS   2          HZ3       LYS   2  22.765  -6.378  -1.245
   23    H    ALA   3           HN       ALA   3  18.882  -2.378  -7.400
   24    HA   ALA   3           HA       ALA   3  19.580  -0.724  -5.081
   25   1HB   ALA   3          HB1       ALA   3  17.973   0.703  -6.897
   26   2HB   ALA   3          HB2       ALA   3  18.862  -0.456  -7.885
   27   3HB   ALA   3          HB3       ALA   3  19.736   0.676  -6.852
   28    H    SER   4           HN       SER   4  18.130   0.076  -3.551
   29    HA   SER   4           HA       SER   4  15.685  -1.282  -3.022
   30   1HB   SER   4          HB2       SER   4  17.365   0.515  -1.775
   31   2HB   SER   4          HB1       SER   4  15.921   1.488  -2.045
   32    HG   SER   4           HG       SER   4  15.243   0.475  -0.325
   33    H    CYS   5           HN       CYS   5  13.554   0.123  -2.775
   34    HA   CYS   5           HA       CYS   5  12.990   1.286  -5.460
   35   1HB   CYS   5          HB2       CYS   5  11.374   0.105  -3.202
   36   2HB   CYS   5          HB1       CYS   5  10.595   0.977  -4.524
   37    H    LYS   6           HN       LYS   6  10.758   2.837  -4.767
   38    HA   LYS   6           HA       LYS   6  11.857   4.896  -2.886
   39   1HB   LYS   6          HB2       LYS   6  10.716   5.236  -5.677
   40   2HB   LYS   6          HB1       LYS   6  11.073   6.578  -4.589
   41   1HG   LYS   6          HG2       LYS   6  13.199   4.539  -5.183
   42   2HG   LYS   6          HG1       LYS   6  12.879   5.833  -6.339
   43   1HD   LYS   6          HD2       LYS   6  12.949   7.218  -3.971
   44   2HD   LYS   6          HD1       LYS   6  14.156   5.964  -3.685
   45   1HE   LYS   6          HE2       LYS   6  14.276   7.267  -6.354
   46   2HE   LYS   6          HE1       LYS   6  14.742   8.278  -4.972
   47   1HZ   LYS   6          HZ1       LYS   6  16.691   7.153  -5.377
   48   2HZ   LYS   6          HZ2       LYS   6  15.906   5.735  -5.888
   49   3HZ   LYS   6          HZ3       LYS   6  15.970   6.126  -4.235
   50    H    LEU   7           HN       LEU   7  10.342   5.135  -1.288
   51    HA   LEU   7           HA       LEU   7   7.783   4.146  -1.084
   52   1HB   LEU   7          HB2       LEU   7   7.399   6.196   0.397
   53   2HB   LEU   7          HB1       LEU   7   8.859   5.263   0.745
   54    HG   LEU   7           HG       LEU   7   9.545   7.149  -1.265
   55   1HD1  LEU   7          HD11      LEU   7   9.010   9.107   0.591
   56   2HD1  LEU   7          HD12      LEU   7   7.544   8.129   0.663
   57   3HD1  LEU   7          HD13      LEU   7   8.065   8.828  -0.871
   58   1HD2  LEU   7          HD21      LEU   7  10.147   6.796   1.676
   59   2HD2  LEU   7          HD22      LEU   7  10.886   8.092   0.735
   60   3HD2  LEU   7          HD23      LEU   7  11.173   6.409   0.294
   61    HA   PRO   8           HA       PRO   8   6.054   6.327  -4.705
   62   1HB   PRO   8          HB2       PRO   8   3.690   4.739  -4.298
   63   2HB   PRO   8          HB1       PRO   8   4.910   4.571  -5.567
   64   1HG   PRO   8          HG2       PRO   8   4.458   2.847  -3.314
   65   2HG   PRO   8          HG1       PRO   8   5.665   2.675  -4.591
   66   1HD   PRO   8          HD2       PRO   8   6.102   3.408  -1.840
   67   2HD   PRO   8          HD1       PRO   8   7.315   3.265  -3.135
   68    H    VAL   9           HN       VAL   9   4.547   5.665  -1.562
   69    HA   VAL   9           HA       VAL   9   3.084   8.276  -1.797
   70    HB   VAL   9           HB       VAL   9   2.153   5.837  -0.272
   71   1HG1  VAL   9          HG11      VAL   9   1.205   8.539  -0.690
   72   2HG1  VAL   9          HG12      VAL   9   0.562   7.292   0.378
   73   3HG1  VAL   9          HG13      VAL   9   0.028   7.377  -1.300
   74   1HG2  VAL   9          HG21      VAL   9   1.418   6.630  -3.107
   75   2HG2  VAL   9          HG22      VAL   9   0.778   5.255  -2.207
   76   3HG2  VAL   9          HG23      VAL   9   2.474   5.281  -2.688
   77    H    LYS  10           HN       LYS  10   2.541   9.157   0.457
   78    HA   LYS  10           HA       LYS  10   4.881   8.714   2.267
   79   1HB   LYS  10          HB2       LYS  10   4.066  10.966   1.106
   80   2HB   LYS  10          HB1       LYS  10   2.967  11.010   2.485
   81   1HG   LYS  10          HG2       LYS  10   4.657  11.860   3.708
   82   2HG   LYS  10          HG1       LYS  10   5.468  10.301   3.556
   83   1HD   LYS  10          HD2       LYS  10   5.812  11.766   1.110
   84   2HD   LYS  10          HD1       LYS  10   6.287  12.791   2.464
   85   1HE   LYS  10          HE2       LYS  10   7.394  10.358   3.168
   86   2HE   LYS  10          HE1       LYS  10   7.608  10.387   1.407
   87   1HZ   LYS  10          HZ1       LYS  10   9.415  11.603   2.190
   88   2HZ   LYS  10          HZ2       LYS  10   8.508  12.369   3.406
   89   3HZ   LYS  10          HZ3       LYS  10   8.294  12.808   1.777
   90    H    LYS  11           HN       LYS  11   1.892   7.500   2.019
   91    HA   LYS  11           HA       LYS  11   1.648   7.055   4.917
   92   1HB   LYS  11          HB2       LYS  11   0.500   9.308   3.911
   93   2HB   LYS  11          HB1       LYS  11  -0.817   8.157   3.688
   94   1HG   LYS  11          HG2       LYS  11  -0.974   7.693   5.985
   95   2HG   LYS  11          HG1       LYS  11   0.651   8.297   6.313
   96   1HD   LYS  11          HD2       LYS  11  -0.063  10.587   5.886
   97   2HD   LYS  11          HD1       LYS  11  -1.669  10.030   5.414
   98   1HE   LYS  11          HE2       LYS  11  -1.903   9.029   7.737
   99   2HE   LYS  11          HE1       LYS  11  -0.413   9.890   8.171
  100   1HZ   LYS  11          HZ1       LYS  11  -2.478  11.190   8.587
  101   2HZ   LYS  11          HZ2       LYS  11  -2.768  11.189   6.914
  102   3HZ   LYS  11          HZ3       LYS  11  -1.387  11.955   7.539
  103    H    ALA  12           HN       ALA  12   2.023   5.358   2.564
  104    HA   ALA  12           HA       ALA  12  -0.590   4.056   2.091
  105   1HB   ALA  12          HB1       ALA  12   1.622   2.607   1.025
  106   2HB   ALA  12          HB2       ALA  12   1.966   4.323   0.812
  107   3HB   ALA  12          HB3       ALA  12   0.484   3.632   0.151
  108    H    THR  13           HN       THR  13  -1.265   2.287   3.254
  109    HA   THR  13           HA       THR  13   0.649   1.057   5.182
  110    HB   THR  13           HB       THR  13  -2.364   1.128   4.901
  111    HG1  THR  13           HG1      THR  13  -2.246   2.512   6.519
  112   1HG2  THR  13          HG21      THR  13  -2.164  -0.960   5.854
  113   2HG2  THR  13          HG22      THR  13  -2.048   0.028   7.310
  114   3HG2  THR  13          HG23      THR  13  -0.586  -0.605   6.554
  115    H    VAL  14           HN       VAL  14   1.499  -0.916   4.644
  116    HA   VAL  14           HA       VAL  14   0.013  -2.577   2.636
  117    HB   VAL  14           HB       VAL  14   2.216  -3.332   1.919
  118   1HG1  VAL  14          HG11      VAL  14   1.356  -0.589   1.884
  119   2HG1  VAL  14          HG12      VAL  14   2.253  -1.477   0.651
  120   3HG1  VAL  14          HG13      VAL  14   3.118  -0.644   1.943
  121   1HG2  VAL  14          HG21      VAL  14   4.220  -2.117   3.049
  122   2HG2  VAL  14          HG22      VAL  14   3.488  -3.476   3.904
  123   3HG2  VAL  14          HG23      VAL  14   3.099  -1.824   4.378
  124    H    VAL  15           HN       VAL  15   1.389  -4.953   2.949
  125    HA   VAL  15           HA       VAL  15   1.093  -5.669   5.841
  126    HB   VAL  15           HB       VAL  15  -0.175  -6.940   3.396
  127   1HG1  VAL  15          HG11      VAL  15   0.829  -8.299   5.616
  128   2HG1  VAL  15          HG12      VAL  15  -0.393  -8.901   4.496
  129   3HG1  VAL  15          HG13      VAL  15  -0.884  -8.092   5.984
  130   1HG2  VAL  15          HG21      VAL  15  -1.343  -5.803   5.959
  131   2HG2  VAL  15          HG22      VAL  15  -2.265  -6.488   4.620
  132   3HG2  VAL  15          HG23      VAL  15  -1.352  -4.996   4.390
  133    H    TYR  16           HN       TYR  16   3.506  -5.726   5.727
  134    HA   TYR  16           HA       TYR  16   4.744  -7.740   3.963
  135   1HB   TYR  16          HB2       TYR  16   5.675  -5.457   4.683
  136   2HB   TYR  16          HB1       TYR  16   5.974  -6.194   6.257
  137    HD1  TYR  16           HD1      TYR  16   8.265  -6.612   6.471
  138    HD2  TYR  16           HD2      TYR  16   6.296  -7.514   2.764
  139    HE1  TYR  16           HE1      TYR  16  10.360  -7.615   5.603
  140    HE2  TYR  16           HE2      TYR  16   8.391  -8.518   1.893
  141    HH   TYR  16           HH       TYR  16  11.385  -8.473   3.820
  142    H    GLN  17           HN       GLN  17   5.289  -9.809   4.616
  143    HA   GLN  17           HA       GLN  17   5.287 -11.745   5.964
  144   1HB   GLN  17          HB2       GLN  17   6.370  -9.473   7.600
  145   2HB   GLN  17          HB1       GLN  17   6.170 -11.056   8.356
  146   1HG   GLN  17          HG2       GLN  17   7.351 -11.680   5.933
  147   2HG   GLN  17          HG1       GLN  17   8.151 -10.174   6.383
  148   1HE2  GLN  17          HE21      GLN  17   8.651 -10.210   8.978
  149   2HE2  GLN  17          HE22      GLN  17   9.422 -11.630   9.499
  150    H    GLY  18           HN       GLY  18   2.777 -10.060   5.852
  151   1HA   GLY  18          HA2       GLY  18   0.627 -10.373   6.780
  152   2HA   GLY  18          HA1       GLY  18   1.342 -11.464   7.966
  153    H    GLU  19           HN       GLU  19   2.818  -8.353   7.654
  154    HA   GLU  19           HA       GLU  19   1.465  -7.497  10.195
  155   1HB   GLU  19          HB2       GLU  19   4.306  -7.429   9.202
  156   2HB   GLU  19          HB1       GLU  19   3.776  -6.272  10.424
  157   1HG   GLU  19          HG2       GLU  19   3.144  -9.180  10.802
  158   2HG   GLU  19          HG1       GLU  19   4.771  -8.602  11.161
  159    H    ARG  20           HN       ARG  20   0.366  -5.580  10.009
  160    HA   ARG  20           HA       ARG  20   0.383  -4.054   7.539
  161   1HB   ARG  20          HB2       ARG  20  -0.819  -3.720  10.295
  162   2HB   ARG  20          HB1       ARG  20  -1.106  -2.558   8.996
  163   1HG   ARG  20          HG2       ARG  20  -2.606  -3.919   8.007
  164   2HG   ARG  20          HG1       ARG  20  -1.494  -5.288   8.070
  165   1HD   ARG  20          HD2       ARG  20  -2.131  -5.332  10.629
  166   2HD   ARG  20          HD1       ARG  20  -3.568  -4.447  10.079
  167    HE   ARG  20           HE       ARG  20  -3.002  -6.717   8.368
  168   1HH1  ARG  20          HH21      ARG  20  -3.603  -6.508  11.672
  169   2HH1  ARG  20          HH22      ARG  20  -5.034  -7.484  11.649
  170   1HH2  ARG  20          HH11      ARG  20  -5.184  -7.648   8.188
  171   2HH2  ARG  20          HH12      ARG  20  -5.929  -8.130   9.676
  172    H    VAL  21           HN       VAL  21   1.698  -2.330   7.045
  173    HA   VAL  21           HA       VAL  21   2.910  -0.722   9.225
  174    HB   VAL  21           HB       VAL  21   5.170  -1.104   8.069
  175   1HG1  VAL  21          HG11      VAL  21   3.793  -3.469   9.380
  176   2HG1  VAL  21          HG12      VAL  21   4.576  -2.138  10.231
  177   3HG1  VAL  21          HG13      VAL  21   5.537  -3.243   9.248
  178   1HG2  VAL  21          HG21      VAL  21   3.563  -2.408   6.212
  179   2HG2  VAL  21          HG22      VAL  21   4.305  -3.733   7.108
  180   3HG2  VAL  21          HG23      VAL  21   5.319  -2.529   6.314
  181    H    LYS  22           HN       LYS  22   3.720   1.330   8.427
  182    HA   LYS  22           HA       LYS  22   2.397   2.220   5.944
  183   1HB   LYS  22          HB2       LYS  22   3.848   3.468   8.273
  184   2HB   LYS  22          HB1       LYS  22   3.489   4.426   6.835
  185   1HG   LYS  22          HG2       LYS  22   1.302   2.793   8.078
  186   2HG   LYS  22          HG1       LYS  22   1.751   4.330   8.818
  187   1HD   LYS  22          HD2       LYS  22   1.629   5.042   6.185
  188   2HD   LYS  22          HD1       LYS  22   0.374   3.805   6.257
  189   1HE   LYS  22          HE2       LYS  22  -0.014   5.331   8.583
  190   2HE   LYS  22          HE1       LYS  22   0.305   6.516   7.300
  191   1HZ   LYS  22          HZ1       LYS  22  -1.277   5.323   5.885
  192   2HZ   LYS  22          HZ2       LYS  22  -2.024   5.909   7.293
  193   3HZ   LYS  22          HZ3       LYS  22  -1.629   4.262   7.162
  194    H    ILE  23           HN       ILE  23   3.549   1.674   4.099
  195    HA   ILE  23           HA       ILE  23   6.257   1.136   3.767
  196    HB   ILE  23           HB       ILE  23   4.351   0.999   2.106
  197   1HG1  ILE  23          HG12      ILE  23   6.895   2.394   1.207
  198   2HG1  ILE  23          HG11      ILE  23   6.677   0.653   1.392
  199   1HG2  ILE  23          HG21      ILE  23   3.997   3.059   0.716
  200   2HG2  ILE  23          HG22      ILE  23   4.964   3.962   1.883
  201   3HG2  ILE  23          HG23      ILE  23   3.436   3.235   2.379
  202   1HD1  ILE  23          HD11      ILE  23   5.235   0.505  -0.449
  203   2HD1  ILE  23          HD12      ILE  23   6.409   1.707  -0.984
  204   3HD1  ILE  23          HD13      ILE  23   4.830   2.221  -0.391
  205    H    GLN  24           HN       GLN  24   4.700   4.310   4.018
  206    HA   GLN  24           HA       GLN  24   6.965   5.893   3.212
  207   1HB   GLN  24          HB2       GLN  24   5.647   7.702   4.252
  208   2HB   GLN  24          HB1       GLN  24   4.599   6.639   3.306
  209   1HG   GLN  24          HG2       GLN  24   3.381   6.172   5.136
  210   2HG   GLN  24          HG1       GLN  24   4.822   5.588   5.967
  211   1HE2  GLN  24          HE21      GLN  24   2.410   7.601   6.604
  212   2HE2  GLN  24          HE22      GLN  24   3.220   8.865   7.397
  213    H    GLU  25           HN       GLU  25   6.467   3.966   5.967
  214    HA   GLU  25           HA       GLU  25   8.484   5.552   7.526
  215   1HB   GLU  25          HB2       GLU  25   6.095   3.870   8.273
  216   2HB   GLU  25          HB1       GLU  25   7.369   4.189   9.449
  217   1HG   GLU  25          HG2       GLU  25   7.046   6.690   8.672
  218   2HG   GLU  25          HG1       GLU  25   5.460   6.110   8.158
  219    H    LYS  26           HN       LYS  26   7.277   2.174   7.552
  220    HA   LYS  26           HA       LYS  26   9.554   0.862   8.440
  221   1HB   LYS  26          HB2       LYS  26   7.434  -0.243   7.995
  222   2HB   LYS  26          HB1       LYS  26   7.581   0.097   6.267
  223   1HG   LYS  26          HG2       LYS  26   8.225  -2.244   6.824
  224   2HG   LYS  26          HG1       LYS  26   9.562  -1.332   6.122
  225   1HD   LYS  26          HD2       LYS  26  10.539  -0.956   8.302
  226   2HD   LYS  26          HD1       LYS  26   9.133  -1.658   9.104
  227   1HE   LYS  26          HE2       LYS  26  10.242  -3.495   7.127
  228   2HE   LYS  26          HE1       LYS  26  11.441  -3.048   8.357
  229   1HZ   LYS  26          HZ1       LYS  26   9.603  -4.897   8.792
  230   2HZ   LYS  26          HZ2       LYS  26   8.717  -3.532   9.277
  231   3HZ   LYS  26          HZ3       LYS  26  10.196  -3.900  10.028
  232    H    PHE  27           HN       PHE  27   8.922   2.129   5.197
  233    HA   PHE  27           HA       PHE  27  11.707   1.349   4.397
  234   1HB   PHE  27          HB2       PHE  27   9.136   1.772   2.842
  235   2HB   PHE  27          HB1       PHE  27  10.706   1.526   2.071
  236    HD1  PHE  27           HD1      PHE  27  12.078  -0.524   3.313
  237    HD2  PHE  27           HD2      PHE  27   7.815  -0.138   2.960
  238    HE1  PHE  27           HE1      PHE  27  11.833  -2.977   3.586
  239    HE2  PHE  27           HE2      PHE  27   7.570  -2.591   3.233
  240    HZ   PHE  27           HZ       PHE  27   9.580  -4.010   3.545
  241    H    LYS  28           HN       LYS  28  11.172   3.738   5.922
  242    HA   LYS  28           HA       LYS  28  10.691   6.142   4.666
  243   1HB   LYS  28          HB2       LYS  28  11.907   5.240   6.982
  244   2HB   LYS  28          HB1       LYS  28  13.209   6.123   6.184
  245   1HG   LYS  28          HG2       LYS  28  12.217   8.126   6.545
  246   2HG   LYS  28          HG1       LYS  28  10.630   7.519   6.071
  247   1HD   LYS  28          HD2       LYS  28  10.051   6.960   8.215
  248   2HD   LYS  28          HD1       LYS  28  11.699   6.508   8.651
  249   1HE   LYS  28          HE2       LYS  28  12.050   9.174   8.286
  250   2HE   LYS  28          HE1       LYS  28  10.365   9.156   8.838
  251   1HZ   LYS  28          HZ1       LYS  28  11.184   7.507  10.576
  252   2HZ   LYS  28          HZ2       LYS  28  11.606   9.137  10.802
  253   3HZ   LYS  28          HZ3       LYS  28  12.747   8.038  10.188
  254    H    ASN  29           HN       ASN  29  13.521   4.066   4.210
  255    HA   ASN  29           HA       ASN  29  14.663   6.032   2.274
  256   1HB   ASN  29          HB2       ASN  29  15.771   3.550   3.620
  257   2HB   ASN  29          HB1       ASN  29  16.693   4.613   2.551
  258   1HD2  ASN  29          HD21      ASN  29  15.616   7.132   3.478
  259   2HD2  ASN  29          HD22      ASN  29  16.156   7.375   5.069
  260    H    GLY  30           HN       GLY  30  12.325   4.526   1.494
  261   1HA   GLY  30          HA2       GLY  30  11.713   3.508  -0.565
  262   2HA   GLY  30          HA1       GLY  30  13.420   3.202  -0.888
  263    H    MET  31           HN       MET  31  11.792   1.134  -1.445
  264    HA   MET  31           HA       MET  31  11.743  -0.662   0.935
  265   1HB   MET  31          HB2       MET  31  10.625  -0.931  -1.879
  266   2HB   MET  31          HB1       MET  31  10.313  -2.038  -0.541
  267   1HG   MET  31          HG2       MET  31   9.270  -0.224   0.743
  268   2HG   MET  31          HG1       MET  31   9.616   0.912  -0.560
  269   1HE   MET  31          HE1       MET  31   7.125  -2.780  -0.485
  270   2HE   MET  31          HE2       MET  31   6.452  -1.527   0.555
  271   3HE   MET  31          HE3       MET  31   8.132  -2.018   0.754
  272    H    LEU  32           HN       LEU  32  12.886  -2.655   0.909
  273    HA   LEU  32           HA       LEU  32  15.408  -2.730  -0.417
  274   1HB   LEU  32          HB2       LEU  32  13.677  -4.865   0.857
  275   2HB   LEU  32          HB1       LEU  32  15.368  -5.109   0.415
  276    HG   LEU  32           HG       LEU  32  14.539  -2.799   2.169
  277   1HD1  LEU  32          HD11      LEU  32  15.582  -4.655   3.900
  278   2HD1  LEU  32          HD12      LEU  32  14.626  -5.675   2.824
  279   3HD1  LEU  32          HD13      LEU  32  13.859  -4.346   3.693
  280   1HD2  LEU  32          HD21      LEU  32  17.114  -4.374   2.173
  281   2HD2  LEU  32          HD22      LEU  32  16.834  -2.725   2.733
  282   3HD2  LEU  32          HD23      LEU  32  16.842  -3.081   1.006
  283    H    HIS  33           HN       HIS  33  16.102  -3.964  -2.229
  284    HA   HIS  33           HA       HIS  33  14.291  -4.196  -4.433
  285   1HB   HIS  33          HB2       HIS  33  16.658  -3.867  -4.744
  286   2HB   HIS  33          HB1       HIS  33  17.033  -5.327  -3.824
  287    HD1  HIS  33           HD1      HIS  33  15.012  -4.439  -6.946
  288    HD2  HIS  33           HD2      HIS  33  17.424  -7.500  -5.468
  289    HE1  HIS  33           HE1      HIS  33  15.200  -6.158  -8.796
  290    H    GLY  34           HN       GLY  34  12.941  -5.867  -5.007
  291   1HA   GLY  34          HA2       GLY  34  12.209  -8.130  -5.194
  292   2HA   GLY  34          HA1       GLY  34  13.491  -8.610  -4.083
  293    H    ASP  35           HN       ASP  35  12.537  -6.317  -2.254
  294    HA   ASP  35           HA       ASP  35  11.091  -7.765  -0.357
  295   1HB   ASP  35          HB2       ASP  35  12.158  -5.342  -0.459
  296   2HB   ASP  35          HB1       ASP  35  10.503  -4.859  -0.828
  297    H    LYS  36           HN       LYS  36   9.028  -8.583  -0.345
  298    HA   LYS  36           HA       LYS  36   7.103  -7.587  -2.408
  299   1HB   LYS  36          HB2       LYS  36   7.655 -10.169  -0.995
  300   2HB   LYS  36          HB1       LYS  36   6.009  -9.862  -1.552
  301   1HG   LYS  36          HG2       LYS  36   7.436  -9.107  -3.749
  302   2HG   LYS  36          HG1       LYS  36   8.462 -10.397  -3.118
  303   1HD   LYS  36          HD2       LYS  36   5.698 -11.203  -2.969
  304   2HD   LYS  36          HD1       LYS  36   6.074 -10.680  -4.612
  305   1HE   LYS  36          HE2       LYS  36   8.301 -12.209  -3.763
  306   2HE   LYS  36          HE1       LYS  36   6.856 -13.127  -3.294
  307   1HZ   LYS  36          HZ1       LYS  36   7.046 -13.703  -5.496
  308   2HZ   LYS  36          HZ2       LYS  36   7.680 -12.197  -5.960
  309   3HZ   LYS  36          HZ3       LYS  36   6.024 -12.355  -5.619
  310    H    VAL  37           HN       VAL  37   5.411  -6.378  -1.680
  311    HA   VAL  37           HA       VAL  37   4.406  -6.819   1.097
  312    HB   VAL  37           HB       VAL  37   6.135  -4.842   0.567
  313   1HG1  VAL  37          HG11      VAL  37   5.045  -2.760   0.010
  314   2HG1  VAL  37          HG12      VAL  37   3.460  -3.533   0.004
  315   3HG1  VAL  37          HG13      VAL  37   4.639  -3.929  -1.246
  316   1HG2  VAL  37          HG21      VAL  37   5.166  -3.618   2.456
  317   2HG2  VAL  37          HG22      VAL  37   5.064  -5.354   2.747
  318   3HG2  VAL  37          HG23      VAL  37   3.633  -4.461   2.238
  319    H    SER  38           HN       SER  38   2.143  -6.497   1.271
  320    HA   SER  38           HA       SER  38   0.716  -6.138  -1.330
  321   1HB   SER  38          HB2       SER  38  -0.682  -7.028   1.135
  322   2HB   SER  38          HB1       SER  38  -0.761  -7.685  -0.500
  323    HG   SER  38           HG       SER  38   1.317  -8.586  -0.132
  324    H    PHE  39           HN       PHE  39  -0.825  -4.501  -1.570
  325    HA   PHE  39           HA       PHE  39  -0.935  -2.453   0.602
  326   1HB   PHE  39          HB2       PHE  39  -1.448  -2.508  -2.375
  327   2HB   PHE  39          HB1       PHE  39  -1.958  -1.139  -1.383
  328    HD1  PHE  39           HD1      PHE  39   0.970  -3.134  -2.491
  329    HD2  PHE  39           HD2      PHE  39  -0.371   0.436  -0.513
  330    HE1  PHE  39           HE1      PHE  39   3.282  -2.238  -2.540
  331    HE2  PHE  39           HE2      PHE  39   1.941   1.332  -0.563
  332    HZ   PHE  39           HZ       PHE  39   3.767  -0.004  -1.576
  333    H    PHE  40           HN       PHE  40  -3.018  -1.666   1.322
  334    HA   PHE  40           HA       PHE  40  -5.129  -3.692   1.269
  335   1HB   PHE  40          HB2       PHE  40  -4.535  -1.090   2.612
  336   2HB   PHE  40          HB1       PHE  40  -6.227  -1.604   2.554
  337    HD1  PHE  40           HD1      PHE  40  -6.654  -4.137   3.186
  338    HD2  PHE  40           HD2      PHE  40  -3.173  -1.894   4.328
  339    HE1  PHE  40           HE1      PHE  40  -6.227  -5.738   5.031
  340    HE2  PHE  40           HE2      PHE  40  -2.746  -3.496   6.172
  341    HZ   PHE  40           HZ       PHE  40  -4.274  -5.418   6.524
  342    H    CYS  41           HN       CYS  41  -6.924  -3.683  -0.022
  343    HA   CYS  41           HA       CYS  41  -7.571  -1.202  -1.572
  344   1HB   CYS  41          HB2       CYS  41  -6.461  -3.673  -2.490
  345   2HB   CYS  41          HB1       CYS  41  -8.115  -3.567  -3.100
  346    H    LYS  42           HN       LYS  42  -9.865  -1.300  -2.419
  347    HA   LYS  42           HA       LYS  42 -11.595  -2.919  -0.579
  348   1HB   LYS  42          HB2       LYS  42 -13.199  -1.017  -0.900
  349   2HB   LYS  42          HB1       LYS  42 -11.673  -0.524  -0.159
  350   1HG   LYS  42          HG2       LYS  42 -10.899   0.490  -2.131
  351   2HG   LYS  42          HG1       LYS  42 -12.018  -0.419  -3.147
  352   1HD   LYS  42          HD2       LYS  42 -12.964   1.745  -3.059
  353   2HD   LYS  42          HD1       LYS  42 -13.888   0.830  -1.868
  354   1HE   LYS  42          HE2       LYS  42 -11.822   1.727  -0.316
  355   2HE   LYS  42          HE1       LYS  42 -12.003   3.076  -1.455
  356   1HZ   LYS  42          HZ1       LYS  42 -13.630   3.564   0.076
  357   2HZ   LYS  42          HZ2       LYS  42 -13.984   1.934   0.399
  358   3HZ   LYS  42          HZ3       LYS  42 -14.520   2.653  -1.045
  359    H    ASN  43           HN       ASN  43 -13.412  -3.937  -1.474
  360    HA   ASN  43           HA       ASN  43 -13.414  -4.175  -4.460
  361   1HB   ASN  43          HB2       ASN  43 -13.068  -6.107  -2.693
  362   2HB   ASN  43          HB1       ASN  43 -14.826  -6.022  -2.552
  363   1HD2  ASN  43          HD21      ASN  43 -12.170  -6.746  -4.797
  364   2HD2  ASN  43          HD22      ASN  43 -13.136  -7.510  -5.965
  365    H    LYS  44           HN       LYS  44 -15.242  -3.521  -5.574
  366    HA   LYS  44           HA       LYS  44 -17.399  -2.190  -4.076
  367   1HB   LYS  44          HB2       LYS  44 -16.166  -2.114  -6.664
  368   2HB   LYS  44          HB1       LYS  44 -17.897  -2.374  -6.883
  369   1HG   LYS  44          HG2       LYS  44 -18.289  -0.458  -5.272
  370   2HG   LYS  44          HG1       LYS  44 -16.558  -0.130  -5.353
  371   1HD   LYS  44          HD2       LYS  44 -16.695   0.755  -7.445
  372   2HD   LYS  44          HD1       LYS  44 -17.868  -0.451  -7.978
  373   1HE   LYS  44          HE2       LYS  44 -19.358   0.977  -6.161
  374   2HE   LYS  44          HE1       LYS  44 -18.336   2.244  -6.870
  375   1HZ   LYS  44          HZ1       LYS  44 -20.357   1.802  -8.194
  376   2HZ   LYS  44          HZ2       LYS  44 -19.827   0.206  -8.438
  377   3HZ   LYS  44          HZ3       LYS  44 -18.929   1.507  -9.062
  378    H    GLU  45           HN       GLU  45 -16.977  -5.132  -6.022
  379    HA   GLU  45           HA       GLU  45 -19.804  -5.798  -6.119
  380   1HB   GLU  45          HB2       GLU  45 -17.568  -6.547  -7.450
  381   2HB   GLU  45          HB1       GLU  45 -17.706  -7.897  -6.323
  382   1HG   GLU  45          HG2       GLU  45 -20.253  -7.820  -7.071
  383   2HG   GLU  45          HG1       GLU  45 -19.572  -7.053  -8.506
  384    H    LYS  46           HN       LYS  46 -17.055  -6.911  -4.118
  385    HA   LYS  46           HA       LYS  46 -18.851  -8.564  -2.451
  386   1HB   LYS  46          HB2       LYS  46 -15.902  -7.933  -2.157
  387   2HB   LYS  46          HB1       LYS  46 -16.768  -9.316  -1.480
  388   1HG   LYS  46          HG2       LYS  46 -17.266 -10.114  -3.770
  389   2HG   LYS  46          HG1       LYS  46 -16.372  -8.747  -4.434
  390   1HD   LYS  46          HD2       LYS  46 -14.311  -9.524  -3.424
  391   2HD   LYS  46          HD1       LYS  46 -15.168 -10.801  -2.559
  392   1HE   LYS  46          HE2       LYS  46 -15.378 -12.122  -4.443
  393   2HE   LYS  46          HE1       LYS  46 -15.466 -10.726  -5.536
  394   1HZ   LYS  46          HZ1       LYS  46 -13.011 -11.138  -3.988
  395   2HZ   LYS  46          HZ2       LYS  46 -13.214 -10.444  -5.525
  396   3HZ   LYS  46          HZ3       LYS  46 -13.273 -12.131  -5.337
  397    H    LYS  47           HN       LYS  47 -17.551  -5.372  -2.472
  398    HA   LYS  47           HA       LYS  47 -17.850  -3.589  -0.958
  399   1HB   LYS  47          HB2       LYS  47 -19.506  -5.528   0.659
  400   2HB   LYS  47          HB1       LYS  47 -19.704  -3.779   0.515
  401   1HG   LYS  47          HG2       LYS  47 -19.955  -4.472  -2.085
  402   2HG   LYS  47          HG1       LYS  47 -20.575  -5.941  -1.330
  403   1HD   LYS  47          HD2       LYS  47 -22.462  -4.495  -1.612
  404   2HD   LYS  47          HD1       LYS  47 -22.048  -4.434   0.102
  405   1HE   LYS  47          HE2       LYS  47 -20.516  -2.439  -1.320
  406   2HE   LYS  47          HE1       LYS  47 -22.245  -2.234  -1.669
  407   1HZ   LYS  47          HZ1       LYS  47 -22.766  -2.013   0.542
  408   2HZ   LYS  47          HZ2       LYS  47 -21.246  -1.254   0.511
  409   3HZ   LYS  47          HZ3       LYS  47 -21.390  -2.850   1.075
  410    H    CYS  48           HN       CYS  48 -15.706  -5.703  -0.599
  411    HA   CYS  48           HA       CYS  48 -15.131  -5.103   2.285
  412   1HB   CYS  48          HB2       CYS  48 -14.024  -7.597   1.130
  413   2HB   CYS  48          HB1       CYS  48 -14.665  -7.299   2.740
  414    H    SER  49           HN       SER  49 -12.618  -5.758   2.585
  415    HA   SER  49           HA       SER  49 -11.162  -4.512   0.281
  416   1HB   SER  49          HB2       SER  49  -9.582  -4.190   2.503
  417   2HB   SER  49          HB1       SER  49 -10.732  -2.992   1.915
  418    HG   SER  49           HG       SER  49 -11.216  -5.046   3.816
  419    H    TYR  50           HN       TYR  50  -8.832  -5.198   0.219
  420    HA   TYR  50           HA       TYR  50  -8.173  -7.821   1.401
  421   1HB   TYR  50          HB2       TYR  50  -7.736  -8.664  -1.016
  422   2HB   TYR  50          HB1       TYR  50  -9.414  -8.599  -0.469
  423    HD1  TYR  50           HD1      TYR  50 -10.923  -6.783  -1.234
  424    HD2  TYR  50           HD2      TYR  50  -6.905  -7.158  -2.708
  425    HE1  TYR  50           HE1      TYR  50 -11.462  -5.248  -3.107
  426    HE2  TYR  50           HE2      TYR  50  -7.445  -5.624  -4.577
  427    HH   TYR  50           HH       TYR  50  -9.111  -4.586  -5.676
  428    H    THR  51           HN       THR  51  -5.946  -8.453  -0.101
  429    HA   THR  51           HA       THR  51  -4.291  -5.961   0.131
  430    HB   THR  51           HB       THR  51  -2.458  -7.752   0.532
  431    HG1  THR  51           HG1      THR  51  -3.752  -9.508  -0.145
  432   1HG2  THR  51          HG21      THR  51  -4.551  -6.687   2.290
  433   2HG2  THR  51          HG22      THR  51  -2.804  -6.737   2.524
  434   3HG2  THR  51          HG23      THR  51  -3.787  -8.147   2.919
  435    H    GLU  52           HN       GLU  52  -2.824  -5.518  -1.499
  436    HA   GLU  52           HA       GLU  52  -3.014  -7.203  -3.977
  437   1HB   GLU  52          HB2       GLU  52  -3.077  -4.311  -3.356
  438   2HB   GLU  52          HB1       GLU  52  -2.052  -4.736  -4.726
  439   1HG   GLU  52          HG2       GLU  52  -4.905  -5.705  -4.429
  440   2HG   GLU  52          HG1       GLU  52  -4.467  -4.247  -5.320
  441    H    ASP  53           HN       ASP  53  -1.233  -8.528  -3.034
  442    HA   ASP  53           HA       ASP  53   1.223  -7.822  -2.065
  443   1HB   ASP  53          HB2       ASP  53   0.638  -9.790  -4.292
  444   2HB   ASP  53          HB1       ASP  53   2.075  -9.815  -3.267
  445    H    ALA  54           HN       ALA  54   3.164  -7.018  -2.856
  446    HA   ALA  54           HA       ALA  54   3.293  -6.172  -5.719
  447   1HB   ALA  54          HB1       ALA  54   4.363  -4.246  -3.763
  448   2HB   ALA  54          HB2       ALA  54   2.622  -4.487  -3.633
  449   3HB   ALA  54          HB3       ALA  54   3.327  -3.961  -5.161
  450    H    GLN  55           HN       GLN  55   5.664  -5.332  -6.128
  451    HA   GLN  55           HA       GLN  55   7.622  -6.793  -4.405
  452   1HB   GLN  55          HB2       GLN  55   6.752  -8.085  -6.455
  453   2HB   GLN  55          HB1       GLN  55   7.634  -6.906  -7.426
  454   1HG   GLN  55          HG2       GLN  55   9.559  -7.566  -5.638
  455   2HG   GLN  55          HG1       GLN  55   8.667  -9.088  -5.700
  456   1HE2  GLN  55          HE21      GLN  55   9.498 -10.464  -7.268
  457   2HE2  GLN  55          HE22      GLN  55  10.172  -9.970  -8.746
  458    H    CYS  56           HN       CYS  56   9.748  -5.887  -4.476
  459    HA   CYS  56           HA       CYS  56   9.857  -3.120  -5.587
  460   1HB   CYS  56          HB2       CYS  56  10.272  -3.350  -3.211
  461   2HB   CYS  56          HB1       CYS  56  11.438  -4.639  -3.496
  462    H    ILE  57           HN       ILE  57  11.228  -2.675  -7.278
  463    HA   ILE  57           HA       ILE  57  13.197  -4.795  -8.068
  464    HB   ILE  57           HB       ILE  57  11.448  -2.927  -9.697
  465   1HG1  ILE  57          HG12      ILE  57  10.902  -5.320 -10.670
  466   2HG1  ILE  57          HG11      ILE  57  11.529  -5.871  -9.116
  467   1HG2  ILE  57          HG21      ILE  57  12.569  -4.448 -11.575
  468   2HG2  ILE  57          HG22      ILE  57  13.895  -4.488 -10.413
  469   3HG2  ILE  57          HG23      ILE  57  13.324  -2.944 -11.047
  470   1HD1  ILE  57          HD11      ILE  57   8.962  -4.690  -9.715
  471   2HD1  ILE  57          HD12      ILE  57   9.820  -3.699  -8.536
  472   3HD1  ILE  57          HD13      ILE  57   9.525  -5.405  -8.205
  473    H    ASP  58           HN       ASP  58  15.138  -3.965  -9.118
  474    HA   ASP  58           HA       ASP  58  16.714  -2.172  -7.861
  475   1HB   ASP  58          HB2       ASP  58  16.936  -3.604 -10.063
  476   2HB   ASP  58          HB1       ASP  58  16.654  -2.050 -10.853
  477    H    GLY  59           HN       GLY  59  15.648  -0.317  -7.014
  478   1HA   GLY  59          HA2       GLY  59  15.000   1.930  -7.007
  479   2HA   GLY  59          HA1       GLY  59  15.814   2.054  -8.561
  480    H    THR  60           HN       THR  60  13.378  -0.302  -8.724
  481    HA   THR  60           HA       THR  60  11.379   1.742  -9.628
  482    HB   THR  60           HB       THR  60  12.187  -0.776 -11.108
  483    HG1  THR  60           HG1      THR  60  12.780   1.938 -11.670
  484   1HG2  THR  60          HG21      THR  60   9.833   0.151 -11.393
  485   2HG2  THR  60          HG22      THR  60  10.787   0.031 -12.872
  486   3HG2  THR  60          HG23      THR  60  10.581   1.594 -12.080
  487    H    ILE  61           HN       ILE  61   9.216   1.133  -9.271
  488    HA   ILE  61           HA       ILE  61   8.689  -1.631  -8.297
  489    HB   ILE  61           HB       ILE  61   9.125  -0.500  -6.265
  490   1HG1  ILE  61          HG12      ILE  61   6.316   0.209  -6.047
  491   2HG1  ILE  61          HG11      ILE  61   6.520  -1.326  -6.891
  492   1HG2  ILE  61          HG21      ILE  61   7.513   1.806  -7.395
  493   2HG2  ILE  61          HG22      ILE  61   9.260   1.774  -7.149
  494   3HG2  ILE  61          HG23      ILE  61   8.173   1.745  -5.760
  495   1HD1  ILE  61          HD11      ILE  61   8.249  -1.006  -4.525
  496   2HD1  ILE  61          HD12      ILE  61   7.280  -2.389  -5.031
  497   3HD1  ILE  61          HD13      ILE  61   6.523  -1.052  -4.163
  498    H    GLU  62           HN       GLU  62   6.633  -2.338  -8.850
  499    HA   GLU  62           HA       GLU  62   4.988  -0.463 -10.487
  500   1HB   GLU  62          HB2       GLU  62   5.612  -3.360 -10.412
  501   2HB   GLU  62          HB1       GLU  62   3.953  -2.956 -10.856
  502   1HG   GLU  62          HG2       GLU  62   5.809  -1.188 -12.199
  503   2HG   GLU  62          HG1       GLU  62   6.216  -2.873 -12.530
  504    H    VAL  63           HN       VAL  63   3.721   0.592  -8.897
  505    HA   VAL  63           HA       VAL  63   2.475  -0.749  -6.672
  506    HB   VAL  63           HB       VAL  63   2.132   1.866  -8.137
  507   1HG1  VAL  63          HG11      VAL  63   0.022   1.953  -7.311
  508   2HG1  VAL  63          HG12      VAL  63   0.799   2.195  -5.747
  509   3HG1  VAL  63          HG13      VAL  63   0.290   0.579  -6.239
  510   1HG2  VAL  63          HG21      VAL  63   2.935   2.695  -5.866
  511   2HG2  VAL  63          HG22      VAL  63   4.107   1.746  -6.779
  512   3HG2  VAL  63          HG23      VAL  63   3.221   1.007  -5.445
  513    HA   PRO  64           HA       PRO  64  -0.806  -2.811  -8.862
  514   1HB   PRO  64          HB2       PRO  64  -2.517  -2.626  -6.554
  515   2HB   PRO  64          HB1       PRO  64  -1.602  -4.028  -7.126
  516   1HG   PRO  64          HG2       PRO  64  -1.068  -2.380  -4.827
  517   2HG   PRO  64          HG1       PRO  64  -0.182  -3.805  -5.378
  518   1HD   PRO  64          HD2       PRO  64   0.681  -1.069  -5.473
  519   2HD   PRO  64          HD1       PRO  64   1.536  -2.496  -6.107
  520    H    LYS  65           HN       LYS  65  -2.179  -1.788 -10.266
  521    HA   LYS  65           HA       LYS  65  -2.965   0.905 -10.192
  522   1HB   LYS  65          HB2       LYS  65  -3.194  -1.210 -11.887
  523   2HB   LYS  65          HB1       LYS  65  -4.869  -1.052 -11.359
  524   1HG   LYS  65          HG2       LYS  65  -5.023   0.543 -12.964
  525   2HG   LYS  65          HG1       LYS  65  -4.164   1.568 -11.813
  526   1HD   LYS  65          HD2       LYS  65  -2.014   0.497 -12.827
  527   2HD   LYS  65          HD1       LYS  65  -3.065   0.055 -14.173
  528   1HE   LYS  65          HE2       LYS  65  -2.103   2.199 -14.727
  529   2HE   LYS  65          HE1       LYS  65  -3.779   2.520 -14.240
  530   1HZ   LYS  65          HZ1       LYS  65  -1.960   3.897 -13.124
  531   2HZ   LYS  65          HZ2       LYS  65  -1.576   2.480 -12.268
  532   3HZ   LYS  65          HZ3       LYS  65  -3.118   3.176 -12.117
  533    H    CYS  66           HN       CYS  66  -4.561  -1.922  -8.764
  534    HA   CYS  66           HA       CYS  66  -7.095  -1.011  -8.129
  535   1HB   CYS  66          HB2       CYS  66  -6.093  -3.211  -7.559
  536   2HB   CYS  66          HB1       CYS  66  -5.133  -2.433  -6.300
  537    H    PHE  67           HN       PHE  67  -4.044  -0.008  -6.637
  538    HA   PHE  67           HA       PHE  67  -4.963   1.323  -4.336
  539   1HB   PHE  67          HB2       PHE  67  -2.603   0.928  -5.076
  540   2HB   PHE  67          HB1       PHE  67  -2.803   2.201  -6.280
  541    HD1  PHE  67           HD1      PHE  67  -2.876   1.501  -2.622
  542    HD2  PHE  67           HD2      PHE  67  -2.634   4.498  -5.689
  543    HE1  PHE  67           HE1      PHE  67  -2.340   3.212  -0.908
  544    HE2  PHE  67           HE2      PHE  67  -2.098   6.208  -3.975
  545    HZ   PHE  67           HZ       PHE  67  -1.952   5.566  -1.586
  546    H    LYS  68           HN       LYS  68  -5.108   3.776  -4.083
  547    HA   LYS  68           HA       LYS  68  -5.941   5.352  -6.408
  548   1HB   LYS  68          HB2       LYS  68  -7.799   3.658  -5.203
  549   2HB   LYS  68          HB1       LYS  68  -8.142   5.232  -4.484
  550   1HG   LYS  68          HG2       LYS  68  -7.661   5.607  -7.283
  551   2HG   LYS  68          HG1       LYS  68  -8.842   4.312  -7.089
  552   1HD   LYS  68          HD2       LYS  68  -9.358   6.523  -5.260
  553   2HD   LYS  68          HD1       LYS  68  -9.370   7.047  -6.945
  554   1HE   LYS  68          HE2       LYS  68 -10.807   4.504  -6.292
  555   2HE   LYS  68          HE1       LYS  68 -11.570   6.034  -5.818
  556   1HZ   LYS  68          HZ1       LYS  68 -11.278   6.868  -8.044
  557   2HZ   LYS  68          HZ2       LYS  68 -12.115   5.391  -8.119
  558   3HZ   LYS  68          HZ3       LYS  68 -10.465   5.457  -8.517
  559    H    GLU  69           HN       GLU  69  -5.321   7.422  -5.916
  560    HA   GLU  69           HA       GLU  69  -4.598   8.137  -3.164
  561   1HB   GLU  69          HB2       GLU  69  -3.702  10.111  -4.238
  562   2HB   GLU  69          HB1       GLU  69  -3.358   8.739  -5.291
  563   1HG   GLU  69          HG2       GLU  69  -5.503   9.292  -6.533
  564   2HG   GLU  69          HG1       GLU  69  -5.560  10.791  -5.604
  565    H    HIS  70           HN       HIS  70  -5.317  10.936  -3.372
  566    HA   HIS  70           HA       HIS  70  -8.209  10.722  -2.677
  567   1HB   HIS  70          HB2       HIS  70  -5.849  12.302  -1.863
  568   2HB   HIS  70          HB1       HIS  70  -7.346  13.227  -1.959
  569    HD1  HIS  70           HD1      HIS  70  -5.846  10.217  -0.223
  570    HD2  HIS  70           HD2      HIS  70  -9.209  12.663   0.065
  571    HE1  HIS  70           HE1      HIS  70  -6.999   9.597   1.945
  572    H    SER  71           HN       SER  71  -9.203  10.893  -4.761
  573    HA   SER  71           HA       SER  71  -8.484  13.232  -6.455
  574   1HB   SER  71          HB2       SER  71  -9.057  11.802  -8.115
  575   2HB   SER  71          HB1       SER  71  -9.254  10.559  -6.878
  576    HG   SER  71           HG       SER  71 -11.120  11.847  -8.354
  577    H    SER  72           HN       SER  72 -10.961  13.724  -7.640
  578    HA   SER  72           HA       SER  72 -12.264  15.382  -5.638
  579   1HB   SER  72          HB2       SER  72 -12.877  14.607  -8.504
  580   2HB   SER  72          HB1       SER  72 -13.797  15.814  -7.609
  581    HG   SER  72           HG       SER  72 -11.007  15.844  -8.156
  582    H    LEU  73           HN       LEU  73 -14.407  15.105  -4.801
  583    HA   LEU  73           HA       LEU  73 -16.179  13.822  -3.902
  584   1HB   LEU  73          HB2       LEU  73 -15.805  12.993  -6.764
  585   2HB   LEU  73          HB1       LEU  73 -16.982  12.119  -5.775
  586    HG   LEU  73           HG       LEU  73 -17.933  14.097  -7.033
  587   1HD1  LEU  73          HD11      LEU  73 -18.486  13.145  -4.512
  588   2HD1  LEU  73          HD12      LEU  73 -19.474  14.320  -5.380
  589   3HD1  LEU  73          HD13      LEU  73 -18.274  14.870  -4.211
  590   1HD2  LEU  73          HD21      LEU  73 -16.358  15.692  -4.991
  591   2HD2  LEU  73          HD22      LEU  73 -17.383  16.328  -6.277
  592   3HD2  LEU  73          HD23      LEU  73 -15.870  15.517  -6.677
  593    H    ALA  74           HN       ALA  74 -13.337  12.867  -3.549
  594    HA   ALA  74           HA       ALA  74 -13.541   9.926  -3.600
  595   1HB   ALA  74          HB1       ALA  74 -11.500  12.037  -3.047
  596   2HB   ALA  74          HB2       ALA  74 -11.389  10.620  -4.090
  597   3HB   ALA  74          HB3       ALA  74 -11.232  10.443  -2.342
  598    H    PHE  75           HN       PHE  75 -15.141  11.903  -1.727
  599    HA   PHE  75           HA       PHE  75 -14.367  11.544   0.967
  600   1HB   PHE  75          HB2       PHE  75 -16.836  12.085  -0.587
  601   2HB   PHE  75          HB1       PHE  75 -17.094  11.487   1.052
  602    HD1  PHE  75           HD1      PHE  75 -16.322  14.351  -0.946
  603    HD2  PHE  75           HD2      PHE  75 -15.755  12.644   2.957
  604    HE1  PHE  75           HE1      PHE  75 -15.795  16.598  -0.038
  605    HE2  PHE  75           HE2      PHE  75 -15.228  14.892   3.863
  606    HZ   PHE  75           HZ       PHE  75 -15.248  16.869   2.365
  607    H    TRP  76           HN       TRP  76 -17.208   9.790  -0.216
  608    HA   TRP  76           HA       TRP  76 -17.906   7.568   0.183
  609   1HB   TRP  76          HB2       TRP  76 -15.160   7.644  -0.732
  610   2HB   TRP  76          HB1       TRP  76 -15.432   6.238   0.300
  611    HD1  TRP  76           HD1      TRP  76 -17.064   7.985  -2.731
  612    HE1  TRP  76           HE1      TRP  76 -18.184   6.177  -4.193
  613    HE3  TRP  76           HE3      TRP  76 -16.212   3.882   0.162
  614    HZ2  TRP  76           HZ2      TRP  76 -18.657   3.352  -4.132
  615    HZ3  TRP  76           HZ3      TRP  76 -17.005   1.643  -0.553
  616    HH2  TRP  76           HH2      TRP  76 -18.227   1.375  -2.694
  617    H    LYS  77           HN       LYS  77 -16.515   5.530   1.651
  618    HA   LYS  77           HA       LYS  77 -16.564   6.725   4.403
  619   1HB   LYS  77          HB2       LYS  77 -17.445   4.542   5.089
  620   2HB   LYS  77          HB1       LYS  77 -18.415   5.175   3.759
  621   1HG   LYS  77          HG2       LYS  77 -17.066   3.813   2.168
  622   2HG   LYS  77          HG1       LYS  77 -16.190   3.126   3.537
  623   1HD   LYS  77          HD2       LYS  77 -18.650   2.611   4.406
  624   2HD   LYS  77          HD1       LYS  77 -19.023   2.683   2.683
  625   1HE   LYS  77          HE2       LYS  77 -18.460   0.368   3.321
  626   2HE   LYS  77          HE1       LYS  77 -17.190   1.017   2.264
  627   1HZ   LYS  77          HZ1       LYS  77 -15.713   0.994   3.918
  628   2HZ   LYS  77          HZ2       LYS  77 -16.804   0.013   4.772
  629   3HZ   LYS  77          HZ3       LYS  77 -16.794   1.692   5.023
  630    H    THR  78           HN       THR  78 -15.646   4.058   5.419
  631    HA   THR  78           HA       THR  78 -12.919   4.486   5.792
  632    HB   THR  78           HB       THR  78 -13.250   1.704   5.666
  633    HG1  THR  78           HG1      THR  78 -15.439   1.911   6.904
  634   1HG2  THR  78          HG21      THR  78 -12.305   2.547   7.611
  635   2HG2  THR  78          HG22      THR  78 -13.931   2.164   8.177
  636   3HG2  THR  78          HG23      THR  78 -13.510   3.827   7.763
  637    H    ASP  79           HN       ASP  79 -11.162   4.399   4.447
  638    HA   ASP  79           HA       ASP  79 -11.486   3.597   1.647
  639   1HB   ASP  79          HB2       ASP  79  -9.558   4.990   3.399
  640   2HB   ASP  79          HB1       ASP  79  -8.819   4.094   2.070
  641    H    ALA  80           HN       ALA  80  -9.864   2.069   0.652
  642    HA   ALA  80           HA       ALA  80  -9.985  -0.545   1.559
  643   1HB   ALA  80          HB1       ALA  80  -7.994   1.036  -0.048
  644   2HB   ALA  80          HB2       ALA  80  -9.148  -0.178  -0.600
  645   3HB   ALA  80          HB3       ALA  80  -7.697  -0.671   0.271
  646    H    SER  81           HN       SER  81  -7.468   1.852   2.391
  647    HA   SER  81           HA       SER  81  -5.861   0.078   3.982
  648   1HB   SER  81          HB2       SER  81  -5.342   2.381   2.957
  649   2HB   SER  81          HB1       SER  81  -6.191   3.063   4.341
  650    HG   SER  81           HG       SER  81  -4.698   2.129   5.693
  651    H    ASP  82           HN       ASP  82  -8.967   1.325   4.537
  652    HA   ASP  82           HA       ASP  82  -8.693   0.784   7.472
  653   1HB   ASP  82          HB2       ASP  82 -10.168   2.982   6.002
  654   2HB   ASP  82          HB1       ASP  82 -10.382   2.653   7.722
  655    H    VAL  83           HN       VAL  83  -9.670  -0.908   5.167
  656    HA   VAL  83           HA       VAL  83 -12.525  -1.239   6.032
  657    HB   VAL  83           HB       VAL  83 -11.154  -2.080   3.464
  658   1HG1  VAL  83          HG11      VAL  83 -13.363  -2.546   2.653
  659   2HG1  VAL  83          HG12      VAL  83 -14.107  -1.803   4.069
  660   3HG1  VAL  83          HG13      VAL  83 -13.234  -3.327   4.228
  661   1HG2  VAL  83          HG21      VAL  83 -13.134  -0.001   3.173
  662   2HG2  VAL  83          HG22      VAL  83 -11.434   0.025   2.705
  663   3HG2  VAL  83          HG23      VAL  83 -11.908   0.509   4.333
  664    H    LYS  84           HN       LYS  84 -13.227  -3.368   6.530
  665    HA   LYS  84           HA       LYS  84 -11.155  -5.206   7.468
  666   1HB   LYS  84          HB2       LYS  84 -14.161  -5.045   7.429
  667   2HB   LYS  84          HB1       LYS  84 -13.376  -6.555   7.892
  668   1HG   LYS  84          HG2       LYS  84 -12.028  -5.251   9.575
  669   2HG   LYS  84          HG1       LYS  84 -13.020  -3.842   9.194
  670   1HD   LYS  84          HD2       LYS  84 -14.798  -4.632  10.363
  671   2HD   LYS  84          HD1       LYS  84 -14.577  -6.275   9.760
  672   1HE   LYS  84          HE2       LYS  84 -13.440  -6.900  11.626
  673   2HE   LYS  84          HE1       LYS  84 -12.427  -5.443  11.581
  674   1HZ   LYS  84          HZ1       LYS  84 -14.560  -4.237  12.259
  675   2HZ   LYS  84          HZ2       LYS  84 -13.748  -5.129  13.456
  676   3HZ   LYS  84          HZ3       LYS  84 -15.138  -5.765  12.715
  677    HA   PRO  85           HA       PRO  85 -10.776  -7.610   3.776
  678   1HB   PRO  85          HB2       PRO  85 -10.430 -10.049   5.266
  679   2HB   PRO  85          HB1       PRO  85  -9.182  -9.046   4.515
  680   1HG   PRO  85          HG2       PRO  85  -9.736  -9.359   7.311
  681   2HG   PRO  85          HG1       PRO  85  -8.504  -8.343   6.557
  682   1HD   PRO  85          HD2       PRO  85 -10.942  -7.504   7.860
  683   2HD   PRO  85          HD1       PRO  85  -9.692  -6.480   7.112
  684    H    CYS  86           HN       CYS  86 -12.334  -8.617   2.496
  685    HA   CYS  86           HA       CYS  86 -14.987  -9.024   3.220
  686   1HB   CYS  86          HB2       CYS  86 -13.491  -9.328   0.980
  687   2HB   CYS  86          HB1       CYS  86 -13.782 -11.023   1.372
  Start of MODEL   14
    1   1H    THR   1          HT1       THR   1  22.472  -8.452  -8.225
    2   2H    THR   1          HT2       THR   1  23.787  -8.302  -7.160
    3   3H    THR   1          HT3       THR   1  24.025  -8.153  -8.836
    4    HA   THR   1           HA       THR   1  23.802  -6.043  -7.246
    5    HB   THR   1           HB       THR   1  22.473  -5.755  -9.863
    6    HG1  THR   1           HG1      THR   1  25.084  -6.752  -9.939
    7   1HG2  THR   1          HG21      THR   1  25.262  -4.881  -9.214
    8   2HG2  THR   1          HG22      THR   1  23.916  -4.119  -8.367
    9   3HG2  THR   1          HG23      THR   1  24.010  -4.040 -10.126
   10    H    LYS   2           HN       LYS   2  22.182  -5.847  -5.676
   11    HA   LYS   2           HA       LYS   2  19.353  -5.755  -6.679
   12   1HB   LYS   2          HB2       LYS   2  18.838  -6.457  -4.286
   13   2HB   LYS   2          HB1       LYS   2  19.696  -7.664  -5.247
   14   1HG   LYS   2          HG2       LYS   2  21.586  -7.507  -3.991
   15   2HG   LYS   2          HG1       LYS   2  21.443  -5.758  -3.821
   16   1HD   LYS   2          HD2       LYS   2  19.677  -6.052  -2.132
   17   2HD   LYS   2          HD1       LYS   2  19.793  -7.804  -2.310
   18   1HE   LYS   2          HE2       LYS   2  22.164  -6.080  -1.525
   19   2HE   LYS   2          HE1       LYS   2  21.102  -6.867  -0.341
   20   1HZ   LYS   2          HZ1       LYS   2  22.978  -8.059  -2.229
   21   2HZ   LYS   2          HZ2       LYS   2  21.505  -8.877  -2.012
   22   3HZ   LYS   2          HZ3       LYS   2  22.521  -8.584  -0.682
   23    H    ALA   3           HN       ALA   3  18.909  -3.567  -6.834
   24    HA   ALA   3           HA       ALA   3  20.094  -1.623  -4.979
   25   1HB   ALA   3          HB1       ALA   3  17.984  -1.389  -7.149
   26   2HB   ALA   3          HB2       ALA   3  19.719  -1.190  -7.387
   27   3HB   ALA   3          HB3       ALA   3  18.829  -0.038  -6.393
   28    H    SER   4           HN       SER   4  18.003   0.149  -4.557
   29    HA   SER   4           HA       SER   4  16.225  -1.404  -2.709
   30   1HB   SER   4          HB2       SER   4  16.132   1.165  -1.842
   31   2HB   SER   4          HB1       SER   4  17.374   0.028  -1.328
   32    HG   SER   4           HG       SER   4  17.579   1.708  -3.609
   33    H    CYS   5           HN       CYS   5  14.388   0.736  -2.252
   34    HA   CYS   5           HA       CYS   5  13.195   1.196  -4.960
   35   1HB   CYS   5          HB2       CYS   5  11.527   0.462  -2.559
   36   2HB   CYS   5          HB1       CYS   5  11.139   0.281  -4.270
   37    H    LYS   6           HN       LYS   6  12.409   3.274  -5.199
   38    HA   LYS   6           HA       LYS   6  12.784   5.187  -3.006
   39   1HB   LYS   6          HB2       LYS   6  13.193   5.416  -5.568
   40   2HB   LYS   6          HB1       LYS   6  11.453   5.695  -5.666
   41   1HG   LYS   6          HG2       LYS   6  12.193   7.872  -5.381
   42   2HG   LYS   6          HG1       LYS   6  11.963   7.403  -3.697
   43   1HD   LYS   6          HD2       LYS   6  14.169   7.576  -3.259
   44   2HD   LYS   6          HD1       LYS   6  14.590   6.614  -4.677
   45   1HE   LYS   6          HE2       LYS   6  13.765   9.527  -4.872
   46   2HE   LYS   6          HE1       LYS   6  15.457   9.009  -4.731
   47   1HZ   LYS   6          HZ1       LYS   6  15.429   8.018  -6.755
   48   2HZ   LYS   6          HZ2       LYS   6  14.236   9.187  -7.065
   49   3HZ   LYS   6          HZ3       LYS   6  13.787   7.599  -6.665
   50    H    LEU   7           HN       LEU   7  11.205   5.011  -1.408
   51    HA   LEU   7           HA       LEU   7   8.598   4.126  -1.488
   52   1HB   LEU   7          HB2       LEU   7   8.226   5.869   0.325
   53   2HB   LEU   7          HB1       LEU   7   9.664   4.865   0.542
   54    HG   LEU   7           HG       LEU   7  10.311   7.150  -1.097
   55   1HD1  LEU   7          HD11      LEU   7   9.930   8.412   1.415
   56   2HD1  LEU   7          HD12      LEU   7   8.391   7.663   0.990
   57   3HD1  LEU   7          HD13      LEU   7   9.149   8.810  -0.115
   58   1HD2  LEU   7          HD21      LEU   7  12.000   5.933   0.096
   59   2HD2  LEU   7          HD22      LEU   7  11.141   6.113   1.626
   60   3HD2  LEU   7          HD23      LEU   7  11.897   7.515   0.869
   61    HA   PRO   8           HA       PRO   8   7.119   6.983  -4.724
   62   1HB   PRO   8          HB2       PRO   8   4.650   5.505  -4.644
   63   2HB   PRO   8          HB1       PRO   8   5.899   5.478  -5.897
   64   1HG   PRO   8          HG2       PRO   8   5.277   3.429  -3.981
   65   2HG   PRO   8          HG1       PRO   8   6.515   3.401  -5.239
   66   1HD   PRO   8          HD2       PRO   8   6.900   3.631  -2.393
   67   2HD   PRO   8          HD1       PRO   8   8.147   3.636  -3.666
   68    H    VAL   9           HN       VAL   9   5.378   5.876  -1.820
   69    HA   VAL   9           HA       VAL   9   4.061   8.570  -1.685
   70    HB   VAL   9           HB       VAL   9   3.108   5.956  -0.494
   71   1HG1  VAL   9          HG11      VAL   9   1.178   8.021  -1.272
   72   2HG1  VAL   9          HG12      VAL   9   2.322   8.571  -0.046
   73   3HG1  VAL   9          HG13      VAL   9   1.330   7.143   0.251
   74   1HG2  VAL   9          HG21      VAL   9   3.135   5.559  -2.845
   75   2HG2  VAL   9          HG22      VAL   9   2.603   7.203  -3.201
   76   3HG2  VAL   9          HG23      VAL   9   1.480   6.050  -2.478
   77    H    LYS  10           HN       LYS  10   4.059   9.602   0.360
   78    HA   LYS  10           HA       LYS  10   6.159   8.679   2.234
   79   1HB   LYS  10          HB2       LYS  10   4.700  11.171   1.531
   80   2HB   LYS  10          HB1       LYS  10   5.214  11.029   3.213
   81   1HG   LYS  10          HG2       LYS  10   7.501  10.815   2.611
   82   2HG   LYS  10          HG1       LYS  10   7.107  10.483   0.924
   83   1HD   LYS  10          HD2       LYS  10   5.918  12.974   1.524
   84   2HD   LYS  10          HD1       LYS  10   7.543  13.031   2.207
   85   1HE   LYS  10          HE2       LYS  10   7.003  12.082  -0.623
   86   2HE   LYS  10          HE1       LYS  10   7.392  13.768  -0.227
   87   1HZ   LYS  10          HZ1       LYS  10   9.407  13.083   0.822
   88   2HZ   LYS  10          HZ2       LYS  10   9.376  12.381  -0.726
   89   3HZ   LYS  10          HZ3       LYS  10   9.019  11.442   0.645
   90    H    LYS  11           HN       LYS  11   3.091   7.767   1.897
   91    HA   LYS  11           HA       LYS  11   2.735   7.242   4.776
   92   1HB   LYS  11          HB2       LYS  11   1.335   9.346   3.238
   93   2HB   LYS  11          HB1       LYS  11   0.278   8.313   4.202
   94   1HG   LYS  11          HG2       LYS  11   2.159   8.738   6.047
   95   2HG   LYS  11          HG1       LYS  11   2.416  10.202   5.095
   96   1HD   LYS  11          HD2       LYS  11   0.324  11.056   5.585
   97   2HD   LYS  11          HD1       LYS  11  -0.395   9.458   5.798
   98   1HE   LYS  11          HE2       LYS  11   1.311   9.359   7.857
   99   2HE   LYS  11          HE1       LYS  11   1.123  11.121   7.765
  100   1HZ   LYS  11          HZ1       LYS  11  -1.304   9.558   7.436
  101   2HZ   LYS  11          HZ2       LYS  11  -1.058  11.019   8.268
  102   3HZ   LYS  11          HZ3       LYS  11  -0.633   9.542   8.994
  103    H    ALA  12           HN       ALA  12   3.137   5.402   2.715
  104    HA   ALA  12           HA       ALA  12   0.503   4.402   1.815
  105   1HB   ALA  12          HB1       ALA  12   3.155   4.370   0.901
  106   2HB   ALA  12          HB2       ALA  12   1.792   3.515   0.179
  107   3HB   ALA  12          HB3       ALA  12   2.821   2.700   1.356
  108    H    THR  13           HN       THR  13  -0.523   2.615   2.714
  109    HA   THR  13           HA       THR  13   0.788   1.365   5.103
  110    HB   THR  13           HB       THR  13  -2.110   1.016   4.635
  111    HG1  THR  13           HG1      THR  13  -0.891   3.551   4.892
  112   1HG2  THR  13          HG21      THR  13  -0.280   1.816   6.891
  113   2HG2  THR  13          HG22      THR  13  -1.311   0.391   6.761
  114   3HG2  THR  13          HG23      THR  13  -2.029   1.978   7.042
  115    H    VAL  14           HN       VAL  14   1.884  -0.341   3.982
  116    HA   VAL  14           HA       VAL  14   0.226  -2.159   2.298
  117    HB   VAL  14           HB       VAL  14   2.458  -3.064   1.684
  118   1HG1  VAL  14          HG11      VAL  14   2.947  -1.311   0.271
  119   2HG1  VAL  14          HG12      VAL  14   2.837  -0.107   1.555
  120   3HG1  VAL  14          HG13      VAL  14   1.368  -0.768   0.837
  121   1HG2  VAL  14          HG21      VAL  14   3.260  -2.206   4.132
  122   2HG2  VAL  14          HG22      VAL  14   3.857  -0.881   3.131
  123   3HG2  VAL  14          HG23      VAL  14   4.380  -2.535   2.810
  124    H    VAL  15           HN       VAL  15   1.181  -4.590   2.662
  125    HA   VAL  15           HA       VAL  15   1.037  -5.125   5.612
  126    HB   VAL  15           HB       VAL  15  -0.092  -6.748   3.310
  127   1HG1  VAL  15          HG11      VAL  15  -1.019  -7.026   6.126
  128   2HG1  VAL  15          HG12      VAL  15   0.576  -7.676   5.747
  129   3HG1  VAL  15          HG13      VAL  15  -0.842  -8.256   4.873
  130   1HG2  VAL  15          HG21      VAL  15  -1.743  -5.202   3.298
  131   2HG2  VAL  15          HG22      VAL  15  -1.086  -4.400   4.724
  132   3HG2  VAL  15          HG23      VAL  15  -2.172  -5.776   4.910
  133    H    TYR  16           HN       TYR  16   3.391  -5.271   5.672
  134    HA   TYR  16           HA       TYR  16   4.803  -7.172   3.950
  135   1HB   TYR  16          HB2       TYR  16   5.443  -4.946   5.402
  136   2HB   TYR  16          HB1       TYR  16   6.000  -6.218   6.489
  137    HD1  TYR  16           HD1      TYR  16   7.591  -7.984   5.611
  138    HD2  TYR  16           HD2      TYR  16   6.635  -4.421   3.411
  139    HE1  TYR  16           HE1      TYR  16   9.602  -8.318   4.198
  140    HE2  TYR  16           HE2      TYR  16   8.643  -4.756   1.996
  141    HH   TYR  16           HH       TYR  16  11.089  -7.027   2.789
  142    H    GLN  17           HN       GLN  17   5.292  -9.306   4.474
  143    HA   GLN  17           HA       GLN  17   5.098 -11.365   5.623
  144   1HB   GLN  17          HB2       GLN  17   5.750  -9.318   7.753
  145   2HB   GLN  17          HB1       GLN  17   5.740 -11.053   8.078
  146   1HG   GLN  17          HG2       GLN  17   7.225 -10.769   5.714
  147   2HG   GLN  17          HG1       GLN  17   7.769  -9.454   6.757
  148   1HE2  GLN  17          HE21      GLN  17   6.701 -12.819   7.513
  149   2HE2  GLN  17          HE22      GLN  17   8.107 -13.225   8.374
  150    H    GLY  18           HN       GLY  18   2.610  -9.704   5.271
  151   1HA   GLY  18          HA2       GLY  18   0.352 -10.079   5.858
  152   2HA   GLY  18          HA1       GLY  18   0.903 -11.245   7.062
  153    H    GLU  19           HN       GLU  19   2.637  -8.419   7.473
  154    HA   GLU  19           HA       GLU  19   0.821  -7.585   9.702
  155   1HB   GLU  19          HB2       GLU  19   3.728  -7.868   9.269
  156   2HB   GLU  19          HB1       GLU  19   3.262  -6.398  10.126
  157   1HG   GLU  19          HG2       GLU  19   2.184  -9.111  10.908
  158   2HG   GLU  19          HG1       GLU  19   3.691  -8.477  11.572
  159    H    ARG  20           HN       ARG  20  -0.101  -5.574   9.583
  160    HA   ARG  20           HA       ARG  20   0.219  -3.917   7.232
  161   1HB   ARG  20          HB2       ARG  20  -1.049  -3.353   9.930
  162   2HB   ARG  20          HB1       ARG  20  -1.382  -2.487   8.427
  163   1HG   ARG  20          HG2       ARG  20  -2.638  -4.201   7.556
  164   2HG   ARG  20          HG1       ARG  20  -1.690  -5.449   8.366
  165   1HD   ARG  20          HD2       ARG  20  -3.248  -3.640  10.147
  166   2HD   ARG  20          HD1       ARG  20  -4.183  -4.797   9.179
  167    HE   ARG  20           HE       ARG  20  -1.893  -6.111  10.309
  168   1HH1  ARG  20          HH11      ARG  20  -4.116  -4.244  11.957
  169   2HH1  ARG  20          HH12      ARG  20  -4.757  -5.529  12.924
  170   1HH2  ARG  20          HH21      ARG  20  -3.087  -8.024  11.191
  171   2HH2  ARG  20          HH22      ARG  20  -4.176  -7.670  12.489
  172    H    VAL  21           HN       VAL  21   1.527  -2.112   6.961
  173    HA   VAL  21           HA       VAL  21   2.752  -0.765   9.275
  174    HB   VAL  21           HB       VAL  21   5.070  -1.278   8.207
  175   1HG1  VAL  21          HG11      VAL  21   3.730  -3.697   9.399
  176   2HG1  VAL  21          HG12      VAL  21   3.951  -2.235  10.361
  177   3HG1  VAL  21          HG13      VAL  21   5.353  -3.072   9.694
  178   1HG2  VAL  21          HG21      VAL  21   3.999  -2.289   6.141
  179   2HG2  VAL  21          HG22      VAL  21   3.499  -3.647   7.149
  180   3HG2  VAL  21          HG23      VAL  21   5.214  -3.309   6.911
  181    H    LYS  22           HN       LYS  22   4.053   1.135   8.543
  182    HA   LYS  22           HA       LYS  22   2.969   2.226   5.988
  183   1HB   LYS  22          HB2       LYS  22   4.026   3.303   8.585
  184   2HB   LYS  22          HB1       LYS  22   4.044   4.341   7.159
  185   1HG   LYS  22          HG2       LYS  22   1.514   2.875   7.606
  186   2HG   LYS  22          HG1       LYS  22   1.897   4.094   8.821
  187   1HD   LYS  22          HD2       LYS  22   2.521   5.404   6.483
  188   2HD   LYS  22          HD1       LYS  22   1.125   4.437   6.002
  189   1HE   LYS  22          HE2       LYS  22  -0.074   5.317   8.063
  190   2HE   LYS  22          HE1       LYS  22   1.276   6.452   8.266
  191   1HZ   LYS  22          HZ1       LYS  22   0.039   7.688   6.847
  192   2HZ   LYS  22          HZ2       LYS  22  -0.757   6.345   6.176
  193   3HZ   LYS  22          HZ3       LYS  22   0.820   6.738   5.679
  194    H    ILE  23           HN       ILE  23   4.335   2.034   4.255
  195    HA   ILE  23           HA       ILE  23   7.061   1.287   4.323
  196    HB   ILE  23           HB       ILE  23   5.557   1.195   2.365
  197   1HG1  ILE  23          HG12      ILE  23   7.996   2.962   1.975
  198   2HG1  ILE  23          HG11      ILE  23   7.974   1.198   1.951
  199   1HG2  ILE  23          HG21      ILE  23   5.220   3.400   1.119
  200   2HG2  ILE  23          HG22      ILE  23   5.738   4.205   2.600
  201   3HG2  ILE  23          HG23      ILE  23   4.286   3.205   2.602
  202   1HD1  ILE  23          HD11      ILE  23   6.928   3.135  -0.082
  203   2HD1  ILE  23          HD12      ILE  23   6.128   1.572   0.087
  204   3HD1  ILE  23          HD13      ILE  23   7.843   1.647  -0.323
  205    H    GLN  24           HN       GLN  24   5.571   4.466   4.637
  206    HA   GLN  24           HA       GLN  24   7.857   6.099   4.129
  207   1HB   GLN  24          HB2       GLN  24   6.546   7.778   5.362
  208   2HB   GLN  24          HB1       GLN  24   5.483   6.834   4.312
  209   1HG   GLN  24          HG2       GLN  24   4.354   5.953   6.065
  210   2HG   GLN  24          HG1       GLN  24   5.837   5.642   6.970
  211   1HE2  GLN  24          HE21      GLN  24   3.038   7.423   7.141
  212   2HE2  GLN  24          HE22      GLN  24   3.587   8.724   8.083
  213    H    GLU  25           HN       GLU  25   7.124   3.986   6.764
  214    HA   GLU  25           HA       GLU  25   9.263   5.263   8.432
  215   1HB   GLU  25          HB2       GLU  25   6.780   3.654   9.032
  216   2HB   GLU  25          HB1       GLU  25   8.051   3.856  10.239
  217   1HG   GLU  25          HG2       GLU  25   7.833   6.279  10.131
  218   2HG   GLU  25          HG1       GLU  25   6.660   6.146   8.819
  219    H    LYS  26           HN       LYS  26   7.892   2.082   7.516
  220    HA   LYS  26           HA       LYS  26  10.014   0.481   8.558
  221   1HB   LYS  26          HB2       LYS  26   7.756  -0.290   7.866
  222   2HB   LYS  26          HB1       LYS  26   8.180   0.036   6.182
  223   1HG   LYS  26          HG2       LYS  26   9.128  -1.995   6.030
  224   2HG   LYS  26          HG1       LYS  26  10.266  -1.552   7.303
  225   1HD   LYS  26          HD2       LYS  26   8.011  -2.042   8.768
  226   2HD   LYS  26          HD1       LYS  26   7.824  -3.206   7.456
  227   1HE   LYS  26          HE2       LYS  26   9.305  -4.546   8.528
  228   2HE   LYS  26          HE1       LYS  26  10.553  -3.320   8.230
  229   1HZ   LYS  26          HZ1       LYS  26   9.990  -3.903  10.654
  230   2HZ   LYS  26          HZ2       LYS  26   8.589  -2.974  10.406
  231   3HZ   LYS  26          HZ3       LYS  26  10.123  -2.265  10.233
  232    H    PHE  27           HN       PHE  27   9.833   2.508   5.751
  233    HA   PHE  27           HA       PHE  27  12.555   1.582   4.931
  234   1HB   PHE  27          HB2       PHE  27  10.056   1.900   3.245
  235   2HB   PHE  27          HB1       PHE  27  11.674   1.798   2.543
  236    HD1  PHE  27           HD1      PHE  27  13.148  -0.199   3.676
  237    HD2  PHE  27           HD2      PHE  27   8.868  -0.093   3.338
  238    HE1  PHE  27           HE1      PHE  27  13.073  -2.672   3.854
  239    HE2  PHE  27           HE2      PHE  27   8.792  -2.566   3.517
  240    HZ   PHE  27           HZ       PHE  27  10.894  -3.855   3.775
  241    H    LYS  28           HN       LYS  28  12.379   3.823   6.409
  242    HA   LYS  28           HA       LYS  28  11.658   6.296   5.375
  243   1HB   LYS  28          HB2       LYS  28  13.206   5.286   7.440
  244   2HB   LYS  28          HB1       LYS  28  14.363   6.245   6.516
  245   1HG   LYS  28          HG2       LYS  28  13.496   7.913   7.852
  246   2HG   LYS  28          HG1       LYS  28  12.342   7.994   6.520
  247   1HD   LYS  28          HD2       LYS  28  10.639   7.170   7.781
  248   2HD   LYS  28          HD1       LYS  28  11.680   5.989   8.580
  249   1HE   LYS  28          HE2       LYS  28  12.695   8.131   9.761
  250   2HE   LYS  28          HE1       LYS  28  11.121   8.838   9.345
  251   1HZ   LYS  28          HZ1       LYS  28  10.158   6.677  10.233
  252   2HZ   LYS  28          HZ2       LYS  28  10.760   7.772  11.382
  253   3HZ   LYS  28          HZ3       LYS  28  11.674   6.409  10.944
  254    H    ASN  29           HN       ASN  29  14.665   4.497   4.637
  255    HA   ASN  29           HA       ASN  29  15.309   6.487   2.513
  256   1HB   ASN  29          HB2       ASN  29  16.793   4.248   3.908
  257   2HB   ASN  29          HB1       ASN  29  17.475   5.121   2.532
  258   1HD2  ASN  29          HD21      ASN  29  16.471   5.460   5.922
  259   2HD2  ASN  29          HD22      ASN  29  17.229   6.957   6.177
  260    H    GLY  30           HN       GLY  30  13.126   5.094   1.714
  261   1HA   GLY  30          HA2       GLY  30  12.372   3.836  -0.123
  262   2HA   GLY  30          HA1       GLY  30  14.057   3.677  -0.625
  263    H    MET  31           HN       MET  31  12.526   1.465  -0.950
  264    HA   MET  31           HA       MET  31  12.938  -0.275   1.435
  265   1HB   MET  31          HB2       MET  31  11.552  -0.829  -1.208
  266   2HB   MET  31          HB1       MET  31  11.377  -1.737   0.295
  267   1HG   MET  31          HG2       MET  31  10.673   0.630   1.258
  268   2HG   MET  31          HG1       MET  31  10.284   0.954  -0.430
  269   1HE   MET  31          HE1       MET  31   9.569  -0.898  -1.804
  270   2HE   MET  31          HE2       MET  31   7.816  -0.792  -1.662
  271   3HE   MET  31          HE3       MET  31   8.630  -2.316  -1.317
  272    H    LEU  32           HN       LEU  32  13.134  -2.719  -0.045
  273    HA   LEU  32           HA       LEU  32  15.892  -2.441  -1.192
  274   1HB   LEU  32          HB2       LEU  32  14.482  -4.512   0.483
  275   2HB   LEU  32          HB1       LEU  32  15.928  -4.935  -0.438
  276    HG   LEU  32           HG       LEU  32  16.814  -2.673   0.714
  277   1HD1  LEU  32          HD11      LEU  32  14.441  -2.677   1.889
  278   2HD1  LEU  32          HD12      LEU  32  15.882  -2.213   2.793
  279   3HD1  LEU  32          HD13      LEU  32  15.216  -3.836   2.969
  280   1HD2  LEU  32          HD21      LEU  32  17.896  -4.879   0.841
  281   2HD2  LEU  32          HD22      LEU  32  16.706  -5.405   2.031
  282   3HD2  LEU  32          HD23      LEU  32  17.852  -4.129   2.436
  283    H    HIS  33           HN       HIS  33  16.398  -3.889  -2.994
  284    HA   HIS  33           HA       HIS  33  14.333  -4.076  -4.979
  285   1HB   HIS  33          HB2       HIS  33  16.628  -3.862  -5.623
  286   2HB   HIS  33          HB1       HIS  33  17.101  -5.253  -4.643
  287    HD1  HIS  33           HD1      HIS  33  14.117  -5.162  -6.972
  288    HD2  HIS  33           HD2      HIS  33  17.868  -6.963  -6.734
  289    HE1  HIS  33           HE1      HIS  33  14.213  -6.867  -8.842
  290    H    GLY  34           HN       GLY  34  12.976  -5.782  -5.502
  291   1HA   GLY  34          HA2       GLY  34  12.132  -8.000  -5.498
  292   2HA   GLY  34          HA1       GLY  34  13.482  -8.482  -4.473
  293    H    ASP  35           HN       ASP  35  12.218  -5.769  -3.064
  294    HA   ASP  35           HA       ASP  35  11.193  -7.104  -0.771
  295   1HB   ASP  35          HB2       ASP  35  11.111  -4.360  -1.962
  296   2HB   ASP  35          HB1       ASP  35  10.034  -4.698  -0.606
  297    H    LYS  36           HN       LYS  36   9.000  -7.478  -0.098
  298    HA   LYS  36           HA       LYS  36   6.960  -7.353  -2.298
  299   1HB   LYS  36          HB2       LYS  36   7.893  -9.534  -0.493
  300   2HB   LYS  36          HB1       LYS  36   6.172  -9.488  -0.876
  301   1HG   LYS  36          HG2       LYS  36   7.311  -9.055  -3.341
  302   2HG   LYS  36          HG1       LYS  36   8.457 -10.173  -2.602
  303   1HD   LYS  36          HD2       LYS  36   7.003 -11.903  -2.711
  304   2HD   LYS  36          HD1       LYS  36   5.665 -10.919  -2.116
  305   1HE   LYS  36          HE2       LYS  36   6.357 -10.031  -4.768
  306   2HE   LYS  36          HE1       LYS  36   6.091 -11.786  -4.785
  307   1HZ   LYS  36          HZ1       LYS  36   3.952 -10.904  -4.944
  308   2HZ   LYS  36          HZ2       LYS  36   4.271  -9.658  -3.834
  309   3HZ   LYS  36          HZ3       LYS  36   4.105 -11.259  -3.293
  310    H    VAL  37           HN       VAL  37   5.227  -6.151  -1.709
  311    HA   VAL  37           HA       VAL  37   4.360  -6.128   1.150
  312    HB   VAL  37           HB       VAL  37   4.188  -3.666   1.021
  313   1HG1  VAL  37          HG11      VAL  37   6.362  -3.427   1.618
  314   2HG1  VAL  37          HG12      VAL  37   6.942  -3.963   0.040
  315   3HG1  VAL  37          HG13      VAL  37   6.503  -5.151   1.268
  316   1HG2  VAL  37          HG21      VAL  37   4.505  -4.223  -1.797
  317   2HG2  VAL  37          HG22      VAL  37   5.751  -3.092  -1.268
  318   3HG2  VAL  37          HG23      VAL  37   4.049  -2.709  -1.016
  319    H    SER  38           HN       SER  38   2.080  -5.894   1.363
  320    HA   SER  38           HA       SER  38   0.560  -6.110  -1.202
  321   1HB   SER  38          HB2       SER  38  -0.685  -6.617   1.454
  322   2HB   SER  38          HB1       SER  38  -0.824  -7.536  -0.046
  323    HG   SER  38           HG       SER  38   1.067  -7.676   1.995
  324    H    PHE  39           HN       PHE  39  -1.078  -4.625  -1.678
  325    HA   PHE  39           HA       PHE  39  -1.251  -2.237   0.107
  326   1HB   PHE  39          HB2       PHE  39  -1.738  -2.832  -2.808
  327   2HB   PHE  39          HB1       PHE  39  -2.396  -1.366  -2.075
  328    HD1  PHE  39           HD1      PHE  39  -0.870   0.318  -1.052
  329    HD2  PHE  39           HD2      PHE  39   0.618  -3.074  -3.226
  330    HE1  PHE  39           HE1      PHE  39   1.347   1.413  -1.242
  331    HE2  PHE  39           HE2      PHE  39   2.835  -1.980  -3.417
  332    HZ   PHE  39           HZ       PHE  39   3.200   0.264  -2.425
  333    H    PHE  40           HN       PHE  40  -3.445  -1.317   0.472
  334    HA   PHE  40           HA       PHE  40  -5.448  -3.484   0.816
  335   1HB   PHE  40          HB2       PHE  40  -4.836  -0.803   1.979
  336   2HB   PHE  40          HB1       PHE  40  -6.519  -1.340   2.030
  337    HD1  PHE  40           HD1      PHE  40  -3.379  -1.495   3.670
  338    HD2  PHE  40           HD2      PHE  40  -6.889  -3.825   2.836
  339    HE1  PHE  40           HE1      PHE  40  -2.854  -2.973   5.591
  340    HE2  PHE  40           HE2      PHE  40  -6.365  -5.303   4.756
  341    HZ   PHE  40           HZ       PHE  40  -4.348  -4.877   6.134
  342    H    CYS  41           HN       CYS  41  -7.354  -3.542  -0.322
  343    HA   CYS  41           HA       CYS  41  -8.155  -1.160  -1.939
  344   1HB   CYS  41          HB2       CYS  41  -6.732  -3.029  -3.123
  345   2HB   CYS  41          HB1       CYS  41  -8.243  -3.945  -3.077
  346    H    LYS  42           HN       LYS  42 -10.434  -1.854  -3.018
  347    HA   LYS  42           HA       LYS  42 -12.030  -3.203  -0.862
  348   1HB   LYS  42          HB2       LYS  42 -13.819  -1.585  -1.544
  349   2HB   LYS  42          HB1       LYS  42 -12.368  -0.798  -0.920
  350   1HG   LYS  42          HG2       LYS  42 -12.366  -1.299  -3.835
  351   2HG   LYS  42          HG1       LYS  42 -13.556  -0.121  -3.278
  352   1HD   LYS  42          HD2       LYS  42 -10.744   0.058  -2.248
  353   2HD   LYS  42          HD1       LYS  42 -11.104   0.660  -3.866
  354   1HE   LYS  42          HE2       LYS  42 -12.858   1.474  -1.553
  355   2HE   LYS  42          HE1       LYS  42 -11.327   2.320  -1.855
  356   1HZ   LYS  42          HZ1       LYS  42 -13.720   2.159  -3.532
  357   2HZ   LYS  42          HZ2       LYS  42 -12.212   2.194  -4.316
  358   3HZ   LYS  42          HZ3       LYS  42 -12.666   3.463  -3.280
  359    H    ASN  43           HN       ASN  43 -13.617  -4.632  -1.527
  360    HA   ASN  43           HA       ASN  43 -13.631  -5.338  -4.441
  361   1HB   ASN  43          HB2       ASN  43 -12.828  -6.906  -2.509
  362   2HB   ASN  43          HB1       ASN  43 -14.552  -7.093  -2.168
  363   1HD2  ASN  43          HD21      ASN  43 -11.986  -7.925  -4.416
  364   2HD2  ASN  43          HD22      ASN  43 -12.929  -8.916  -5.421
  365    H    LYS  44           HN       LYS  44 -15.565  -5.110  -5.519
  366    HA   LYS  44           HA       LYS  44 -17.918  -4.129  -4.034
  367   1HB   LYS  44          HB2       LYS  44 -18.740  -3.644  -6.266
  368   2HB   LYS  44          HB1       LYS  44 -17.036  -3.193  -6.207
  369   1HG   LYS  44          HG2       LYS  44 -16.468  -5.440  -7.170
  370   2HG   LYS  44          HG1       LYS  44 -18.195  -5.742  -7.366
  371   1HD   LYS  44          HD2       LYS  44 -17.279  -3.152  -8.445
  372   2HD   LYS  44          HD1       LYS  44 -16.614  -4.563  -9.268
  373   1HE   LYS  44          HE2       LYS  44 -19.270  -5.270  -8.970
  374   2HE   LYS  44          HE1       LYS  44 -19.366  -3.528  -9.294
  375   1HZ   LYS  44          HZ1       LYS  44 -17.586  -4.028 -11.055
  376   2HZ   LYS  44          HZ2       LYS  44 -19.196  -4.441 -11.408
  377   3HZ   LYS  44          HZ3       LYS  44 -18.096  -5.640 -10.920
  378    H    GLU  45           HN       GLU  45 -17.031  -6.943  -6.046
  379    HA   GLU  45           HA       GLU  45 -19.626  -8.209  -5.903
  380   1HB   GLU  45          HB2       GLU  45 -17.411  -8.493  -7.402
  381   2HB   GLU  45          HB1       GLU  45 -17.114  -9.783  -6.237
  382   1HG   GLU  45          HG2       GLU  45 -19.065 -10.947  -6.835
  383   2HG   GLU  45          HG1       GLU  45 -19.801  -9.522  -7.569
  384    H    LYS  46           HN       LYS  46 -17.008  -7.923  -3.673
  385    HA   LYS  46           HA       LYS  46 -18.060 -10.215  -2.054
  386   1HB   LYS  46          HB2       LYS  46 -15.399  -8.774  -2.191
  387   2HB   LYS  46          HB1       LYS  46 -15.778  -9.973  -0.951
  388   1HG   LYS  46          HG2       LYS  46 -16.273 -10.711  -3.805
  389   2HG   LYS  46          HG1       LYS  46 -14.603 -10.678  -3.241
  390   1HD   LYS  46          HD2       LYS  46 -16.677 -12.065  -1.575
  391   2HD   LYS  46          HD1       LYS  46 -16.029 -12.884  -2.997
  392   1HE   LYS  46          HE2       LYS  46 -13.786 -12.796  -2.146
  393   2HE   LYS  46          HE1       LYS  46 -14.255 -11.669  -0.856
  394   1HZ   LYS  46          HZ1       LYS  46 -14.833 -14.533  -1.118
  395   2HZ   LYS  46          HZ2       LYS  46 -15.988 -13.548  -0.357
  396   3HZ   LYS  46          HZ3       LYS  46 -14.409 -13.644   0.262
  397    H    LYS  47           HN       LYS  47 -17.567  -6.767  -2.141
  398    HA   LYS  47           HA       LYS  47 -18.374  -5.089  -0.682
  399   1HB   LYS  47          HB2       LYS  47 -19.498  -7.334   0.993
  400   2HB   LYS  47          HB1       LYS  47 -20.143  -5.708   0.763
  401   1HG   LYS  47          HG2       LYS  47 -19.977  -6.847  -1.819
  402   2HG   LYS  47          HG1       LYS  47 -20.671  -8.093  -0.780
  403   1HD   LYS  47          HD2       LYS  47 -22.516  -6.779  -0.208
  404   2HD   LYS  47          HD1       LYS  47 -21.681  -5.271  -0.583
  405   1HE   LYS  47          HE2       LYS  47 -21.637  -6.262  -3.040
  406   2HE   LYS  47          HE1       LYS  47 -23.022  -7.203  -2.449
  407   1HZ   LYS  47          HZ1       LYS  47 -24.225  -5.319  -1.977
  408   2HZ   LYS  47          HZ2       LYS  47 -23.394  -4.812  -3.369
  409   3HZ   LYS  47          HZ3       LYS  47 -22.853  -4.333  -1.831
  410    H    CYS  48           HN       CYS  48 -15.763  -6.529  -0.290
  411    HA   CYS  48           HA       CYS  48 -15.284  -5.603   2.501
  412   1HB   CYS  48          HB2       CYS  48 -14.023  -8.182   1.708
  413   2HB   CYS  48          HB1       CYS  48 -14.579  -7.648   3.292
  414    H    SER  49           HN       SER  49 -12.783  -5.754   2.903
  415    HA   SER  49           HA       SER  49 -11.429  -4.757   0.439
  416   1HB   SER  49          HB2       SER  49 -10.389  -3.314   1.872
  417   2HB   SER  49          HB1       SER  49 -11.677  -3.767   2.984
  418    HG   SER  49           HG       SER  49  -9.106  -4.953   2.749
  419    H    TYR  50           HN       TYR  50  -9.019  -5.336   0.397
  420    HA   TYR  50           HA       TYR  50  -8.225  -7.870   1.656
  421   1HB   TYR  50          HB2       TYR  50  -7.942  -8.954  -0.621
  422   2HB   TYR  50          HB1       TYR  50  -9.621  -8.699  -0.137
  423    HD1  TYR  50           HD1      TYR  50 -11.065  -7.274  -1.380
  424    HD2  TYR  50           HD2      TYR  50  -6.846  -7.300  -2.188
  425    HE1  TYR  50           HE1      TYR  50 -11.445  -5.914  -3.419
  426    HE2  TYR  50           HE2      TYR  50  -7.227  -5.938  -4.226
  427    HH   TYR  50           HH       TYR  50  -9.015  -5.433  -5.786
  428    H    THR  51           HN       THR  51  -5.966  -8.510   0.645
  429    HA   THR  51           HA       THR  51  -4.447  -5.963   0.278
  430    HB   THR  51           HB       THR  51  -2.532  -7.560   0.947
  431    HG1  THR  51           HG1      THR  51  -3.080  -9.514   1.596
  432   1HG2  THR  51          HG21      THR  51  -2.856  -6.967   3.149
  433   2HG2  THR  51          HG22      THR  51  -4.551  -7.453   3.141
  434   3HG2  THR  51          HG23      THR  51  -4.068  -5.926   2.403
  435    H    GLU  52           HN       GLU  52  -3.007  -5.747  -1.447
  436    HA   GLU  52           HA       GLU  52  -3.134  -7.883  -3.556
  437   1HB   GLU  52          HB2       GLU  52  -3.761  -5.081  -3.533
  438   2HB   GLU  52          HB1       GLU  52  -2.376  -5.329  -4.598
  439   1HG   GLU  52          HG2       GLU  52  -3.559  -6.884  -5.952
  440   2HG   GLU  52          HG1       GLU  52  -4.836  -7.078  -4.751
  441    H    ASP  53           HN       ASP  53  -1.210  -8.896  -2.649
  442    HA   ASP  53           HA       ASP  53   1.190  -7.864  -1.840
  443   1HB   ASP  53          HB2       ASP  53   0.772 -10.099  -3.843
  444   2HB   ASP  53          HB1       ASP  53   2.194  -9.891  -2.816
  445    H    ALA  54           HN       ALA  54   3.013  -6.961  -2.762
  446    HA   ALA  54           HA       ALA  54   3.031  -6.430  -5.704
  447   1HB   ALA  54          HB1       ALA  54   2.203  -4.380  -4.987
  448   2HB   ALA  54          HB2       ALA  54   3.929  -4.077  -4.794
  449   3HB   ALA  54          HB3       ALA  54   2.951  -4.522  -3.397
  450    H    GLN  55           HN       GLN  55   5.298  -5.728  -6.392
  451    HA   GLN  55           HA       GLN  55   7.388  -6.631  -4.452
  452   1HB   GLN  55          HB2       GLN  55   6.573  -8.392  -6.124
  453   2HB   GLN  55          HB1       GLN  55   7.311  -7.396  -7.378
  454   1HG   GLN  55          HG2       GLN  55   9.491  -7.642  -6.419
  455   2HG   GLN  55          HG1       GLN  55   8.832  -8.349  -4.943
  456   1HE2  GLN  55          HE21      GLN  55   8.236  -9.064  -8.434
  457   2HE2  GLN  55          HE22      GLN  55   8.575 -10.721  -8.300
  458    H    CYS  56           HN       CYS  56   9.552  -5.857  -4.988
  459    HA   CYS  56           HA       CYS  56   9.477  -3.328  -6.578
  460   1HB   CYS  56          HB2       CYS  56   9.892  -2.964  -4.238
  461   2HB   CYS  56          HB1       CYS  56  11.093  -4.256  -4.198
  462    H    ILE  57           HN       ILE  57  11.504  -2.766  -7.684
  463    HA   ILE  57           HA       ILE  57  13.053  -5.179  -8.557
  464    HB   ILE  57           HB       ILE  57  12.229  -2.776 -10.216
  465   1HG1  ILE  57          HG12      ILE  57  10.700  -4.720 -11.211
  466   2HG1  ILE  57          HG11      ILE  57  10.833  -5.342  -9.567
  467   1HG2  ILE  57          HG21      ILE  57  13.596  -5.399 -10.758
  468   2HG2  ILE  57          HG22      ILE  57  14.023  -3.785 -11.327
  469   3HG2  ILE  57          HG23      ILE  57  12.643  -4.632 -12.028
  470   1HD1  ILE  57          HD11      ILE  57  10.139  -2.452 -10.020
  471   2HD1  ILE  57          HD12      ILE  57   9.767  -3.479  -8.635
  472   3HD1  ILE  57          HD13      ILE  57   8.887  -3.687 -10.150
  473    H    ASP  58           HN       ASP  58  15.107  -4.274  -9.811
  474    HA   ASP  58           HA       ASP  58  16.909  -3.142  -8.020
  475   1HB   ASP  58          HB2       ASP  58  17.086  -4.259 -10.397
  476   2HB   ASP  58          HB1       ASP  58  17.094  -2.586 -10.964
  477    H    GLY  59           HN       GLY  59  15.826  -1.285  -6.982
  478   1HA   GLY  59          HA2       GLY  59  15.910   1.065  -6.694
  479   2HA   GLY  59          HA1       GLY  59  16.481   1.215  -8.350
  480    H    THR  60           HN       THR  60  14.139  -0.338  -9.417
  481    HA   THR  60           HA       THR  60  12.154   1.892  -9.165
  482    HB   THR  60           HB       THR  60  12.613  -0.138 -11.365
  483    HG1  THR  60           HG1      THR  60  13.486   2.511 -10.941
  484   1HG2  THR  60          HG21      THR  60  11.327   2.152 -12.340
  485   2HG2  THR  60          HG22      THR  60  10.515   1.789 -10.818
  486   3HG2  THR  60          HG23      THR  60  10.601   0.566 -12.085
  487    H    ILE  61           HN       ILE  61   9.990   1.404  -8.757
  488    HA   ILE  61           HA       ILE  61   9.166  -1.449  -8.573
  489    HB   ILE  61           HB       ILE  61  10.133  -0.659  -6.399
  490   1HG1  ILE  61          HG12      ILE  61   8.013  -2.263  -6.836
  491   2HG1  ILE  61          HG11      ILE  61   8.616  -1.917  -5.219
  492   1HG2  ILE  61          HG21      ILE  61   9.462   1.695  -6.564
  493   2HG2  ILE  61          HG22      ILE  61   8.816   0.979  -5.087
  494   3HG2  ILE  61          HG23      ILE  61   7.763   1.230  -6.478
  495   1HD1  ILE  61          HD11      ILE  61   6.373  -0.421  -6.608
  496   2HD1  ILE  61          HD12      ILE  61   6.949  -0.133  -4.966
  497   3HD1  ILE  61          HD13      ILE  61   6.158  -1.657  -5.369
  498    H    GLU  62           HN       GLU  62   6.829  -1.672  -8.532
  499    HA   GLU  62           HA       GLU  62   5.398   0.773  -9.524
  500   1HB   GLU  62          HB2       GLU  62   4.922  -2.168 -10.110
  501   2HB   GLU  62          HB1       GLU  62   4.086  -0.812 -10.867
  502   1HG   GLU  62          HG2       GLU  62   6.049  -0.086 -11.988
  503   2HG   GLU  62          HG1       GLU  62   7.093  -1.083 -10.974
  504    H    VAL  63           HN       VAL  63   3.288   1.145  -8.701
  505    HA   VAL  63           HA       VAL  63   2.583  -0.469  -6.277
  506    HB   VAL  63           HB       VAL  63   3.225   1.877  -5.897
  507   1HG1  VAL  63          HG11      VAL  63   1.783   2.260  -8.321
  508   2HG1  VAL  63          HG12      VAL  63   2.675   3.465  -7.392
  509   3HG1  VAL  63          HG13      VAL  63   0.962   3.194  -7.071
  510   1HG2  VAL  63          HG21      VAL  63   1.462   0.892  -4.473
  511   2HG2  VAL  63          HG22      VAL  63   0.236   1.418  -5.626
  512   3HG2  VAL  63          HG23      VAL  63   1.173   2.613  -4.729
  513    HA   PRO  64           HA       PRO  64  -1.051  -1.780  -8.477
  514   1HB   PRO  64          HB2       PRO  64  -2.510  -2.041  -6.012
  515   2HB   PRO  64          HB1       PRO  64  -1.754  -3.321  -6.969
  516   1HG   PRO  64          HG2       PRO  64  -0.903  -2.291  -4.433
  517   2HG   PRO  64          HG1       PRO  64  -0.135  -3.550  -5.404
  518   1HD   PRO  64          HD2       PRO  64   0.789  -0.850  -4.945
  519   2HD   PRO  64          HD1       PRO  64   1.572  -2.128  -5.907
  520    H    LYS  65           HN       LYS  65  -2.434  -0.340  -9.468
  521    HA   LYS  65           HA       LYS  65  -3.028   2.273  -8.747
  522   1HB   LYS  65          HB2       LYS  65  -5.082   1.920 -10.154
  523   2HB   LYS  65          HB1       LYS  65  -3.622   1.255 -10.887
  524   1HG   LYS  65          HG2       LYS  65  -4.195  -0.975 -10.197
  525   2HG   LYS  65          HG1       LYS  65  -5.517  -0.385  -9.190
  526   1HD   LYS  65          HD2       LYS  65  -6.837  -0.781 -10.987
  527   2HD   LYS  65          HD1       LYS  65  -6.125   0.684 -11.664
  528   1HE   LYS  65          HE2       LYS  65  -5.688  -0.869 -13.368
  529   2HE   LYS  65          HE1       LYS  65  -4.197  -0.990 -12.411
  530   1HZ   LYS  65          HZ1       LYS  65  -4.976  -3.186 -12.624
  531   2HZ   LYS  65          HZ2       LYS  65  -6.585  -2.743 -12.301
  532   3HZ   LYS  65          HZ3       LYS  65  -5.427  -2.712 -11.058
  533    H    CYS  66           HN       CYS  66  -4.352  -0.668  -7.385
  534    HA   CYS  66           HA       CYS  66  -6.747   0.205  -6.205
  535   1HB   CYS  66          HB2       CYS  66  -4.698  -1.860  -5.819
  536   2HB   CYS  66          HB1       CYS  66  -5.535  -1.442  -4.324
  537    H    PHE  67           HN       PHE  67  -3.403   0.768  -5.169
  538    HA   PHE  67           HA       PHE  67  -3.699   1.706  -2.564
  539   1HB   PHE  67          HB2       PHE  67  -1.548   1.561  -3.581
  540   2HB   PHE  67          HB1       PHE  67  -2.025   2.614  -4.913
  541    HD1  PHE  67           HD1      PHE  67  -1.955   2.708  -1.156
  542    HD2  PHE  67           HD2      PHE  67  -1.255   4.800  -4.840
  543    HE1  PHE  67           HE1      PHE  67  -1.164   4.684   0.116
  544    HE2  PHE  67           HE2      PHE  67  -0.464   6.777  -3.569
  545    HZ   PHE  67           HZ       PHE  67  -0.419   6.719  -1.090
  546    H    LYS  68           HN       LYS  68  -4.752   3.441  -1.644
  547    HA   LYS  68           HA       LYS  68  -6.566   5.081  -3.137
  548   1HB   LYS  68          HB2       LYS  68  -6.718   6.280  -0.937
  549   2HB   LYS  68          HB1       LYS  68  -6.838   4.527  -0.774
  550   1HG   LYS  68          HG2       LYS  68  -4.987   4.453   0.506
  551   2HG   LYS  68          HG1       LYS  68  -4.065   5.369  -0.689
  552   1HD   LYS  68          HD2       LYS  68  -4.207   7.243   0.551
  553   2HD   LYS  68          HD1       LYS  68  -5.961   7.094   0.659
  554   1HE   LYS  68          HE2       LYS  68  -5.645   6.649   2.867
  555   2HE   LYS  68          HE1       LYS  68  -5.002   5.077   2.351
  556   1HZ   LYS  68          HZ1       LYS  68  -3.353   6.258   3.654
  557   2HZ   LYS  68          HZ2       LYS  68  -3.450   7.600   2.617
  558   3HZ   LYS  68          HZ3       LYS  68  -2.829   6.125   2.046
  559    H    GLU  69           HN       GLU  69  -4.819   5.778  -4.802
  560    HA   GLU  69           HA       GLU  69  -2.993   7.907  -3.858
  561   1HB   GLU  69          HB2       GLU  69  -2.332   6.172  -5.515
  562   2HB   GLU  69          HB1       GLU  69  -3.577   6.769  -6.612
  563   1HG   GLU  69          HG2       GLU  69  -1.190   7.642  -6.995
  564   2HG   GLU  69          HG1       GLU  69  -2.467   8.853  -6.907
  565    H    HIS  70           HN       HIS  70  -5.940   8.354  -3.707
  566    HA   HIS  70           HA       HIS  70  -6.471  10.305  -5.874
  567   1HB   HIS  70          HB2       HIS  70  -7.946   8.699  -3.932
  568   2HB   HIS  70          HB1       HIS  70  -8.532  10.363  -3.987
  569    HD1  HIS  70           HD1      HIS  70 -10.713   9.352  -5.177
  570    HD2  HIS  70           HD2      HIS  70  -7.183   9.064  -7.377
  571    HE1  HIS  70           HE1      HIS  70 -11.394   8.845  -7.564
  572    H    SER  71           HN       SER  71  -7.441  12.481  -5.076
  573    HA   SER  71           HA       SER  71  -5.993  13.455  -2.638
  574   1HB   SER  71          HB2       SER  71  -5.128  15.283  -3.883
  575   2HB   SER  71          HB1       SER  71  -4.930  13.898  -4.958
  576    HG   SER  71           HG       SER  71  -7.259  14.660  -5.551
  577    H    SER  72           HN       SER  72  -7.815  13.772  -1.342
  578    HA   SER  72           HA       SER  72  -9.838  14.746  -0.605
  579   1HB   SER  72          HB2       SER  72  -8.439  16.670  -2.399
  580   2HB   SER  72          HB1       SER  72 -10.100  17.061  -1.963
  581    HG   SER  72           HG       SER  72  -9.004  16.279   0.253
  582    H    LEU  73           HN       LEU  73 -10.266  16.239  -3.740
  583    HA   LEU  73           HA       LEU  73 -11.958  15.946  -5.364
  584   1HB   LEU  73          HB2       LEU  73 -11.226  13.164  -4.450
  585   2HB   LEU  73          HB1       LEU  73 -12.436  13.416  -5.713
  586    HG   LEU  73           HG       LEU  73  -9.667  14.635  -5.819
  587   1HD1  LEU  73          HD11      LEU  73 -10.660  12.113  -7.180
  588   2HD1  LEU  73          HD12      LEU  73  -9.567  12.139  -5.796
  589   3HD1  LEU  73          HD13      LEU  73  -9.055  12.826  -7.339
  590   1HD2  LEU  73          HD21      LEU  73 -11.732  14.109  -7.980
  591   2HD2  LEU  73          HD22      LEU  73 -10.217  14.995  -8.162
  592   3HD2  LEU  73          HD23      LEU  73 -11.517  15.663  -7.174
  593    H    ALA  74           HN       ALA  74 -14.204  14.457  -5.532
  594    HA   ALA  74           HA       ALA  74 -16.077  15.569  -3.791
  595   1HB   ALA  74          HB1       ALA  74 -17.520  14.189  -4.932
  596   2HB   ALA  74          HB2       ALA  74 -16.530  12.758  -4.649
  597   3HB   ALA  74          HB3       ALA  74 -16.095  13.892  -5.926
  598    H    PHE  75           HN       PHE  75 -17.435  14.227  -2.145
  599    HA   PHE  75           HA       PHE  75 -15.531  12.874  -0.270
  600   1HB   PHE  75          HB2       PHE  75 -17.608  14.888  -0.073
  601   2HB   PHE  75          HB1       PHE  75 -17.949  13.545   1.017
  602    HD1  PHE  75           HD1      PHE  75 -15.080  15.695  -0.097
  603    HD2  PHE  75           HD2      PHE  75 -16.921  13.511   3.111
  604    HE1  PHE  75           HE1      PHE  75 -13.334  16.512   1.462
  605    HE2  PHE  75           HE2      PHE  75 -15.175  14.329   4.670
  606    HZ   PHE  75           HZ       PHE  75 -13.380  15.830   3.846
  607    H    TRP  76           HN       TRP  76 -17.582  11.733   1.361
  608    HA   TRP  76           HA       TRP  76 -18.908   9.784   1.522
  609   1HB   TRP  76          HB2       TRP  76 -19.611  11.202  -0.930
  610   2HB   TRP  76          HB1       TRP  76 -19.926   9.469  -1.049
  611    HD1  TRP  76           HD1      TRP  76 -20.579  12.359   1.431
  612    HE1  TRP  76           HE1      TRP  76 -22.850  11.936   2.580
  613    HE3  TRP  76           HE3      TRP  76 -21.761   7.852  -0.625
  614    HZ2  TRP  76           HZ2      TRP  76 -24.898   9.932   2.620
  615    HZ3  TRP  76           HZ3      TRP  76 -23.873   6.699  -0.018
  616    HH2  TRP  76           HH2      TRP  76 -25.440   7.733   1.602
  617    H    LYS  77           HN       LYS  77 -16.550   8.841   1.549
  618    HA   LYS  77           HA       LYS  77 -16.497   6.494  -0.160
  619   1HB   LYS  77          HB2       LYS  77 -15.765   8.531  -1.581
  620   2HB   LYS  77          HB1       LYS  77 -14.290   8.507  -0.613
  621   1HG   LYS  77          HG2       LYS  77 -14.157   5.999  -1.233
  622   2HG   LYS  77          HG1       LYS  77 -15.334   6.389  -2.488
  623   1HD   LYS  77          HD2       LYS  77 -13.631   8.369  -2.986
  624   2HD   LYS  77          HD1       LYS  77 -12.486   7.266  -2.221
  625   1HE   LYS  77          HE2       LYS  77 -12.419   5.961  -4.072
  626   2HE   LYS  77          HE1       LYS  77 -14.189   5.853  -4.118
  627   1HZ   LYS  77          HZ1       LYS  77 -13.061   7.092  -6.021
  628   2HZ   LYS  77          HZ2       LYS  77 -12.766   8.327  -4.893
  629   3HZ   LYS  77          HZ3       LYS  77 -14.361   7.868  -5.256
  630    H    THR  78           HN       THR  78 -14.706   5.061   0.441
  631    HA   THR  78           HA       THR  78 -13.151   5.933   2.848
  632    HB   THR  78           HB       THR  78 -14.388   3.197   2.586
  633    HG1  THR  78           HG1      THR  78 -16.147   4.484   2.434
  634   1HG2  THR  78          HG21      THR  78 -13.445   2.945   4.608
  635   2HG2  THR  78          HG22      THR  78 -14.379   4.310   5.219
  636   3HG2  THR  78          HG23      THR  78 -12.791   4.580   4.501
  637    H    ASP  79           HN       ASP  79 -11.007   5.363   2.684
  638    HA   ASP  79           HA       ASP  79 -10.029   4.001   0.304
  639   1HB   ASP  79          HB2       ASP  79  -7.841   4.410   1.428
  640   2HB   ASP  79          HB1       ASP  79  -8.853   5.855   1.412
  641    H    ALA  80           HN       ALA  80  -9.376   1.863   0.129
  642    HA   ALA  80           HA       ALA  80 -10.350  -0.202   1.720
  643   1HB   ALA  80          HB1       ALA  80  -9.295  -0.425  -0.502
  644   2HB   ALA  80          HB2       ALA  80  -8.553  -1.537   0.648
  645   3HB   ALA  80          HB3       ALA  80  -7.724  -0.045   0.202
  646    H    SER  81           HN       SER  81  -7.334   1.622   2.149
  647    HA   SER  81           HA       SER  81  -6.000   0.125   4.090
  648   1HB   SER  81          HB2       SER  81  -5.790   2.596   2.942
  649   2HB   SER  81          HB1       SER  81  -6.203   3.033   4.598
  650    HG   SER  81           HG       SER  81  -4.276   1.048   4.151
  651    H    ASP  82           HN       ASP  82  -9.059   1.776   4.409
  652    HA   ASP  82           HA       ASP  82  -8.995   1.309   7.372
  653   1HB   ASP  82          HB2       ASP  82 -10.311   3.338   5.575
  654   2HB   ASP  82          HB1       ASP  82 -10.894   3.074   7.218
  655    H    VAL  83           HN       VAL  83  -9.769  -0.631   5.181
  656    HA   VAL  83           HA       VAL  83 -12.641  -1.029   5.955
  657    HB   VAL  83           HB       VAL  83 -11.195  -2.071   3.508
  658   1HG1  VAL  83          HG11      VAL  83 -14.125  -1.699   4.197
  659   2HG1  VAL  83          HG12      VAL  83 -13.270  -3.238   4.095
  660   3HG1  VAL  83          HG13      VAL  83 -13.515  -2.267   2.643
  661   1HG2  VAL  83          HG21      VAL  83 -11.073   0.334   3.373
  662   2HG2  VAL  83          HG22      VAL  83 -12.737   0.503   3.934
  663   3HG2  VAL  83          HG23      VAL  83 -12.410  -0.171   2.338
  664    H    LYS  84           HN       LYS  84 -13.286  -3.239   6.379
  665    HA   LYS  84           HA       LYS  84 -11.122  -4.875   7.545
  666   1HB   LYS  84          HB2       LYS  84 -13.055  -6.129   8.458
  667   2HB   LYS  84          HB1       LYS  84 -13.231  -4.398   8.745
  668   1HG   LYS  84          HG2       LYS  84 -14.354  -4.962   6.185
  669   2HG   LYS  84          HG1       LYS  84 -15.001  -6.144   7.323
  670   1HD   LYS  84          HD2       LYS  84 -14.876  -3.363   8.330
  671   2HD   LYS  84          HD1       LYS  84 -16.022  -3.639   7.018
  672   1HE   LYS  84          HE2       LYS  84 -16.202  -5.809   8.922
  673   2HE   LYS  84          HE1       LYS  84 -16.408  -4.253   9.751
  674   1HZ   LYS  84          HZ1       LYS  84 -17.900  -3.618   7.854
  675   2HZ   LYS  84          HZ2       LYS  84 -18.518  -4.822   8.879
  676   3HZ   LYS  84          HZ3       LYS  84 -17.870  -5.242   7.366
  677    HA   PRO  85           HA       PRO  85 -10.780  -7.503   3.988
  678   1HB   PRO  85          HB2       PRO  85 -10.113  -9.768   5.631
  679   2HB   PRO  85          HB1       PRO  85  -9.017  -8.736   4.701
  680   1HG   PRO  85          HG2       PRO  85  -9.326  -8.851   7.549
  681   2HG   PRO  85          HG1       PRO  85  -8.249  -7.808   6.616
  682   1HD   PRO  85          HD2       PRO  85 -10.644  -7.057   8.048
  683   2HD   PRO  85          HD1       PRO  85  -9.549  -6.004   7.119
  684    H    CYS  86           HN       CYS  86 -12.211  -8.917   2.933
  685    HA   CYS  86           HA       CYS  86 -14.806  -9.393   3.855
  686   1HB   CYS  86          HB2       CYS  86 -13.360  -9.886   1.594
  687   2HB   CYS  86          HB1       CYS  86 -13.577 -11.527   2.202
  Start of MODEL   15
    1   1H    THR   1          HT1       THR   1  23.433  -7.217  -6.987
    2   2H    THR   1          HT2       THR   1  25.068  -6.765  -7.054
    3   3H    THR   1          HT3       THR   1  24.081  -6.597  -8.426
    4    HA   THR   1           HA       THR   1  24.187  -4.934  -5.998
    5    HB   THR   1           HB       THR   1  23.708  -3.366  -8.136
    6    HG1  THR   1           HG1      THR   1  24.394  -4.285  -9.973
    7   1HG2  THR   1          HG21      THR   1  25.899  -4.037  -6.574
    8   2HG2  THR   1          HG22      THR   1  25.847  -2.741  -7.769
    9   3HG2  THR   1          HG23      THR   1  26.470  -4.329  -8.217
   10    H    LYS   2           HN       LYS   2  22.222  -5.078  -4.910
   11    HA   LYS   2           HA       LYS   2  19.705  -5.086  -6.523
   12   1HB   LYS   2          HB2       LYS   2  20.320  -5.665  -3.605
   13   2HB   LYS   2          HB1       LYS   2  18.724  -5.802  -4.341
   14   1HG   LYS   2          HG2       LYS   2  19.229  -7.886  -5.012
   15   2HG   LYS   2          HG1       LYS   2  20.532  -7.232  -6.005
   16   1HD   LYS   2          HD2       LYS   2  21.257  -7.303  -3.181
   17   2HD   LYS   2          HD1       LYS   2  20.837  -8.903  -3.792
   18   1HE   LYS   2          HE2       LYS   2  22.420  -8.586  -5.684
   19   2HE   LYS   2          HE1       LYS   2  22.879  -7.008  -5.011
   20   1HZ   LYS   2          HZ1       LYS   2  23.112  -9.651  -3.673
   21   2HZ   LYS   2          HZ2       LYS   2  23.380  -8.163  -2.898
   22   3HZ   LYS   2          HZ3       LYS   2  24.390  -8.655  -4.173
   23    H    ALA   3           HN       ALA   3  19.040  -2.995  -6.909
   24    HA   ALA   3           HA       ALA   3  19.606  -0.833  -4.987
   25   1HB   ALA   3          HB1       ALA   3  19.595  -0.857  -7.610
   26   2HB   ALA   3          HB2       ALA   3  18.953   0.554  -6.770
   27   3HB   ALA   3          HB3       ALA   3  17.852  -0.657  -7.430
   28    H    SER   4           HN       SER   4  18.181  -0.240  -3.396
   29    HA   SER   4           HA       SER   4  15.764  -1.605  -2.816
   30   1HB   SER   4          HB2       SER   4  15.460   0.211  -1.211
   31   2HB   SER   4          HB1       SER   4  17.171  -0.195  -1.294
   32    HG   SER   4           HG       SER   4  15.802   2.065  -2.175
   33    H    CYS   5           HN       CYS   5  13.886   0.522  -2.422
   34    HA   CYS   5           HA       CYS   5  13.182   1.209  -5.259
   35   1HB   CYS   5          HB2       CYS   5  11.627   0.096  -2.936
   36   2HB   CYS   5          HB1       CYS   5  10.785   1.029  -4.177
   37    H    LYS   6           HN       LYS   6  11.129   2.919  -4.903
   38    HA   LYS   6           HA       LYS   6  12.156   5.046  -3.053
   39   1HB   LYS   6          HB2       LYS   6  11.322   6.579  -4.980
   40   2HB   LYS   6          HB1       LYS   6  12.831   5.699  -5.227
   41   1HG   LYS   6          HG2       LYS   6  11.841   4.144  -6.672
   42   2HG   LYS   6          HG1       LYS   6  10.219   4.459  -6.057
   43   1HD   LYS   6          HD2       LYS   6  10.264   5.532  -8.169
   44   2HD   LYS   6          HD1       LYS   6  10.515   6.837  -7.009
   45   1HE   LYS   6          HE2       LYS   6  12.285   7.300  -8.429
   46   2HE   LYS   6          HE1       LYS   6  13.093   6.094  -7.408
   47   1HZ   LYS   6          HZ1       LYS   6  11.779   4.509  -9.080
   48   2HZ   LYS   6          HZ2       LYS   6  13.365   5.044  -9.374
   49   3HZ   LYS   6          HZ3       LYS   6  12.050   5.827 -10.114
   50    H    LEU   7           HN       LEU   7  10.571   5.167  -1.502
   51    HA   LEU   7           HA       LEU   7   7.951   4.367  -1.456
   52   1HB   LEU   7          HB2       LEU   7   7.636   6.389   0.075
   53   2HB   LEU   7          HB1       LEU   7   9.019   5.355   0.451
   54    HG   LEU   7           HG       LEU   7   9.917   7.240  -1.466
   55   1HD1  LEU   7          HD11      LEU   7   7.933   8.597  -0.836
   56   2HD1  LEU   7          HD12      LEU   7   9.440   9.371  -0.348
   57   3HD1  LEU   7          HD13      LEU   7   8.449   8.538   0.849
   58   1HD2  LEU   7          HD21      LEU   7  11.393   6.343   0.175
   59   2HD2  LEU   7          HD22      LEU   7  10.338   6.832   1.501
   60   3HD2  LEU   7          HD23      LEU   7  11.230   8.049   0.589
   61    HA   PRO   8           HA       PRO   8   6.552   6.809  -5.063
   62   1HB   PRO   8          HB2       PRO   8   4.120   5.278  -4.915
   63   2HB   PRO   8          HB1       PRO   8   5.416   5.154  -6.113
   64   1HG   PRO   8          HG2       PRO   8   4.766   3.290  -4.035
   65   2HG   PRO   8          HG1       PRO   8   6.076   3.184  -5.214
   66   1HD   PRO   8          HD2       PRO   8   6.273   3.734  -2.383
   67   2HD   PRO   8          HD1       PRO   8   7.595   3.601  -3.569
   68    H    VAL   9           HN       VAL   9   5.007   6.124  -1.982
   69    HA   VAL   9           HA       VAL   9   3.467   8.688  -2.239
   70    HB   VAL   9           HB       VAL   9   2.595   6.258  -0.668
   71   1HG1  VAL   9          HG11      VAL   9   0.995   7.734  -0.072
   72   2HG1  VAL   9          HG12      VAL   9   0.415   7.644  -1.735
   73   3HG1  VAL   9          HG13      VAL   9   1.548   8.910  -1.264
   74   1HG2  VAL   9          HG21      VAL   9   1.151   5.727  -2.666
   75   2HG2  VAL   9          HG22      VAL   9   2.873   5.470  -2.945
   76   3HG2  VAL   9          HG23      VAL   9   2.082   6.910  -3.587
   77    H    LYS  10           HN       LYS  10   2.660   9.176   0.229
   78    HA   LYS  10           HA       LYS  10   5.134   9.046   1.921
   79   1HB   LYS  10          HB2       LYS  10   3.703  11.199   0.868
   80   2HB   LYS  10          HB1       LYS  10   3.173  11.119   2.549
   81   1HG   LYS  10          HG2       LYS  10   5.312  11.494   3.385
   82   2HG   LYS  10          HG1       LYS  10   6.099  10.880   1.930
   83   1HD   LYS  10          HD2       LYS  10   5.667  12.858   0.716
   84   2HD   LYS  10          HD1       LYS  10   4.419  13.384   1.847
   85   1HE   LYS  10          HE2       LYS  10   6.016  13.984   3.506
   86   2HE   LYS  10          HE1       LYS  10   7.311  13.076   2.698
   87   1HZ   LYS  10          HZ1       LYS  10   6.690  14.599   0.707
   88   2HZ   LYS  10          HZ2       LYS  10   7.703  15.196   1.933
   89   3HZ   LYS  10          HZ3       LYS  10   6.057  15.619   1.905
   90    H    LYS  11           HN       LYS  11   1.939   7.955   1.677
   91    HA   LYS  11           HA       LYS  11   1.936   7.210   4.562
   92   1HB   LYS  11          HB2       LYS  11   0.667   9.420   3.872
   93   2HB   LYS  11          HB1       LYS  11  -0.556   8.294   3.282
   94   1HG   LYS  11          HG2       LYS  11  -1.283   7.911   5.375
   95   2HG   LYS  11          HG1       LYS  11   0.344   7.469   5.895
   96   1HD   LYS  11          HD2       LYS  11   0.900   9.851   6.207
   97   2HD   LYS  11          HD1       LYS  11  -0.724  10.301   5.681
   98   1HE   LYS  11          HE2       LYS  11  -1.294   8.474   7.650
   99   2HE   LYS  11          HE1       LYS  11   0.168   9.249   8.291
  100   1HZ   LYS  11          HZ1       LYS  11  -1.779  10.542   8.880
  101   2HZ   LYS  11          HZ2       LYS  11  -2.239  10.647   7.248
  102   3HZ   LYS  11          HZ3       LYS  11  -0.821  11.411   7.784
  103    H    ALA  12           HN       ALA  12   2.478   5.490   2.405
  104    HA   ALA  12           HA       ALA  12  -0.042   4.108   1.692
  105   1HB   ALA  12          HB1       ALA  12   2.675   4.374   0.717
  106   2HB   ALA  12          HB2       ALA  12   1.246   3.789  -0.135
  107   3HB   ALA  12          HB3       ALA  12   2.222   2.673   0.820
  108    H    THR  13           HN       THR  13  -0.780   2.330   2.790
  109    HA   THR  13           HA       THR  13   1.009   1.096   4.857
  110    HB   THR  13           HB       THR  13  -2.007   1.186   4.533
  111    HG1  THR  13           HG1      THR  13  -1.774   2.528   6.425
  112   1HG2  THR  13          HG21      THR  13  -1.044  -0.857   5.691
  113   2HG2  THR  13          HG22      THR  13  -2.148   0.109   6.669
  114   3HG2  THR  13          HG23      THR  13  -0.406   0.238   6.916
  115    H    VAL  14           HN       VAL  14   1.902  -0.790   4.079
  116    HA   VAL  14           HA       VAL  14   0.195  -2.513   2.313
  117    HB   VAL  14           HB       VAL  14   2.265  -3.185   1.264
  118   1HG1  VAL  14          HG11      VAL  14   2.350  -0.204   1.817
  119   2HG1  VAL  14          HG12      VAL  14   1.342  -0.980   0.595
  120   3HG1  VAL  14          HG13      VAL  14   3.100  -1.025   0.448
  121   1HG2  VAL  14          HG21      VAL  14   3.365  -2.275   3.808
  122   2HG2  VAL  14          HG22      VAL  14   4.264  -1.621   2.439
  123   3HG2  VAL  14          HG23      VAL  14   4.071  -3.365   2.614
  124    H    VAL  15           HN       VAL  15   1.280  -4.895   2.431
  125    HA   VAL  15           HA       VAL  15   1.510  -5.598   5.341
  126    HB   VAL  15           HB       VAL  15   0.229  -7.134   3.056
  127   1HG1  VAL  15          HG11      VAL  15  -0.171  -7.645   5.993
  128   2HG1  VAL  15          HG12      VAL  15   1.231  -8.323   5.165
  129   3HG1  VAL  15          HG13      VAL  15  -0.397  -8.747   4.635
  130   1HG2  VAL  15          HG21      VAL  15  -0.880  -5.314   5.195
  131   2HG2  VAL  15          HG22      VAL  15  -1.876  -6.561   4.446
  132   3HG2  VAL  15          HG23      VAL  15  -1.183  -5.274   3.458
  133    H    TYR  16           HN       TYR  16   3.389  -6.673   5.830
  134    HA   TYR  16           HA       TYR  16   5.146  -7.554   3.611
  135   1HB   TYR  16          HB2       TYR  16   5.627  -6.154   5.836
  136   2HB   TYR  16          HB1       TYR  16   5.852  -7.769   6.509
  137    HD1  TYR  16           HD1      TYR  16   7.804  -5.275   5.600
  138    HD2  TYR  16           HD2      TYR  16   6.954  -9.251   4.215
  139    HE1  TYR  16           HE1      TYR  16  10.057  -5.398   4.569
  140    HE2  TYR  16           HE2      TYR  16   9.205  -9.374   3.183
  141    HH   TYR  16           HH       TYR  16  11.550  -8.095   3.736
  142    H    GLN  17           HN       GLN  17   2.903  -9.218   3.839
  143    HA   GLN  17           HA       GLN  17   2.355 -11.510   4.035
  144   1HB   GLN  17          HB2       GLN  17   5.326 -11.821   4.495
  145   2HB   GLN  17          HB1       GLN  17   4.227 -12.974   3.732
  146   1HG   GLN  17          HG2       GLN  17   3.798 -10.936   2.077
  147   2HG   GLN  17          HG1       GLN  17   5.405 -10.456   2.624
  148   1HE2  GLN  17          HE21      GLN  17   6.948 -12.606   2.725
  149   2HE2  GLN  17          HE22      GLN  17   6.912 -13.529   1.302
  150    H    GLY  18           HN       GLY  18   1.892 -10.151   6.398
  151   1HA   GLY  18          HA2       GLY  18   1.560 -11.939   8.391
  152   2HA   GLY  18          HA1       GLY  18   3.276 -11.574   8.581
  153    H    GLU  19           HN       GLU  19   3.359  -8.864   8.061
  154    HA   GLU  19           HA       GLU  19   1.535  -7.727  10.161
  155   1HB   GLU  19          HB2       GLU  19   4.469  -7.764   9.787
  156   2HB   GLU  19          HB1       GLU  19   3.803  -6.194  10.240
  157   1HG   GLU  19          HG2       GLU  19   3.407  -6.882  12.350
  158   2HG   GLU  19          HG1       GLU  19   2.596  -8.343  11.786
  159    H    ARG  20           HN       ARG  20   1.467  -5.232   9.943
  160    HA   ARG  20           HA       ARG  20   1.637  -4.389   7.074
  161   1HB   ARG  20          HB2       ARG  20  -0.647  -3.763   8.961
  162   2HB   ARG  20          HB1       ARG  20  -0.598  -3.519   7.212
  163   1HG   ARG  20          HG2       ARG  20  -1.727  -5.516   7.217
  164   2HG   ARG  20          HG1       ARG  20  -0.088  -6.164   7.293
  165   1HD   ARG  20          HD2       ARG  20  -0.477  -7.043   9.343
  166   2HD   ARG  20          HD1       ARG  20  -1.050  -5.477   9.953
  167    HE   ARG  20           HE       ARG  20  -2.840  -7.165   8.257
  168   1HH1  ARG  20          HH11      ARG  20  -2.271  -7.255  11.434
  169   2HH1  ARG  20          HH12      ARG  20  -3.777  -6.584  11.966
  170   1HH2  ARG  20          HH21      ARG  20  -4.717  -5.511   8.806
  171   2HH2  ARG  20          HH22      ARG  20  -5.163  -5.597  10.478
  172    H    VAL  21           HN       VAL  21   2.262  -2.215   6.808
  173    HA   VAL  21           HA       VAL  21   2.284  -0.374   9.105
  174    HB   VAL  21           HB       VAL  21   4.841  -0.149   8.805
  175   1HG1  VAL  21          HG11      VAL  21   3.526  -1.347  10.685
  176   2HG1  VAL  21          HG12      VAL  21   5.227  -1.767  10.486
  177   3HG1  VAL  21          HG13      VAL  21   3.976  -2.840   9.860
  178   1HG2  VAL  21          HG21      VAL  21   4.329  -1.973   6.748
  179   2HG2  VAL  21          HG22      VAL  21   5.055  -2.951   8.024
  180   3HG2  VAL  21          HG23      VAL  21   5.915  -1.547   7.391
  181    H    LYS  22           HN       LYS  22   3.739   1.654   8.291
  182    HA   LYS  22           HA       LYS  22   2.635   2.344   5.614
  183   1HB   LYS  22          HB2       LYS  22   2.528   3.628   7.962
  184   2HB   LYS  22          HB1       LYS  22   4.067   4.275   7.392
  185   1HG   LYS  22          HG2       LYS  22   2.387   5.782   6.599
  186   2HG   LYS  22          HG1       LYS  22   2.875   4.821   5.202
  187   1HD   LYS  22          HD2       LYS  22   0.579   4.626   5.016
  188   2HD   LYS  22          HD1       LYS  22   0.908   3.239   6.054
  189   1HE   LYS  22          HE2       LYS  22   0.550   5.788   7.512
  190   2HE   LYS  22          HE1       LYS  22  -0.901   5.195   6.680
  191   1HZ   LYS  22          HZ1       LYS  22   0.686   3.909   8.787
  192   2HZ   LYS  22          HZ2       LYS  22  -0.059   2.919   7.624
  193   3HZ   LYS  22          HZ3       LYS  22  -0.997   3.958   8.587
  194    H    ILE  23           HN       ILE  23   4.026   2.039   3.919
  195    HA   ILE  23           HA       ILE  23   6.776   1.466   4.041
  196    HB   ILE  23           HB       ILE  23   5.387   1.109   2.075
  197   1HG1  ILE  23          HG12      ILE  23   7.553   3.182   1.606
  198   2HG1  ILE  23          HG11      ILE  23   7.757   1.430   1.602
  199   1HG2  ILE  23          HG21      ILE  23   4.172   2.760   1.009
  200   2HG2  ILE  23          HG22      ILE  23   5.312   4.030   1.449
  201   3HG2  ILE  23          HG23      ILE  23   4.173   3.414   2.646
  202   1HD1  ILE  23          HD11      ILE  23   5.965   2.953  -0.312
  203   2HD1  ILE  23          HD12      ILE  23   6.312   1.224  -0.349
  204   3HD1  ILE  23          HD13      ILE  23   7.590   2.386  -0.701
  205    H    GLN  24           HN       GLN  24   5.140   4.609   3.977
  206    HA   GLN  24           HA       GLN  24   7.345   6.291   3.388
  207   1HB   GLN  24          HB2       GLN  24   5.969   7.991   4.578
  208   2HB   GLN  24          HB1       GLN  24   4.992   6.996   3.492
  209   1HG   GLN  24          HG2       GLN  24   3.676   6.518   5.255
  210   2HG   GLN  24          HG1       GLN  24   5.024   5.596   5.923
  211   1HE2  GLN  24          HE21      GLN  24   2.919   7.516   7.189
  212   2HE2  GLN  24          HE22      GLN  24   3.866   8.566   8.129
  213    H    GLU  25           HN       GLU  25   6.694   4.384   6.208
  214    HA   GLU  25           HA       GLU  25   8.819   5.857   7.732
  215   1HB   GLU  25          HB2       GLU  25   6.347   4.305   8.480
  216   2HB   GLU  25          HB1       GLU  25   7.638   4.541   9.657
  217   1HG   GLU  25          HG2       GLU  25   7.140   7.049   8.380
  218   2HG   GLU  25          HG1       GLU  25   5.592   6.383   8.903
  219    H    LYS  26           HN       LYS  26   7.460   2.544   7.826
  220    HA   LYS  26           HA       LYS  26   9.719   1.166   8.697
  221   1HB   LYS  26          HB2       LYS  26   7.485   0.200   8.396
  222   2HB   LYS  26          HB1       LYS  26   7.635   0.366   6.643
  223   1HG   LYS  26          HG2       LYS  26   8.154  -1.930   7.246
  224   2HG   LYS  26          HG1       LYS  26   9.642  -1.134   6.730
  225   1HD   LYS  26          HD2       LYS  26   9.637  -0.564   9.407
  226   2HD   LYS  26          HD1       LYS  26   8.884  -2.160   9.393
  227   1HE   LYS  26          HE2       LYS  26  10.900  -3.124   9.046
  228   2HE   LYS  26          HE1       LYS  26  11.125  -2.158   7.573
  229   1HZ   LYS  26          HZ1       LYS  26  11.847  -1.478  10.354
  230   2HZ   LYS  26          HZ2       LYS  26  11.571  -0.251   9.213
  231   3HZ   LYS  26          HZ3       LYS  26  12.804  -1.391   8.957
  232    H    PHE  27           HN       PHE  27   9.083   2.497   5.511
  233    HA   PHE  27           HA       PHE  27  11.743   1.453   4.588
  234   1HB   PHE  27          HB2       PHE  27   9.165   1.977   3.069
  235   2HB   PHE  27          HB1       PHE  27  10.682   1.459   2.324
  236    HD1  PHE  27           HD1      PHE  27   7.672   0.174   3.016
  237    HD2  PHE  27           HD2      PHE  27  11.759  -0.509   4.147
  238    HE1  PHE  27           HE1      PHE  27   7.130  -2.186   3.552
  239    HE2  PHE  27           HE2      PHE  27  11.217  -2.868   4.683
  240    HZ   PHE  27           HZ       PHE  27   8.902  -3.708   4.385
  241    H    LYS  28           HN       LYS  28  11.421   3.928   6.002
  242    HA   LYS  28           HA       LYS  28  10.981   6.284   4.613
  243   1HB   LYS  28          HB2       LYS  28  12.616   5.325   6.831
  244   2HB   LYS  28          HB1       LYS  28  13.368   6.696   6.014
  245   1HG   LYS  28          HG2       LYS  28  11.853   8.130   6.867
  246   2HG   LYS  28          HG1       LYS  28  10.512   7.115   6.335
  247   1HD   LYS  28          HD2       LYS  28  10.249   7.026   8.647
  248   2HD   LYS  28          HD1       LYS  28  11.244   5.598   8.362
  249   1HE   LYS  28          HE2       LYS  28  13.103   7.678   8.614
  250   2HE   LYS  28          HE1       LYS  28  11.896   8.001   9.875
  251   1HZ   LYS  28          HZ1       LYS  28  13.199   5.379   9.358
  252   2HZ   LYS  28          HZ2       LYS  28  12.028   5.685  10.552
  253   3HZ   LYS  28          HZ3       LYS  28  13.559   6.416  10.651
  254    H    ASN  29           HN       ASN  29  13.795   4.130   4.317
  255    HA   ASN  29           HA       ASN  29  14.968   5.926   2.247
  256   1HB   ASN  29          HB2       ASN  29  15.908   3.584   3.903
  257   2HB   ASN  29          HB1       ASN  29  16.851   4.165   2.527
  258   1HD2  ASN  29          HD21      ASN  29  16.120   4.739   5.855
  259   2HD2  ASN  29          HD22      ASN  29  16.940   6.217   6.006
  260    H    GLY  30           HN       GLY  30  12.580   4.619   1.469
  261   1HA   GLY  30          HA2       GLY  30  11.847   3.483  -0.467
  262   2HA   GLY  30          HA1       GLY  30  13.534   3.124  -0.844
  263    H    MET  31           HN       MET  31  11.943   1.049  -1.290
  264    HA   MET  31           HA       MET  31  11.853  -0.638   1.167
  265   1HB   MET  31          HB2       MET  31  10.778  -0.997  -1.651
  266   2HB   MET  31          HB1       MET  31  10.477  -2.099  -0.307
  267   1HG   MET  31          HG2       MET  31   9.365  -0.315   0.947
  268   2HG   MET  31          HG1       MET  31   9.722   0.838  -0.339
  269   1HE   MET  31          HE1       MET  31   7.677  -2.854   0.007
  270   2HE   MET  31          HE2       MET  31   6.312  -1.786   0.324
  271   3HE   MET  31          HE3       MET  31   7.807  -1.585   1.233
  272    H    LEU  32           HN       LEU  32  12.996  -2.636   1.243
  273    HA   LEU  32           HA       LEU  32  15.538  -2.762  -0.045
  274   1HB   LEU  32          HB2       LEU  32  13.918  -5.054   1.091
  275   2HB   LEU  32          HB1       LEU  32  15.678  -4.902   1.051
  276    HG   LEU  32           HG       LEU  32  14.829  -2.581   2.343
  277   1HD1  LEU  32          HD11      LEU  32  13.557  -4.090   4.248
  278   2HD1  LEU  32          HD12      LEU  32  12.922  -4.793   2.760
  279   3HD1  LEU  32          HD13      LEU  32  12.731  -3.067   3.073
  280   1HD2  LEU  32          HD21      LEU  32  16.740  -3.549   3.213
  281   2HD2  LEU  32          HD22      LEU  32  16.082  -5.182   3.113
  282   3HD2  LEU  32          HD23      LEU  32  15.572  -4.105   4.413
  283    H    HIS  33           HN       HIS  33  16.258  -4.105  -1.785
  284    HA   HIS  33           HA       HIS  33  14.450  -4.426  -3.991
  285   1HB   HIS  33          HB2       HIS  33  16.788  -4.083  -4.365
  286   2HB   HIS  33          HB1       HIS  33  17.218  -5.436  -3.313
  287    HD1  HIS  33           HD1      HIS  33  15.514  -4.752  -6.641
  288    HD2  HIS  33           HD2      HIS  33  17.342  -7.902  -4.612
  289    HE1  HIS  33           HE1      HIS  33  15.665  -6.672  -8.287
  290    H    GLY  34           HN       GLY  34  13.387  -6.281  -4.749
  291   1HA   GLY  34          HA2       GLY  34  12.596  -8.503  -4.755
  292   2HA   GLY  34          HA1       GLY  34  13.884  -8.916  -3.622
  293    H    ASP  35           HN       ASP  35  12.197  -6.241  -2.483
  294    HA   ASP  35           HA       ASP  35  11.047  -7.740  -0.273
  295   1HB   ASP  35          HB2       ASP  35  11.942  -5.482  -0.023
  296   2HB   ASP  35          HB1       ASP  35  10.806  -4.867  -1.226
  297    H    LYS  36           HN       LYS  36   8.729  -7.829   0.228
  298    HA   LYS  36           HA       LYS  36   6.949  -7.506  -2.165
  299   1HB   LYS  36          HB2       LYS  36   7.629  -9.849  -0.498
  300   2HB   LYS  36          HB1       LYS  36   5.905  -9.638  -0.802
  301   1HG   LYS  36          HG2       LYS  36   6.745  -9.208  -3.287
  302   2HG   LYS  36          HG1       LYS  36   8.118 -10.174  -2.743
  303   1HD   LYS  36          HD2       LYS  36   5.542 -11.302  -1.922
  304   2HD   LYS  36          HD1       LYS  36   5.712 -11.187  -3.674
  305   1HE   LYS  36          HE2       LYS  36   6.973 -13.069  -3.585
  306   2HE   LYS  36          HE1       LYS  36   8.207 -12.126  -2.726
  307   1HZ   LYS  36          HZ1       LYS  36   7.438 -14.014  -1.394
  308   2HZ   LYS  36          HZ2       LYS  36   5.848 -13.420  -1.461
  309   3HZ   LYS  36          HZ3       LYS  36   7.053 -12.537  -0.654
  310    H    VAL  37           HN       VAL  37   5.183  -6.283  -1.691
  311    HA   VAL  37           HA       VAL  37   4.154  -6.237   1.114
  312    HB   VAL  37           HB       VAL  37   3.987  -3.704   0.772
  313   1HG1  VAL  37          HG11      VAL  37   5.813  -5.048   2.045
  314   2HG1  VAL  37          HG12      VAL  37   6.154  -3.367   1.634
  315   3HG1  VAL  37          HG13      VAL  37   6.840  -4.670   0.662
  316   1HG2  VAL  37          HG21      VAL  37   6.135  -4.088  -1.296
  317   2HG2  VAL  37          HG22      VAL  37   5.110  -2.681  -1.006
  318   3HG2  VAL  37          HG23      VAL  37   4.442  -4.113  -1.789
  319    H    SER  38           HN       SER  38   1.910  -6.166   1.181
  320    HA   SER  38           HA       SER  38   0.482  -6.070  -1.440
  321   1HB   SER  38          HB2       SER  38  -0.859  -6.837   1.106
  322   2HB   SER  38          HB1       SER  38  -0.956  -7.595  -0.485
  323    HG   SER  38           HG       SER  38   0.214  -8.939   0.849
  324    H    PHE  39           HN       PHE  39  -1.083  -4.467  -1.807
  325    HA   PHE  39           HA       PHE  39  -1.250  -2.299   0.233
  326   1HB   PHE  39          HB2       PHE  39  -1.768  -2.561  -2.730
  327   2HB   PHE  39          HB1       PHE  39  -2.309  -1.140  -1.829
  328    HD1  PHE  39           HD1      PHE  39   0.605  -3.021  -3.056
  329    HD2  PHE  39           HD2      PHE  39  -0.699   0.402  -0.811
  330    HE1  PHE  39           HE1      PHE  39   2.897  -2.079  -3.161
  331    HE2  PHE  39           HE2      PHE  39   1.592   1.344  -0.917
  332    HZ   PHE  39           HZ       PHE  39   3.391   0.103  -2.092
  333    H    PHE  40           HN       PHE  40  -3.256  -1.663   1.109
  334    HA   PHE  40           HA       PHE  40  -5.394  -3.656   1.035
  335   1HB   PHE  40          HB2       PHE  40  -4.752  -1.091   2.447
  336   2HB   PHE  40          HB1       PHE  40  -6.424  -1.665   2.478
  337    HD1  PHE  40           HD1      PHE  40  -3.545  -1.693   4.341
  338    HD2  PHE  40           HD2      PHE  40  -6.433  -4.442   2.741
  339    HE1  PHE  40           HE1      PHE  40  -2.951  -3.341   6.096
  340    HE2  PHE  40           HE2      PHE  40  -5.838  -6.089   4.497
  341    HZ   PHE  40           HZ       PHE  40  -4.098  -5.538   6.175
  342    H    CYS  41           HN       CYS  41  -7.157  -3.606  -0.291
  343    HA   CYS  41           HA       CYS  41  -7.962  -1.014  -1.543
  344   1HB   CYS  41          HB2       CYS  41  -6.920  -3.500  -2.776
  345   2HB   CYS  41          HB1       CYS  41  -8.349  -2.816  -3.556
  346    H    LYS  42           HN       LYS  42 -10.237  -0.974  -2.119
  347    HA   LYS  42           HA       LYS  42 -11.862  -2.913  -0.562
  348   1HB   LYS  42          HB2       LYS  42 -13.608  -1.235  -0.845
  349   2HB   LYS  42          HB1       LYS  42 -12.116  -0.433  -0.356
  350   1HG   LYS  42          HG2       LYS  42 -11.710  -0.199  -2.938
  351   2HG   LYS  42          HG1       LYS  42 -13.450  -0.464  -3.050
  352   1HD   LYS  42          HD2       LYS  42 -13.638   1.764  -2.690
  353   2HD   LYS  42          HD1       LYS  42 -13.263   1.384  -1.009
  354   1HE   LYS  42          HE2       LYS  42 -11.438   2.716  -1.239
  355   2HE   LYS  42          HE1       LYS  42 -10.763   1.463  -2.299
  356   1HZ   LYS  42          HZ1       LYS  42 -11.096   3.797  -3.275
  357   2HZ   LYS  42          HZ2       LYS  42 -12.748   3.404  -3.308
  358   3HZ   LYS  42          HZ3       LYS  42 -11.632   2.472  -4.186
  359    H    ASN  43           HN       ASN  43 -13.672  -3.990  -1.524
  360    HA   ASN  43           HA       ASN  43 -13.463  -4.332  -4.500
  361   1HB   ASN  43          HB2       ASN  43 -12.730  -6.243  -3.043
  362   2HB   ASN  43          HB1       ASN  43 -14.366  -6.307  -2.377
  363   1HD2  ASN  43          HD21      ASN  43 -12.478  -7.821  -4.625
  364   2HD2  ASN  43          HD22      ASN  43 -13.670  -8.293  -5.738
  365    H    LYS  44           HN       LYS  44 -15.242  -3.465  -5.497
  366    HA   LYS  44           HA       LYS  44 -17.668  -2.782  -4.050
  367   1HB   LYS  44          HB2       LYS  44 -16.356  -2.097  -6.422
  368   2HB   LYS  44          HB1       LYS  44 -17.848  -2.869  -6.959
  369   1HG   LYS  44          HG2       LYS  44 -19.031  -1.042  -6.400
  370   2HG   LYS  44          HG1       LYS  44 -18.443  -1.147  -4.740
  371   1HD   LYS  44          HD2       LYS  44 -16.236  -0.135  -5.849
  372   2HD   LYS  44          HD1       LYS  44 -17.405   0.481  -7.018
  373   1HE   LYS  44          HE2       LYS  44 -17.353   2.195  -5.393
  374   2HE   LYS  44          HE1       LYS  44 -18.743   1.223  -4.870
  375   1HZ   LYS  44          HZ1       LYS  44 -17.162   1.629  -3.049
  376   2HZ   LYS  44          HZ2       LYS  44 -15.947   0.837  -3.935
  377   3HZ   LYS  44          HZ3       LYS  44 -17.314  -0.023  -3.404
  378    H    GLU  45           HN       GLU  45 -16.665  -5.451  -6.140
  379    HA   GLU  45           HA       GLU  45 -19.322  -6.538  -6.554
  380   1HB   GLU  45          HB2       GLU  45 -16.551  -7.767  -6.707
  381   2HB   GLU  45          HB1       GLU  45 -18.013  -8.459  -7.411
  382   1HG   GLU  45          HG2       GLU  45 -17.591  -5.657  -8.169
  383   2HG   GLU  45          HG1       GLU  45 -16.290  -6.722  -8.703
  384    H    LYS  46           HN       LYS  46 -16.683  -7.252  -4.251
  385    HA   LYS  46           HA       LYS  46 -18.373  -9.287  -2.903
  386   1HB   LYS  46          HB2       LYS  46 -15.563  -8.311  -2.322
  387   2HB   LYS  46          HB1       LYS  46 -16.302  -9.806  -1.739
  388   1HG   LYS  46          HG2       LYS  46 -16.666  -9.978  -4.472
  389   2HG   LYS  46          HG1       LYS  46 -15.079  -9.219  -4.343
  390   1HD   LYS  46          HD2       LYS  46 -14.747 -11.612  -4.342
  391   2HD   LYS  46          HD1       LYS  46 -14.437 -11.028  -2.706
  392   1HE   LYS  46          HE2       LYS  46 -16.071 -12.369  -1.894
  393   2HE   LYS  46          HE1       LYS  46 -17.251 -11.636  -3.000
  394   1HZ   LYS  46          HZ1       LYS  46 -16.902 -13.204  -4.576
  395   2HZ   LYS  46          HZ2       LYS  46 -16.465 -14.153  -3.236
  396   3HZ   LYS  46          HZ3       LYS  46 -15.265 -13.411  -4.183
  397    H    LYS  47           HN       LYS  47 -17.561  -5.954  -2.613
  398    HA   LYS  47           HA       LYS  47 -18.289  -4.353  -1.029
  399   1HB   LYS  47          HB2       LYS  47 -19.613  -6.635   0.429
  400   2HB   LYS  47          HB1       LYS  47 -20.147  -4.960   0.295
  401   1HG   LYS  47          HG2       LYS  47 -19.982  -5.876  -2.352
  402   2HG   LYS  47          HG1       LYS  47 -20.721  -7.203  -1.455
  403   1HD   LYS  47          HD2       LYS  47 -21.666  -4.334  -1.620
  404   2HD   LYS  47          HD1       LYS  47 -22.523  -5.784  -2.144
  405   1HE   LYS  47          HE2       LYS  47 -23.457  -5.946  -0.089
  406   2HE   LYS  47          HE1       LYS  47 -21.839  -6.124   0.617
  407   1HZ   LYS  47          HZ1       LYS  47 -21.577  -3.792   0.732
  408   2HZ   LYS  47          HZ2       LYS  47 -23.115  -4.115   1.379
  409   3HZ   LYS  47          HZ3       LYS  47 -22.965  -3.505  -0.199
  410    H    CYS  48           HN       CYS  48 -15.802  -6.016  -0.695
  411    HA   CYS  48           HA       CYS  48 -15.388  -5.430   2.207
  412   1HB   CYS  48          HB2       CYS  48 -14.208  -7.913   1.021
  413   2HB   CYS  48          HB1       CYS  48 -14.666  -7.585   2.691
  414    H    SER  49           HN       SER  49 -12.865  -5.857   2.610
  415    HA   SER  49           HA       SER  49 -11.434  -4.446   0.403
  416   1HB   SER  49          HB2       SER  49 -10.472  -3.280   2.094
  417   2HB   SER  49          HB1       SER  49 -11.674  -4.021   3.141
  418    HG   SER  49           HG       SER  49  -9.979  -4.847   4.078
  419    H    TYR  50           HN       TYR  50  -9.086  -5.112   0.211
  420    HA   TYR  50           HA       TYR  50  -8.397  -7.858   1.021
  421   1HB   TYR  50          HB2       TYR  50  -8.095  -8.501  -1.424
  422   2HB   TYR  50          HB1       TYR  50  -9.773  -8.311  -0.907
  423    HD1  TYR  50           HD1      TYR  50  -6.954  -6.597  -2.640
  424    HD2  TYR  50           HD2      TYR  50 -11.181  -6.659  -1.875
  425    HE1  TYR  50           HE1      TYR  50  -7.297  -4.874  -4.391
  426    HE2  TYR  50           HE2      TYR  50 -11.523  -4.934  -3.625
  427    HH   TYR  50           HH       TYR  50  -8.772  -3.638  -5.488
  428    H    THR  51           HN       THR  51  -6.160  -8.384  -0.195
  429    HA   THR  51           HA       THR  51  -4.541  -5.864  -0.056
  430    HB   THR  51           HB       THR  51  -2.704  -7.567   0.501
  431    HG1  THR  51           HG1      THR  51  -4.063  -9.472   1.476
  432   1HG2  THR  51          HG21      THR  51  -4.108  -6.145   2.131
  433   2HG2  THR  51          HG22      THR  51  -3.284  -7.557   2.796
  434   3HG2  THR  51          HG23      THR  51  -5.012  -7.627   2.445
  435    H    GLU  52           HN       GLU  52  -3.005  -5.485  -1.660
  436    HA   GLU  52           HA       GLU  52  -3.184  -7.220  -4.102
  437   1HB   GLU  52          HB2       GLU  52  -3.027  -4.292  -3.539
  438   2HB   GLU  52          HB1       GLU  52  -2.191  -4.869  -4.981
  439   1HG   GLU  52          HG2       GLU  52  -5.108  -5.365  -4.311
  440   2HG   GLU  52          HG1       GLU  52  -4.507  -4.231  -5.522
  441    H    ASP  53           HN       ASP  53  -1.453  -8.605  -3.210
  442    HA   ASP  53           HA       ASP  53   0.997  -7.986  -2.159
  443   1HB   ASP  53          HB2       ASP  53   0.500  -9.871  -4.477
  444   2HB   ASP  53          HB1       ASP  53   1.815  -9.982  -3.303
  445    H    ALA  54           HN       ALA  54   2.944  -7.165  -2.855
  446    HA   ALA  54           HA       ALA  54   3.259  -6.351  -5.705
  447   1HB   ALA  54          HB1       ALA  54   4.154  -4.282  -3.872
  448   2HB   ALA  54          HB2       ALA  54   2.448  -4.646  -3.611
  449   3HB   ALA  54          HB3       ALA  54   3.012  -4.155  -5.209
  450    H    GLN  55           HN       GLN  55   5.608  -5.564  -6.042
  451    HA   GLN  55           HA       GLN  55   7.490  -6.764  -4.052
  452   1HB   GLN  55          HB2       GLN  55   6.795  -8.321  -5.966
  453   2HB   GLN  55          HB1       GLN  55   7.664  -7.223  -7.038
  454   1HG   GLN  55          HG2       GLN  55   9.725  -7.560  -5.742
  455   2HG   GLN  55          HG1       GLN  55   8.865  -8.630  -4.636
  456   1HE2  GLN  55          HE21      GLN  55  10.020 -10.571  -5.183
  457   2HE2  GLN  55          HE22      GLN  55   9.926 -11.288  -6.719
  458    H    CYS  56           HN       CYS  56   9.589  -5.819  -4.096
  459    HA   CYS  56           HA       CYS  56   9.736  -3.189  -5.495
  460   1HB   CYS  56          HB2       CYS  56  10.033  -3.036  -3.139
  461   2HB   CYS  56          HB1       CYS  56  11.059  -4.468  -3.099
  462    H    ILE  57           HN       ILE  57  11.388  -2.790  -6.982
  463    HA   ILE  57           HA       ILE  57  13.305  -5.036  -7.506
  464    HB   ILE  57           HB       ILE  57  11.936  -3.194  -9.493
  465   1HG1  ILE  57          HG12      ILE  57  10.433  -4.840  -8.283
  466   2HG1  ILE  57          HG11      ILE  57  10.507  -5.060 -10.032
  467   1HG2  ILE  57          HG21      ILE  57  13.802  -5.556  -9.759
  468   2HG2  ILE  57          HG22      ILE  57  13.999  -3.936 -10.425
  469   3HG2  ILE  57          HG23      ILE  57  12.773  -5.016 -11.086
  470   1HD1  ILE  57          HD11      ILE  57  11.331  -7.140  -9.792
  471   2HD1  ILE  57          HD12      ILE  57  11.072  -6.989  -8.054
  472   3HD1  ILE  57          HD13      ILE  57  12.630  -6.549  -8.755
  473    H    ASP  58           HN       ASP  58  15.175  -4.166  -8.936
  474    HA   ASP  58           HA       ASP  58  16.864  -2.462  -7.620
  475   1HB   ASP  58          HB2       ASP  58  16.948  -3.853  -9.883
  476   2HB   ASP  58          HB1       ASP  58  16.721  -2.254 -10.602
  477    H    GLY  59           HN       GLY  59  15.850  -0.605  -6.705
  478   1HA   GLY  59          HA2       GLY  59  15.139   1.625  -6.635
  479   2HA   GLY  59          HA1       GLY  59  16.000   1.802  -8.159
  480    H    THR  60           HN       THR  60  13.506  -0.536  -8.364
  481    HA   THR  60           HA       THR  60  11.546   1.526  -9.288
  482    HB   THR  60           HB       THR  60  12.378  -0.918 -10.869
  483    HG1  THR  60           HG1      THR  60  14.056   0.267 -11.290
  484   1HG2  THR  60          HG21      THR  60  10.418   1.295 -11.218
  485   2HG2  THR  60          HG22      THR  60  10.321  -0.387 -11.742
  486   3HG2  THR  60          HG23      THR  60  11.295   0.766 -12.654
  487    H    ILE  61           HN       ILE  61   9.422   0.942  -8.849
  488    HA   ILE  61           HA       ILE  61   8.886  -1.895  -8.063
  489    HB   ILE  61           HB       ILE  61   9.211  -0.794  -5.988
  490   1HG1  ILE  61          HG12      ILE  61   6.390  -0.141  -5.852
  491   2HG1  ILE  61          HG11      ILE  61   6.633  -1.636  -6.758
  492   1HG2  ILE  61          HG21      ILE  61   9.325   1.464  -6.128
  493   2HG2  ILE  61          HG22      ILE  61   7.583   1.435  -5.855
  494   3HG2  ILE  61          HG23      ILE  61   8.217   1.518  -7.498
  495   1HD1  ILE  61          HD11      ILE  61   6.386  -1.982  -4.277
  496   2HD1  ILE  61          HD12      ILE  61   7.887  -1.083  -4.055
  497   3HD1  ILE  61          HD13      ILE  61   7.896  -2.610  -4.938
  498    H    GLU  62           HN       GLU  62   6.827  -2.614  -8.663
  499    HA   GLU  62           HA       GLU  62   5.275  -0.769 -10.416
  500   1HB   GLU  62          HB2       GLU  62   6.185  -3.383 -10.635
  501   2HB   GLU  62          HB1       GLU  62   4.476  -3.584 -10.244
  502   1HG   GLU  62          HG2       GLU  62   4.441  -1.528 -12.095
  503   2HG   GLU  62          HG1       GLU  62   5.717  -2.582 -12.705
  504    H    VAL  63           HN       VAL  63   4.550   0.223  -8.192
  505    HA   VAL  63           HA       VAL  63   2.960  -0.975  -6.270
  506    HB   VAL  63           HB       VAL  63   2.565   1.636  -7.757
  507   1HG1  VAL  63          HG11      VAL  63   0.577   0.806  -6.383
  508   2HG1  VAL  63          HG12      VAL  63   1.221   2.382  -5.925
  509   3HG1  VAL  63          HG13      VAL  63   1.616   0.957  -4.966
  510   1HG2  VAL  63          HG21      VAL  63   4.291   0.703  -5.497
  511   2HG2  VAL  63          HG22      VAL  63   3.672   2.353  -5.444
  512   3HG2  VAL  63          HG23      VAL  63   4.668   1.829  -6.801
  513    HA   PRO  64           HA       PRO  64  -0.456  -2.817  -8.384
  514   1HB   PRO  64          HB2       PRO  64  -2.271  -2.189  -6.237
  515   2HB   PRO  64          HB1       PRO  64  -1.484  -3.735  -6.584
  516   1HG   PRO  64          HG2       PRO  64  -0.915  -1.915  -4.437
  517   2HG   PRO  64          HG1       PRO  64  -0.129  -3.456  -4.793
  518   1HD   PRO  64          HD2       PRO  64   0.956  -0.804  -5.118
  519   2HD   PRO  64          HD1       PRO  64   1.741  -2.357  -5.492
  520    H    LYS  65           HN       LYS  65  -1.630  -1.831  -9.986
  521    HA   LYS  65           HA       LYS  65  -2.082   0.913 -10.286
  522   1HB   LYS  65          HB2       LYS  65  -2.385  -1.168 -11.850
  523   2HB   LYS  65          HB1       LYS  65  -4.049  -1.147 -11.264
  524   1HG   LYS  65          HG2       LYS  65  -4.511   0.918 -12.238
  525   2HG   LYS  65          HG1       LYS  65  -2.816   1.406 -12.248
  526   1HD   LYS  65          HD2       LYS  65  -3.794  -0.907 -13.923
  527   2HD   LYS  65          HD1       LYS  65  -3.867   0.754 -14.514
  528   1HE   LYS  65          HE2       LYS  65  -1.703   0.531 -15.153
  529   2HE   LYS  65          HE1       LYS  65  -1.268   0.436 -13.435
  530   1HZ   LYS  65          HZ1       LYS  65  -0.596  -1.564 -14.674
  531   2HZ   LYS  65          HZ2       LYS  65  -2.221  -1.852 -15.075
  532   3HZ   LYS  65          HZ3       LYS  65  -1.718  -1.915 -13.453
  533    H    CYS  66           HN       CYS  66  -4.017  -1.447  -8.498
  534    HA   CYS  66           HA       CYS  66  -6.472  -0.201  -8.170
  535   1HB   CYS  66          HB2       CYS  66  -5.632  -2.343  -7.149
  536   2HB   CYS  66          HB1       CYS  66  -4.760  -1.379  -5.958
  537    H    PHE  67           HN       PHE  67  -3.700   0.378  -5.965
  538    HA   PHE  67           HA       PHE  67  -4.664   2.480  -4.449
  539   1HB   PHE  67          HB2       PHE  67  -2.438   1.389  -4.280
  540   2HB   PHE  67          HB1       PHE  67  -1.924   2.240  -5.737
  541    HD1  PHE  67           HD1      PHE  67  -2.119   2.390  -2.185
  542    HD2  PHE  67           HD2      PHE  67  -2.178   4.845  -5.709
  543    HE1  PHE  67           HE1      PHE  67  -1.503   4.365  -0.819
  544    HE2  PHE  67           HE2      PHE  67  -1.562   6.820  -4.343
  545    HZ   PHE  67           HZ       PHE  67  -1.224   6.580  -1.897
  546    H    LYS  68           HN       LYS  68  -4.646   4.805  -4.695
  547    HA   LYS  68           HA       LYS  68  -4.246   5.854  -7.462
  548   1HB   LYS  68          HB2       LYS  68  -6.741   5.771  -5.786
  549   2HB   LYS  68          HB1       LYS  68  -6.509   7.093  -6.930
  550   1HG   LYS  68          HG2       LYS  68  -5.882   5.082  -8.567
  551   2HG   LYS  68          HG1       LYS  68  -6.911   4.179  -7.455
  552   1HD   LYS  68          HD2       LYS  68  -8.514   6.274  -7.779
  553   2HD   LYS  68          HD1       LYS  68  -7.627   6.425  -9.296
  554   1HE   LYS  68          HE2       LYS  68  -8.696   4.635 -10.196
  555   2HE   LYS  68          HE1       LYS  68  -8.432   3.658  -8.738
  556   1HZ   LYS  68          HZ1       LYS  68 -10.315   5.914  -8.645
  557   2HZ   LYS  68          HZ2       LYS  68 -10.300   4.489  -7.721
  558   3HZ   LYS  68          HZ3       LYS  68 -10.824   4.451  -9.336
  559    H    GLU  69           HN       GLU  69  -2.611   7.320  -6.971
  560    HA   GLU  69           HA       GLU  69  -2.557   8.830  -4.472
  561   1HB   GLU  69          HB2       GLU  69  -0.747   8.015  -6.350
  562   2HB   GLU  69          HB1       GLU  69  -0.955   9.708  -6.802
  563   1HG   GLU  69          HG2       GLU  69  -0.792   9.656  -3.979
  564   2HG   GLU  69          HG1       GLU  69   0.499   8.609  -4.568
  565    H    HIS  70           HN       HIS  70  -2.481  10.088  -7.817
  566    HA   HIS  70           HA       HIS  70  -4.223  12.352  -6.911
  567   1HB   HIS  70          HB2       HIS  70  -1.939  12.903  -7.653
  568   2HB   HIS  70          HB1       HIS  70  -2.224  12.070  -9.181
  569    HD1  HIS  70           HD1      HIS  70  -2.662  13.728 -10.980
  570    HD2  HIS  70           HD2      HIS  70  -4.320  14.947  -7.354
  571    HE1  HIS  70           HE1      HIS  70  -3.841  15.922 -11.434
  572    H    SER  71           HN       SER  71  -5.753  13.168  -8.611
  573    HA   SER  71           HA       SER  71  -7.462  12.811 -10.207
  574   1HB   SER  71          HB2       SER  71  -5.115  12.074 -11.318
  575   2HB   SER  71          HB1       SER  71  -5.943  10.516 -11.353
  576    HG   SER  71           HG       SER  71  -7.708  11.647 -12.374
  577    H    SER  72           HN       SER  72  -8.760  11.924  -8.357
  578    HA   SER  72           HA       SER  72  -9.794   9.275  -8.964
  579   1HB   SER  72          HB2       SER  72  -8.279   8.143  -7.719
  580   2HB   SER  72          HB1       SER  72  -7.597   9.637  -7.087
  581    HG   SER  72           HG       SER  72  -9.216   7.883  -5.887
  582    H    LEU  73           HN       LEU  73 -11.277   8.620  -6.902
  583    HA   LEU  73           HA       LEU  73 -13.343  10.510  -6.660
  584   1HB   LEU  73          HB2       LEU  73 -12.396   8.215  -4.936
  585   2HB   LEU  73          HB1       LEU  73 -13.896   9.084  -4.594
  586    HG   LEU  73           HG       LEU  73 -14.289   8.633  -7.205
  587   1HD1  LEU  73          HD11      LEU  73 -13.490   6.086  -7.355
  588   2HD1  LEU  73          HD12      LEU  73 -12.205   6.689  -6.310
  589   3HD1  LEU  73          HD13      LEU  73 -12.459   7.409  -7.900
  590   1HD2  LEU  73          HD21      LEU  73 -15.815   6.976  -6.546
  591   2HD2  LEU  73          HD22      LEU  73 -15.553   7.862  -5.043
  592   3HD2  LEU  73          HD23      LEU  73 -14.729   6.328  -5.318
  593    H    ALA  74           HN       ALA  74 -13.512  12.395  -5.507
  594    HA   ALA  74           HA       ALA  74 -11.325  13.190  -3.695
  595   1HB   ALA  74          HB1       ALA  74 -13.655  14.423  -5.101
  596   2HB   ALA  74          HB2       ALA  74 -11.975  14.957  -5.038
  597   3HB   ALA  74          HB3       ALA  74 -13.046  15.248  -3.667
  598    H    PHE  75           HN       PHE  75 -14.602  11.994  -3.468
  599    HA   PHE  75           HA       PHE  75 -15.142  12.950  -0.778
  600   1HB   PHE  75          HB2       PHE  75 -16.298  11.005  -2.750
  601   2HB   PHE  75          HB1       PHE  75 -16.870  10.958  -1.082
  602    HD1  PHE  75           HD1      PHE  75 -16.201  13.382  -3.864
  603    HD2  PHE  75           HD2      PHE  75 -18.567  12.426  -0.407
  604    HE1  PHE  75           HE1      PHE  75 -17.642  15.350  -4.305
  605    HE2  PHE  75           HE2      PHE  75 -20.009  14.396  -0.851
  606    HZ   PHE  75           HZ       PHE  75 -19.546  15.858  -2.799
  607    H    TRP  76           HN       TRP  76 -14.520  12.012   1.140
  608    HA   TRP  76           HA       TRP  76 -12.681   9.735   1.107
  609   1HB   TRP  76          HB2       TRP  76 -13.323  11.956   2.736
  610   2HB   TRP  76          HB1       TRP  76 -13.629  10.518   3.714
  611    HD1  TRP  76           HD1      TRP  76 -11.562   8.673   3.746
  612    HE1  TRP  76           HE1      TRP  76  -9.020   9.112   3.814
  613    HE3  TRP  76           HE3      TRP  76 -11.468  13.487   2.083
  614    HZ2  TRP  76           HZ2      TRP  76  -7.190  11.236   3.233
  615    HZ3  TRP  76           HZ3      TRP  76  -9.318  14.702   1.846
  616    HH2  TRP  76           HH2      TRP  76  -7.179  13.580   2.416
  617    H    LYS  77           HN       LYS  77 -13.476   7.665   1.001
  618    HA   LYS  77           HA       LYS  77 -15.984   7.054   2.532
  619   1HB   LYS  77          HB2       LYS  77 -15.354   6.882  -0.277
  620   2HB   LYS  77          HB1       LYS  77 -15.685   5.265   0.349
  621   1HG   LYS  77          HG2       LYS  77 -17.700   6.547   1.544
  622   2HG   LYS  77          HG1       LYS  77 -17.492   7.636   0.173
  623   1HD   LYS  77          HD2       LYS  77 -17.380   5.251  -1.109
  624   2HD   LYS  77          HD1       LYS  77 -18.452   4.829   0.228
  625   1HE   LYS  77          HE2       LYS  77 -19.175   7.418  -0.887
  626   2HE   LYS  77          HE1       LYS  77 -19.205   6.151  -2.129
  627   1HZ   LYS  77          HZ1       LYS  77 -20.311   5.655   0.561
  628   2HZ   LYS  77          HZ2       LYS  77 -20.653   4.850  -0.896
  629   3HZ   LYS  77          HZ3       LYS  77 -21.255   6.415  -0.624
  630    H    THR  78           HN       THR  78 -13.970   6.590   4.083
  631    HA   THR  78           HA       THR  78 -12.529   4.992   5.092
  632    HB   THR  78           HB       THR  78 -14.465   2.941   4.084
  633    HG1  THR  78           HG1      THR  78 -15.224   4.813   6.042
  634   1HG2  THR  78          HG21      THR  78 -14.477   2.387   6.530
  635   2HG2  THR  78          HG22      THR  78 -13.316   3.689   6.785
  636   3HG2  THR  78          HG23      THR  78 -12.876   2.295   5.798
  637    H    ASP  79           HN       ASP  79 -10.732   5.111   3.574
  638    HA   ASP  79           HA       ASP  79 -10.611   3.665   1.102
  639   1HB   ASP  79          HB2       ASP  79  -8.690   4.881   3.065
  640   2HB   ASP  79          HB1       ASP  79  -8.051   3.891   1.752
  641    H    ALA  80           HN       ALA  80  -9.724   1.584   0.666
  642    HA   ALA  80           HA       ALA  80 -10.293  -0.598   2.249
  643   1HB   ALA  80          HB1       ALA  80  -7.790  -0.262   0.569
  644   2HB   ALA  80          HB2       ALA  80  -9.399  -0.526  -0.104
  645   3HB   ALA  80          HB3       ALA  80  -8.646  -1.769   0.896
  646    H    SER  81           HN       SER  81  -7.610   1.628   2.663
  647    HA   SER  81           HA       SER  81  -5.862   0.121   4.293
  648   1HB   SER  81          HB2       SER  81  -5.316   2.436   5.202
  649   2HB   SER  81          HB1       SER  81  -5.293   2.301   3.445
  650    HG   SER  81           HG       SER  81  -6.518   4.066   3.871
  651    H    ASP  82           HN       ASP  82  -9.077   1.203   4.968
  652    HA   ASP  82           HA       ASP  82  -8.711   0.422   7.840
  653   1HB   ASP  82          HB2       ASP  82 -10.401   2.655   6.679
  654   2HB   ASP  82          HB1       ASP  82 -10.258   2.260   8.392
  655    H    VAL  83           HN       VAL  83  -9.737  -1.088   5.434
  656    HA   VAL  83           HA       VAL  83 -12.574  -1.502   6.318
  657    HB   VAL  83           HB       VAL  83 -11.261  -2.296   3.708
  658   1HG1  VAL  83          HG11      VAL  83 -13.663  -3.049   4.781
  659   2HG1  VAL  83          HG12      VAL  83 -13.332  -2.966   3.051
  660   3HG1  VAL  83          HG13      VAL  83 -14.128  -1.617   3.862
  661   1HG2  VAL  83          HG21      VAL  83 -12.744   0.249   4.437
  662   2HG2  VAL  83          HG22      VAL  83 -12.336  -0.231   2.789
  663   3HG2  VAL  83          HG23      VAL  83 -11.054   0.125   3.947
  664    H    LYS  84           HN       LYS  84 -13.293  -3.747   6.462
  665    HA   LYS  84           HA       LYS  84 -11.155  -5.568   7.377
  666   1HB   LYS  84          HB2       LYS  84 -13.281  -5.132   8.627
  667   2HB   LYS  84          HB1       LYS  84 -14.178  -5.847   7.287
  668   1HG   LYS  84          HG2       LYS  84 -13.958  -7.739   8.566
  669   2HG   LYS  84          HG1       LYS  84 -12.412  -7.833   7.722
  670   1HD   LYS  84          HD2       LYS  84 -11.217  -6.963   9.561
  671   2HD   LYS  84          HD1       LYS  84 -12.673  -6.297  10.303
  672   1HE   LYS  84          HE2       LYS  84 -12.505  -9.268   9.885
  673   2HE   LYS  84          HE1       LYS  84 -11.644  -8.537  11.254
  674   1HZ   LYS  84          HZ1       LYS  84 -13.695  -8.728  12.189
  675   2HZ   LYS  84          HZ2       LYS  84 -14.516  -8.634  10.704
  676   3HZ   LYS  84          HZ3       LYS  84 -13.910  -7.224  11.435
  677    HA   PRO  85           HA       PRO  85 -10.918  -7.670   3.465
  678   1HB   PRO  85          HB2       PRO  85 -10.279 -10.150   4.781
  679   2HB   PRO  85          HB1       PRO  85  -9.178  -9.036   3.961
  680   1HG   PRO  85          HG2       PRO  85  -9.470  -9.489   6.795
  681   2HG   PRO  85          HG1       PRO  85  -8.319  -8.436   5.968
  682   1HD   PRO  85          HD2       PRO  85 -10.570  -7.635   7.541
  683   2HD   PRO  85          HD1       PRO  85  -9.496  -6.583   6.589
  684    H    CYS  86           HN       CYS  86 -12.470  -8.816   2.275
  685    HA   CYS  86           HA       CYS  86 -15.042  -9.329   3.170
  686   1HB   CYS  86          HB2       CYS  86 -13.642  -9.646   0.855
  687   2HB   CYS  86          HB1       CYS  86 -13.917 -11.331   1.295
  Start of MODEL   16
    1   1H    THR   1          HT1       THR   1  20.330  -3.323 -10.099
    2   2H    THR   1          HT2       THR   1  19.357  -4.129 -11.234
    3   3H    THR   1          HT3       THR   1  21.017  -3.919 -11.531
    4    HA   THR   1           HA       THR   1  20.382  -6.215 -10.784
    5    HB   THR   1           HB       THR   1  22.234  -5.736  -8.791
    6    HG1  THR   1           HG1      THR   1  23.451  -4.011 -10.125
    7   1HG2  THR   1          HG21      THR   1  22.745  -7.240 -10.538
    8   2HG2  THR   1          HG22      THR   1  23.900  -5.925 -10.756
    9   3HG2  THR   1          HG23      THR   1  22.469  -6.021 -11.783
   10    H    LYS   2           HN       LYS   2  21.073  -4.474  -7.789
   11    HA   LYS   2           HA       LYS   2  18.471  -5.444  -6.661
   12   1HB   LYS   2          HB2       LYS   2  19.668  -6.286  -4.751
   13   2HB   LYS   2          HB1       LYS   2  20.527  -6.873  -6.175
   14   1HG   LYS   2          HG2       LYS   2  21.914  -4.659  -5.912
   15   2HG   LYS   2          HG1       LYS   2  21.318  -4.703  -4.253
   16   1HD   LYS   2          HD2       LYS   2  22.184  -7.335  -4.924
   17   2HD   LYS   2          HD1       LYS   2  23.459  -6.215  -5.403
   18   1HE   LYS   2          HE2       LYS   2  23.805  -6.875  -3.064
   19   2HE   LYS   2          HE1       LYS   2  23.309  -5.171  -3.109
   20   1HZ   LYS   2          HZ1       LYS   2  20.940  -6.354  -3.113
   21   2HZ   LYS   2          HZ2       LYS   2  21.738  -5.909  -1.679
   22   3HZ   LYS   2          HZ3       LYS   2  21.813  -7.513  -2.234
   23    H    ALA   3           HN       ALA   3  18.764  -2.813  -7.527
   24    HA   ALA   3           HA       ALA   3  19.716  -1.073  -5.380
   25   1HB   ALA   3          HB1       ALA   3  17.816  -0.214  -7.533
   26   2HB   ALA   3          HB2       ALA   3  19.419  -0.777  -8.009
   27   3HB   ALA   3          HB3       ALA   3  19.256   0.604  -6.924
   28    H    SER   4           HN       SER   4  18.396   0.089  -3.901
   29    HA   SER   4           HA       SER   4  16.040  -1.183  -2.914
   30   1HB   SER   4          HB2       SER   4  15.901   1.351  -1.949
   31   2HB   SER   4          HB1       SER   4  17.025   0.146  -1.326
   32    HG   SER   4           HG       SER   4  18.591   1.303  -2.097
   33    H    CYS   5           HN       CYS   5  14.037   0.589  -2.587
   34    HA   CYS   5           HA       CYS   5  13.166   1.226  -5.385
   35   1HB   CYS   5          HB2       CYS   5  11.496   0.702  -2.914
   36   2HB   CYS   5          HB1       CYS   5  10.934   0.746  -4.586
   37    H    LYS   6           HN       LYS   6  10.823   2.641  -4.227
   38    HA   LYS   6           HA       LYS   6  11.940   4.969  -2.799
   39   1HB   LYS   6          HB2       LYS   6  11.960   4.809  -5.612
   40   2HB   LYS   6          HB1       LYS   6  10.603   5.864  -5.217
   41   1HG   LYS   6          HG2       LYS   6  12.206   7.085  -3.634
   42   2HG   LYS   6          HG1       LYS   6  13.504   6.196  -4.433
   43   1HD   LYS   6          HD2       LYS   6  13.411   7.514  -6.265
   44   2HD   LYS   6          HD1       LYS   6  11.652   7.403  -6.343
   45   1HE   LYS   6          HE2       LYS   6  11.371   9.199  -4.776
   46   2HE   LYS   6          HE1       LYS   6  13.093   9.173  -4.343
   47   1HZ   LYS   6          HZ1       LYS   6  12.300  10.862  -6.103
   48   2HZ   LYS   6          HZ2       LYS   6  12.263   9.525  -7.151
   49   3HZ   LYS   6          HZ3       LYS   6  13.718   9.982  -6.403
   50    H    LEU   7           HN       LEU   7  10.326   4.879  -1.228
   51    HA   LEU   7           HA       LEU   7   7.724   4.058  -1.246
   52   1HB   LEU   7          HB2       LEU   7   7.341   5.984   0.369
   53   2HB   LEU   7          HB1       LEU   7   8.772   5.003   0.703
   54    HG   LEU   7           HG       LEU   7   9.546   7.032  -1.139
   55   1HD1  LEU   7          HD11      LEU   7   8.335   8.246   1.343
   56   2HD1  LEU   7          HD12      LEU   7   7.402   8.104  -0.146
   57   3HD1  LEU   7          HD13      LEU   7   8.884   9.058  -0.123
   58   1HD2  LEU   7          HD21      LEU   7  10.125   6.219   1.682
   59   2HD2  LEU   7          HD22      LEU   7  10.727   7.782   1.133
   60   3HD2  LEU   7          HD23      LEU   7  11.212   6.307   0.297
   61    HA   PRO   8           HA       PRO   8   6.335   6.617  -4.777
   62   1HB   PRO   8          HB2       PRO   8   3.983   4.961  -4.795
   63   2HB   PRO   8          HB1       PRO   8   5.322   4.964  -5.951
   64   1HG   PRO   8          HG2       PRO   8   4.695   2.963  -3.995
   65   2HG   PRO   8          HG1       PRO   8   6.043   2.979  -5.135
   66   1HD   PRO   8          HD2       PRO   8   6.129   3.388  -2.275
   67   2HD   PRO   8          HD1       PRO   8   7.490   3.378  -3.422
   68    H    VAL   9           HN       VAL   9   4.970   5.854  -1.689
   69    HA   VAL   9           HA       VAL   9   3.120   8.206  -1.930
   70    HB   VAL   9           HB       VAL   9   2.602   5.750  -0.250
   71   1HG1  VAL   9          HG11      VAL   9   0.764   7.789  -1.538
   72   2HG1  VAL   9          HG12      VAL   9   1.284   7.825   0.147
   73   3HG1  VAL   9          HG13      VAL   9   0.281   6.497  -0.439
   74   1HG2  VAL   9          HG21      VAL   9   2.212   6.158  -3.201
   75   2HG2  VAL   9          HG22      VAL   9   1.025   5.216  -2.299
   76   3HG2  VAL   9          HG23      VAL   9   2.713   4.707  -2.335
   77    H    LYS  10           HN       LYS  10   2.605   9.138   0.285
   78    HA   LYS  10           HA       LYS  10   5.050   9.049   2.004
   79   1HB   LYS  10          HB2       LYS  10   4.079  11.154   0.829
   80   2HB   LYS  10          HB1       LYS  10   2.828  11.090   2.072
   81   1HG   LYS  10          HG2       LYS  10   4.988  10.820   3.649
   82   2HG   LYS  10          HG1       LYS  10   5.724  11.732   2.330
   83   1HD   LYS  10          HD2       LYS  10   3.171  12.559   3.740
   84   2HD   LYS  10          HD1       LYS  10   4.770  13.183   4.148
   85   1HE   LYS  10          HE2       LYS  10   4.690  13.519   1.401
   86   2HE   LYS  10          HE1       LYS  10   3.028  13.895   1.895
   87   1HZ   LYS  10          HZ1       LYS  10   4.608  15.803   2.079
   88   2HZ   LYS  10          HZ2       LYS  10   5.430  14.941   3.291
   89   3HZ   LYS  10          HZ3       LYS  10   3.815  15.411   3.525
   90    H    LYS  11           HN       LYS  11   1.990   7.730   1.914
   91    HA   LYS  11           HA       LYS  11   2.035   7.170   4.812
   92   1HB   LYS  11          HB2       LYS  11   0.292   9.146   3.480
   93   2HB   LYS  11          HB1       LYS  11  -0.571   8.002   4.510
   94   1HG   LYS  11          HG2       LYS  11   0.846   8.557   6.405
   95   2HG   LYS  11          HG1       LYS  11   1.854   9.590   5.394
   96   1HD   LYS  11          HD2       LYS  11   0.314  11.007   6.613
   97   2HD   LYS  11          HD1       LYS  11  -0.171  10.998   4.918
   98   1HE   LYS  11          HE2       LYS  11  -1.399   8.863   6.569
   99   2HE   LYS  11          HE1       LYS  11  -1.912  10.517   6.960
  100   1HZ   LYS  11          HZ1       LYS  11  -1.727   9.525   4.174
  101   2HZ   LYS  11          HZ2       LYS  11  -2.506  10.926   4.736
  102   3HZ   LYS  11          HZ3       LYS  11  -3.152   9.394   5.083
  103    H    ALA  12           HN       ALA  12   2.374   5.339   2.761
  104    HA   ALA  12           HA       ALA  12  -0.241   4.115   2.120
  105   1HB   ALA  12          HB1       ALA  12   2.155   2.606   1.442
  106   2HB   ALA  12          HB2       ALA  12   2.303   4.294   0.952
  107   3HB   ALA  12          HB3       ALA  12   0.953   3.320   0.369
  108    H    THR  13           HN       THR  13  -0.817   1.983   2.813
  109    HA   THR  13           HA       THR  13   0.707   0.956   5.193
  110    HB   THR  13           HB       THR  13  -2.223   0.466   4.777
  111    HG1  THR  13           HG1      THR  13  -2.606   2.493   5.814
  112   1HG2  THR  13          HG21      THR  13  -2.208   0.046   7.024
  113   2HG2  THR  13          HG22      THR  13  -1.050   1.333   7.361
  114   3HG2  THR  13          HG23      THR  13  -0.488  -0.217   6.736
  115    H    VAL  14           HN       VAL  14   1.849  -0.730   4.195
  116    HA   VAL  14           HA       VAL  14   0.298  -2.618   2.464
  117    HB   VAL  14           HB       VAL  14   2.603  -3.263   1.715
  118   1HG1  VAL  14          HG11      VAL  14   1.392  -1.548   0.477
  119   2HG1  VAL  14          HG12      VAL  14   3.090  -1.082   0.586
  120   3HG1  VAL  14          HG13      VAL  14   1.895  -0.315   1.632
  121   1HG2  VAL  14          HG21      VAL  14   3.379  -2.133   4.110
  122   2HG2  VAL  14          HG22      VAL  14   3.820  -0.882   2.948
  123   3HG2  VAL  14          HG23      VAL  14   4.470  -2.513   2.776
  124    H    VAL  15           HN       VAL  15   1.448  -4.934   2.641
  125    HA   VAL  15           HA       VAL  15   1.709  -5.616   5.553
  126    HB   VAL  15           HB       VAL  15   0.114  -6.813   3.291
  127   1HG1  VAL  15          HG11      VAL  15   0.965  -8.225   5.840
  128   2HG1  VAL  15          HG12      VAL  15   1.423  -8.679   4.198
  129   3HG1  VAL  15          HG13      VAL  15  -0.257  -8.818   4.715
  130   1HG2  VAL  15          HG21      VAL  15  -0.393  -5.904   6.126
  131   2HG2  VAL  15          HG22      VAL  15  -1.538  -6.947   5.283
  132   3HG2  VAL  15          HG23      VAL  15  -1.164  -5.349   4.640
  133    H    TYR  16           HN       TYR  16   3.714  -6.472   5.930
  134    HA   TYR  16           HA       TYR  16   5.292  -7.568   3.672
  135   1HB   TYR  16          HB2       TYR  16   5.972  -5.873   5.572
  136   2HB   TYR  16          HB1       TYR  16   6.201  -7.338   6.528
  137    HD1  TYR  16           HD1      TYR  16   7.660  -5.155   4.100
  138    HD2  TYR  16           HD2      TYR  16   7.636  -9.230   5.463
  139    HE1  TYR  16           HE1      TYR  16   9.842  -5.542   2.988
  140    HE2  TYR  16           HE2      TYR  16   9.819  -9.615   4.350
  141    HH   TYR  16           HH       TYR  16  11.357  -8.761   2.980
  142    H    GLN  17           HN       GLN  17   3.868  -9.531   3.545
  143    HA   GLN  17           HA       GLN  17   3.591 -11.839   3.911
  144   1HB   GLN  17          HB2       GLN  17   5.912 -11.482   5.820
  145   2HB   GLN  17          HB1       GLN  17   5.454 -12.948   4.951
  146   1HG   GLN  17          HG2       GLN  17   5.732 -11.007   2.953
  147   2HG   GLN  17          HG1       GLN  17   7.087 -10.720   4.047
  148   1HE2  GLN  17          HE21      GLN  17   5.530 -13.254   2.053
  149   2HE2  GLN  17          HE22      GLN  17   6.910 -14.237   1.942
  150    H    GLY  18           HN       GLY  18   2.258  -9.796   5.693
  151   1HA   GLY  18          HA2       GLY  18   0.503 -10.659   7.255
  152   2HA   GLY  18          HA1       GLY  18   1.767 -11.624   8.011
  153    H    GLU  19           HN       GLU  19   2.987  -8.587   7.179
  154    HA   GLU  19           HA       GLU  19   2.478  -7.601   9.970
  155   1HB   GLU  19          HB2       GLU  19   4.889  -7.781   8.213
  156   2HB   GLU  19          HB1       GLU  19   4.789  -6.432   9.346
  157   1HG   GLU  19          HG2       GLU  19   5.621  -7.875  10.881
  158   2HG   GLU  19          HG1       GLU  19   4.004  -8.582  10.896
  159    H    ARG  20           HN       ARG  20   1.319  -5.736   9.992
  160    HA   ARG  20           HA       ARG  20   0.969  -4.157   7.525
  161   1HB   ARG  20          HB2       ARG  20  -0.203  -4.303  10.287
  162   2HB   ARG  20          HB1       ARG  20  -0.478  -2.849   9.320
  163   1HG   ARG  20          HG2       ARG  20  -1.745  -3.967   7.745
  164   2HG   ARG  20          HG1       ARG  20  -0.913  -5.499   8.009
  165   1HD   ARG  20          HD2       ARG  20  -2.148  -4.921  10.471
  166   2HD   ARG  20          HD1       ARG  20  -3.363  -4.540   9.234
  167    HE   ARG  20           HE       ARG  20  -3.237  -6.817   8.450
  168   1HH1  ARG  20          HH11      ARG  20  -2.691  -6.732  11.630
  169   2HH1  ARG  20          HH12      ARG  20  -1.622  -8.092  11.728
  170   1HH2  ARG  20          HH21      ARG  20  -1.147  -8.303   8.300
  171   2HH2  ARG  20          HH22      ARG  20  -0.749  -8.980   9.843
  172    H    VAL  21           HN       VAL  21   2.135  -2.310   7.092
  173    HA   VAL  21           HA       VAL  21   3.272  -0.733   9.331
  174    HB   VAL  21           HB       VAL  21   5.538  -0.900   8.124
  175   1HG1  VAL  21          HG11      VAL  21   4.684  -2.176  10.244
  176   2HG1  VAL  21          HG12      VAL  21   6.158  -2.729   9.450
  177   3HG1  VAL  21          HG13      VAL  21   4.636  -3.573   9.169
  178   1HG2  VAL  21          HG21      VAL  21   4.059  -2.172   6.201
  179   2HG2  VAL  21          HG22      VAL  21   4.726  -3.545   7.084
  180   3HG2  VAL  21          HG23      VAL  21   5.805  -2.341   6.378
  181    H    LYS  22           HN       LYS  22   3.952   1.396   8.634
  182    HA   LYS  22           HA       LYS  22   2.569   2.315   6.185
  183   1HB   LYS  22          HB2       LYS  22   3.756   3.494   8.672
  184   2HB   LYS  22          HB1       LYS  22   3.527   4.544   7.274
  185   1HG   LYS  22          HG2       LYS  22   1.284   2.768   8.200
  186   2HG   LYS  22          HG1       LYS  22   1.581   4.307   9.008
  187   1HD   LYS  22          HD2       LYS  22   1.340   5.512   6.910
  188   2HD   LYS  22          HD1       LYS  22   1.194   3.998   6.017
  189   1HE   LYS  22          HE2       LYS  22  -0.837   3.499   7.537
  190   2HE   LYS  22          HE1       LYS  22  -0.780   5.225   7.951
  191   1HZ   LYS  22          HZ1       LYS  22  -2.065   5.265   6.061
  192   2HZ   LYS  22          HZ2       LYS  22  -1.253   3.959   5.338
  193   3HZ   LYS  22          HZ3       LYS  22  -0.522   5.491   5.394
  194    H    ILE  23           HN       ILE  23   3.826   1.937   4.364
  195    HA   ILE  23           HA       ILE  23   6.573   1.686   4.079
  196    HB   ILE  23           HB       ILE  23   4.880   1.385   2.313
  197   1HG1  ILE  23          HG12      ILE  23   6.718   3.572   1.349
  198   2HG1  ILE  23          HG11      ILE  23   7.370   2.013   1.854
  199   1HG2  ILE  23          HG21      ILE  23   4.049   3.475   1.150
  200   2HG2  ILE  23          HG22      ILE  23   4.699   4.403   2.501
  201   3HG2  ILE  23          HG23      ILE  23   3.405   3.235   2.774
  202   1HD1  ILE  23          HD11      ILE  23   6.893   2.135  -0.604
  203   2HD1  ILE  23          HD12      ILE  23   5.185   2.349  -0.219
  204   3HD1  ILE  23          HD13      ILE  23   6.006   0.850   0.217
  205    H    GLN  24           HN       GLN  24   4.760   4.622   4.694
  206    HA   GLN  24           HA       GLN  24   6.872   6.473   3.934
  207   1HB   GLN  24          HB2       GLN  24   5.354   8.102   4.923
  208   2HB   GLN  24          HB1       GLN  24   4.401   6.920   4.018
  209   1HG   GLN  24          HG2       GLN  24   3.341   6.213   5.881
  210   2HG   GLN  24          HG1       GLN  24   4.855   6.072   6.773
  211   1HE2  GLN  24          HE21      GLN  24   2.134   7.366   7.480
  212   2HE2  GLN  24          HE22      GLN  24   2.555   8.921   8.014
  213    H    GLU  25           HN       GLU  25   6.490   4.377   6.585
  214    HA   GLU  25           HA       GLU  25   8.245   6.104   8.300
  215   1HB   GLU  25          HB2       GLU  25   6.078   4.082   8.839
  216   2HB   GLU  25          HB1       GLU  25   7.265   4.469  10.086
  217   1HG   GLU  25          HG2       GLU  25   6.628   6.770  10.118
  218   2HG   GLU  25          HG1       GLU  25   5.690   6.603   8.633
  219    H    LYS  26           HN       LYS  26   7.528   2.615   7.827
  220    HA   LYS  26           HA       LYS  26  10.179   1.798   8.690
  221   1HB   LYS  26          HB2       LYS  26   8.165   0.413   8.939
  222   2HB   LYS  26          HB1       LYS  26   7.957   0.384   7.186
  223   1HG   LYS  26          HG2       LYS  26   9.631  -1.142   6.874
  224   2HG   LYS  26          HG1       LYS  26  10.613  -0.482   8.182
  225   1HD   LYS  26          HD2       LYS  26   9.604  -1.785   9.788
  226   2HD   LYS  26          HD1       LYS  26   8.053  -1.806   8.946
  227   1HE   LYS  26          HE2       LYS  26  10.281  -3.155   7.519
  228   2HE   LYS  26          HE1       LYS  26   9.718  -3.952   9.002
  229   1HZ   LYS  26          HZ1       LYS  26   8.358  -4.644   7.145
  230   2HZ   LYS  26          HZ2       LYS  26   8.014  -3.029   6.747
  231   3HZ   LYS  26          HZ3       LYS  26   7.430  -3.692   8.198
  232    H    PHE  27           HN       PHE  27   8.706   2.616   5.615
  233    HA   PHE  27           HA       PHE  27  11.240   1.834   4.210
  234   1HB   PHE  27          HB2       PHE  27   8.320   1.904   3.450
  235   2HB   PHE  27          HB1       PHE  27   9.574   1.901   2.205
  236    HD1  PHE  27           HD1      PHE  27   7.383  -0.231   3.586
  237    HD2  PHE  27           HD2      PHE  27  11.644   0.171   3.219
  238    HE1  PHE  27           HE1      PHE  27   7.638  -2.684   3.856
  239    HE2  PHE  27           HE2      PHE  27  11.898  -2.282   3.489
  240    HZ   PHE  27           HZ       PHE  27   9.895  -3.709   3.807
  241    H    LYS  28           HN       LYS  28  10.800   4.372   5.638
  242    HA   LYS  28           HA       LYS  28  10.112   6.463   3.757
  243   1HB   LYS  28          HB2       LYS  28   9.878   7.053   5.996
  244   2HB   LYS  28          HB1       LYS  28  11.323   6.169   6.484
  245   1HG   LYS  28          HG2       LYS  28  11.562   8.588   4.708
  246   2HG   LYS  28          HG1       LYS  28  11.396   8.779   6.455
  247   1HD   LYS  28          HD2       LYS  28  13.288   6.842   6.375
  248   2HD   LYS  28          HD1       LYS  28  13.666   7.703   4.882
  249   1HE   LYS  28          HE2       LYS  28  13.191   9.277   7.405
  250   2HE   LYS  28          HE1       LYS  28  14.773   8.525   7.119
  251   1HZ   LYS  28          HZ1       LYS  28  14.335  10.856   6.146
  252   2HZ   LYS  28          HZ2       LYS  28  13.423  10.033   4.973
  253   3HZ   LYS  28          HZ3       LYS  28  15.077   9.693   5.160
  254    H    ASN  29           HN       ASN  29  12.955   4.568   4.341
  255    HA   ASN  29           HA       ASN  29  14.647   6.493   2.797
  256   1HB   ASN  29          HB2       ASN  29  15.068   4.354   4.850
  257   2HB   ASN  29          HB1       ASN  29  16.376   4.664   3.702
  258   1HD2  ASN  29          HD21      ASN  29  16.607   5.286   6.518
  259   2HD2  ASN  29          HD22      ASN  29  16.727   6.971   6.668
  260    H    GLY  30           HN       GLY  30  12.682   4.949   1.383
  261   1HA   GLY  30          HA2       GLY  30  12.694   3.796  -0.684
  262   2HA   GLY  30          HA1       GLY  30  14.433   3.556  -0.502
  263    H    MET  31           HN       MET  31  12.437   1.546  -1.269
  264    HA   MET  31           HA       MET  31  12.372  -0.255   1.107
  265   1HB   MET  31          HB2       MET  31  11.163  -0.630  -1.647
  266   2HB   MET  31          HB1       MET  31  10.698  -1.441  -0.151
  267   1HG   MET  31          HG2       MET  31   9.958   0.712   0.793
  268   2HG   MET  31          HG1       MET  31  10.430   1.530  -0.696
  269   1HE   MET  31          HE1       MET  31   9.076   2.138  -2.274
  270   2HE   MET  31          HE2       MET  31   7.689   1.314  -2.983
  271   3HE   MET  31          HE3       MET  31   9.306   0.650  -3.203
  272    H    LEU  32           HN       LEU  32  13.292  -2.382   0.967
  273    HA   LEU  32           HA       LEU  32  15.773  -2.604  -0.450
  274   1HB   LEU  32          HB2       LEU  32  13.977  -4.707   0.797
  275   2HB   LEU  32          HB1       LEU  32  15.694  -4.910   0.436
  276    HG   LEU  32           HG       LEU  32  14.505  -2.880   2.354
  277   1HD1  LEU  32          HD11      LEU  32  15.147  -5.613   2.688
  278   2HD1  LEU  32          HD12      LEU  32  14.786  -4.440   3.954
  279   3HD1  LEU  32          HD13      LEU  32  16.454  -4.708   3.451
  280   1HD2  LEU  32          HD21      LEU  32  17.144  -2.855   2.867
  281   2HD2  LEU  32          HD22      LEU  32  16.414  -1.779   1.675
  282   3HD2  LEU  32          HD23      LEU  32  17.210  -3.265   1.153
  283    H    HIS  33           HN       HIS  33  16.292  -4.046  -2.222
  284    HA   HIS  33           HA       HIS  33  14.411  -4.047  -4.395
  285   1HB   HIS  33          HB2       HIS  33  16.707  -4.002  -4.923
  286   2HB   HIS  33          HB1       HIS  33  17.086  -5.292  -3.779
  287    HD1  HIS  33           HD1      HIS  33  14.940  -4.921  -6.927
  288    HD2  HIS  33           HD2      HIS  33  17.425  -7.701  -5.064
  289    HE1  HIS  33           HE1      HIS  33  15.044  -6.931  -8.463
  290    H    GLY  34           HN       GLY  34  13.067  -5.699  -5.155
  291   1HA   GLY  34          HA2       GLY  34  11.975  -7.786  -5.217
  292   2HA   GLY  34          HA1       GLY  34  13.265  -8.435  -4.207
  293    H    ASP  35           HN       ASP  35  12.150  -5.726  -2.646
  294    HA   ASP  35           HA       ASP  35  11.015  -7.118  -0.448
  295   1HB   ASP  35          HB2       ASP  35  11.910  -4.749  -0.583
  296   2HB   ASP  35          HB1       ASP  35  10.399  -4.293  -1.371
  297    H    LYS  36           HN       LYS  36   9.069  -8.184  -0.328
  298    HA   LYS  36           HA       LYS  36   6.985  -7.581  -2.371
  299   1HB   LYS  36          HB2       LYS  36   7.728  -9.867  -0.575
  300   2HB   LYS  36          HB1       LYS  36   6.074  -9.764  -1.181
  301   1HG   LYS  36          HG2       LYS  36   7.939  -9.230  -3.321
  302   2HG   LYS  36          HG1       LYS  36   8.327 -10.770  -2.553
  303   1HD   LYS  36          HD2       LYS  36   5.774 -11.236  -2.699
  304   2HD   LYS  36          HD1       LYS  36   5.757  -9.927  -3.882
  305   1HE   LYS  36          HE2       LYS  36   7.355 -11.100  -5.295
  306   2HE   LYS  36          HE1       LYS  36   7.566 -12.364  -4.067
  307   1HZ   LYS  36          HZ1       LYS  36   4.997 -11.656  -5.387
  308   2HZ   LYS  36          HZ2       LYS  36   5.210 -12.863  -4.211
  309   3HZ   LYS  36          HZ3       LYS  36   5.932 -13.027  -5.740
  310    H    VAL  37           HN       VAL  37   5.246  -6.372  -1.781
  311    HA   VAL  37           HA       VAL  37   4.325  -6.430   1.062
  312    HB   VAL  37           HB       VAL  37   4.061  -3.869   0.728
  313   1HG1  VAL  37          HG11      VAL  37   5.743  -4.068   2.220
  314   2HG1  VAL  37          HG12      VAL  37   6.847  -3.909   0.852
  315   3HG1  VAL  37          HG13      VAL  37   6.371  -5.509   1.422
  316   1HG2  VAL  37          HG21      VAL  37   4.430  -3.824  -1.688
  317   2HG2  VAL  37          HG22      VAL  37   6.022  -4.554  -1.484
  318   3HG2  VAL  37          HG23      VAL  37   5.716  -2.923  -0.886
  319    H    SER  38           HN       SER  38   2.066  -6.302   1.240
  320    HA   SER  38           HA       SER  38   0.543  -6.282  -1.327
  321   1HB   SER  38          HB2       SER  38  -0.755  -6.892   1.274
  322   2HB   SER  38          HB1       SER  38  -0.864  -7.749  -0.264
  323    HG   SER  38           HG       SER  38   0.400  -9.087   0.807
  324    H    PHE  39           HN       PHE  39  -0.996  -4.684  -1.731
  325    HA   PHE  39           HA       PHE  39  -1.117  -2.418   0.207
  326   1HB   PHE  39          HB2       PHE  39  -1.614  -2.826  -2.736
  327   2HB   PHE  39          HB1       PHE  39  -2.212  -1.377  -1.923
  328    HD1  PHE  39           HD1      PHE  39  -0.807   0.481  -1.834
  329    HD2  PHE  39           HD2      PHE  39   0.920  -3.440  -2.140
  330    HE1  PHE  39           HE1      PHE  39   1.458   1.488  -1.963
  331    HE2  PHE  39           HE2      PHE  39   3.183  -2.434  -2.266
  332    HZ   PHE  39           HZ       PHE  39   3.452   0.030  -2.178
  333    H    PHE  40           HN       PHE  40  -3.157  -1.667   0.981
  334    HA   PHE  40           HA       PHE  40  -5.300  -3.680   1.001
  335   1HB   PHE  40          HB2       PHE  40  -4.624  -1.102   2.375
  336   2HB   PHE  40          HB1       PHE  40  -6.305  -1.653   2.414
  337    HD1  PHE  40           HD1      PHE  40  -3.543  -4.064   2.170
  338    HD2  PHE  40           HD2      PHE  40  -6.229  -2.046   4.847
  339    HE1  PHE  40           HE1      PHE  40  -2.970  -5.678   3.962
  340    HE2  PHE  40           HE2      PHE  40  -5.657  -3.661   6.639
  341    HZ   PHE  40           HZ       PHE  40  -4.027  -5.477   6.197
  342    H    CYS  41           HN       CYS  41  -6.986  -3.658  -0.410
  343    HA   CYS  41           HA       CYS  41  -7.781  -1.058  -1.662
  344   1HB   CYS  41          HB2       CYS  41  -7.222  -3.756  -2.909
  345   2HB   CYS  41          HB1       CYS  41  -8.153  -2.511  -3.749
  346    H    LYS  42           HN       LYS  42 -10.073  -1.110  -2.415
  347    HA   LYS  42           HA       LYS  42 -11.694  -3.050  -0.801
  348   1HB   LYS  42          HB2       LYS  42 -13.393  -1.177  -0.917
  349   2HB   LYS  42          HB1       LYS  42 -11.903  -0.759  -0.063
  350   1HG   LYS  42          HG2       LYS  42 -11.085   0.523  -1.866
  351   2HG   LYS  42          HG1       LYS  42 -12.197  -0.222  -3.015
  352   1HD   LYS  42          HD2       LYS  42 -13.799   1.300  -2.572
  353   2HD   LYS  42          HD1       LYS  42 -13.638   1.049  -0.833
  354   1HE   LYS  42          HE2       LYS  42 -12.904   3.248  -0.946
  355   2HE   LYS  42          HE1       LYS  42 -11.360   2.438  -1.277
  356   1HZ   LYS  42          HZ1       LYS  42 -11.930   4.105  -2.981
  357   2HZ   LYS  42          HZ2       LYS  42 -13.336   3.227  -3.353
  358   3HZ   LYS  42          HZ3       LYS  42 -11.805   2.540  -3.624
  359    H    ASN  43           HN       ASN  43 -13.476  -4.042  -1.799
  360    HA   ASN  43           HA       ASN  43 -13.517  -3.887  -4.789
  361   1HB   ASN  43          HB2       ASN  43 -13.013  -6.011  -3.333
  362   2HB   ASN  43          HB1       ASN  43 -14.764  -6.046  -3.097
  363   1HD2  ASN  43          HD21      ASN  43 -15.890  -5.475  -5.469
  364   2HD2  ASN  43          HD22      ASN  43 -15.329  -6.486  -6.713
  365    H    LYS  44           HN       LYS  44 -15.415  -3.250  -5.797
  366    HA   LYS  44           HA       LYS  44 -17.567  -2.132  -4.160
  367   1HB   LYS  44          HB2       LYS  44 -16.878  -2.372  -7.082
  368   2HB   LYS  44          HB1       LYS  44 -18.473  -1.795  -6.596
  369   1HG   LYS  44          HG2       LYS  44 -16.353  -0.515  -5.060
  370   2HG   LYS  44          HG1       LYS  44 -16.155  -0.249  -6.793
  371   1HD   LYS  44          HD2       LYS  44 -17.793   1.289  -6.727
  372   2HD   LYS  44          HD1       LYS  44 -18.925   0.040  -6.208
  373   1HE   LYS  44          HE2       LYS  44 -17.093   1.135  -4.120
  374   2HE   LYS  44          HE1       LYS  44 -18.415   2.182  -4.673
  375   1HZ   LYS  44          HZ1       LYS  44 -19.169   0.726  -2.892
  376   2HZ   LYS  44          HZ2       LYS  44 -18.691  -0.642  -3.780
  377   3HZ   LYS  44          HZ3       LYS  44 -19.956   0.342  -4.345
  378    H    GLU  45           HN       GLU  45 -17.367  -4.760  -6.600
  379    HA   GLU  45           HA       GLU  45 -20.052  -5.664  -6.390
  380   1HB   GLU  45          HB2       GLU  45 -17.572  -6.417  -7.586
  381   2HB   GLU  45          HB1       GLU  45 -18.232  -7.848  -6.793
  382   1HG   GLU  45          HG2       GLU  45 -20.162  -6.195  -8.332
  383   2HG   GLU  45          HG1       GLU  45 -18.970  -7.086  -9.278
  384    H    LYS  46           HN       LYS  46 -17.141  -6.681  -4.576
  385    HA   LYS  46           HA       LYS  46 -18.747  -8.449  -2.839
  386   1HB   LYS  46          HB2       LYS  46 -15.834  -7.659  -2.595
  387   2HB   LYS  46          HB1       LYS  46 -16.602  -9.145  -2.032
  388   1HG   LYS  46          HG2       LYS  46 -16.617  -8.444  -4.965
  389   2HG   LYS  46          HG1       LYS  46 -15.214  -9.223  -4.238
  390   1HD   LYS  46          HD2       LYS  46 -17.004 -10.877  -3.246
  391   2HD   LYS  46          HD1       LYS  46 -18.002 -10.283  -4.575
  392   1HE   LYS  46          HE2       LYS  46 -16.733 -11.342  -6.165
  393   2HE   LYS  46          HE1       LYS  46 -15.215 -11.023  -5.302
  394   1HZ   LYS  46          HZ1       LYS  46 -17.291 -12.998  -4.506
  395   2HZ   LYS  46          HZ2       LYS  46 -15.872 -12.661  -3.636
  396   3HZ   LYS  46          HZ3       LYS  46 -15.779 -13.369  -5.177
  397    H    LYS  47           HN       LYS  47 -17.554  -5.205  -2.876
  398    HA   LYS  47           HA       LYS  47 -17.724  -3.450  -1.328
  399   1HB   LYS  47          HB2       LYS  47 -19.701  -5.461  -0.231
  400   2HB   LYS  47          HB1       LYS  47 -19.548  -3.815   0.381
  401   1HG   LYS  47          HG2       LYS  47 -19.849  -3.067  -2.065
  402   2HG   LYS  47          HG1       LYS  47 -20.414  -4.711  -2.367
  403   1HD   LYS  47          HD2       LYS  47 -22.441  -3.806  -1.800
  404   2HD   LYS  47          HD1       LYS  47 -21.871  -4.125  -0.162
  405   1HE   LYS  47          HE2       LYS  47 -20.866  -1.789  -0.161
  406   2HE   LYS  47          HE1       LYS  47 -21.748  -1.499  -1.673
  407   1HZ   LYS  47          HZ1       LYS  47 -22.956  -2.436   0.876
  408   2HZ   LYS  47          HZ2       LYS  47 -23.794  -2.163  -0.577
  409   3HZ   LYS  47          HZ3       LYS  47 -23.081  -0.863   0.254
  410    H    CYS  48           HN       CYS  48 -15.741  -5.691  -0.891
  411    HA   CYS  48           HA       CYS  48 -15.293  -5.175   2.029
  412   1HB   CYS  48          HB2       CYS  48 -14.048  -7.625   1.360
  413   2HB   CYS  48          HB1       CYS  48 -15.449  -7.388   2.396
  414    H    SER  49           HN       SER  49 -12.901  -5.657   2.571
  415    HA   SER  49           HA       SER  49 -11.239  -4.335   0.484
  416   1HB   SER  49          HB2       SER  49 -10.084  -3.461   2.274
  417   2HB   SER  49          HB1       SER  49 -11.599  -3.812   3.093
  418    HG   SER  49           HG       SER  49  -9.158  -5.193   3.143
  419    H    TYR  50           HN       TYR  50  -9.006  -5.139   0.239
  420    HA   TYR  50           HA       TYR  50  -8.381  -7.897   1.035
  421   1HB   TYR  50          HB2       TYR  50  -8.299  -8.691  -1.327
  422   2HB   TYR  50          HB1       TYR  50  -9.931  -8.207  -0.854
  423    HD1  TYR  50           HD1      TYR  50 -11.003  -6.281  -1.828
  424    HD2  TYR  50           HD2      TYR  50  -6.917  -7.212  -2.760
  425    HE1  TYR  50           HE1      TYR  50 -11.053  -4.635  -3.682
  426    HE2  TYR  50           HE2      TYR  50  -6.964  -5.566  -4.615
  427    HH   TYR  50           HH       TYR  50  -9.847  -4.214  -5.799
  428    H    THR  51           HN       THR  51  -6.140  -8.473   0.281
  429    HA   THR  51           HA       THR  51  -4.483  -6.007   0.040
  430    HB   THR  51           HB       THR  51  -2.676  -7.773   0.594
  431    HG1  THR  51           HG1      THR  51  -3.371  -9.732   0.714
  432   1HG2  THR  51          HG21      THR  51  -4.716  -7.670   2.772
  433   2HG2  THR  51          HG22      THR  51  -4.101  -6.139   2.148
  434   3HG2  THR  51          HG23      THR  51  -2.988  -7.324   2.834
  435    H    GLU  52           HN       GLU  52  -3.018  -5.725  -1.628
  436    HA   GLU  52           HA       GLU  52  -3.207  -7.651  -3.925
  437   1HB   GLU  52          HB2       GLU  52  -3.781  -4.893  -3.689
  438   2HB   GLU  52          HB1       GLU  52  -2.263  -4.987  -4.582
  439   1HG   GLU  52          HG2       GLU  52  -4.787  -6.524  -5.269
  440   2HG   GLU  52          HG1       GLU  52  -4.220  -5.075  -6.102
  441    H    ASP  53           HN       ASP  53  -1.369  -8.858  -3.061
  442    HA   ASP  53           HA       ASP  53   1.062  -8.065  -2.104
  443   1HB   ASP  53          HB2       ASP  53   0.447 -10.076  -4.278
  444   2HB   ASP  53          HB1       ASP  53   1.984 -10.011  -3.413
  445    H    ALA  54           HN       ALA  54   2.966  -7.207  -2.896
  446    HA   ALA  54           HA       ALA  54   3.114  -6.380  -5.760
  447   1HB   ALA  54          HB1       ALA  54   2.283  -4.689  -3.769
  448   2HB   ALA  54          HB2       ALA  54   3.103  -4.150  -5.235
  449   3HB   ALA  54          HB3       ALA  54   4.023  -4.402  -3.752
  450    H    GLN  55           HN       GLN  55   5.379  -5.912  -6.397
  451    HA   GLN  55           HA       GLN  55   7.374  -7.080  -4.481
  452   1HB   GLN  55          HB2       GLN  55   6.616  -8.460  -6.501
  453   2HB   GLN  55          HB1       GLN  55   7.439  -7.262  -7.501
  454   1HG   GLN  55          HG2       GLN  55   9.546  -7.694  -6.304
  455   2HG   GLN  55          HG1       GLN  55   8.729  -8.879  -5.283
  456   1HE2  GLN  55          HE21      GLN  55   8.186  -8.440  -8.793
  457   2HE2  GLN  55          HE22      GLN  55   8.764  -9.974  -9.236
  458    H    CYS  56           HN       CYS  56   9.483  -6.140  -4.540
  459    HA   CYS  56           HA       CYS  56   9.565  -3.389  -5.697
  460   1HB   CYS  56          HB2       CYS  56  10.142  -4.537  -3.197
  461   2HB   CYS  56          HB1       CYS  56  11.714  -4.158  -3.899
  462    H    ILE  57           HN       ILE  57  11.202  -2.850  -7.162
  463    HA   ILE  57           HA       ILE  57  13.108  -5.046  -7.907
  464    HB   ILE  57           HB       ILE  57  12.041  -2.969  -9.818
  465   1HG1  ILE  57          HG12      ILE  57  10.031  -3.922  -8.864
  466   2HG1  ILE  57          HG11      ILE  57  10.285  -4.682 -10.435
  467   1HG2  ILE  57          HG21      ILE  57  12.286  -5.242 -11.222
  468   2HG2  ILE  57          HG22      ILE  57  13.446  -5.593  -9.941
  469   3HG2  ILE  57          HG23      ILE  57  13.650  -4.159 -10.947
  470   1HD1  ILE  57          HD11      ILE  57  10.121  -5.935  -7.859
  471   2HD1  ILE  57          HD12      ILE  57  11.734  -6.207  -8.517
  472   3HD1  ILE  57          HD13      ILE  57  10.313  -6.698  -9.438
  473    H    ASP  58           HN       ASP  58  14.820  -3.830  -9.509
  474    HA   ASP  58           HA       ASP  58  16.529  -2.281  -7.870
  475   1HB   ASP  58          HB2       ASP  58  16.846  -3.640 -10.083
  476   2HB   ASP  58          HB1       ASP  58  16.491  -2.101 -10.872
  477    H    GLY  59           HN       GLY  59  15.352  -0.474  -6.987
  478   1HA   GLY  59          HA2       GLY  59  14.749   1.790  -6.943
  479   2HA   GLY  59          HA1       GLY  59  15.529   1.942  -8.514
  480    H    THR  60           HN       THR  60  13.202  -0.477  -8.710
  481    HA   THR  60           HA       THR  60  11.062   1.470  -9.485
  482    HB   THR  60           HB       THR  60  11.927  -0.924 -11.116
  483    HG1  THR  60           HG1      THR  60  12.803   0.818 -12.482
  484   1HG2  THR  60          HG21      THR  60  10.590   0.114 -12.864
  485   2HG2  THR  60          HG22      THR  60  10.270   1.506 -11.829
  486   3HG2  THR  60          HG23      THR  60   9.603  -0.072 -11.414
  487    H    ILE  61           HN       ILE  61   9.034   0.788  -8.846
  488    HA   ILE  61           HA       ILE  61   8.699  -2.092  -8.093
  489    HB   ILE  61           HB       ILE  61   9.075  -0.984  -6.033
  490   1HG1  ILE  61          HG12      ILE  61   6.216  -0.500  -5.777
  491   2HG1  ILE  61          HG11      ILE  61   6.539  -2.006  -6.637
  492   1HG2  ILE  61          HG21      ILE  61   7.273   1.218  -7.085
  493   2HG2  ILE  61          HG22      ILE  61   9.020   1.313  -6.865
  494   3HG2  ILE  61          HG23      ILE  61   7.961   1.170  -5.462
  495   1HD1  ILE  61          HD11      ILE  61   7.780  -2.906  -4.840
  496   2HD1  ILE  61          HD12      ILE  61   6.421  -2.105  -4.052
  497   3HD1  ILE  61          HD13      ILE  61   8.004  -1.327  -4.089
  498    H    GLU  62           HN       GLU  62   6.661  -2.936  -8.586
  499    HA   GLU  62           HA       GLU  62   4.928  -1.251 -10.310
  500   1HB   GLU  62          HB2       GLU  62   4.953  -4.210  -9.627
  501   2HB   GLU  62          HB1       GLU  62   3.951  -3.463 -10.872
  502   1HG   GLU  62          HG2       GLU  62   6.298  -2.525 -11.703
  503   2HG   GLU  62          HG1       GLU  62   6.902  -3.945 -10.850
  504    H    VAL  63           HN       VAL  63   3.767   0.025  -8.759
  505    HA   VAL  63           HA       VAL  63   2.505  -1.131  -6.418
  506    HB   VAL  63           HB       VAL  63   2.425   1.457  -7.952
  507   1HG1  VAL  63          HG11      VAL  63   0.270   1.749  -7.281
  508   2HG1  VAL  63          HG12      VAL  63   0.979   2.019  -5.690
  509   3HG1  VAL  63          HG13      VAL  63   0.355   0.428  -6.118
  510   1HG2  VAL  63          HG21      VAL  63   3.297   0.528  -5.212
  511   2HG2  VAL  63          HG22      VAL  63   3.109   2.241  -5.593
  512   3HG2  VAL  63          HG23      VAL  63   4.279   1.263  -6.480
  513    HA   PRO  64           HA       PRO  64  -0.994  -2.994  -8.409
  514   1HB   PRO  64          HB2       PRO  64  -2.669  -2.447  -6.129
  515   2HB   PRO  64          HB1       PRO  64  -1.898  -3.976  -6.578
  516   1HG   PRO  64          HG2       PRO  64  -1.194  -2.207  -4.422
  517   2HG   PRO  64          HG1       PRO  64  -0.446  -3.746  -4.856
  518   1HD   PRO  64          HD2       PRO  64   0.657  -1.113  -5.172
  519   2HD   PRO  64          HD1       PRO  64   1.382  -2.658  -5.675
  520    H    LYS  65           HN       LYS  65  -3.092  -2.318  -9.276
  521    HA   LYS  65           HA       LYS  65  -3.294   0.604  -9.613
  522   1HB   LYS  65          HB2       LYS  65  -4.698  -1.816 -10.776
  523   2HB   LYS  65          HB1       LYS  65  -5.086  -0.161 -11.248
  524   1HG   LYS  65          HG2       LYS  65  -2.750   0.202 -11.941
  525   2HG   LYS  65          HG1       LYS  65  -2.346  -1.446 -11.459
  526   1HD   LYS  65          HD2       LYS  65  -2.718  -1.526 -13.820
  527   2HD   LYS  65          HD1       LYS  65  -4.159  -2.222 -13.078
  528   1HE   LYS  65          HE2       LYS  65  -5.476  -0.593 -13.949
  529   2HE   LYS  65          HE1       LYS  65  -4.390   0.677 -13.352
  530   1HZ   LYS  65          HZ1       LYS  65  -3.400  -0.991 -15.527
  531   2HZ   LYS  65          HZ2       LYS  65  -3.170   0.668 -15.243
  532   3HZ   LYS  65          HZ3       LYS  65  -4.623   0.114 -15.928
  533    H    CYS  66           HN       CYS  66  -5.024  -1.992  -7.969
  534    HA   CYS  66           HA       CYS  66  -7.520  -0.702  -7.521
  535   1HB   CYS  66          HB2       CYS  66  -7.718  -2.343  -5.722
  536   2HB   CYS  66          HB1       CYS  66  -6.905  -3.093  -7.095
  537    H    PHE  67           HN       PHE  67  -4.386   0.040  -6.285
  538    HA   PHE  67           HA       PHE  67  -5.098   1.184  -3.743
  539   1HB   PHE  67          HB2       PHE  67  -2.819   0.617  -4.278
  540   2HB   PHE  67          HB1       PHE  67  -2.846   1.629  -5.725
  541    HD1  PHE  67           HD1      PHE  67  -2.354   1.542  -2.128
  542    HD2  PHE  67           HD2      PHE  67  -3.037   4.131  -5.486
  543    HE1  PHE  67           HE1      PHE  67  -1.596   3.484  -0.784
  544    HE2  PHE  67           HE2      PHE  67  -2.277   6.073  -4.143
  545    HZ   PHE  67           HZ       PHE  67  -1.557   5.749  -1.792
  546    H    LYS  68           HN       LYS  68  -5.213   3.519  -3.256
  547    HA   LYS  68           HA       LYS  68  -5.682   5.400  -5.472
  548   1HB   LYS  68          HB2       LYS  68  -8.043   5.812  -4.654
  549   2HB   LYS  68          HB1       LYS  68  -7.802   4.226  -5.388
  550   1HG   LYS  68          HG2       LYS  68  -8.331   3.176  -3.466
  551   2HG   LYS  68          HG1       LYS  68  -7.184   4.157  -2.554
  552   1HD   LYS  68          HD2       LYS  68  -9.271   5.917  -3.170
  553   2HD   LYS  68          HD1       LYS  68 -10.077   4.408  -2.736
  554   1HE   LYS  68          HE2       LYS  68  -9.768   5.077  -0.576
  555   2HE   LYS  68          HE1       LYS  68  -8.070   4.617  -0.820
  556   1HZ   LYS  68          HZ1       LYS  68  -8.460   6.993  -0.116
  557   2HZ   LYS  68          HZ2       LYS  68  -9.152   7.252  -1.645
  558   3HZ   LYS  68          HZ3       LYS  68  -7.523   6.788  -1.514
  559    H    GLU  69           HN       GLU  69  -4.441   7.062  -4.639
  560    HA   GLU  69           HA       GLU  69  -3.710   7.614  -2.025
  561   1HB   GLU  69          HB2       GLU  69  -2.897   8.778  -4.031
  562   2HB   GLU  69          HB1       GLU  69  -4.466   9.552  -4.238
  563   1HG   GLU  69          HG2       GLU  69  -4.209  10.680  -2.061
  564   2HG   GLU  69          HG1       GLU  69  -2.645   9.895  -1.836
  565    H    HIS  70           HN       HIS  70  -5.995   9.973  -3.305
  566    HA   HIS  70           HA       HIS  70  -8.053   9.289  -1.299
  567   1HB   HIS  70          HB2       HIS  70  -7.822  11.616  -0.311
  568   2HB   HIS  70          HB1       HIS  70  -6.465  10.540   0.026
  569    HD1  HIS  70           HD1      HIS  70  -4.783  12.519   0.222
  570    HD2  HIS  70           HD2      HIS  70  -6.663  12.269  -3.491
  571    HE1  HIS  70           HE1      HIS  70  -3.516  14.070  -1.329
  572    H    SER  71           HN       SER  71  -9.501  11.643  -1.360
  573    HA   SER  71           HA       SER  71  -9.750  12.605  -4.132
  574   1HB   SER  71          HB2       SER  71 -12.146  11.701  -4.190
  575   2HB   SER  71          HB1       SER  71 -10.865  10.496  -4.341
  576    HG   SER  71           HG       SER  71 -12.161   9.707  -2.780
  577    H    SER  72           HN       SER  72 -11.380  14.334  -4.280
  578    HA   SER  72           HA       SER  72 -11.421  16.148  -2.113
  579   1HB   SER  72          HB2       SER  72 -13.435  15.819  -4.360
  580   2HB   SER  72          HB1       SER  72 -13.092  17.305  -3.477
  581    HG   SER  72           HG       SER  72 -11.909  17.342  -5.359
  582    H    LEU  73           HN       LEU  73 -13.397  16.862  -0.882
  583    HA   LEU  73           HA       LEU  73 -15.121  16.361   0.658
  584   1HB   LEU  73          HB2       LEU  73 -15.699  14.938  -1.906
  585   2HB   LEU  73          HB1       LEU  73 -16.707  14.541  -0.510
  586    HG   LEU  73           HG       LEU  73 -17.126  16.994  -0.191
  587   1HD1  LEU  73          HD11      LEU  73 -15.799  17.214  -2.911
  588   2HD1  LEU  73          HD12      LEU  73 -15.070  17.745  -1.394
  589   3HD1  LEU  73          HD13      LEU  73 -16.533  18.530  -1.993
  590   1HD2  LEU  73          HD21      LEU  73 -18.969  16.208  -1.281
  591   2HD2  LEU  73          HD22      LEU  73 -18.006  15.344  -2.480
  592   3HD2  LEU  73          HD23      LEU  73 -18.302  17.073  -2.666
  593    H    ALA  74           HN       ALA  74 -13.305  15.296   1.970
  594    HA   ALA  74           HA       ALA  74 -12.843  12.466   1.895
  595   1HB   ALA  74          HB1       ALA  74 -11.988  14.757   3.300
  596   2HB   ALA  74          HB2       ALA  74 -11.327  13.128   3.436
  597   3HB   ALA  74          HB3       ALA  74 -12.606  13.655   4.530
  598    H    PHE  75           HN       PHE  75 -14.779  14.357   4.258
  599    HA   PHE  75           HA       PHE  75 -16.574  13.654   5.640
  600   1HB   PHE  75          HB2       PHE  75 -16.980  13.008   2.855
  601   2HB   PHE  75          HB1       PHE  75 -17.793  11.809   3.861
  602    HD1  PHE  75           HD1      PHE  75 -18.952  12.964   6.059
  603    HD2  PHE  75           HD2      PHE  75 -18.259  14.850   2.263
  604    HE1  PHE  75           HE1      PHE  75 -20.757  14.595   6.540
  605    HE2  PHE  75           HE2      PHE  75 -20.064  16.482   2.744
  606    HZ   PHE  75           HZ       PHE  75 -21.312  16.354   4.882
  607    H    TRP  76           HN       TRP  76 -17.897  11.227   5.873
  608    HA   TRP  76           HA       TRP  76 -16.047   9.621   7.389
  609   1HB   TRP  76          HB2       TRP  76 -18.839   9.881   6.906
  610   2HB   TRP  76          HB1       TRP  76 -18.412   8.191   6.622
  611    HD1  TRP  76           HD1      TRP  76 -18.035  10.923   9.310
  612    HE1  TRP  76           HE1      TRP  76 -17.847   9.773  11.612
  613    HE3  TRP  76           HE3      TRP  76 -17.926   6.048   7.837
  614    HZ2  TRP  76           HZ2      TRP  76 -17.667   7.122  12.682
  615    HZ3  TRP  76           HZ3      TRP  76 -17.742   4.226   9.510
  616    HH2  TRP  76           HH2      TRP  76 -17.612   4.757  11.929
  617    H    LYS  77           HN       LYS  77 -14.620   9.649   5.176
  618    HA   LYS  77           HA       LYS  77 -15.352   7.567   3.247
  619   1HB   LYS  77          HB2       LYS  77 -13.046   8.152   2.389
  620   2HB   LYS  77          HB1       LYS  77 -14.124   9.538   2.551
  621   1HG   LYS  77          HG2       LYS  77 -12.824  10.494   4.134
  622   2HG   LYS  77          HG1       LYS  77 -12.648   8.976   5.013
  623   1HD   LYS  77          HD2       LYS  77 -11.208   8.865   2.500
  624   2HD   LYS  77          HD1       LYS  77 -10.686  10.255   3.454
  625   1HE   LYS  77          HE2       LYS  77 -10.397   8.723   5.430
  626   2HE   LYS  77          HE1       LYS  77 -10.744   7.354   4.355
  627   1HZ   LYS  77          HZ1       LYS  77  -8.993   8.445   2.847
  628   2HZ   LYS  77          HZ2       LYS  77  -8.452   7.564   4.196
  629   3HZ   LYS  77          HZ3       LYS  77  -8.494   9.262   4.247
  630    H    THR  78           HN       THR  78 -14.439   5.495   3.116
  631    HA   THR  78           HA       THR  78 -12.664   4.661   5.389
  632    HB   THR  78           HB       THR  78 -14.723   2.919   4.034
  633    HG1  THR  78           HG1      THR  78 -15.165   4.399   6.396
  634   1HG2  THR  78          HG21      THR  78 -14.060   2.732   6.918
  635   2HG2  THR  78          HG22      THR  78 -12.767   2.305   5.799
  636   3HG2  THR  78          HG23      THR  78 -14.307   1.449   5.733
  637    H    ASP  79           HN       ASP  79 -11.078   5.283   3.505
  638    HA   ASP  79           HA       ASP  79 -10.793   3.918   1.089
  639   1HB   ASP  79          HB2       ASP  79  -8.298   4.277   1.588
  640   2HB   ASP  79          HB1       ASP  79  -9.328   5.705   1.686
  641    H    ALA  80           HN       ALA  80  -9.608   1.998   0.486
  642    HA   ALA  80           HA       ALA  80 -10.124  -0.402   1.745
  643   1HB   ALA  80          HB1       ALA  80  -7.602   0.435   0.280
  644   2HB   ALA  80          HB2       ALA  80  -9.102  -0.102  -0.477
  645   3HB   ALA  80          HB3       ALA  80  -8.150  -1.227   0.491
  646    H    SER  81           HN       SER  81  -7.423   1.793   2.456
  647    HA   SER  81           HA       SER  81  -5.944   0.147   4.221
  648   1HB   SER  81          HB2       SER  81  -6.128   2.892   3.407
  649   2HB   SER  81          HB1       SER  81  -5.959   2.842   5.160
  650    HG   SER  81           HG       SER  81  -4.290   1.674   3.185
  651    H    ASP  82           HN       ASP  82  -9.099   1.488   4.617
  652    HA   ASP  82           HA       ASP  82  -9.008   0.801   7.537
  653   1HB   ASP  82          HB2       ASP  82 -10.302   3.078   6.034
  654   2HB   ASP  82          HB1       ASP  82 -10.764   2.664   7.684
  655    H    VAL  83           HN       VAL  83  -9.864  -0.828   5.143
  656    HA   VAL  83           HA       VAL  83 -12.765  -1.155   5.836
  657    HB   VAL  83           HB       VAL  83 -11.267  -2.008   3.342
  658   1HG1  VAL  83          HG11      VAL  83 -13.566  -3.032   4.177
  659   2HG1  VAL  83          HG12      VAL  83 -13.323  -2.638   2.475
  660   3HG1  VAL  83          HG13      VAL  83 -14.217  -1.532   3.517
  661   1HG2  VAL  83          HG21      VAL  83 -11.537   0.559   3.973
  662   2HG2  VAL  83          HG22      VAL  83 -13.193   0.291   3.430
  663   3HG2  VAL  83          HG23      VAL  83 -11.846   0.007   2.327
  664    H    LYS  84           HN       LYS  84 -13.496  -3.277   6.313
  665    HA   LYS  84           HA       LYS  84 -11.479  -5.114   7.354
  666   1HB   LYS  84          HB2       LYS  84 -14.037  -4.484   7.975
  667   2HB   LYS  84          HB1       LYS  84 -14.323  -5.924   6.996
  668   1HG   LYS  84          HG2       LYS  84 -13.291  -7.324   8.499
  669   2HG   LYS  84          HG1       LYS  84 -12.151  -6.085   9.030
  670   1HD   LYS  84          HD2       LYS  84 -14.790  -5.221   9.719
  671   2HD   LYS  84          HD1       LYS  84 -14.586  -6.878  10.286
  672   1HE   LYS  84          HE2       LYS  84 -12.506  -6.248  11.449
  673   2HE   LYS  84          HE1       LYS  84 -12.676  -4.583  10.860
  674   1HZ   LYS  84          HZ1       LYS  84 -15.038  -4.784  11.839
  675   2HZ   LYS  84          HZ2       LYS  84 -13.741  -4.494  12.896
  676   3HZ   LYS  84          HZ3       LYS  84 -14.390  -6.057  12.753
  677    HA   PRO  85           HA       PRO  85 -10.871  -7.562   3.731
  678   1HB   PRO  85          HB2       PRO  85 -10.724 -10.002   5.252
  679   2HB   PRO  85          HB1       PRO  85  -9.389  -9.041   4.601
  680   1HG   PRO  85          HG2       PRO  85 -10.183  -9.317   7.345
  681   2HG   PRO  85          HG1       PRO  85  -8.857  -8.351   6.690
  682   1HD   PRO  85          HD2       PRO  85 -11.357  -7.412   7.788
  683   2HD   PRO  85          HD1       PRO  85 -10.022  -6.440   7.123
  684    H    CYS  86           HN       CYS  86 -12.144  -8.901   2.371
  685    HA   CYS  86           HA       CYS  86 -14.937  -9.094   2.869
  686   1HB   CYS  86          HB2       CYS  86 -13.385  -9.257   0.723
  687   2HB   CYS  86          HB1       CYS  86 -13.505 -10.991   1.040
  Start of MODEL   17
    1   1H    THR   1          HT1       THR   1  24.150  -6.024  -9.990
    2   2H    THR   1          HT2       THR   1  22.858  -5.012 -10.428
    3   3H    THR   1          HT3       THR   1  22.554  -6.579  -9.845
    4    HA   THR   1           HA       THR   1  23.790  -5.763  -7.731
    5    HB   THR   1           HB       THR   1  23.233  -3.212  -7.615
    6    HG1  THR   1           HG1      THR   1  23.485  -2.373  -9.846
    7   1HG2  THR   1          HG21      THR   1  25.384  -3.040  -9.366
    8   2HG2  THR   1          HG22      THR   1  25.481  -4.689  -8.751
    9   3HG2  THR   1          HG23      THR   1  25.486  -3.329  -7.629
   10    H    LYS   2           HN       LYS   2  22.152  -4.244  -6.217
   11    HA   LYS   2           HA       LYS   2  19.335  -4.973  -6.886
   12   1HB   LYS   2          HB2       LYS   2  19.225  -5.802  -4.442
   13   2HB   LYS   2          HB1       LYS   2  20.074  -6.833  -5.595
   14   1HG   LYS   2          HG2       LYS   2  22.224  -5.938  -4.878
   15   2HG   LYS   2          HG1       LYS   2  21.422  -4.792  -3.804
   16   1HD   LYS   2          HD2       LYS   2  20.365  -6.814  -2.656
   17   2HD   LYS   2          HD1       LYS   2  21.505  -7.805  -3.568
   18   1HE   LYS   2          HE2       LYS   2  22.872  -5.563  -2.315
   19   2HE   LYS   2          HE1       LYS   2  22.015  -6.549  -1.113
   20   1HZ   LYS   2          HZ1       LYS   2  23.596  -7.776  -3.292
   21   2HZ   LYS   2          HZ2       LYS   2  23.060  -8.490  -1.846
   22   3HZ   LYS   2          HZ3       LYS   2  24.314  -7.345  -1.818
   23    H    ALA   3           HN       ALA   3  19.105  -2.623  -7.150
   24    HA   ALA   3           HA       ALA   3  19.662  -0.846  -4.885
   25   1HB   ALA   3          HB1       ALA   3  19.799  -0.282  -7.348
   26   2HB   ALA   3          HB2       ALA   3  18.815   0.841  -6.409
   27   3HB   ALA   3          HB3       ALA   3  18.040  -0.387  -7.407
   28    H    SER   4           HN       SER   4  18.087   0.073  -3.508
   29    HA   SER   4           HA       SER   4  15.737  -1.497  -2.929
   30   1HB   SER   4          HB2       SER   4  15.416   0.939  -1.682
   31   2HB   SER   4          HB1       SER   4  16.381  -0.389  -1.044
   32    HG   SER   4           HG       SER   4  17.308   1.896  -1.486
   33    H    CYS   5           HN       CYS   5  13.768   0.479  -2.482
   34    HA   CYS   5           HA       CYS   5  13.078   1.279  -5.292
   35   1HB   CYS   5          HB2       CYS   5  11.543   0.142  -2.970
   36   2HB   CYS   5          HB1       CYS   5  10.693   1.084  -4.196
   37    H    LYS   6           HN       LYS   6  10.905   2.899  -4.710
   38    HA   LYS   6           HA       LYS   6  12.017   5.042  -2.932
   39   1HB   LYS   6          HB2       LYS   6  11.375   4.990  -5.817
   40   2HB   LYS   6          HB1       LYS   6  10.727   6.385  -4.952
   41   1HG   LYS   6          HG2       LYS   6  12.774   7.314  -5.110
   42   2HG   LYS   6          HG1       LYS   6  13.333   6.091  -3.968
   43   1HD   LYS   6          HD2       LYS   6  14.725   5.448  -5.642
   44   2HD   LYS   6          HD1       LYS   6  13.292   4.680  -6.326
   45   1HE   LYS   6          HE2       LYS   6  12.816   6.682  -7.665
   46   2HE   LYS   6          HE1       LYS   6  14.202   7.517  -6.936
   47   1HZ   LYS   6          HZ1       LYS   6  14.389   6.059  -9.159
   48   2HZ   LYS   6          HZ2       LYS   6  14.729   4.865  -7.999
   49   3HZ   LYS   6          HZ3       LYS   6  15.676   6.274  -8.077
   50    H    LEU   7           HN       LEU   7  10.515   5.020  -1.271
   51    HA   LEU   7           HA       LEU   7   7.932   4.153  -1.097
   52   1HB   LEU   7          HB2       LEU   7   7.623   6.153   0.477
   53   2HB   LEU   7          HB1       LEU   7   9.037   5.137   0.780
   54    HG   LEU   7           HG       LEU   7   9.825   7.075  -1.135
   55   1HD1  LEU   7          HD11      LEU   7   9.351   8.972   0.809
   56   2HD1  LEU   7          HD12      LEU   7   7.836   8.068   0.789
   57   3HD1  LEU   7          HD13      LEU   7   8.437   8.814  -0.692
   58   1HD2  LEU   7          HD21      LEU   7  11.160   7.883   0.945
   59   2HD2  LEU   7          HD22      LEU   7  11.416   6.229   0.389
   60   3HD2  LEU   7          HD23      LEU   7  10.380   6.541   1.782
   61    HA   PRO   8           HA       PRO   8   6.264   6.599  -4.583
   62   1HB   PRO   8          HB2       PRO   8   3.916   4.949  -4.356
   63   2HB   PRO   8          HB1       PRO   8   5.154   4.917  -5.618
   64   1HG   PRO   8          HG2       PRO   8   4.699   2.980  -3.555
   65   2HG   PRO   8          HG1       PRO   8   5.946   2.962  -4.803
   66   1HD   PRO   8          HD2       PRO   8   6.275   3.452  -1.976
   67   2HD   PRO   8          HD1       PRO   8   7.533   3.423  -3.235
   68    H    VAL   9           HN       VAL   9   4.851   5.756  -1.463
   69    HA   VAL   9           HA       VAL   9   3.291   8.318  -1.555
   70    HB   VAL   9           HB       VAL   9   2.437   5.806  -0.111
   71   1HG1  VAL   9          HG11      VAL   9   0.993   8.276  -1.115
   72   2HG1  VAL   9          HG12      VAL   9   1.327   7.868   0.568
   73   3HG1  VAL   9          HG13      VAL   9   0.198   6.889  -0.370
   74   1HG2  VAL   9          HG21      VAL   9   2.462   6.362  -2.987
   75   2HG2  VAL   9          HG22      VAL   9   0.842   6.025  -2.375
   76   3HG2  VAL   9          HG23      VAL   9   2.135   4.848  -2.143
   77    H    LYS  10           HN       LYS  10   3.079   9.369   0.542
   78    HA   LYS  10           HA       LYS  10   5.342   8.748   2.364
   79   1HB   LYS  10          HB2       LYS  10   4.080  11.053   1.333
   80   2HB   LYS  10          HB1       LYS  10   3.718  11.040   3.059
   81   1HG   LYS  10          HG2       LYS  10   5.828  12.216   2.680
   82   2HG   LYS  10          HG1       LYS  10   6.141  10.705   3.535
   83   1HD   LYS  10          HD2       LYS  10   7.670  10.324   1.903
   84   2HD   LYS  10          HD1       LYS  10   6.276   9.908   0.906
   85   1HE   LYS  10          HE2       LYS  10   6.767  11.645  -0.458
   86   2HE   LYS  10          HE1       LYS  10   6.527  12.761   0.901
   87   1HZ   LYS  10          HZ1       LYS  10   8.744  13.085   0.481
   88   2HZ   LYS  10          HZ2       LYS  10   9.003  11.488  -0.039
   89   3HZ   LYS  10          HZ3       LYS  10   8.840  11.830   1.618
   90    H    LYS  11           HN       LYS  11   2.289   7.625   2.148
   91    HA   LYS  11           HA       LYS  11   2.133   7.048   5.027
   92   1HB   LYS  11          HB2       LYS  11  -0.038   8.157   5.302
   93   2HB   LYS  11          HB1       LYS  11   1.160   9.328   4.748
   94   1HG   LYS  11          HG2       LYS  11   0.082   9.665   2.786
   95   2HG   LYS  11          HG1       LYS  11  -0.195   7.939   2.547
   96   1HD   LYS  11          HD2       LYS  11  -2.371   8.768   2.833
   97   2HD   LYS  11          HD1       LYS  11  -1.958   8.206   4.453
   98   1HE   LYS  11          HE2       LYS  11  -0.993  10.876   4.246
   99   2HE   LYS  11          HE1       LYS  11  -2.660  10.869   3.636
  100   1HZ   LYS  11          HZ1       LYS  11  -1.923   9.370   6.071
  101   2HZ   LYS  11          HZ2       LYS  11  -3.458   9.907   5.576
  102   3HZ   LYS  11          HZ3       LYS  11  -2.313  11.019   6.160
  103    H    ALA  12           HN       ALA  12   2.386   5.394   2.671
  104    HA   ALA  12           HA       ALA  12  -0.295   4.250   2.165
  105   1HB   ALA  12          HB1       ALA  12   0.831   4.025   0.206
  106   2HB   ALA  12          HB2       ALA  12   1.632   2.651   0.968
  107   3HB   ALA  12          HB3       ALA  12   2.394   4.242   0.993
  108    H    THR  13           HN       THR  13  -1.047   2.410   3.169
  109    HA   THR  13           HA       THR  13   0.720   1.111   5.193
  110    HB   THR  13           HB       THR  13  -2.137   0.380   4.952
  111    HG1  THR  13           HG1      THR  13  -2.748   2.441   5.813
  112   1HG2  THR  13          HG21      THR  13  -2.049   0.460   7.300
  113   2HG2  THR  13          HG22      THR  13  -0.724   1.624   7.301
  114   3HG2  THR  13          HG23      THR  13  -0.422  -0.055   6.855
  115    H    VAL  14           HN       VAL  14   1.869  -0.521   4.153
  116    HA   VAL  14           HA       VAL  14   0.394  -2.310   2.271
  117    HB   VAL  14           HB       VAL  14   2.670  -2.941   1.569
  118   1HG1  VAL  14          HG11      VAL  14   3.193  -0.097   1.629
  119   2HG1  VAL  14          HG12      VAL  14   1.482  -0.394   1.323
  120   3HG1  VAL  14          HG13      VAL  14   2.704  -1.103   0.267
  121   1HG2  VAL  14          HG21      VAL  14   4.613  -2.194   2.674
  122   2HG2  VAL  14          HG22      VAL  14   3.527  -2.582   4.008
  123   3HG2  VAL  14          HG23      VAL  14   3.751  -0.905   3.511
  124    H    VAL  15           HN       VAL  15   0.887  -4.676   2.493
  125    HA   VAL  15           HA       VAL  15   1.119  -5.438   5.381
  126    HB   VAL  15           HB       VAL  15  -0.063  -6.961   3.039
  127   1HG1  VAL  15          HG11      VAL  15  -1.208  -7.512   5.620
  128   2HG1  VAL  15          HG12      VAL  15   0.545  -7.679   5.718
  129   3HG1  VAL  15          HG13      VAL  15  -0.365  -8.616   4.533
  130   1HG2  VAL  15          HG21      VAL  15  -1.930  -5.700   3.192
  131   2HG2  VAL  15          HG22      VAL  15  -1.019  -4.589   4.215
  132   3HG2  VAL  15          HG23      VAL  15  -1.969  -5.883   4.947
  133    H    TYR  16           HN       TYR  16   3.255  -6.015   5.734
  134    HA   TYR  16           HA       TYR  16   4.889  -7.286   3.663
  135   1HB   TYR  16          HB2       TYR  16   5.355  -5.712   5.828
  136   2HB   TYR  16          HB1       TYR  16   5.709  -7.297   6.514
  137    HD1  TYR  16           HD1      TYR  16   6.169  -6.020   3.029
  138    HD2  TYR  16           HD2      TYR  16   8.055  -7.461   6.609
  139    HE1  TYR  16           HE1      TYR  16   8.359  -6.039   1.866
  140    HE2  TYR  16           HE2      TYR  16  10.246  -7.481   5.445
  141    HH   TYR  16           HH       TYR  16  11.256  -7.338   3.430
  142    H    GLN  17           HN       GLN  17   6.167  -8.992   5.835
  143    HA   GLN  17           HA       GLN  17   4.916 -11.487   5.195
  144   1HB   GLN  17          HB2       GLN  17   6.823 -10.592   7.374
  145   2HB   GLN  17          HB1       GLN  17   6.448 -12.286   7.042
  146   1HG   GLN  17          HG2       GLN  17   7.285 -10.562   4.747
  147   2HG   GLN  17          HG1       GLN  17   8.527 -11.084   5.885
  148   1HE2  GLN  17          HE21      GLN  17   8.383 -13.581   6.406
  149   2HE2  GLN  17          HE22      GLN  17   8.070 -14.595   5.082
  150    H    GLY  18           HN       GLY  18   2.644 -10.474   5.865
  151   1HA   GLY  18          HA2       GLY  18   0.792 -10.847   7.271
  152   2HA   GLY  18          HA1       GLY  18   1.842 -11.807   8.315
  153    H    GLU  19           HN       GLU  19   2.802  -8.567   7.487
  154    HA   GLU  19           HA       GLU  19   1.915  -7.617  10.189
  155   1HB   GLU  19          HB2       GLU  19   4.619  -7.471   8.832
  156   2HB   GLU  19          HB1       GLU  19   4.204  -6.481  10.232
  157   1HG   GLU  19          HG2       GLU  19   3.588  -9.364  10.499
  158   2HG   GLU  19          HG1       GLU  19   5.304  -8.963  10.421
  159    H    ARG  20           HN       ARG  20   0.778  -5.732   9.996
  160    HA   ARG  20           HA       ARG  20   0.749  -4.282   7.432
  161   1HB   ARG  20          HB2       ARG  20  -0.716  -4.135  10.071
  162   2HB   ARG  20          HB1       ARG  20  -0.976  -2.933   8.801
  163   1HG   ARG  20          HG2       ARG  20  -1.811  -4.552   7.284
  164   2HG   ARG  20          HG1       ARG  20  -1.179  -5.893   8.241
  165   1HD   ARG  20          HD2       ARG  20  -3.339  -6.001   9.020
  166   2HD   ARG  20          HD1       ARG  20  -2.813  -4.674  10.074
  167    HE   ARG  20           HE       ARG  20  -3.493  -3.368   7.748
  168   1HH1  ARG  20          HH21      ARG  20  -5.015  -5.294  10.146
  169   2HH1  ARG  20          HH22      ARG  20  -6.625  -4.907   9.636
  170   1HH2  ARG  20          HH11      ARG  20  -5.595  -3.024   6.913
  171   2HH2  ARG  20          HH12      ARG  20  -6.952  -3.621   7.806
  172    H    VAL  21           HN       VAL  21   1.741  -2.298   7.082
  173    HA   VAL  21           HA       VAL  21   2.649  -0.633   9.329
  174    HB   VAL  21           HB       VAL  21   5.060  -0.814   8.364
  175   1HG1  VAL  21          HG11      VAL  21   3.850  -1.953  10.494
  176   2HG1  VAL  21          HG12      VAL  21   5.545  -2.227  10.099
  177   3HG1  VAL  21          HG13      VAL  21   4.326  -3.407   9.617
  178   1HG2  VAL  21          HG21      VAL  21   3.874  -3.429   7.374
  179   2HG2  VAL  21          HG22      VAL  21   5.570  -2.951   7.281
  180   3HG2  VAL  21          HG23      VAL  21   4.357  -2.087   6.335
  181    H    LYS  22           HN       LYS  22   3.648   1.408   8.499
  182    HA   LYS  22           HA       LYS  22   2.479   2.133   5.856
  183   1HB   LYS  22          HB2       LYS  22   2.203   3.289   8.233
  184   2HB   LYS  22          HB1       LYS  22   3.723   4.062   7.788
  185   1HG   LYS  22          HG2       LYS  22   1.927   5.490   7.030
  186   2HG   LYS  22          HG1       LYS  22   2.646   4.736   5.607
  187   1HD   LYS  22          HD2       LYS  22   0.438   4.289   5.141
  188   2HD   LYS  22          HD1       LYS  22   0.783   2.880   6.147
  189   1HE   LYS  22          HE2       LYS  22  -0.590   3.607   7.812
  190   2HE   LYS  22          HE1       LYS  22   0.018   5.271   7.695
  191   1HZ   LYS  22          HZ1       LYS  22  -1.389   5.761   5.948
  192   2HZ   LYS  22          HZ2       LYS  22  -2.377   4.766   6.906
  193   3HZ   LYS  22          HZ3       LYS  22  -1.618   4.134   5.523
  194    H    ILE  23           HN       ILE  23   3.874   2.113   4.149
  195    HA   ILE  23           HA       ILE  23   6.616   1.648   4.157
  196    HB   ILE  23           HB       ILE  23   5.018   1.681   2.224
  197   1HG1  ILE  23          HG12      ILE  23   7.479   3.407   1.808
  198   2HG1  ILE  23          HG11      ILE  23   7.511   1.647   1.935
  199   1HG2  ILE  23          HG21      ILE  23   5.555   4.609   1.914
  200   2HG2  ILE  23          HG22      ILE  23   4.277   4.108   3.022
  201   3HG2  ILE  23          HG23      ILE  23   4.199   3.650   1.321
  202   1HD1  ILE  23          HD11      ILE  23   5.963   3.231  -0.138
  203   2HD1  ILE  23          HD12      ILE  23   6.012   1.471  -0.013
  204   3HD1  ILE  23          HD13      ILE  23   7.473   2.367  -0.429
  205    H    GLN  24           HN       GLN  24   4.965   4.731   4.700
  206    HA   GLN  24           HA       GLN  24   6.988   6.602   4.268
  207   1HB   GLN  24          HB2       GLN  24   5.832   7.905   6.005
  208   2HB   GLN  24          HB1       GLN  24   4.651   7.027   5.027
  209   1HG   GLN  24          HG2       GLN  24   4.209   5.479   6.711
  210   2HG   GLN  24          HG1       GLN  24   5.753   5.756   7.514
  211   1HE2  GLN  24          HE21      GLN  24   2.574   7.291   6.888
  212   2HE2  GLN  24          HE22      GLN  24   2.621   8.307   8.247
  213    H    GLU  25           HN       GLU  25   6.884   4.085   6.682
  214    HA   GLU  25           HA       GLU  25   9.393   5.187   7.907
  215   1HB   GLU  25          HB2       GLU  25   7.062   3.647   9.074
  216   2HB   GLU  25          HB1       GLU  25   8.571   3.910   9.947
  217   1HG   GLU  25          HG2       GLU  25   8.050   6.444   9.133
  218   2HG   GLU  25          HG1       GLU  25   6.405   5.828   9.298
  219    H    LYS  26           HN       LYS  26   7.595   2.106   7.494
  220    HA   LYS  26           HA       LYS  26   9.584   0.242   7.957
  221   1HB   LYS  26          HB2       LYS  26   7.149  -0.034   7.212
  222   2HB   LYS  26          HB1       LYS  26   7.741   0.161   5.558
  223   1HG   LYS  26          HG2       LYS  26   7.783  -2.168   5.840
  224   2HG   LYS  26          HG1       LYS  26   9.445  -1.706   6.209
  225   1HD   LYS  26          HD2       LYS  26   8.270  -1.430   8.662
  226   2HD   LYS  26          HD1       LYS  26   7.351  -2.780   7.994
  227   1HE   LYS  26          HE2       LYS  26   9.124  -4.196   8.162
  228   2HE   LYS  26          HE1       LYS  26  10.246  -2.991   7.498
  229   1HZ   LYS  26          HZ1       LYS  26  10.719  -3.414   9.838
  230   2HZ   LYS  26          HZ2       LYS  26   9.128  -2.985  10.254
  231   3HZ   LYS  26          HZ3       LYS  26  10.186  -1.819   9.614
  232    H    PHE  27           HN       PHE  27   9.284   2.378   5.163
  233    HA   PHE  27           HA       PHE  27  12.008   1.513   4.286
  234   1HB   PHE  27          HB2       PHE  27   9.523   1.822   2.565
  235   2HB   PHE  27          HB1       PHE  27  11.141   1.460   1.956
  236    HD1  PHE  27           HD1      PHE  27  12.335  -0.593   3.187
  237    HD2  PHE  27           HD2      PHE  27   8.091   0.034   2.982
  238    HE1  PHE  27           HE1      PHE  27  11.958  -3.007   3.617
  239    HE2  PHE  27           HE2      PHE  27   7.713  -2.380   3.413
  240    HZ   PHE  27           HZ       PHE  27   9.647  -3.900   3.729
  241    H    LYS  28           HN       LYS  28  11.197   3.896   5.739
  242    HA   LYS  28           HA       LYS  28  10.616   6.229   4.399
  243   1HB   LYS  28          HB2       LYS  28  11.985   7.316   6.076
  244   2HB   LYS  28          HB1       LYS  28  11.289   5.871   6.812
  245   1HG   LYS  28          HG2       LYS  28  14.021   5.865   5.515
  246   2HG   LYS  28          HG1       LYS  28  13.785   6.239   7.222
  247   1HD   LYS  28          HD2       LYS  28  12.455   4.023   7.324
  248   2HD   LYS  28          HD1       LYS  28  13.216   3.654   5.776
  249   1HE   LYS  28          HE2       LYS  28  15.247   3.263   6.739
  250   2HE   LYS  28          HE1       LYS  28  15.088   4.648   7.839
  251   1HZ   LYS  28          HZ1       LYS  28  14.944   2.574   9.071
  252   2HZ   LYS  28          HZ2       LYS  28  13.661   2.050   8.089
  253   3HZ   LYS  28          HZ3       LYS  28  13.457   3.387   9.117
  254    H    ASN  29           HN       ASN  29  13.545   4.301   4.047
  255    HA   ASN  29           HA       ASN  29  14.664   6.348   2.173
  256   1HB   ASN  29          HB2       ASN  29  15.763   4.186   3.947
  257   2HB   ASN  29          HB1       ASN  29  16.707   4.706   2.546
  258   1HD2  ASN  29          HD21      ASN  29  17.681   5.220   5.163
  259   2HD2  ASN  29          HD22      ASN  29  17.618   6.891   5.456
  260    H    GLY  30           HN       GLY  30  12.485   4.560   1.390
  261   1HA   GLY  30          HA2       GLY  30  12.077   3.536  -0.736
  262   2HA   GLY  30          HA1       GLY  30  13.814   3.285  -0.921
  263    H    MET  31           HN       MET  31  12.091   1.184  -1.470
  264    HA   MET  31           HA       MET  31  12.126  -0.563   0.946
  265   1HB   MET  31          HB2       MET  31  10.998  -1.165  -1.797
  266   2HB   MET  31          HB1       MET  31  10.520  -1.858  -0.247
  267   1HG   MET  31          HG2       MET  31  10.125   0.829   0.190
  268   2HG   MET  31          HG1       MET  31   9.682   0.667  -1.509
  269   1HE   MET  31          HE1       MET  31   6.857   0.478  -1.736
  270   2HE   MET  31          HE2       MET  31   6.719  -1.276  -1.832
  271   3HE   MET  31          HE3       MET  31   8.145  -0.476  -2.486
  272    H    LEU  32           HN       LEU  32  13.215  -2.599   0.887
  273    HA   LEU  32           HA       LEU  32  15.705  -2.672  -0.551
  274   1HB   LEU  32          HB2       LEU  32  14.139  -4.826   0.901
  275   2HB   LEU  32          HB1       LEU  32  15.857  -4.909   0.497
  276    HG   LEU  32           HG       LEU  32  14.797  -2.570   2.063
  277   1HD1  LEU  32          HD11      LEU  32  15.846  -4.248   3.972
  278   2HD1  LEU  32          HD12      LEU  32  14.971  -5.378   2.938
  279   3HD1  LEU  32          HD13      LEU  32  14.122  -4.021   3.677
  280   1HD2  LEU  32          HD21      LEU  32  17.193  -2.939   3.038
  281   2HD2  LEU  32          HD22      LEU  32  17.038  -2.258   1.418
  282   3HD2  LEU  32          HD23      LEU  32  17.432  -3.965   1.623
  283    H    HIS  33           HN       HIS  33  16.330  -4.154  -2.242
  284    HA   HIS  33           HA       HIS  33  14.478  -4.476  -4.386
  285   1HB   HIS  33          HB2       HIS  33  17.090  -4.470  -4.233
  286   2HB   HIS  33          HB1       HIS  33  16.908  -6.206  -3.965
  287    HD1  HIS  33           HD1      HIS  33  14.940  -7.190  -5.856
  288    HD2  HIS  33           HD2      HIS  33  17.444  -4.034  -6.927
  289    HE1  HIS  33           HE1      HIS  33  14.953  -7.114  -8.387
  290    H    GLY  34           HN       GLY  34  13.100  -6.161  -4.917
  291   1HA   GLY  34          HA2       GLY  34  12.128  -8.320  -4.828
  292   2HA   GLY  34          HA1       GLY  34  13.384  -8.802  -3.689
  293    H    ASP  35           HN       ASP  35  12.373  -6.046  -2.349
  294    HA   ASP  35           HA       ASP  35  10.972  -7.248  -0.184
  295   1HB   ASP  35          HB2       ASP  35  12.084  -5.124   0.031
  296   2HB   ASP  35          HB1       ASP  35  11.134  -4.429  -1.283
  297    H    LYS  36           HN       LYS  36   8.939  -8.128  -0.245
  298    HA   LYS  36           HA       LYS  36   7.033  -7.209  -2.343
  299   1HB   LYS  36          HB2       LYS  36   7.811  -9.681  -1.295
  300   2HB   LYS  36          HB1       LYS  36   6.201  -9.410  -0.630
  301   1HG   LYS  36          HG2       LYS  36   5.265  -9.091  -2.825
  302   2HG   LYS  36          HG1       LYS  36   6.866  -9.085  -3.566
  303   1HD   LYS  36          HD2       LYS  36   6.026 -11.273  -3.958
  304   2HD   LYS  36          HD1       LYS  36   7.135 -11.454  -2.599
  305   1HE   LYS  36          HE2       LYS  36   5.428 -11.833  -1.078
  306   2HE   LYS  36          HE1       LYS  36   4.264 -10.850  -1.987
  307   1HZ   LYS  36          HZ1       LYS  36   5.317 -13.524  -2.735
  308   2HZ   LYS  36          HZ2       LYS  36   4.400 -12.545  -3.779
  309   3HZ   LYS  36          HZ3       LYS  36   3.715 -13.134  -2.340
  310    H    VAL  37           HN       VAL  37   5.205  -6.102  -1.812
  311    HA   VAL  37           HA       VAL  37   4.317  -6.002   1.037
  312    HB   VAL  37           HB       VAL  37   4.320  -3.595   0.994
  313   1HG1  VAL  37          HG11      VAL  37   6.579  -4.957   1.082
  314   2HG1  VAL  37          HG12      VAL  37   6.615  -3.197   0.975
  315   3HG1  VAL  37          HG13      VAL  37   6.874  -4.175  -0.470
  316   1HG2  VAL  37          HG21      VAL  37   4.365  -4.063  -1.912
  317   2HG2  VAL  37          HG22      VAL  37   5.430  -2.758  -1.387
  318   3HG2  VAL  37          HG23      VAL  37   3.709  -2.700  -1.004
  319    H    SER  38           HN       SER  38   2.056  -5.868   1.210
  320    HA   SER  38           HA       SER  38   0.552  -6.034  -1.361
  321   1HB   SER  38          HB2       SER  38  -0.761  -6.549   1.245
  322   2HB   SER  38          HB1       SER  38  -0.784  -7.510  -0.234
  323    HG   SER  38           HG       SER  38   0.573  -8.712   0.844
  324    H    PHE  39           HN       PHE  39  -1.048  -4.537  -1.860
  325    HA   PHE  39           HA       PHE  39  -1.284  -2.159  -0.073
  326   1HB   PHE  39          HB2       PHE  39  -1.754  -2.776  -2.988
  327   2HB   PHE  39          HB1       PHE  39  -2.420  -1.309  -2.264
  328    HD1  PHE  39           HD1      PHE  39   0.722  -3.170  -2.953
  329    HD2  PHE  39           HD2      PHE  39  -1.021   0.553  -1.706
  330    HE1  PHE  39           HE1      PHE  39   2.933  -2.065  -3.162
  331    HE2  PHE  39           HE2      PHE  39   1.190   1.658  -1.916
  332    HZ   PHE  39           HZ       PHE  39   3.167   0.349  -2.645
  333    H    PHE  40           HN       PHE  40  -3.317  -1.546   0.761
  334    HA   PHE  40           HA       PHE  40  -5.372  -3.630   0.857
  335   1HB   PHE  40          HB2       PHE  40  -4.953  -0.876   2.017
  336   2HB   PHE  40          HB1       PHE  40  -6.485  -1.728   2.241
  337    HD1  PHE  40           HD1      PHE  40  -3.539  -1.062   3.854
  338    HD2  PHE  40           HD2      PHE  40  -5.950  -4.433   2.727
  339    HE1  PHE  40           HE1      PHE  40  -2.525  -2.398   5.681
  340    HE2  PHE  40           HE2      PHE  40  -4.938  -5.768   4.555
  341    HZ   PHE  40           HZ       PHE  40  -3.225  -4.751   6.031
  342    H    CYS  41           HN       CYS  41  -7.243  -3.691  -0.331
  343    HA   CYS  41           HA       CYS  41  -8.017  -1.265  -1.912
  344   1HB   CYS  41          HB2       CYS  41  -7.183  -3.959  -2.759
  345   2HB   CYS  41          HB1       CYS  41  -8.706  -3.432  -3.484
  346    H    LYS  42           HN       LYS  42 -10.379  -1.806  -2.875
  347    HA   LYS  42           HA       LYS  42 -11.956  -3.068  -0.653
  348   1HB   LYS  42          HB2       LYS  42 -13.654  -1.316  -1.216
  349   2HB   LYS  42          HB1       LYS  42 -12.114  -0.637  -0.681
  350   1HG   LYS  42          HG2       LYS  42 -12.325  -1.124  -3.591
  351   2HG   LYS  42          HG1       LYS  42 -13.391   0.134  -2.962
  352   1HD   LYS  42          HD2       LYS  42 -10.624   0.221  -1.927
  353   2HD   LYS  42          HD1       LYS  42 -10.783   0.556  -3.651
  354   1HE   LYS  42          HE2       LYS  42 -12.724   2.150  -2.932
  355   2HE   LYS  42          HE1       LYS  42 -11.975   2.061  -1.326
  356   1HZ   LYS  42          HZ1       LYS  42  -9.914   2.779  -2.189
  357   2HZ   LYS  42          HZ2       LYS  42 -11.071   3.844  -2.832
  358   3HZ   LYS  42          HZ3       LYS  42 -10.426   2.601  -3.795
  359    H    ASN  43           HN       ASN  43 -13.773  -4.283  -1.259
  360    HA   ASN  43           HA       ASN  43 -14.022  -4.916  -4.186
  361   1HB   ASN  43          HB2       ASN  43 -13.101  -6.572  -2.303
  362   2HB   ASN  43          HB1       ASN  43 -14.826  -6.816  -2.015
  363   1HD2  ASN  43          HD21      ASN  43 -15.669  -6.452  -4.795
  364   2HD2  ASN  43          HD22      ASN  43 -15.113  -7.800  -5.664
  365    H    LYS  44           HN       LYS  44 -15.882  -3.807  -4.801
  366    HA   LYS  44           HA       LYS  44 -18.085  -3.167  -3.097
  367   1HB   LYS  44          HB2       LYS  44 -17.670  -1.989  -5.159
  368   2HB   LYS  44          HB1       LYS  44 -17.761  -3.482  -6.093
  369   1HG   LYS  44          HG2       LYS  44 -20.076  -3.622  -5.906
  370   2HG   LYS  44          HG1       LYS  44 -20.116  -2.666  -4.424
  371   1HD   LYS  44          HD2       LYS  44 -19.043  -1.231  -6.766
  372   2HD   LYS  44          HD1       LYS  44 -20.740  -1.689  -6.907
  373   1HE   LYS  44          HE2       LYS  44 -21.112  -0.675  -4.608
  374   2HE   LYS  44          HE1       LYS  44 -19.464  -0.023  -4.715
  375   1HZ   LYS  44          HZ1       LYS  44 -20.378   0.615  -7.117
  376   2HZ   LYS  44          HZ2       LYS  44 -20.526   1.651  -5.779
  377   3HZ   LYS  44          HZ3       LYS  44 -21.836   0.682  -6.255
  378    H    GLU  45           HN       GLU  45 -17.700  -5.805  -5.491
  379    HA   GLU  45           HA       GLU  45 -20.230  -7.029  -5.164
  380   1HB   GLU  45          HB2       GLU  45 -17.515  -7.729  -6.117
  381   2HB   GLU  45          HB1       GLU  45 -18.530  -9.106  -5.683
  382   1HG   GLU  45          HG2       GLU  45 -19.511  -8.892  -7.702
  383   2HG   GLU  45          HG1       GLU  45 -20.236  -7.401  -7.101
  384    H    LYS  46           HN       LYS  46 -17.159  -7.808  -3.474
  385    HA   LYS  46           HA       LYS  46 -18.507  -9.657  -1.643
  386   1HB   LYS  46          HB2       LYS  46 -15.736  -8.513  -1.996
  387   2HB   LYS  46          HB1       LYS  46 -16.129  -9.531  -0.607
  388   1HG   LYS  46          HG2       LYS  46 -16.148 -11.414  -1.863
  389   2HG   LYS  46          HG1       LYS  46 -17.084 -10.644  -3.146
  390   1HD   LYS  46          HD2       LYS  46 -15.170  -9.796  -4.211
  391   2HD   LYS  46          HD1       LYS  46 -14.177  -9.961  -2.762
  392   1HE   LYS  46          HE2       LYS  46 -13.443 -11.819  -3.962
  393   2HE   LYS  46          HE1       LYS  46 -14.804 -12.550  -3.088
  394   1HZ   LYS  46          HZ1       LYS  46 -16.252 -12.070  -4.922
  395   2HZ   LYS  46          HZ2       LYS  46 -14.910 -12.931  -5.513
  396   3HZ   LYS  46          HZ3       LYS  46 -15.019 -11.252  -5.752
  397    H    LYS  47           HN       LYS  47 -17.848  -6.270  -1.743
  398    HA   LYS  47           HA       LYS  47 -18.420  -4.554  -0.230
  399   1HB   LYS  47          HB2       LYS  47 -19.536  -6.777   1.487
  400   2HB   LYS  47          HB1       LYS  47 -20.053  -5.093   1.423
  401   1HG   LYS  47          HG2       LYS  47 -20.459  -5.681  -1.140
  402   2HG   LYS  47          HG1       LYS  47 -20.614  -7.316  -0.493
  403   1HD   LYS  47          HD2       LYS  47 -22.177  -6.181   1.280
  404   2HD   LYS  47          HD1       LYS  47 -22.296  -4.892   0.083
  405   1HE   LYS  47          HE2       LYS  47 -22.695  -7.064  -1.515
  406   2HE   LYS  47          HE1       LYS  47 -23.418  -7.633   0.003
  407   1HZ   LYS  47          HZ1       LYS  47 -25.024  -6.356  -1.280
  408   2HZ   LYS  47          HZ2       LYS  47 -23.971  -5.025  -1.315
  409   3HZ   LYS  47          HZ3       LYS  47 -24.638  -5.545   0.159
  410    H    CYS  48           HN       CYS  48 -15.865  -6.150  -0.032
  411    HA   CYS  48           HA       CYS  48 -15.146  -5.259   2.725
  412   1HB   CYS  48          HB2       CYS  48 -14.013  -7.836   1.735
  413   2HB   CYS  48          HB1       CYS  48 -14.372  -7.335   3.385
  414    H    SER  49           HN       SER  49 -12.569  -5.664   2.861
  415    HA   SER  49           HA       SER  49 -11.442  -4.600   0.298
  416   1HB   SER  49          HB2       SER  49  -9.677  -3.720   1.963
  417   2HB   SER  49          HB1       SER  49 -11.272  -2.974   2.018
  418    HG   SER  49           HG       SER  49 -11.771  -4.245   3.786
  419    H    TYR  50           HN       TYR  50  -9.019  -5.162   0.131
  420    HA   TYR  50           HA       TYR  50  -8.243  -7.726   1.384
  421   1HB   TYR  50          HB2       TYR  50  -7.878  -8.632  -1.019
  422   2HB   TYR  50          HB1       TYR  50  -9.536  -8.579  -0.414
  423    HD1  TYR  50           HD1      TYR  50  -7.052  -6.810  -2.534
  424    HD2  TYR  50           HD2      TYR  50 -11.187  -7.166  -1.426
  425    HE1  TYR  50           HE1      TYR  50  -7.684  -5.343  -4.431
  426    HE2  TYR  50           HE2      TYR  50 -11.818  -5.697  -3.323
  427    HH   TYR  50           HH       TYR  50 -11.014  -4.881  -5.361
  428    H    THR  51           HN       THR  51  -6.009  -8.389   0.167
  429    HA   THR  51           HA       THR  51  -4.416  -5.853   0.016
  430    HB   THR  51           HB       THR  51  -2.556  -7.419   0.762
  431    HG1  THR  51           HG1      THR  51  -3.014  -9.451   1.040
  432   1HG2  THR  51          HG21      THR  51  -3.126  -7.174   3.018
  433   2HG2  THR  51          HG22      THR  51  -4.832  -7.508   2.724
  434   3HG2  THR  51          HG23      THR  51  -4.140  -5.958   2.243
  435    H    GLU  52           HN       GLU  52  -2.924  -5.621  -1.652
  436    HA   GLU  52           HA       GLU  52  -3.007  -7.693  -3.824
  437   1HB   GLU  52          HB2       GLU  52  -3.006  -4.678  -3.770
  438   2HB   GLU  52          HB1       GLU  52  -2.399  -5.527  -5.192
  439   1HG   GLU  52          HG2       GLU  52  -5.053  -6.304  -4.016
  440   2HG   GLU  52          HG1       GLU  52  -4.941  -4.894  -5.071
  441    H    ASP  53           HN       ASP  53  -1.127  -8.722  -2.773
  442    HA   ASP  53           HA       ASP  53   1.260  -7.668  -1.926
  443   1HB   ASP  53          HB2       ASP  53   0.861 -10.009  -3.806
  444   2HB   ASP  53          HB1       ASP  53   2.273  -9.752  -2.777
  445    H    ALA  54           HN       ALA  54   3.093  -6.807  -2.827
  446    HA   ALA  54           HA       ALA  54   3.179  -6.393  -5.792
  447   1HB   ALA  54          HB1       ALA  54   2.483  -4.473  -3.964
  448   2HB   ALA  54          HB2       ALA  54   3.247  -4.120  -5.513
  449   3HB   ALA  54          HB3       ALA  54   4.228  -4.236  -4.053
  450    H    GLN  55           HN       GLN  55   5.564  -5.499  -6.301
  451    HA   GLN  55           HA       GLN  55   7.521  -6.863  -4.488
  452   1HB   GLN  55          HB2       GLN  55   6.653  -8.118  -6.621
  453   2HB   GLN  55          HB1       GLN  55   7.722  -7.013  -7.486
  454   1HG   GLN  55          HG2       GLN  55   9.598  -7.732  -5.995
  455   2HG   GLN  55          HG1       GLN  55   8.517  -8.922  -5.268
  456   1HE2  GLN  55          HE21      GLN  55   7.860 -10.765  -6.588
  457   2HE2  GLN  55          HE22      GLN  55   8.662 -11.147  -8.035
  458    H    CYS  56           HN       CYS  56   9.558  -5.865  -4.394
  459    HA   CYS  56           HA       CYS  56   9.747  -3.190  -5.713
  460   1HB   CYS  56          HB2       CYS  56   9.876  -3.073  -3.335
  461   2HB   CYS  56          HB1       CYS  56  10.939  -4.475  -3.249
  462    H    ILE  57           HN       ILE  57  11.543  -2.715  -7.013
  463    HA   ILE  57           HA       ILE  57  13.592  -4.867  -7.373
  464    HB   ILE  57           HB       ILE  57  11.986  -3.392  -9.486
  465   1HG1  ILE  57          HG12      ILE  57  11.675  -6.055  -9.955
  466   2HG1  ILE  57          HG11      ILE  57  11.840  -6.061  -8.199
  467   1HG2  ILE  57          HG21      ILE  57  13.241  -5.019 -11.022
  468   2HG2  ILE  57          HG22      ILE  57  14.353  -5.262  -9.675
  469   3HG2  ILE  57          HG23      ILE  57  14.173  -3.661 -10.390
  470   1HD1  ILE  57          HD11      ILE  57  10.000  -4.095  -9.543
  471   2HD1  ILE  57          HD12      ILE  57   9.951  -4.703  -7.888
  472   3HD1  ILE  57          HD13      ILE  57   9.462  -5.745  -9.225
  473    H    ASP  58           HN       ASP  58  15.442  -3.951  -8.782
  474    HA   ASP  58           HA       ASP  58  16.964  -2.028  -7.655
  475   1HB   ASP  58          HB2       ASP  58  17.095  -3.442  -9.903
  476   2HB   ASP  58          HB1       ASP  58  16.677  -1.887 -10.630
  477    H    GLY  59           HN       GLY  59  15.846  -0.257  -6.730
  478   1HA   GLY  59          HA2       GLY  59  14.768   1.829  -6.657
  479   2HA   GLY  59          HA1       GLY  59  15.725   2.151  -8.100
  480    H    THR  60           HN       THR  60  13.399  -0.434  -8.292
  481    HA   THR  60           HA       THR  60  11.437   1.417  -9.588
  482    HB   THR  60           HB       THR  60  12.315  -1.186 -10.824
  483    HG1  THR  60           HG1      THR  60  13.496   1.347 -10.888
  484   1HG2  THR  60          HG21      THR  60  11.260  -0.347 -12.779
  485   2HG2  THR  60          HG22      THR  60  11.195   1.292 -12.131
  486   3HG2  THR  60          HG23      THR  60  10.156   0.035 -11.458
  487    H    ILE  61           HN       ILE  61   9.397   0.934  -8.932
  488    HA   ILE  61           HA       ILE  61   8.762  -1.877  -8.145
  489    HB   ILE  61           HB       ILE  61   9.201  -0.795  -6.075
  490   1HG1  ILE  61          HG12      ILE  61   6.377  -0.095  -5.903
  491   2HG1  ILE  61          HG11      ILE  61   6.619  -1.629  -6.740
  492   1HG2  ILE  61          HG21      ILE  61   9.260   1.516  -7.061
  493   2HG2  ILE  61          HG22      ILE  61   8.415   1.437  -5.516
  494   3HG2  ILE  61          HG23      ILE  61   7.497   1.530  -7.018
  495   1HD1  ILE  61          HD11      ILE  61   6.598  -1.292  -3.991
  496   2HD1  ILE  61          HD12      ILE  61   8.321  -1.347  -4.371
  497   3HD1  ILE  61          HD13      ILE  61   7.270  -2.681  -4.846
  498    H    GLU  62           HN       GLU  62   6.726  -2.510  -8.809
  499    HA   GLU  62           HA       GLU  62   5.167  -0.531 -10.402
  500   1HB   GLU  62          HB2       GLU  62   6.005  -3.186 -10.754
  501   2HB   GLU  62          HB1       GLU  62   4.271  -3.299 -10.453
  502   1HG   GLU  62          HG2       GLU  62   5.209  -1.178 -12.332
  503   2HG   GLU  62          HG1       GLU  62   5.231  -2.845 -12.905
  504    H    VAL  63           HN       VAL  63   3.237   0.228  -9.613
  505    HA   VAL  63           HA       VAL  63   2.195  -0.886  -7.075
  506    HB   VAL  63           HB       VAL  63   1.307   1.480  -8.750
  507   1HG1  VAL  63          HG11      VAL  63  -0.214   0.499  -6.915
  508   2HG1  VAL  63          HG12      VAL  63   0.160   2.220  -6.807
  509   3HG1  VAL  63          HG13      VAL  63   1.004   1.068  -5.773
  510   1HG2  VAL  63          HG21      VAL  63   2.750   2.265  -6.426
  511   2HG2  VAL  63          HG22      VAL  63   3.207   2.507  -8.111
  512   3HG2  VAL  63          HG23      VAL  63   3.725   1.054  -7.257
  513    HA   PRO  64           HA       PRO  64  -0.887  -3.313  -9.144
  514   1HB   PRO  64          HB2       PRO  64  -2.721  -2.971  -6.948
  515   2HB   PRO  64          HB1       PRO  64  -1.711  -4.375  -7.320
  516   1HG   PRO  64          HG2       PRO  64  -1.380  -2.502  -5.177
  517   2HG   PRO  64          HG1       PRO  64  -0.353  -3.882  -5.578
  518   1HD   PRO  64          HD2       PRO  64   0.235  -1.071  -5.918
  519   2HD   PRO  64          HD1       PRO  64   1.279  -2.464  -6.294
  520    H    LYS  65           HN       LYS  65  -2.297  -2.582 -10.684
  521    HA   LYS  65           HA       LYS  65  -3.150   0.042 -11.067
  522   1HB   LYS  65          HB2       LYS  65  -4.672  -0.929 -12.670
  523   2HB   LYS  65          HB1       LYS  65  -3.250  -1.972 -12.611
  524   1HG   LYS  65          HG2       LYS  65  -4.380  -3.551 -11.173
  525   2HG   LYS  65          HG1       LYS  65  -5.756  -2.464 -10.982
  526   1HD   LYS  65          HD2       LYS  65  -5.931  -2.598 -13.576
  527   2HD   LYS  65          HD1       LYS  65  -4.925  -4.037 -13.412
  528   1HE   LYS  65          HE2       LYS  65  -6.696  -4.701 -11.561
  529   2HE   LYS  65          HE1       LYS  65  -7.736  -3.581 -12.462
  530   1HZ   LYS  65          HZ1       LYS  65  -7.428  -6.094 -13.202
  531   2HZ   LYS  65          HZ2       LYS  65  -6.093  -5.427 -14.016
  532   3HZ   LYS  65          HZ3       LYS  65  -7.659  -4.846 -14.327
  533    H    CYS  66           HN       CYS  66  -4.422  -2.283  -8.805
  534    HA   CYS  66           HA       CYS  66  -7.071  -1.271  -8.462
  535   1HB   CYS  66          HB2       CYS  66  -6.054  -3.423  -7.620
  536   2HB   CYS  66          HB1       CYS  66  -5.207  -2.477  -6.397
  537    H    PHE  67           HN       PHE  67  -3.952  -0.208  -7.156
  538    HA   PHE  67           HA       PHE  67  -5.311   1.841  -5.471
  539   1HB   PHE  67          HB2       PHE  67  -3.533   0.426  -4.510
  540   2HB   PHE  67          HB1       PHE  67  -2.415   0.973  -5.758
  541    HD1  PHE  67           HD1      PHE  67  -4.936   2.777  -3.641
  542    HD2  PHE  67           HD2      PHE  67  -0.821   2.393  -4.811
  543    HE1  PHE  67           HE1      PHE  67  -4.360   4.756  -2.261
  544    HE2  PHE  67           HE2      PHE  67  -0.244   4.372  -3.432
  545    HZ   PHE  67           HZ       PHE  67  -2.012   5.552  -2.156
  546    H    LYS  68           HN       LYS  68  -4.569   4.108  -5.658
  547    HA   LYS  68           HA       LYS  68  -2.999   4.912  -8.001
  548   1HB   LYS  68          HB2       LYS  68  -5.031   6.170  -8.937
  549   2HB   LYS  68          HB1       LYS  68  -5.048   4.416  -9.126
  550   1HG   LYS  68          HG2       LYS  68  -6.207   5.364  -6.587
  551   2HG   LYS  68          HG1       LYS  68  -7.094   5.875  -8.024
  552   1HD   LYS  68          HD2       LYS  68  -6.468   3.205  -8.537
  553   2HD   LYS  68          HD1       LYS  68  -6.894   3.223  -6.824
  554   1HE   LYS  68          HE2       LYS  68  -8.949   4.635  -7.550
  555   2HE   LYS  68          HE1       LYS  68  -8.589   4.047  -9.185
  556   1HZ   LYS  68          HZ1       LYS  68  -8.841   1.848  -8.547
  557   2HZ   LYS  68          HZ2       LYS  68 -10.086   2.614  -7.681
  558   3HZ   LYS  68          HZ3       LYS  68  -8.640   2.185  -6.897
  559    H    GLU  69           HN       GLU  69  -1.806   6.098  -6.385
  560    HA   GLU  69           HA       GLU  69  -2.897   7.859  -4.440
  561   1HB   GLU  69          HB2       GLU  69  -0.566   7.069  -4.533
  562   2HB   GLU  69          HB1       GLU  69  -0.308   7.979  -6.023
  563   1HG   GLU  69          HG2       GLU  69  -1.397   9.797  -4.137
  564   2HG   GLU  69          HG1       GLU  69  -0.121   8.905  -3.307
  565    H    HIS  70           HN       HIS  70  -4.159   9.637  -4.820
  566    HA   HIS  70           HA       HIS  70  -3.620  11.250  -7.295
  567   1HB   HIS  70          HB2       HIS  70  -5.904   9.810  -6.494
  568   2HB   HIS  70          HB1       HIS  70  -6.297  11.503  -6.195
  569    HD1  HIS  70           HD1      HIS  70  -6.764  12.961  -8.208
  570    HD2  HIS  70           HD2      HIS  70  -5.126   9.279  -9.272
  571    HE1  HIS  70           HE1      HIS  70  -6.892  12.823 -10.734
  572    H    SER  71           HN       SER  71  -4.888  13.526  -6.859
  573    HA   SER  71           HA       SER  71  -3.575  14.654  -4.454
  574   1HB   SER  71          HB2       SER  71  -4.511  15.521  -7.101
  575   2HB   SER  71          HB1       SER  71  -4.869  16.685  -5.824
  576    HG   SER  71           HG       SER  71  -2.842  17.198  -5.949
  577    H    SER  72           HN       SER  72  -4.950  16.430  -3.311
  578    HA   SER  72           HA       SER  72  -6.745  16.761  -1.795
  579   1HB   SER  72          HB2       SER  72  -7.927  16.282  -4.530
  580   2HB   SER  72          HB1       SER  72  -8.945  16.727  -3.163
  581    HG   SER  72           HG       SER  72  -6.608  18.180  -3.775
  582    H    LEU  73           HN       LEU  73  -9.248  15.634  -1.586
  583    HA   LEU  73           HA       LEU  73  -8.645  12.727  -1.147
  584   1HB   LEU  73          HB2       LEU  73 -10.362  14.720   0.361
  585   2HB   LEU  73          HB1       LEU  73 -10.289  12.996   0.741
  586    HG   LEU  73           HG       LEU  73  -7.629  13.646   0.645
  587   1HD1  LEU  73          HD11      LEU  73  -7.927  16.008   0.422
  588   2HD1  LEU  73          HD12      LEU  73  -7.515  15.733   2.114
  589   3HD1  LEU  73          HD13      LEU  73  -9.191  16.033   1.652
  590   1HD2  LEU  73          HD21      LEU  73  -7.662  13.268   2.977
  591   2HD2  LEU  73          HD22      LEU  73  -9.106  12.435   2.402
  592   3HD2  LEU  73          HD23      LEU  73  -9.247  14.018   3.164
  593    H    ALA  74           HN       ALA  74  -9.708  11.618  -2.770
  594    HA   ALA  74           HA       ALA  74 -11.874  12.466  -4.338
  595   1HB   ALA  74          HB1       ALA  74 -12.235   9.933  -4.553
  596   2HB   ALA  74          HB2       ALA  74 -10.951   9.756  -3.358
  597   3HB   ALA  74          HB3       ALA  74 -10.611  10.518  -4.911
  598    H    PHE  75           HN       PHE  75 -14.171  11.801  -4.231
  599    HA   PHE  75           HA       PHE  75 -15.148  11.501  -1.407
  600   1HB   PHE  75          HB2       PHE  75 -17.172  12.760  -2.426
  601   2HB   PHE  75          HB1       PHE  75 -15.694  13.684  -2.162
  602    HD1  PHE  75           HD1      PHE  75 -14.219  14.277  -4.051
  603    HD2  PHE  75           HD2      PHE  75 -17.937  12.216  -4.663
  604    HE1  PHE  75           HE1      PHE  75 -14.123  14.824  -6.469
  605    HE2  PHE  75           HE2      PHE  75 -17.842  12.762  -7.082
  606    HZ   PHE  75           HZ       PHE  75 -15.934  14.067  -7.983
  607    H    TRP  76           HN       TRP  76 -17.381  10.461  -1.336
  608    HA   TRP  76           HA       TRP  76 -18.822   8.664  -1.879
  609   1HB   TRP  76          HB2       TRP  76 -18.258  10.165  -4.208
  610   2HB   TRP  76          HB1       TRP  76 -18.164   8.466  -4.679
  611    HD1  TRP  76           HD1      TRP  76 -20.318   6.920  -3.903
  612    HE1  TRP  76           HE1      TRP  76 -22.819   7.551  -3.848
  613    HE3  TRP  76           HE3      TRP  76 -19.929  11.997  -3.897
  614    HZ2  TRP  76           HZ2      TRP  76 -24.440   9.914  -3.804
  615    HZ3  TRP  76           HZ3      TRP  76 -21.959  13.421  -3.845
  616    HH2  TRP  76           HH2      TRP  76 -24.212  12.387  -3.798
  617    H    LYS  77           HN       LYS  77 -15.715   8.379  -1.526
  618    HA   LYS  77           HA       LYS  77 -15.653   5.503  -2.342
  619   1HB   LYS  77          HB2       LYS  77 -14.501   6.917  -4.031
  620   2HB   LYS  77          HB1       LYS  77 -13.460   7.563  -2.761
  621   1HG   LYS  77          HG2       LYS  77 -12.312   5.556  -2.491
  622   2HG   LYS  77          HG1       LYS  77 -13.649   4.590  -3.115
  623   1HD   LYS  77          HD2       LYS  77 -11.762   4.703  -4.727
  624   2HD   LYS  77          HD1       LYS  77 -13.231   5.429  -5.381
  625   1HE   LYS  77          HE2       LYS  77 -11.172   6.829  -5.776
  626   2HE   LYS  77          HE1       LYS  77 -12.408   7.675  -4.825
  627   1HZ   LYS  77          HZ1       LYS  77 -11.185   7.558  -2.957
  628   2HZ   LYS  77          HZ2       LYS  77  -9.873   7.359  -4.017
  629   3HZ   LYS  77          HZ3       LYS  77 -10.600   6.003  -3.298
  630    H    THR  78           HN       THR  78 -14.357   4.199  -0.936
  631    HA   THR  78           HA       THR  78 -13.633   5.528   1.647
  632    HB   THR  78           HB       THR  78 -14.403   2.708   0.862
  633    HG1  THR  78           HG1      THR  78 -15.965   3.437   2.665
  634   1HG2  THR  78          HG21      THR  78 -14.359   2.427   3.444
  635   2HG2  THR  78          HG22      THR  78 -13.280   3.821   3.422
  636   3HG2  THR  78          HG23      THR  78 -12.830   2.344   2.569
  637    H    ASP  79           HN       ASP  79 -11.649   4.765   2.711
  638    HA   ASP  79           HA       ASP  79  -9.483   4.225   0.772
  639   1HB   ASP  79          HB2       ASP  79  -9.826   5.245   3.545
  640   2HB   ASP  79          HB1       ASP  79  -8.304   4.420   3.206
  641    H    ALA  80           HN       ALA  80  -9.360   2.045   0.257
  642    HA   ALA  80           HA       ALA  80 -10.172  -0.217   1.590
  643   1HB   ALA  80          HB1       ALA  80  -7.538   0.236   0.153
  644   2HB   ALA  80          HB2       ALA  80  -9.080  -0.139  -0.617
  645   3HB   ALA  80          HB3       ALA  80  -8.296  -1.334   0.416
  646    H    SER  81           HN       SER  81  -6.930   1.256   2.042
  647    HA   SER  81           HA       SER  81  -5.875  -0.372   4.025
  648   1HB   SER  81          HB2       SER  81  -4.547   1.406   3.253
  649   2HB   SER  81          HB1       SER  81  -5.831   2.589   3.481
  650    HG   SER  81           HG       SER  81  -4.878   1.208   5.717
  651    H    ASP  82           HN       ASP  82  -8.574   1.848   4.296
  652    HA   ASP  82           HA       ASP  82  -8.646   1.528   7.258
  653   1HB   ASP  82          HB2       ASP  82  -9.992   3.311   5.224
  654   2HB   ASP  82          HB1       ASP  82 -10.518   3.266   6.905
  655    H    VAL  83           HN       VAL  83  -9.353  -0.633   5.260
  656    HA   VAL  83           HA       VAL  83 -12.179  -1.076   6.169
  657    HB   VAL  83           HB       VAL  83 -10.960  -2.033   3.574
  658   1HG1  VAL  83          HG11      VAL  83 -13.805  -1.422   3.653
  659   2HG1  VAL  83          HG12      VAL  83 -13.360  -2.594   4.894
  660   3HG1  VAL  83          HG13      VAL  83 -12.998  -2.924   3.199
  661   1HG2  VAL  83          HG21      VAL  83 -10.835   0.444   3.678
  662   2HG2  VAL  83          HG22      VAL  83 -12.555   0.503   4.066
  663   3HG2  VAL  83          HG23      VAL  83 -12.025  -0.094   2.493
  664    H    LYS  84           HN       LYS  84 -12.707  -3.308   6.613
  665    HA   LYS  84           HA       LYS  84 -10.377  -4.929   7.445
  666   1HB   LYS  84          HB2       LYS  84 -12.227  -6.303   8.474
  667   2HB   LYS  84          HB1       LYS  84 -12.240  -4.613   8.979
  668   1HG   LYS  84          HG2       LYS  84 -14.174  -4.145   7.844
  669   2HG   LYS  84          HG1       LYS  84 -13.797  -5.265   6.534
  670   1HD   LYS  84          HD2       LYS  84 -14.112  -7.030   8.560
  671   2HD   LYS  84          HD1       LYS  84 -15.213  -5.761   9.096
  672   1HE   LYS  84          HE2       LYS  84 -15.274  -6.862   6.271
  673   2HE   LYS  84          HE1       LYS  84 -16.266  -7.528   7.583
  674   1HZ   LYS  84          HZ1       LYS  84 -17.207  -5.589   6.184
  675   2HZ   LYS  84          HZ2       LYS  84 -16.174  -4.618   7.123
  676   3HZ   LYS  84          HZ3       LYS  84 -17.385  -5.545   7.871
  677    HA   PRO  85           HA       PRO  85 -10.432  -7.528   3.870
  678   1HB   PRO  85          HB2       PRO  85  -9.787  -9.869   5.417
  679   2HB   PRO  85          HB1       PRO  85  -8.696  -8.873   4.444
  680   1HG   PRO  85          HG2       PRO  85  -8.840  -9.044   7.305
  681   2HG   PRO  85          HG1       PRO  85  -7.759  -8.045   6.331
  682   1HD   PRO  85          HD2       PRO  85 -10.007  -7.184   7.923
  683   2HD   PRO  85          HD1       PRO  85  -8.918  -6.179   6.937
  684    H    CYS  86           HN       CYS  86 -12.108  -8.665   2.888
  685    HA   CYS  86           HA       CYS  86 -14.620  -9.069   3.972
  686   1HB   CYS  86          HB2       CYS  86 -13.401  -9.558   1.601
  687   2HB   CYS  86          HB1       CYS  86 -13.610 -11.212   2.175
  Start of MODEL   18
    1   1H    THR   1          HT1       THR   1  23.601  -6.502  -7.362
    2   2H    THR   1          HT2       THR   1  24.270  -7.191  -8.765
    3   3H    THR   1          HT3       THR   1  23.180  -8.083  -7.814
    4    HA   THR   1           HA       THR   1  22.521  -5.622  -9.356
    5    HB   THR   1           HB       THR   1  21.081  -7.624 -10.425
    6    HG1  THR   1           HG1      THR   1  21.777  -9.328  -9.323
    7   1HG2  THR   1          HG21      THR   1  23.971  -7.520 -11.208
    8   2HG2  THR   1          HG22      THR   1  22.999  -6.054 -11.341
    9   3HG2  THR   1          HG23      THR   1  22.535  -7.504 -12.231
   10    H    LYS   2           HN       LYS   2  21.874  -5.391  -6.761
   11    HA   LYS   2           HA       LYS   2  18.946  -5.902  -6.739
   12   1HB   LYS   2          HB2       LYS   2  20.965  -6.858  -4.687
   13   2HB   LYS   2          HB1       LYS   2  19.226  -6.825  -4.390
   14   1HG   LYS   2          HG2       LYS   2  19.025  -8.177  -6.587
   15   2HG   LYS   2          HG1       LYS   2  20.752  -8.479  -6.398
   16   1HD   LYS   2          HD2       LYS   2  18.995  -8.934  -4.025
   17   2HD   LYS   2          HD1       LYS   2  18.937 -10.118  -5.331
   18   1HE   LYS   2          HE2       LYS   2  20.806 -11.042  -4.435
   19   2HE   LYS   2          HE1       LYS   2  21.679  -9.581  -4.942
   20   1HZ   LYS   2          HZ1       LYS   2  20.290 -10.063  -2.367
   21   2HZ   LYS   2          HZ2       LYS   2  20.758  -8.512  -2.880
   22   3HZ   LYS   2          HZ3       LYS   2  21.931  -9.711  -2.610
   23    H    ALA   3           HN       ALA   3  18.991  -3.519  -7.008
   24    HA   ALA   3           HA       ALA   3  20.086  -1.915  -4.778
   25   1HB   ALA   3          HB1       ALA   3  18.551  -1.247  -7.311
   26   2HB   ALA   3          HB2       ALA   3  20.302  -1.177  -7.108
   27   3HB   ALA   3          HB3       ALA   3  19.265  -0.052  -6.229
   28    H    SER   4           HN       SER   4  18.776  -0.793  -3.284
   29    HA   SER   4           HA       SER   4  16.260  -1.930  -2.540
   30   1HB   SER   4          HB2       SER   4  18.136   0.063  -1.667
   31   2HB   SER   4          HB1       SER   4  16.513   0.743  -1.575
   32    HG   SER   4           HG       SER   4  17.238  -0.486   0.304
   33    H    CYS   5           HN       CYS   5  14.551   0.226  -2.102
   34    HA   CYS   5           HA       CYS   5  13.874   1.106  -4.891
   35   1HB   CYS   5          HB2       CYS   5  11.956   0.603  -2.604
   36   2HB   CYS   5          HB1       CYS   5  11.577   0.740  -4.321
   37    H    LYS   6           HN       LYS   6  11.992   2.963  -4.454
   38    HA   LYS   6           HA       LYS   6  13.187   4.919  -2.515
   39   1HB   LYS   6          HB2       LYS   6  13.335   4.965  -5.278
   40   2HB   LYS   6          HB1       LYS   6  11.943   5.999  -4.955
   41   1HG   LYS   6          HG2       LYS   6  13.570   7.595  -4.705
   42   2HG   LYS   6          HG1       LYS   6  13.632   6.937  -3.069
   43   1HD   LYS   6          HD2       LYS   6  15.662   5.964  -3.400
   44   2HD   LYS   6          HD1       LYS   6  15.267   5.476  -5.048
   45   1HE   LYS   6          HE2       LYS   6  15.399   8.124  -5.466
   46   2HE   LYS   6          HE1       LYS   6  16.499   8.020  -4.076
   47   1HZ   LYS   6          HZ1       LYS   6  17.616   7.613  -6.235
   48   2HZ   LYS   6          HZ2       LYS   6  16.635   6.241  -6.453
   49   3HZ   LYS   6          HZ3       LYS   6  17.738   6.305  -5.162
   50    H    LEU   7           HN       LEU   7  11.558   4.878  -0.945
   51    HA   LEU   7           HA       LEU   7   8.883   4.353  -1.023
   52   1HB   LEU   7          HB2       LEU   7   8.701   6.207   0.726
   53   2HB   LEU   7          HB1       LEU   7   9.977   5.016   1.002
   54    HG   LEU   7           HG       LEU   7  10.877   7.233  -0.675
   55   1HD1  LEU   7          HD11      LEU   7   9.101   8.224   0.993
   56   2HD1  LEU   7          HD12      LEU   7  10.662   9.025   0.810
   57   3HD1  LEU   7          HD13      LEU   7  10.369   7.972   2.193
   58   1HD2  LEU   7          HD21      LEU   7  12.084   5.361   0.786
   59   2HD2  LEU   7          HD22      LEU   7  11.948   6.586   2.046
   60   3HD2  LEU   7          HD23      LEU   7  12.822   6.946   0.557
   61    HA   PRO   8           HA       PRO   8   7.812   7.324  -4.335
   62   1HB   PRO   8          HB2       PRO   8   5.338   5.875  -4.571
   63   2HB   PRO   8          HB1       PRO   8   6.711   5.876  -5.686
   64   1HG   PRO   8          HG2       PRO   8   5.862   3.751  -3.976
   65   2HG   PRO   8          HG1       PRO   8   7.278   3.784  -5.030
   66   1HD   PRO   8          HD2       PRO   8   7.188   3.944  -2.131
   67   2HD   PRO   8          HD1       PRO   8   8.618   3.861  -3.189
   68    H    VAL   9           HN       VAL   9   5.600   6.057  -1.821
   69    HA   VAL   9           HA       VAL   9   4.272   8.739  -1.719
   70    HB   VAL   9           HB       VAL   9   3.342   6.147  -0.475
   71   1HG1  VAL   9          HG11      VAL   9   2.112   8.088   0.247
   72   2HG1  VAL   9          HG12      VAL   9   1.106   7.245  -0.930
   73   3HG1  VAL   9          HG13      VAL   9   1.993   8.694  -1.406
   74   1HG2  VAL   9          HG21      VAL   9   3.812   5.750  -2.879
   75   2HG2  VAL   9          HG22      VAL   9   2.807   7.139  -3.295
   76   3HG2  VAL   9          HG23      VAL   9   2.080   5.717  -2.546
   77    H    LYS  10           HN       LYS  10   3.517   9.301   0.596
   78    HA   LYS  10           HA       LYS  10   5.672   8.589   2.563
   79   1HB   LYS  10          HB2       LYS  10   5.404  10.924   3.358
   80   2HB   LYS  10          HB1       LYS  10   5.831  10.877   1.647
   81   1HG   LYS  10          HG2       LYS  10   3.489  11.182   1.017
   82   2HG   LYS  10          HG1       LYS  10   3.004  11.137   2.712
   83   1HD   LYS  10          HD2       LYS  10   4.476  13.132   3.121
   84   2HD   LYS  10          HD1       LYS  10   4.756  13.221   1.381
   85   1HE   LYS  10          HE2       LYS  10   2.208  13.315   1.112
   86   2HE   LYS  10          HE1       LYS  10   2.142  13.603   2.862
   87   1HZ   LYS  10          HZ1       LYS  10   3.872  15.365   2.469
   88   2HZ   LYS  10          HZ2       LYS  10   2.324  15.721   1.867
   89   3HZ   LYS  10          HZ3       LYS  10   3.553  15.212   0.810
   90    H    LYS  11           HN       LYS  11   2.714   7.672   1.997
   91    HA   LYS  11           HA       LYS  11   1.974   7.469   4.837
   92   1HB   LYS  11          HB2       LYS  11   0.885   9.468   2.997
   93   2HB   LYS  11          HB1       LYS  11  -0.374   8.467   3.720
   94   1HG   LYS  11          HG2       LYS  11  -0.181   9.617   5.643
   95   2HG   LYS  11          HG1       LYS  11   1.503   9.112   5.770
   96   1HD   LYS  11          HD2       LYS  11   2.102  11.254   5.434
   97   2HD   LYS  11          HD1       LYS  11   1.470  11.116   3.794
   98   1HE   LYS  11          HE2       LYS  11  -0.702  11.485   5.694
   99   2HE   LYS  11          HE1       LYS  11   0.479  12.806   5.804
  100   1HZ   LYS  11          HZ1       LYS  11   0.390  13.119   3.457
  101   2HZ   LYS  11          HZ2       LYS  11  -1.212  13.118   4.024
  102   3HZ   LYS  11          HZ3       LYS  11  -0.583  11.747   3.242
  103    H    ALA  12           HN       ALA  12   2.588   5.620   2.614
  104    HA   ALA  12           HA       ALA  12  -0.015   4.415   1.883
  105   1HB   ALA  12          HB1       ALA  12   2.399   2.930   1.213
  106   2HB   ALA  12          HB2       ALA  12   2.548   4.631   0.769
  107   3HB   ALA  12          HB3       ALA  12   1.213   3.667   0.136
  108    H    THR  13           HN       THR  13  -0.806   2.516   2.794
  109    HA   THR  13           HA       THR  13   0.767   1.346   5.066
  110    HB   THR  13           HB       THR  13  -2.163   0.884   4.618
  111    HG1  THR  13           HG1      THR  13  -2.406   2.969   4.508
  112   1HG2  THR  13          HG21      THR  13  -0.390   0.234   6.602
  113   2HG2  THR  13          HG22      THR  13  -2.136   0.358   6.826
  114   3HG2  THR  13          HG23      THR  13  -1.094   1.722   7.233
  115    H    VAL  14           HN       VAL  14   1.939  -0.259   3.924
  116    HA   VAL  14           HA       VAL  14   0.410  -2.135   2.187
  117    HB   VAL  14           HB       VAL  14   2.657  -2.824   1.484
  118   1HG1  VAL  14          HG11      VAL  14   1.523  -0.542   0.800
  119   2HG1  VAL  14          HG12      VAL  14   3.189  -0.875   0.323
  120   3HG1  VAL  14          HG13      VAL  14   2.860   0.162   1.711
  121   1HG2  VAL  14          HG21      VAL  14   4.319  -0.954   2.801
  122   2HG2  VAL  14          HG22      VAL  14   4.327  -2.707   2.996
  123   3HG2  VAL  14          HG23      VAL  14   3.341  -1.706   4.062
  124    H    VAL  15           HN       VAL  15   1.240  -4.512   2.456
  125    HA   VAL  15           HA       VAL  15   1.346  -5.171   5.383
  126    HB   VAL  15           HB       VAL  15  -0.047  -6.498   3.038
  127   1HG1  VAL  15          HG11      VAL  15   0.997  -7.695   5.397
  128   2HG1  VAL  15          HG12      VAL  15  -0.058  -8.429   4.189
  129   3HG1  VAL  15          HG13      VAL  15  -0.755  -7.611   5.588
  130   1HG2  VAL  15          HG21      VAL  15  -1.719  -5.120   3.673
  131   2HG2  VAL  15          HG22      VAL  15  -0.818  -4.586   5.093
  132   3HG2  VAL  15          HG23      VAL  15  -1.808  -6.043   5.174
  133    H    TYR  16           HN       TYR  16   3.503  -5.743   5.673
  134    HA   TYR  16           HA       TYR  16   5.025  -7.166   3.614
  135   1HB   TYR  16          HB2       TYR  16   5.676  -5.453   5.560
  136   2HB   TYR  16          HB1       TYR  16   5.882  -6.948   6.472
  137    HD1  TYR  16           HD1      TYR  16   6.505  -8.352   3.570
  138    HD2  TYR  16           HD2      TYR  16   8.193  -5.175   5.919
  139    HE1  TYR  16           HE1      TYR  16   8.702  -8.714   2.481
  140    HE2  TYR  16           HE2      TYR  16  10.390  -5.538   4.827
  141    HH   TYR  16           HH       TYR  16  11.518  -6.685   3.304
  142    H    GLN  17           HN       GLN  17   6.306  -8.746   5.925
  143    HA   GLN  17           HA       GLN  17   5.163 -11.280   5.419
  144   1HB   GLN  17          HB2       GLN  17   6.872 -10.066   7.579
  145   2HB   GLN  17          HB1       GLN  17   6.374 -11.758   7.691
  146   1HG   GLN  17          HG2       GLN  17   7.638 -12.397   5.875
  147   2HG   GLN  17          HG1       GLN  17   7.482 -10.829   5.081
  148   1HE2  GLN  17          HE21      GLN  17   8.842 -12.004   8.222
  149   2HE2  GLN  17          HE22      GLN  17  10.287 -11.122   8.087
  150    H    GLY  18           HN       GLY  18   2.802 -10.705   5.650
  151   1HA   GLY  18          HA2       GLY  18   0.779 -10.759   6.837
  152   2HA   GLY  18          HA1       GLY  18   1.645 -11.789   7.977
  153    H    GLU  19           HN       GLU  19   2.542  -8.444   7.271
  154    HA   GLU  19           HA       GLU  19   1.449  -7.617   9.928
  155   1HB   GLU  19          HB2       GLU  19   3.923  -8.419   9.867
  156   2HB   GLU  19          HB1       GLU  19   4.237  -6.903   9.022
  157   1HG   GLU  19          HG2       GLU  19   4.110  -5.729  10.941
  158   2HG   GLU  19          HG1       GLU  19   2.553  -6.456  11.341
  159    H    ARG  20           HN       ARG  20   0.958  -5.376  10.039
  160    HA   ARG  20           HA       ARG  20   0.781  -4.016   7.403
  161   1HB   ARG  20          HB2       ARG  20  -0.402  -3.479  10.144
  162   2HB   ARG  20          HB1       ARG  20  -0.771  -2.536   8.697
  163   1HG   ARG  20          HG2       ARG  20  -1.824  -4.374   7.633
  164   2HG   ARG  20          HG1       ARG  20  -1.126  -5.534   8.763
  165   1HD   ARG  20          HD2       ARG  20  -2.473  -4.027  10.536
  166   2HD   ARG  20          HD1       ARG  20  -3.495  -3.754   9.110
  167    HE   ARG  20           HE       ARG  20  -2.748  -6.505  10.037
  168   1HH1  ARG  20          HH11      ARG  20  -5.357  -4.883  10.731
  169   2HH1  ARG  20          HH12      ARG  20  -6.474  -5.684   9.676
  170   1HH2  ARG  20          HH21      ARG  20  -4.000  -7.243   7.810
  171   2HH2  ARG  20          HH22      ARG  20  -5.705  -7.020   8.020
  172    H    VAL  21           HN       VAL  21   1.832  -2.047   6.991
  173    HA   VAL  21           HA       VAL  21   3.200  -0.585   9.149
  174    HB   VAL  21           HB       VAL  21   5.424  -0.927   7.900
  175   1HG1  VAL  21          HG11      VAL  21   4.430  -3.541   8.982
  176   2HG1  VAL  21          HG12      VAL  21   4.476  -2.139  10.051
  177   3HG1  VAL  21          HG13      VAL  21   5.959  -2.715   9.288
  178   1HG2  VAL  21          HG21      VAL  21   5.522  -2.338   6.128
  179   2HG2  VAL  21          HG22      VAL  21   3.765  -2.194   6.074
  180   3HG2  VAL  21          HG23      VAL  21   4.514  -3.542   6.930
  181    H    LYS  22           HN       LYS  22   4.138   1.448   8.317
  182    HA   LYS  22           HA       LYS  22   2.707   2.400   5.894
  183   1HB   LYS  22          HB2       LYS  22   4.050   3.585   8.304
  184   2HB   LYS  22          HB1       LYS  22   3.808   4.598   6.880
  185   1HG   LYS  22          HG2       LYS  22   1.593   3.004   8.196
  186   2HG   LYS  22          HG1       LYS  22   1.918   4.701   8.550
  187   1HD   LYS  22          HD2       LYS  22   1.667   5.185   6.089
  188   2HD   LYS  22          HD1       LYS  22   1.141   3.515   5.872
  189   1HE   LYS  22          HE2       LYS  22  -0.915   4.606   6.155
  190   2HE   LYS  22          HE1       LYS  22  -0.552   4.139   7.828
  191   1HZ   LYS  22          HZ1       LYS  22  -0.160   6.759   6.520
  192   2HZ   LYS  22          HZ2       LYS  22   0.752   6.327   7.887
  193   3HZ   LYS  22          HZ3       LYS  22  -0.942   6.413   7.985
  194    H    ILE  23           HN       ILE  23   3.857   2.048   4.016
  195    HA   ILE  23           HA       ILE  23   6.538   1.486   3.618
  196    HB   ILE  23           HB       ILE  23   4.718   1.550   1.916
  197   1HG1  ILE  23          HG12      ILE  23   7.090   3.289   1.166
  198   2HG1  ILE  23          HG11      ILE  23   7.134   1.527   1.251
  199   1HG2  ILE  23          HG21      ILE  23   4.254   3.788   0.854
  200   2HG2  ILE  23          HG22      ILE  23   5.139   4.540   2.180
  201   3HG2  ILE  23          HG23      ILE  23   3.655   3.646   2.507
  202   1HD1  ILE  23          HD11      ILE  23   5.124   1.591  -0.374
  203   2HD1  ILE  23          HD12      ILE  23   6.715   1.977  -1.033
  204   3HD1  ILE  23          HD13      ILE  23   5.579   3.272  -0.656
  205    H    GLN  24           HN       GLN  24   5.119   4.603   4.410
  206    HA   GLN  24           HA       GLN  24   7.438   6.207   3.718
  207   1HB   GLN  24          HB2       GLN  24   6.167   7.929   4.980
  208   2HB   GLN  24          HB1       GLN  24   5.126   7.051   3.854
  209   1HG   GLN  24          HG2       GLN  24   3.841   6.274   5.533
  210   2HG   GLN  24          HG1       GLN  24   5.253   5.702   6.424
  211   1HE2  GLN  24          HE21      GLN  24   2.788   7.266   7.367
  212   2HE2  GLN  24          HE22      GLN  24   3.432   8.621   8.161
  213    H    GLU  25           HN       GLU  25   6.569   4.222   6.430
  214    HA   GLU  25           HA       GLU  25   8.767   5.431   8.067
  215   1HB   GLU  25          HB2       GLU  25   6.401   3.693   8.827
  216   2HB   GLU  25          HB1       GLU  25   7.543   4.420   9.957
  217   1HG   GLU  25          HG2       GLU  25   6.684   6.541   8.331
  218   2HG   GLU  25          HG1       GLU  25   5.225   5.612   8.679
  219    H    LYS  26           HN       LYS  26   7.235   2.210   7.637
  220    HA   LYS  26           HA       LYS  26   9.294   0.581   8.566
  221   1HB   LYS  26          HB2       LYS  26   6.906   0.183   7.446
  222   2HB   LYS  26          HB1       LYS  26   7.892  -0.136   6.015
  223   1HG   LYS  26          HG2       LYS  26   8.097  -1.524   8.704
  224   2HG   LYS  26          HG1       LYS  26   7.537  -2.234   7.189
  225   1HD   LYS  26          HD2       LYS  26   9.814  -1.695   6.212
  226   2HD   LYS  26          HD1       LYS  26  10.334  -1.277   7.846
  227   1HE   LYS  26          HE2       LYS  26   9.775  -3.551   8.626
  228   2HE   LYS  26          HE1       LYS  26   9.225  -3.979   6.993
  229   1HZ   LYS  26          HZ1       LYS  26  11.931  -2.919   7.608
  230   2HZ   LYS  26          HZ2       LYS  26  11.381  -3.518   6.116
  231   3HZ   LYS  26          HZ3       LYS  26  11.585  -4.570   7.435
  232    H    PHE  27           HN       PHE  27   9.037   2.162   5.392
  233    HA   PHE  27           HA       PHE  27  11.818   1.219   4.772
  234   1HB   PHE  27          HB2       PHE  27   9.441   1.945   3.031
  235   2HB   PHE  27          HB1       PHE  27  11.052   1.601   2.390
  236    HD1  PHE  27           HD1      PHE  27  12.085  -0.622   3.789
  237    HD2  PHE  27           HD2      PHE  27   7.993   0.148   2.733
  238    HE1  PHE  27           HE1      PHE  27  11.604  -3.054   3.876
  239    HE2  PHE  27           HE2      PHE  27   7.513  -2.284   2.819
  240    HZ   PHE  27           HZ       PHE  27   9.319  -3.885   3.389
  241    H    LYS  28           HN       LYS  28  11.275   3.579   6.395
  242    HA   LYS  28           HA       LYS  28  11.123   6.067   5.215
  243   1HB   LYS  28          HB2       LYS  28  11.869   5.063   7.623
  244   2HB   LYS  28          HB1       LYS  28  13.432   5.635   7.038
  245   1HG   LYS  28          HG2       LYS  28  12.857   7.760   7.496
  246   2HG   LYS  28          HG1       LYS  28  11.438   7.621   6.456
  247   1HD   LYS  28          HD2       LYS  28  10.028   7.146   8.206
  248   2HD   LYS  28          HD1       LYS  28  11.282   6.315   9.127
  249   1HE   LYS  28          HE2       LYS  28  12.003   8.249  10.144
  250   2HE   LYS  28          HE1       LYS  28  11.683   9.240   8.707
  251   1HZ   LYS  28          HZ1       LYS  28  10.036   9.761  10.340
  252   2HZ   LYS  28          HZ2       LYS  28   9.677   8.120  10.591
  253   3HZ   LYS  28          HZ3       LYS  28   9.280   8.863   9.115
  254    H    ASN  29           HN       ASN  29  13.861   3.818   5.035
  255    HA   ASN  29           HA       ASN  29  15.349   5.754   3.320
  256   1HB   ASN  29          HB2       ASN  29  15.997   3.343   4.996
  257   2HB   ASN  29          HB1       ASN  29  17.116   3.839   3.721
  258   1HD2  ASN  29          HD21      ASN  29  15.297   5.283   6.489
  259   2HD2  ASN  29          HD22      ASN  29  16.519   6.387   6.903
  260    H    GLY  30           HN       GLY  30  13.044   4.470   2.180
  261   1HA   GLY  30          HA2       GLY  30  12.594   3.539   0.050
  262   2HA   GLY  30          HA1       GLY  30  14.313   3.182  -0.119
  263    H    MET  31           HN       MET  31  12.720   1.201  -0.950
  264    HA   MET  31           HA       MET  31  12.417  -0.715   1.327
  265   1HB   MET  31          HB2       MET  31  11.446  -0.888  -1.542
  266   2HB   MET  31          HB1       MET  31  10.906  -1.870  -0.180
  267   1HG   MET  31          HG2       MET  31  10.009   0.142   0.925
  268   2HG   MET  31          HG1       MET  31  10.556   1.132  -0.428
  269   1HE   MET  31          HE1       MET  31   8.768  -2.028   0.542
  270   2HE   MET  31          HE2       MET  31   9.184  -2.561  -1.086
  271   3HE   MET  31          HE3       MET  31   7.497  -2.278  -0.663
  272    H    LEU  32           HN       LEU  32  13.163  -2.966   0.913
  273    HA   LEU  32           HA       LEU  32  15.836  -3.022  -0.253
  274   1HB   LEU  32          HB2       LEU  32  13.973  -5.039   1.020
  275   2HB   LEU  32          HB1       LEU  32  15.599  -5.461   0.473
  276    HG   LEU  32           HG       LEU  32  15.457  -3.022   2.130
  277   1HD1  LEU  32          HD11      LEU  32  14.394  -5.646   3.064
  278   2HD1  LEU  32          HD12      LEU  32  13.986  -4.014   3.595
  279   3HD1  LEU  32          HD13      LEU  32  15.468  -4.782   4.164
  280   1HD2  LEU  32          HD21      LEU  32  17.114  -5.546   2.410
  281   2HD2  LEU  32          HD22      LEU  32  17.485  -3.946   3.052
  282   3HD2  LEU  32          HD23      LEU  32  17.533  -4.230   1.312
  283    H    HIS  33           HN       HIS  33  16.420  -4.758  -1.885
  284    HA   HIS  33           HA       HIS  33  14.661  -4.600  -4.203
  285   1HB   HIS  33          HB2       HIS  33  17.027  -4.554  -4.534
  286   2HB   HIS  33          HB1       HIS  33  17.262  -5.989  -3.530
  287    HD1  HIS  33           HD1      HIS  33  15.770  -4.964  -6.869
  288    HD2  HIS  33           HD2      HIS  33  17.048  -8.410  -4.902
  289    HE1  HIS  33           HE1      HIS  33  15.685  -6.834  -8.574
  290    H    GLY  34           HN       GLY  34  13.399  -6.273  -5.080
  291   1HA   GLY  34          HA2       GLY  34  12.280  -8.339  -5.188
  292   2HA   GLY  34          HA1       GLY  34  13.526  -9.003  -4.132
  293    H    ASP  35           HN       ASP  35  12.238  -6.226  -2.745
  294    HA   ASP  35           HA       ASP  35  11.096  -7.580  -0.510
  295   1HB   ASP  35          HB2       ASP  35  11.632  -4.942  -1.421
  296   2HB   ASP  35          HB1       ASP  35   9.935  -4.978  -0.941
  297    H    LYS  36           HN       LYS  36   8.780  -7.603   0.112
  298    HA   LYS  36           HA       LYS  36   6.900  -7.591  -2.222
  299   1HB   LYS  36          HB2       LYS  36   7.580  -9.725  -0.227
  300   2HB   LYS  36          HB1       LYS  36   5.939  -9.653  -0.866
  301   1HG   LYS  36          HG2       LYS  36   7.892  -9.345  -2.992
  302   2HG   LYS  36          HG1       LYS  36   8.159 -10.844  -2.101
  303   1HD   LYS  36          HD2       LYS  36   5.480 -10.957  -2.313
  304   2HD   LYS  36          HD1       LYS  36   5.833 -10.019  -3.764
  305   1HE   LYS  36          HE2       LYS  36   7.437 -11.756  -4.501
  306   2HE   LYS  36          HE1       LYS  36   7.057 -12.708  -3.053
  307   1HZ   LYS  36          HZ1       LYS  36   5.715 -13.164  -5.180
  308   2HZ   LYS  36          HZ2       LYS  36   4.909 -11.713  -4.816
  309   3HZ   LYS  36          HZ3       LYS  36   4.870 -13.008  -3.718
  310    H    VAL  37           HN       VAL  37   5.199  -6.266  -1.752
  311    HA   VAL  37           HA       VAL  37   4.211  -6.126   1.065
  312    HB   VAL  37           HB       VAL  37   4.214  -3.680   0.909
  313   1HG1  VAL  37          HG11      VAL  37   6.492  -3.402   1.263
  314   2HG1  VAL  37          HG12      VAL  37   6.934  -4.426  -0.103
  315   3HG1  VAL  37          HG13      VAL  37   6.364  -5.156   1.398
  316   1HG2  VAL  37          HG21      VAL  37   3.777  -3.461  -1.488
  317   2HG2  VAL  37          HG22      VAL  37   5.344  -4.179  -1.864
  318   3HG2  VAL  37          HG23      VAL  37   5.261  -2.598  -1.085
  319    H    SER  38           HN       SER  38   1.970  -6.057   1.158
  320    HA   SER  38           HA       SER  38   0.506  -6.004  -1.443
  321   1HB   SER  38          HB2       SER  38  -0.774  -6.674   1.171
  322   2HB   SER  38          HB1       SER  38  -0.978  -7.441  -0.407
  323    HG   SER  38           HG       SER  38   0.207  -8.793   0.947
  324    H    PHE  39           HN       PHE  39  -1.213  -4.521  -1.766
  325    HA   PHE  39           HA       PHE  39  -1.281  -2.226   0.151
  326   1HB   PHE  39          HB2       PHE  39  -1.866  -2.616  -2.787
  327   2HB   PHE  39          HB1       PHE  39  -2.379  -1.155  -1.936
  328    HD1  PHE  39           HD1      PHE  39   0.566  -3.208  -2.897
  329    HD2  PHE  39           HD2      PHE  39  -0.809   0.530  -1.289
  330    HE1  PHE  39           HE1      PHE  39   2.854  -2.276  -3.109
  331    HE2  PHE  39           HE2      PHE  39   1.479   1.462  -1.501
  332    HZ   PHE  39           HZ       PHE  39   3.312   0.060  -2.410
  333    H    PHE  40           HN       PHE  40  -3.278  -1.572   1.045
  334    HA   PHE  40           HA       PHE  40  -5.398  -3.584   1.082
  335   1HB   PHE  40          HB2       PHE  40  -4.800  -0.930   2.363
  336   2HB   PHE  40          HB1       PHE  40  -6.435  -1.593   2.484
  337    HD1  PHE  40           HD1      PHE  40  -6.375  -4.292   2.971
  338    HD2  PHE  40           HD2      PHE  40  -3.395  -1.429   4.143
  339    HE1  PHE  40           HE1      PHE  40  -5.626  -5.814   4.781
  340    HE2  PHE  40           HE2      PHE  40  -2.645  -2.950   5.953
  341    HZ   PHE  40           HZ       PHE  40  -3.759  -5.143   6.271
  342    H    CYS  41           HN       CYS  41  -7.279  -3.539  -0.096
  343    HA   CYS  41           HA       CYS  41  -8.021  -1.028  -1.538
  344   1HB   CYS  41          HB2       CYS  41  -6.710  -3.210  -2.666
  345   2HB   CYS  41          HB1       CYS  41  -8.405  -3.500  -3.070
  346    H    LYS  42           HN       LYS  42 -10.307  -1.385  -2.550
  347    HA   LYS  42           HA       LYS  42 -11.960  -3.017  -0.654
  348   1HB   LYS  42          HB2       LYS  42 -13.684  -1.235  -1.084
  349   2HB   LYS  42          HB1       LYS  42 -12.218  -0.636  -0.307
  350   1HG   LYS  42          HG2       LYS  42 -11.359   0.110  -2.499
  351   2HG   LYS  42          HG1       LYS  42 -12.828  -0.484  -3.273
  352   1HD   LYS  42          HD2       LYS  42 -13.370   1.756  -2.961
  353   2HD   LYS  42          HD1       LYS  42 -14.019   1.047  -1.482
  354   1HE   LYS  42          HE2       LYS  42 -12.434   2.043  -0.156
  355   2HE   LYS  42          HE1       LYS  42 -11.158   1.852  -1.375
  356   1HZ   LYS  42          HZ1       LYS  42 -13.451   3.648  -1.856
  357   2HZ   LYS  42          HZ2       LYS  42 -11.914   3.666  -2.580
  358   3HZ   LYS  42          HZ3       LYS  42 -12.107   4.194  -0.976
  359    H    ASN  43           HN       ASN  43 -13.630  -4.244  -1.550
  360    HA   ASN  43           HA       ASN  43 -13.565  -4.530  -4.530
  361   1HB   ASN  43          HB2       ASN  43 -12.934  -6.476  -3.133
  362   2HB   ASN  43          HB1       ASN  43 -14.505  -6.396  -2.326
  363   1HD2  ASN  43          HD21      ASN  43 -13.988  -8.776  -3.608
  364   2HD2  ASN  43          HD22      ASN  43 -14.868  -8.890  -5.055
  365    H    LYS  44           HN       LYS  44 -15.404  -4.055  -5.676
  366    HA   LYS  44           HA       LYS  44 -17.765  -3.043  -4.214
  367   1HB   LYS  44          HB2       LYS  44 -16.428  -2.679  -6.743
  368   2HB   LYS  44          HB1       LYS  44 -18.126  -3.063  -7.032
  369   1HG   LYS  44          HG2       LYS  44 -18.543  -0.884  -6.596
  370   2HG   LYS  44          HG1       LYS  44 -18.230  -1.281  -4.907
  371   1HD   LYS  44          HD2       LYS  44 -16.084  -0.414  -4.954
  372   2HD   LYS  44          HD1       LYS  44 -15.889  -0.716  -6.681
  373   1HE   LYS  44          HE2       LYS  44 -16.263   1.538  -6.873
  374   2HE   LYS  44          HE1       LYS  44 -17.969   1.096  -6.660
  375   1HZ   LYS  44          HZ1       LYS  44 -17.838   1.439  -4.356
  376   2HZ   LYS  44          HZ2       LYS  44 -17.039   2.778  -5.030
  377   3HZ   LYS  44          HZ3       LYS  44 -16.144   1.497  -4.363
  378    H    GLU  45           HN       GLU  45 -16.815  -5.793  -6.210
  379    HA   GLU  45           HA       GLU  45 -19.477  -6.825  -6.679
  380   1HB   GLU  45          HB2       GLU  45 -16.677  -7.502  -7.142
  381   2HB   GLU  45          HB1       GLU  45 -17.631  -8.932  -6.743
  382   1HG   GLU  45          HG2       GLU  45 -18.595  -6.917  -8.774
  383   2HG   GLU  45          HG1       GLU  45 -17.521  -8.241  -9.229
  384    H    LYS  46           HN       LYS  46 -17.062  -7.277  -4.123
  385    HA   LYS  46           HA       LYS  46 -18.949  -9.124  -2.712
  386   1HB   LYS  46          HB2       LYS  46 -15.965  -8.645  -2.465
  387   2HB   LYS  46          HB1       LYS  46 -16.879  -9.808  -1.501
  388   1HG   LYS  46          HG2       LYS  46 -17.476 -10.164  -4.305
  389   2HG   LYS  46          HG1       LYS  46 -15.733 -10.238  -4.044
  390   1HD   LYS  46          HD2       LYS  46 -15.953 -12.312  -3.205
  391   2HD   LYS  46          HD1       LYS  46 -16.978 -11.673  -1.919
  392   1HE   LYS  46          HE2       LYS  46 -18.348 -11.928  -4.525
  393   2HE   LYS  46          HE1       LYS  46 -17.848 -13.469  -3.801
  394   1HZ   LYS  46          HZ1       LYS  46 -20.058 -12.228  -3.061
  395   2HZ   LYS  46          HZ2       LYS  46 -18.969 -11.457  -2.010
  396   3HZ   LYS  46          HZ3       LYS  46 -19.133 -13.147  -1.978
  397    H    LYS  47           HN       LYS  47 -17.700  -5.960  -2.701
  398    HA   LYS  47           HA       LYS  47 -18.004  -4.177  -1.194
  399   1HB   LYS  47          HB2       LYS  47 -19.674  -6.183   0.338
  400   2HB   LYS  47          HB1       LYS  47 -19.820  -4.427   0.367
  401   1HG   LYS  47          HG2       LYS  47 -20.057  -5.754  -2.293
  402   2HG   LYS  47          HG1       LYS  47 -21.402  -5.955  -1.171
  403   1HD   LYS  47          HD2       LYS  47 -20.686  -3.237  -1.004
  404   2HD   LYS  47          HD1       LYS  47 -20.664  -3.628  -2.724
  405   1HE   LYS  47          HE2       LYS  47 -22.939  -4.490  -2.617
  406   2HE   LYS  47          HE1       LYS  47 -22.969  -4.281  -0.854
  407   1HZ   LYS  47          HZ1       LYS  47 -22.192  -1.984  -2.489
  408   2HZ   LYS  47          HZ2       LYS  47 -23.035  -2.028  -1.015
  409   3HZ   LYS  47          HZ3       LYS  47 -23.836  -2.398  -2.466
  410    H    CYS  48           HN       CYS  48 -15.816  -6.212  -0.815
  411    HA   CYS  48           HA       CYS  48 -15.290  -5.623   2.077
  412   1HB   CYS  48          HB2       CYS  48 -13.973  -8.040   1.158
  413   2HB   CYS  48          HB1       CYS  48 -15.028  -7.812   2.546
  414    H    SER  49           HN       SER  49 -12.882  -5.690   2.540
  415    HA   SER  49           HA       SER  49 -11.413  -4.557   0.207
  416   1HB   SER  49          HB2       SER  49  -9.905  -3.745   2.066
  417   2HB   SER  49          HB1       SER  49 -11.562  -3.157   2.164
  418    HG   SER  49           HG       SER  49 -10.277  -5.176   3.661
  419    H    TYR  50           HN       TYR  50  -9.012  -5.119   0.199
  420    HA   TYR  50           HA       TYR  50  -8.242  -7.704   1.369
  421   1HB   TYR  50          HB2       TYR  50  -7.887  -8.660  -0.970
  422   2HB   TYR  50          HB1       TYR  50  -9.575  -8.474  -0.483
  423    HD1  TYR  50           HD1      TYR  50 -10.955  -6.627  -1.383
  424    HD2  TYR  50           HD2      TYR  50  -6.918  -7.275  -2.701
  425    HE1  TYR  50           HE1      TYR  50 -11.355  -5.154  -3.339
  426    HE2  TYR  50           HE2      TYR  50  -7.318  -5.801  -4.655
  427    HH   TYR  50           HH       TYR  50 -10.430  -4.123  -5.085
  428    H    THR  51           HN       THR  51  -5.971  -8.314   0.313
  429    HA   THR  51           HA       THR  51  -4.425  -5.759   0.131
  430    HB   THR  51           HB       THR  51  -2.541  -7.265   0.865
  431    HG1  THR  51           HG1      THR  51  -3.153  -9.326   1.588
  432   1HG2  THR  51          HG21      THR  51  -5.050  -6.873   2.471
  433   2HG2  THR  51          HG22      THR  51  -3.486  -6.076   2.640
  434   3HG2  THR  51          HG23      THR  51  -3.687  -7.744   3.175
  435    H    GLU  52           HN       GLU  52  -2.959  -5.471  -1.551
  436    HA   GLU  52           HA       GLU  52  -3.087  -7.480  -3.780
  437   1HB   GLU  52          HB2       GLU  52  -2.693  -4.469  -3.726
  438   2HB   GLU  52          HB1       GLU  52  -2.592  -5.448  -5.191
  439   1HG   GLU  52          HG2       GLU  52  -5.021  -5.613  -3.419
  440   2HG   GLU  52          HG1       GLU  52  -4.868  -4.315  -4.604
  441    H    ASP  53           HN       ASP  53  -1.251  -8.681  -3.008
  442    HA   ASP  53           HA       ASP  53   1.174  -7.838  -2.012
  443   1HB   ASP  53          HB2       ASP  53   0.737  -9.897  -4.191
  444   2HB   ASP  53          HB1       ASP  53   2.092  -9.848  -3.057
  445    H    ALA  54           HN       ALA  54   3.045  -6.948  -2.798
  446    HA   ALA  54           HA       ALA  54   3.161  -6.163  -5.687
  447   1HB   ALA  54          HB1       ALA  54   3.667  -3.935  -5.066
  448   2HB   ALA  54          HB2       ALA  54   4.099  -4.401  -3.420
  449   3HB   ALA  54          HB3       ALA  54   2.408  -4.392  -3.918
  450    H    GLN  55           HN       GLN  55   5.536  -5.477  -6.208
  451    HA   GLN  55           HA       GLN  55   7.477  -6.971  -4.486
  452   1HB   GLN  55          HB2       GLN  55   6.473  -8.166  -6.588
  453   2HB   GLN  55          HB1       GLN  55   7.553  -7.104  -7.493
  454   1HG   GLN  55          HG2       GLN  55   9.475  -7.933  -6.197
  455   2HG   GLN  55          HG1       GLN  55   8.404  -8.985  -5.271
  456   1HE2  GLN  55          HE21      GLN  55  10.255 -10.457  -6.485
  457   2HE2  GLN  55          HE22      GLN  55   9.705 -11.168  -7.925
  458    H    CYS  56           HN       CYS  56   9.552  -6.059  -4.437
  459    HA   CYS  56           HA       CYS  56   9.814  -3.371  -5.696
  460   1HB   CYS  56          HB2       CYS  56  10.312  -4.486  -3.159
  461   2HB   CYS  56          HB1       CYS  56  11.903  -4.190  -3.856
  462    H    ILE  57           HN       ILE  57  11.708  -2.874  -6.928
  463    HA   ILE  57           HA       ILE  57  13.483  -5.171  -7.642
  464    HB   ILE  57           HB       ILE  57  12.240  -3.264  -9.641
  465   1HG1  ILE  57          HG12      ILE  57  10.516  -4.627  -8.371
  466   2HG1  ILE  57          HG11      ILE  57  10.559  -4.930 -10.109
  467   1HG2  ILE  57          HG21      ILE  57  12.767  -5.435 -11.053
  468   2HG2  ILE  57          HG22      ILE  57  13.898  -5.762  -9.741
  469   3HG2  ILE  57          HG23      ILE  57  14.051  -4.283 -10.689
  470   1HD1  ILE  57          HD11      ILE  57  11.473  -7.034  -9.862
  471   2HD1  ILE  57          HD12      ILE  57  10.581  -6.935  -8.343
  472   3HD1  ILE  57          HD13      ILE  57  12.314  -6.608  -8.372
  473    H    ASP  58           HN       ASP  58  15.277  -4.185  -9.209
  474    HA   ASP  58           HA       ASP  58  17.039  -2.566  -7.873
  475   1HB   ASP  58          HB2       ASP  58  17.139  -3.771 -10.160
  476   2HB   ASP  58          HB1       ASP  58  16.559  -2.245 -10.833
  477    H    GLY  59           HN       GLY  59  16.002  -0.840  -6.725
  478   1HA   GLY  59          HA2       GLY  59  15.069   1.298  -6.434
  479   2HA   GLY  59          HA1       GLY  59  16.046   1.706  -7.843
  480    H    THR  60           HN       THR  60  13.586  -0.710  -8.282
  481    HA   THR  60           HA       THR  60  11.745   1.357  -9.424
  482    HB   THR  60           HB       THR  60  12.639  -1.200 -10.774
  483    HG1  THR  60           HG1      THR  60  13.876   0.139 -12.054
  484   1HG2  THR  60          HG21      THR  60  10.315  -0.096 -11.220
  485   2HG2  THR  60          HG22      THR  60  11.317  -0.565 -12.594
  486   3HG2  THR  60          HG23      THR  60  11.255   1.122 -12.083
  487    H    ILE  61           HN       ILE  61   9.592   0.883  -9.080
  488    HA   ILE  61           HA       ILE  61   8.788  -1.880  -8.353
  489    HB   ILE  61           HB       ILE  61   9.318  -1.051  -6.205
  490   1HG1  ILE  61          HG12      ILE  61   6.630   0.002  -5.892
  491   2HG1  ILE  61          HG11      ILE  61   6.626  -1.439  -6.909
  492   1HG2  ILE  61          HG21      ILE  61   8.449   1.544  -7.381
  493   2HG2  ILE  61          HG22      ILE  61   9.821   1.188  -6.332
  494   3HG2  ILE  61          HG23      ILE  61   8.203   1.330  -5.648
  495   1HD1  ILE  61          HD11      ILE  61   6.727  -1.408  -4.126
  496   2HD1  ILE  61          HD12      ILE  61   8.394  -1.728  -4.603
  497   3HD1  ILE  61          HD13      ILE  61   7.099  -2.788  -5.160
  498    H    GLU  62           HN       GLU  62   6.669  -2.296  -8.976
  499    HA   GLU  62           HA       GLU  62   5.264  -0.101 -10.420
  500   1HB   GLU  62          HB2       GLU  62   4.694  -3.077 -10.348
  501   2HB   GLU  62          HB1       GLU  62   4.158  -1.915 -11.564
  502   1HG   GLU  62          HG2       GLU  62   7.016  -2.762 -11.015
  503   2HG   GLU  62          HG1       GLU  62   6.061  -3.154 -12.446
  504    H    VAL  63           HN       VAL  63   3.470   0.818  -9.514
  505    HA   VAL  63           HA       VAL  63   2.419  -0.232  -6.977
  506    HB   VAL  63           HB       VAL  63   1.681   2.142  -8.714
  507   1HG1  VAL  63          HG11      VAL  63   0.192   1.051  -6.684
  508   2HG1  VAL  63          HG12      VAL  63   0.158   2.754  -7.142
  509   3HG1  VAL  63          HG13      VAL  63   1.183   2.218  -5.811
  510   1HG2  VAL  63          HG21      VAL  63   4.062   1.763  -7.498
  511   2HG2  VAL  63          HG22      VAL  63   3.151   2.424  -6.141
  512   3HG2  VAL  63          HG23      VAL  63   3.309   3.352  -7.632
  513    HA   PRO  64           HA       PRO  64  -0.752  -2.620  -9.015
  514   1HB   PRO  64          HB2       PRO  64  -2.384  -2.484  -6.645
  515   2HB   PRO  64          HB1       PRO  64  -1.397  -3.837  -7.215
  516   1HG   PRO  64          HG2       PRO  64  -0.895  -2.128  -4.970
  517   2HG   PRO  64          HG1       PRO  64   0.100  -3.460  -5.561
  518   1HD   PRO  64          HD2       PRO  64   0.644  -0.627  -5.733
  519   2HD   PRO  64          HD1       PRO  64   1.656  -1.974  -6.311
  520    H    LYS  65           HN       LYS  65  -2.287  -1.769 -10.370
  521    HA   LYS  65           HA       LYS  65  -3.199   0.858 -10.442
  522   1HB   LYS  65          HB2       LYS  65  -3.873  -1.733 -11.576
  523   2HB   LYS  65          HB1       LYS  65  -5.310  -0.726 -11.396
  524   1HG   LYS  65          HG2       LYS  65  -4.172   1.116 -12.581
  525   2HG   LYS  65          HG1       LYS  65  -2.738   0.108 -12.769
  526   1HD   LYS  65          HD2       LYS  65  -3.629  -0.981 -14.535
  527   2HD   LYS  65          HD1       LYS  65  -5.147  -1.258 -13.681
  528   1HE   LYS  65          HE2       LYS  65  -5.750   1.164 -14.170
  529   2HE   LYS  65          HE1       LYS  65  -4.341   1.210 -15.249
  530   1HZ   LYS  65          HZ1       LYS  65  -5.244  -0.869 -16.276
  531   2HZ   LYS  65          HZ2       LYS  65  -6.175   0.523 -16.560
  532   3HZ   LYS  65          HZ3       LYS  65  -6.676  -0.615 -15.402
  533    H    CYS  66           HN       CYS  66  -4.322  -1.735  -8.359
  534    HA   CYS  66           HA       CYS  66  -6.885  -0.683  -7.641
  535   1HB   CYS  66          HB2       CYS  66  -5.554  -2.944  -7.161
  536   2HB   CYS  66          HB1       CYS  66  -5.137  -2.104  -5.667
  537    H    PHE  67           HN       PHE  67  -3.618   0.118  -6.603
  538    HA   PHE  67           HA       PHE  67  -4.114   1.470  -4.175
  539   1HB   PHE  67          HB2       PHE  67  -1.911   0.931  -5.228
  540   2HB   PHE  67          HB1       PHE  67  -2.197   2.207  -6.412
  541    HD1  PHE  67           HD1      PHE  67  -2.017   4.543  -5.819
  542    HD2  PHE  67           HD2      PHE  67  -1.589   1.483  -2.835
  543    HE1  PHE  67           HE1      PHE  67  -1.138   6.223  -4.223
  544    HE2  PHE  67           HE2      PHE  67  -0.710   3.164  -1.238
  545    HZ   PHE  67           HZ       PHE  67  -0.484   5.535  -1.931
  546    H    LYS  68           HN       LYS  68  -4.157   3.896  -3.873
  547    HA   LYS  68           HA       LYS  68  -5.086   5.579  -6.072
  548   1HB   LYS  68          HB2       LYS  68  -7.357   5.900  -4.916
  549   2HB   LYS  68          HB1       LYS  68  -7.122   4.362  -5.747
  550   1HG   LYS  68          HG2       LYS  68  -7.533   3.285  -3.818
  551   2HG   LYS  68          HG1       LYS  68  -6.105   4.043  -3.113
  552   1HD   LYS  68          HD2       LYS  68  -7.367   5.896  -2.297
  553   2HD   LYS  68          HD1       LYS  68  -8.772   5.456  -3.269
  554   1HE   LYS  68          HE2       LYS  68  -9.542   4.297  -1.478
  555   2HE   LYS  68          HE1       LYS  68  -8.182   3.177  -1.694
  556   1HZ   LYS  68          HZ1       LYS  68  -8.049   4.151   0.487
  557   2HZ   LYS  68          HZ2       LYS  68  -8.154   5.721  -0.156
  558   3HZ   LYS  68          HZ3       LYS  68  -6.783   4.764  -0.461
  559    H    GLU  69           HN       GLU  69  -3.707   7.238  -5.413
  560    HA   GLU  69           HA       GLU  69  -3.139   7.954  -2.698
  561   1HB   GLU  69          HB2       GLU  69  -2.469   8.726  -5.365
  562   2HB   GLU  69          HB1       GLU  69  -2.921  10.186  -4.486
  563   1HG   GLU  69          HG2       GLU  69  -1.025   8.151  -3.311
  564   2HG   GLU  69          HG1       GLU  69  -0.456   9.468  -4.338
  565    H    HIS  70           HN       HIS  70  -5.847   8.639  -4.765
  566    HA   HIS  70           HA       HIS  70  -6.809  10.741  -2.855
  567   1HB   HIS  70          HB2       HIS  70  -6.443  11.377  -5.237
  568   2HB   HIS  70          HB1       HIS  70  -7.595  10.134  -5.724
  569    HD1  HIS  70           HD1      HIS  70  -9.654  11.384  -6.407
  570    HD2  HIS  70           HD2      HIS  70  -8.065  12.854  -2.844
  571    HE1  HIS  70           HE1      HIS  70 -11.284  13.128  -5.562
  572    H    SER  71           HN       SER  71  -8.739  10.362  -1.784
  573    HA   SER  71           HA       SER  71 -10.433   8.061  -2.657
  574   1HB   SER  71          HB2       SER  71 -10.408   7.885   0.102
  575   2HB   SER  71          HB1       SER  71  -9.435   6.887  -0.982
  576    HG   SER  71           HG       SER  71  -8.723   9.042   0.618
  577    H    SER  72           HN       SER  72 -10.529   9.921   0.364
  578    HA   SER  72           HA       SER  72 -12.712  11.648  -0.605
  579   1HB   SER  72          HB2       SER  72 -13.224   9.618   1.583
  580   2HB   SER  72          HB1       SER  72 -14.404  10.653   0.784
  581    HG   SER  72           HG       SER  72 -13.458   8.236   0.052
  582    H    LEU  73           HN       LEU  73 -11.829  10.337   2.610
  583    HA   LEU  73           HA       LEU  73 -10.879  13.065   3.392
  584   1HB   LEU  73          HB2       LEU  73 -13.044  11.335   4.577
  585   2HB   LEU  73          HB1       LEU  73 -12.186  12.503   5.587
  586    HG   LEU  73           HG       LEU  73 -13.248  13.433   2.948
  587   1HD1  LEU  73          HD11      LEU  73 -15.077  12.102   4.088
  588   2HD1  LEU  73          HD12      LEU  73 -15.455  13.807   3.842
  589   3HD1  LEU  73          HD13      LEU  73 -14.965  13.234   5.436
  590   1HD2  LEU  73          HD21      LEU  73 -12.212  15.201   3.995
  591   2HD2  LEU  73          HD22      LEU  73 -12.475  14.533   5.607
  592   3HD2  LEU  73          HD23      LEU  73 -13.792  15.353   4.766
  593    H    ALA  74           HN       ALA  74 -10.148  12.677   5.936
  594    HA   ALA  74           HA       ALA  74  -7.920  10.777   5.748
  595   1HB   ALA  74          HB1       ALA  74  -8.777  12.374   8.161
  596   2HB   ALA  74          HB2       ALA  74  -8.038  13.165   6.769
  597   3HB   ALA  74          HB3       ALA  74  -7.144  11.935   7.662
  598    H    PHE  75           HN       PHE  75 -10.286  11.295   8.388
  599    HA   PHE  75           HA       PHE  75 -10.446   8.313   8.682
  600   1HB   PHE  75          HB2       PHE  75 -11.086   9.553  11.147
  601   2HB   PHE  75          HB1       PHE  75  -9.636   8.633  10.768
  602    HD1  PHE  75           HD1      PHE  75  -7.587   9.807   9.948
  603    HD2  PHE  75           HD2      PHE  75 -11.049  11.952  11.313
  604    HE1  PHE  75           HE1      PHE  75  -6.225  11.867  10.166
  605    HE2  PHE  75           HE2      PHE  75  -9.686  14.014  11.529
  606    HZ   PHE  75           HZ       PHE  75  -7.273  13.970  10.956
  607    H    TRP  76           HN       TRP  76 -12.177  10.574   7.370
  608    HA   TRP  76           HA       TRP  76 -14.691  10.342   8.903
  609   1HB   TRP  76          HB2       TRP  76 -13.487  12.023   6.855
  610   2HB   TRP  76          HB1       TRP  76 -15.148  11.587   6.446
  611    HD1  TRP  76           HD1      TRP  76 -17.052  12.188   8.260
  612    HE1  TRP  76           HE1      TRP  76 -17.153  14.068  10.025
  613    HE3  TRP  76           HE3      TRP  76 -12.123  13.454   8.460
  614    HZ2  TRP  76           HZ2      TRP  76 -15.363  15.873  11.348
  615    HZ3  TRP  76           HZ3      TRP  76 -11.339  15.254   9.978
  616    HH2  TRP  76           HH2      TRP  76 -12.952  16.461  11.422
  617    H    LYS  77           HN       LYS  77 -13.165   8.959   6.056
  618    HA   LYS  77           HA       LYS  77 -15.639   7.323   5.583
  619   1HB   LYS  77          HB2       LYS  77 -13.680   8.698   3.755
  620   2HB   LYS  77          HB1       LYS  77 -14.581   7.294   3.180
  621   1HG   LYS  77          HG2       LYS  77 -16.184   9.352   4.589
  622   2HG   LYS  77          HG1       LYS  77 -15.526   9.835   3.025
  623   1HD   LYS  77          HD2       LYS  77 -16.426   7.523   2.208
  624   2HD   LYS  77          HD1       LYS  77 -17.430   7.592   3.657
  625   1HE   LYS  77          HE2       LYS  77 -17.901  10.075   2.742
  626   2HE   LYS  77          HE1       LYS  77 -17.551   9.276   1.196
  627   1HZ   LYS  77          HZ1       LYS  77 -19.896   9.042   1.827
  628   2HZ   LYS  77          HZ2       LYS  77 -19.432   8.257   3.261
  629   3HZ   LYS  77          HZ3       LYS  77 -19.113   7.540   1.755
  630    H    THR  78           HN       THR  78 -15.284   5.156   5.876
  631    HA   THR  78           HA       THR  78 -12.772   4.049   6.649
  632    HB   THR  78           HB       THR  78 -14.830   2.338   5.340
  633    HG1  THR  78           HG1      THR  78 -16.306   3.589   6.212
  634   1HG2  THR  78          HG21      THR  78 -13.328   1.092   6.598
  635   2HG2  THR  78          HG22      THR  78 -14.599   1.372   7.789
  636   3HG2  THR  78          HG23      THR  78 -13.137   2.358   7.811
  637    H    ASP  79           HN       ASP  79 -11.059   4.254   5.197
  638    HA   ASP  79           HA       ASP  79 -11.435   3.789   2.316
  639   1HB   ASP  79          HB2       ASP  79  -9.457   4.887   4.179
  640   2HB   ASP  79          HB1       ASP  79  -8.716   3.929   2.897
  641    H    ALA  80           HN       ALA  80  -9.781   2.234   1.256
  642    HA   ALA  80           HA       ALA  80 -10.261  -0.445   1.935
  643   1HB   ALA  80          HB1       ALA  80  -9.292  -0.370  -0.117
  644   2HB   ALA  80          HB2       ALA  80  -7.754  -0.414   0.743
  645   3HB   ALA  80          HB3       ALA  80  -8.447   1.132   0.256
  646    H    SER  81           HN       SER  81  -7.379   1.508   2.760
  647    HA   SER  81           HA       SER  81  -5.943  -0.418   4.237
  648   1HB   SER  81          HB2       SER  81  -4.741   1.472   5.037
  649   2HB   SER  81          HB1       SER  81  -5.371   1.974   3.471
  650    HG   SER  81           HG       SER  81  -6.332   2.592   6.062
  651    H    ASP  82           HN       ASP  82  -8.959   1.079   5.040
  652    HA   ASP  82           HA       ASP  82  -8.686   0.083   7.857
  653   1HB   ASP  82          HB2       ASP  82 -10.124   2.493   6.721
  654   2HB   ASP  82          HB1       ASP  82 -10.240   1.977   8.404
  655    H    VAL  83           HN       VAL  83  -9.791  -1.293   5.409
  656    HA   VAL  83           HA       VAL  83 -12.669  -1.514   6.221
  657    HB   VAL  83           HB       VAL  83 -11.175  -2.193   3.675
  658   1HG1  VAL  83          HG11      VAL  83 -12.948  -3.815   3.973
  659   2HG1  VAL  83          HG12      VAL  83 -13.487  -2.634   2.777
  660   3HG1  VAL  83          HG13      VAL  83 -14.087  -2.550   4.433
  661   1HG2  VAL  83          HG21      VAL  83 -11.791  -0.134   2.957
  662   2HG2  VAL  83          HG22      VAL  83 -12.205   0.227   4.632
  663   3HG2  VAL  83          HG23      VAL  83 -13.444  -0.363   3.526
  664    H    LYS  84           HN       LYS  84 -13.566  -3.704   6.327
  665    HA   LYS  84           HA       LYS  84 -11.689  -5.632   7.491
  666   1HB   LYS  84          HB2       LYS  84 -13.961  -5.171   8.379
  667   2HB   LYS  84          HB1       LYS  84 -14.658  -5.767   6.870
  668   1HG   LYS  84          HG2       LYS  84 -13.691  -7.979   7.255
  669   2HG   LYS  84          HG1       LYS  84 -12.891  -7.400   8.717
  670   1HD   LYS  84          HD2       LYS  84 -15.535  -6.672   9.122
  671   2HD   LYS  84          HD1       LYS  84 -15.668  -8.242   8.328
  672   1HE   LYS  84          HE2       LYS  84 -13.636  -7.986  10.508
  673   2HE   LYS  84          HE1       LYS  84 -15.345  -8.072  10.979
  674   1HZ   LYS  84          HZ1       LYS  84 -14.416  -9.886   8.883
  675   2HZ   LYS  84          HZ2       LYS  84 -15.601 -10.126  10.075
  676   3HZ   LYS  84          HZ3       LYS  84 -13.954 -10.242  10.474
  677    HA   PRO  85           HA       PRO  85 -10.894  -7.689   3.618
  678   1HB   PRO  85          HB2       PRO  85 -10.273 -10.130   5.014
  679   2HB   PRO  85          HB1       PRO  85  -9.147  -8.953   4.323
  680   1HG   PRO  85          HG2       PRO  85  -9.685  -9.448   7.096
  681   2HG   PRO  85          HG1       PRO  85  -8.581  -8.257   6.400
  682   1HD   PRO  85          HD2       PRO  85 -11.121  -7.781   7.698
  683   2HD   PRO  85          HD1       PRO  85  -9.995  -6.580   7.021
  684    H    CYS  86           HN       CYS  86 -12.272  -8.859   2.277
  685    HA   CYS  86           HA       CYS  86 -14.877  -9.575   2.907
  686   1HB   CYS  86          HB2       CYS  86 -13.299  -9.656   0.712
  687   2HB   CYS  86          HB1       CYS  86 -13.392 -11.382   1.066
  Start of MODEL   19
    1   1H    THR   1          HT1       THR   1  22.754  -5.569 -10.474
    2   2H    THR   1          HT2       THR   1  24.159  -4.673 -10.805
    3   3H    THR   1          HT3       THR   1  22.629  -3.956 -10.982
    4    HA   THR   1           HA       THR   1  23.775  -4.891  -8.397
    5    HB   THR   1           HB       THR   1  23.960  -2.389  -8.057
    6    HG1  THR   1           HG1      THR   1  24.089  -1.440 -10.372
    7   1HG2  THR   1          HG21      THR   1  26.028  -2.195  -9.259
    8   2HG2  THR   1          HG22      THR   1  25.511  -3.386 -10.454
    9   3HG2  THR   1          HG23      THR   1  25.857  -3.890  -8.800
   10    H    LYS   2           HN       LYS   2  21.813  -5.761  -7.599
   11    HA   LYS   2           HA       LYS   2  19.189  -4.847  -8.002
   12   1HB   LYS   2          HB2       LYS   2  20.659  -6.157  -5.716
   13   2HB   LYS   2          HB1       LYS   2  18.931  -5.818  -5.597
   14   1HG   LYS   2          HG2       LYS   2  18.386  -7.469  -7.059
   15   2HG   LYS   2          HG1       LYS   2  19.732  -7.086  -8.134
   16   1HD   LYS   2          HD2       LYS   2  20.107  -9.295  -7.199
   17   2HD   LYS   2          HD1       LYS   2  21.277  -8.183  -6.486
   18   1HE   LYS   2          HE2       LYS   2  20.096  -8.083  -4.424
   19   2HE   LYS   2          HE1       LYS   2  18.631  -8.786  -5.141
   20   1HZ   LYS   2          HZ1       LYS   2  21.261 -10.159  -4.953
   21   2HZ   LYS   2          HZ2       LYS   2  19.822 -10.822  -5.567
   22   3HZ   LYS   2          HZ3       LYS   2  19.949 -10.444  -3.915
   23    H    ALA   3           HN       ALA   3  18.871  -2.598  -7.941
   24    HA   ALA   3           HA       ALA   3  19.894  -1.006  -5.674
   25   1HB   ALA   3          HB1       ALA   3  19.460  -0.543  -8.324
   26   2HB   ALA   3          HB2       ALA   3  19.539   0.741  -7.116
   27   3HB   ALA   3          HB3       ALA   3  17.974   0.116  -7.637
   28    H    SER   4           HN       SER   4  18.581  -0.157  -4.030
   29    HA   SER   4           HA       SER   4  16.216  -1.521  -3.243
   30   1HB   SER   4          HB2       SER   4  16.483  -0.178  -1.416
   31   2HB   SER   4          HB1       SER   4  17.975   0.323  -2.207
   32    HG   SER   4           HG       SER   4  16.361   2.001  -1.546
   33    H    CYS   5           HN       CYS   5  14.334   0.481  -2.667
   34    HA   CYS   5           HA       CYS   5  13.430   1.307  -5.409
   35   1HB   CYS   5          HB2       CYS   5  11.688   0.654  -3.028
   36   2HB   CYS   5          HB1       CYS   5  11.213   0.737  -4.724
   37    H    LYS   6           HN       LYS   6  11.295   2.894  -4.669
   38    HA   LYS   6           HA       LYS   6  12.399   4.951  -2.801
   39   1HB   LYS   6          HB2       LYS   6  12.784   5.176  -5.429
   40   2HB   LYS   6          HB1       LYS   6  11.127   5.779  -5.382
   41   1HG   LYS   6          HG2       LYS   6  13.359   6.831  -3.622
   42   2HG   LYS   6          HG1       LYS   6  12.859   7.584  -5.137
   43   1HD   LYS   6          HD2       LYS   6  10.448   7.378  -3.954
   44   2HD   LYS   6          HD1       LYS   6  11.459   7.497  -2.512
   45   1HE   LYS   6          HE2       LYS   6  12.330   9.619  -3.163
   46   2HE   LYS   6          HE1       LYS   6  11.740   9.434  -4.826
   47   1HZ   LYS   6          HZ1       LYS   6  10.317  10.279  -2.473
   48   2HZ   LYS   6          HZ2       LYS   6   9.516   9.041  -3.317
   49   3HZ   LYS   6          HZ3       LYS   6   9.920  10.490  -4.108
   50    H    LEU   7           HN       LEU   7  10.792   4.979  -1.261
   51    HA   LEU   7           HA       LEU   7   8.173   4.177  -1.298
   52   1HB   LEU   7          HB2       LEU   7   7.823   6.026   0.386
   53   2HB   LEU   7          HB1       LEU   7   9.285   5.073   0.661
   54    HG   LEU   7           HG       LEU   7   9.773   7.298  -1.157
   55   1HD1  LEU   7          HD11      LEU   7   8.052   8.457   0.088
   56   2HD1  LEU   7          HD12      LEU   7   9.615   9.040   0.657
   57   3HD1  LEU   7          HD13      LEU   7   8.705   7.877   1.620
   58   1HD2  LEU   7          HD21      LEU   7  11.795   7.120  -0.160
   59   2HD2  LEU   7          HD22      LEU   7  11.140   5.733   0.711
   60   3HD2  LEU   7          HD23      LEU   7  11.094   7.337   1.444
   61    HA   PRO   8           HA       PRO   8   6.800   6.851  -4.745
   62   1HB   PRO   8          HB2       PRO   8   4.390   5.278  -4.751
   63   2HB   PRO   8          HB1       PRO   8   5.707   5.256  -5.931
   64   1HG   PRO   8          HG2       PRO   8   5.044   3.237  -4.012
   65   2HG   PRO   8          HG1       PRO   8   6.388   3.242  -5.158
   66   1HD   PRO   8          HD2       PRO   8   6.488   3.602  -2.285
   67   2HD   PRO   8          HD1       PRO   8   7.847   3.543  -3.434
   68    H    VAL   9           HN       VAL   9   5.327   5.995  -1.696
   69    HA   VAL   9           HA       VAL   9   3.674   8.495  -1.831
   70    HB   VAL   9           HB       VAL   9   2.937   5.937  -0.395
   71   1HG1  VAL   9          HG11      VAL   9   1.725   8.587  -0.853
   72   2HG1  VAL   9          HG12      VAL   9   1.410   7.411   0.423
   73   3HG1  VAL   9          HG13      VAL   9   0.639   7.230  -1.152
   74   1HG2  VAL   9          HG21      VAL   9   1.313   5.842  -2.496
   75   2HG2  VAL   9          HG22      VAL   9   2.928   5.139  -2.578
   76   3HG2  VAL   9          HG23      VAL   9   2.624   6.733  -3.268
   77    H    LYS  10           HN       LYS  10   2.947   9.010   0.581
   78    HA   LYS  10           HA       LYS  10   5.342   8.659   2.358
   79   1HB   LYS  10          HB2       LYS  10   3.514  11.020   1.836
   80   2HB   LYS  10          HB1       LYS  10   4.684  10.980   3.156
   81   1HG   LYS  10          HG2       LYS  10   6.394  10.342   1.282
   82   2HG   LYS  10          HG1       LYS  10   5.185  11.023   0.191
   83   1HD   LYS  10          HD2       LYS  10   5.341  12.889   2.252
   84   2HD   LYS  10          HD1       LYS  10   7.015  12.393   2.005
   85   1HE   LYS  10          HE2       LYS  10   6.716  14.168   0.451
   86   2HE   LYS  10          HE1       LYS  10   6.495  12.710  -0.536
   87   1HZ   LYS  10          HZ1       LYS  10   4.311  13.085  -0.754
   88   2HZ   LYS  10          HZ2       LYS  10   4.667  14.682  -0.298
   89   3HZ   LYS  10          HZ3       LYS  10   4.120  13.566   0.860
   90    H    LYS  11           HN       LYS  11   2.345   7.532   2.035
   91    HA   LYS  11           HA       LYS  11   1.960   7.178   4.932
   92   1HB   LYS  11          HB2       LYS  11   0.600   9.207   3.338
   93   2HB   LYS  11          HB1       LYS  11  -0.548   8.102   4.095
   94   1HG   LYS  11          HG2       LYS  11   0.575   8.473   6.282
   95   2HG   LYS  11          HG1       LYS  11   1.652   9.637   5.510
   96   1HD   LYS  11          HD2       LYS  11  -0.702  10.645   4.691
   97   2HD   LYS  11          HD1       LYS  11  -1.236   9.890   6.193
   98   1HE   LYS  11          HE2       LYS  11   0.956  11.083   7.154
   99   2HE   LYS  11          HE1       LYS  11   0.644  12.182   5.796
  100   1HZ   LYS  11          HZ1       LYS  11  -1.561  12.539   6.524
  101   2HZ   LYS  11          HZ2       LYS  11  -0.585  12.720   7.904
  102   3HZ   LYS  11          HZ3       LYS  11  -1.473  11.292   7.671
  103    H    ALA  12           HN       ALA  12   2.433   5.375   2.704
  104    HA   ALA  12           HA       ALA  12  -0.174   4.116   2.098
  105   1HB   ALA  12          HB1       ALA  12   1.103   3.830   0.238
  106   2HB   ALA  12          HB2       ALA  12   1.852   2.503   1.128
  107   3HB   ALA  12          HB3       ALA  12   2.602   4.099   1.129
  108    H    THR  13           HN       THR  13  -0.994   2.485   3.351
  109    HA   THR  13           HA       THR  13   0.785   1.215   5.388
  110    HB   THR  13           HB       THR  13  -2.211   0.965   5.184
  111    HG1  THR  13           HG1      THR  13  -1.169   3.022   6.705
  112   1HG2  THR  13          HG21      THR  13  -1.924   1.028   7.702
  113   2HG2  THR  13          HG22      THR  13  -0.183   0.987   7.429
  114   3HG2  THR  13          HG23      THR  13  -1.188  -0.362   6.905
  115    H    VAL  14           HN       VAL  14   1.759  -0.518   4.286
  116    HA   VAL  14           HA       VAL  14   0.008  -2.343   2.702
  117    HB   VAL  14           HB       VAL  14   2.236  -3.220   1.951
  118   1HG1  VAL  14          HG11      VAL  14   1.108  -1.378   0.740
  119   2HG1  VAL  14          HG12      VAL  14   2.862  -1.207   0.679
  120   3HG1  VAL  14          HG13      VAL  14   1.917  -0.207   1.781
  121   1HG2  VAL  14          HG21      VAL  14   3.483  -0.879   3.374
  122   2HG2  VAL  14          HG22      VAL  14   4.251  -2.345   2.765
  123   3HG2  VAL  14          HG23      VAL  14   3.270  -2.408   4.227
  124    H    VAL  15           HN       VAL  15   1.056  -4.754   2.958
  125    HA   VAL  15           HA       VAL  15   1.135  -5.331   5.904
  126    HB   VAL  15           HB       VAL  15  -0.132  -6.870   3.612
  127   1HG1  VAL  15          HG11      VAL  15   0.431  -7.516   6.466
  128   2HG1  VAL  15          HG12      VAL  15   0.326  -8.589   5.070
  129   3HG1  VAL  15          HG13      VAL  15  -1.145  -7.992   5.836
  130   1HG2  VAL  15          HG21      VAL  15  -1.982  -5.652   4.027
  131   2HG2  VAL  15          HG22      VAL  15  -1.054  -4.673   5.164
  132   3HG2  VAL  15          HG23      VAL  15  -1.918  -6.102   5.731
  133    H    TYR  16           HN       TYR  16   3.484  -5.425   5.854
  134    HA   TYR  16           HA       TYR  16   4.838  -7.242   3.987
  135   1HB   TYR  16          HB2       TYR  16   5.563  -4.995   5.238
  136   2HB   TYR  16          HB1       TYR  16   6.101  -6.142   6.466
  137    HD1  TYR  16           HD1      TYR  16   6.852  -4.623   3.296
  138    HD2  TYR  16           HD2      TYR  16   7.607  -8.089   5.718
  139    HE1  TYR  16           HE1      TYR  16   8.866  -5.131   1.941
  140    HE2  TYR  16           HE2      TYR  16   9.621  -8.597   4.362
  141    HH   TYR  16           HH       TYR  16  10.203  -7.593   1.493
  142    H    GLN  17           HN       GLN  17   4.961  -9.415   4.347
  143    HA   GLN  17           HA       GLN  17   4.957 -11.483   5.481
  144   1HB   GLN  17          HB2       GLN  17   6.386  -9.497   7.222
  145   2HB   GLN  17          HB1       GLN  17   6.133 -11.141   7.817
  146   1HG   GLN  17          HG2       GLN  17   7.163 -12.002   5.696
  147   2HG   GLN  17          HG1       GLN  17   7.544 -10.337   5.257
  148   1HE2  GLN  17          HE21      GLN  17   8.070  -9.635   8.166
  149   2HE2  GLN  17          HE22      GLN  17   9.591 -10.308   8.506
  150    H    GLY  18           HN       GLY  18   2.542  -9.782   5.734
  151   1HA   GLY  18          HA2       GLY  18   0.488 -10.125   6.862
  152   2HA   GLY  18          HA1       GLY  18   1.326 -11.188   7.992
  153    H    GLU  19           HN       GLU  19   3.121  -8.398   7.797
  154    HA   GLU  19           HA       GLU  19   1.879  -7.374  10.314
  155   1HB   GLU  19          HB2       GLU  19   4.605  -7.225   9.020
  156   2HB   GLU  19          HB1       GLU  19   4.174  -6.181  10.375
  157   1HG   GLU  19          HG2       GLU  19   3.962  -7.971  11.863
  158   2HG   GLU  19          HG1       GLU  19   3.701  -9.142  10.570
  159    H    ARG  20           HN       ARG  20   0.677  -5.531  10.144
  160    HA   ARG  20           HA       ARG  20   0.575  -3.984   7.679
  161   1HB   ARG  20          HB2       ARG  20  -0.650  -3.892  10.429
  162   2HB   ARG  20          HB1       ARG  20  -0.885  -2.539   9.317
  163   1HG   ARG  20          HG2       ARG  20  -2.406  -3.698   8.123
  164   2HG   ARG  20          HG1       ARG  20  -1.309  -5.069   7.961
  165   1HD   ARG  20          HD2       ARG  20  -2.220  -6.183   9.761
  166   2HD   ARG  20          HD1       ARG  20  -2.580  -4.680  10.636
  167    HE   ARG  20           HE       ARG  20  -4.268  -4.449   8.531
  168   1HH1  ARG  20          HH21      ARG  20  -3.906  -7.482   8.247
  169   2HH1  ARG  20          HH22      ARG  20  -5.282  -8.057   9.127
  170   1HH2  ARG  20          HH11      ARG  20  -5.889  -5.016  10.680
  171   2HH2  ARG  20          HH12      ARG  20  -6.406  -6.660  10.505
  172    H    VAL  21           HN       VAL  21   1.824  -2.213   7.190
  173    HA   VAL  21           HA       VAL  21   2.960  -0.542   9.355
  174    HB   VAL  21           HB       VAL  21   5.267  -0.895   8.374
  175   1HG1  VAL  21          HG11      VAL  21   5.662  -2.924   9.580
  176   2HG1  VAL  21          HG12      VAL  21   4.007  -3.478   9.324
  177   3HG1  VAL  21          HG13      VAL  21   4.326  -2.121  10.405
  178   1HG2  VAL  21          HG21      VAL  21   4.188  -1.834   6.202
  179   2HG2  VAL  21          HG22      VAL  21   4.088  -3.356   7.086
  180   3HG2  VAL  21          HG23      VAL  21   5.657  -2.606   6.796
  181    H    LYS  22           HN       LYS  22   4.171   1.362   8.341
  182    HA   LYS  22           HA       LYS  22   2.721   2.244   5.892
  183   1HB   LYS  22          HB2       LYS  22   3.057   3.428   8.273
  184   2HB   LYS  22          HB1       LYS  22   4.537   3.996   7.499
  185   1HG   LYS  22          HG2       LYS  22   2.760   5.615   7.099
  186   2HG   LYS  22          HG1       LYS  22   3.168   4.819   5.579
  187   1HD   LYS  22          HD2       LYS  22   0.933   4.445   5.417
  188   2HD   LYS  22          HD1       LYS  22   1.234   3.145   6.572
  189   1HE   LYS  22          HE2       LYS  22   0.729   5.952   7.560
  190   2HE   LYS  22          HE1       LYS  22  -0.626   4.879   7.156
  191   1HZ   LYS  22          HZ1       LYS  22   1.364   4.633   9.274
  192   2HZ   LYS  22          HZ2       LYS  22   0.914   3.195   8.490
  193   3HZ   LYS  22          HZ3       LYS  22  -0.262   4.152   9.257
  194    H    ILE  23           HN       ILE  23   3.864   1.661   4.054
  195    HA   ILE  23           HA       ILE  23   6.578   1.057   3.782
  196    HB   ILE  23           HB       ILE  23   4.721   0.817   2.103
  197   1HG1  ILE  23          HG12      ILE  23   7.215   2.272   1.159
  198   2HG1  ILE  23          HG11      ILE  23   7.070   0.533   1.424
  199   1HG2  ILE  23          HG21      ILE  23   4.118   3.353   2.530
  200   2HG2  ILE  23          HG22      ILE  23   3.865   2.642   0.936
  201   3HG2  ILE  23          HG23      ILE  23   5.289   3.637   1.244
  202   1HD1  ILE  23          HD11      ILE  23   5.944   0.205  -0.526
  203   2HD1  ILE  23          HD12      ILE  23   6.643   1.758  -0.985
  204   3HD1  ILE  23          HD13      ILE  23   5.002   1.685  -0.342
  205    H    GLN  24           HN       GLN  24   5.045   4.243   3.913
  206    HA   GLN  24           HA       GLN  24   7.358   5.753   3.051
  207   1HB   GLN  24          HB2       GLN  24   6.028   7.638   3.827
  208   2HB   GLN  24          HB1       GLN  24   4.943   6.474   3.058
  209   1HG   GLN  24          HG2       GLN  24   3.736   6.500   4.963
  210   2HG   GLN  24          HG1       GLN  24   5.075   5.640   5.723
  211   1HE2  GLN  24          HE21      GLN  24   3.958   7.102   7.585
  212   2HE2  GLN  24          HE22      GLN  24   4.712   8.600   7.838
  213    H    GLU  25           HN       GLU  25   6.762   3.969   5.858
  214    HA   GLU  25           HA       GLU  25   8.635   5.664   7.475
  215   1HB   GLU  25          HB2       GLU  25   6.474   3.667   8.200
  216   2HB   GLU  25          HB1       GLU  25   7.561   4.392   9.384
  217   1HG   GLU  25          HG2       GLU  25   6.108   6.214   7.511
  218   2HG   GLU  25          HG1       GLU  25   5.198   5.490   8.838
  219    H    LYS  26           HN       LYS  26   7.687   2.214   7.249
  220    HA   LYS  26           HA       LYS  26  10.076   1.107   8.272
  221   1HB   LYS  26          HB2       LYS  26   7.766   0.093   7.667
  222   2HB   LYS  26          HB1       LYS  26   8.438  -0.113   6.047
  223   1HG   LYS  26          HG2       LYS  26   9.780  -1.825   6.695
  224   2HG   LYS  26          HG1       LYS  26  10.220  -1.027   8.204
  225   1HD   LYS  26          HD2       LYS  26   8.381  -1.882   9.352
  226   2HD   LYS  26          HD1       LYS  26   7.441  -2.110   7.878
  227   1HE   LYS  26          HE2       LYS  26   8.802  -4.014   7.227
  228   2HE   LYS  26          HE1       LYS  26   9.914  -3.729   8.580
  229   1HZ   LYS  26          HZ1       LYS  26   6.999  -4.159   8.927
  230   2HZ   LYS  26          HZ2       LYS  26   8.191  -4.126  10.137
  231   3HZ   LYS  26          HZ3       LYS  26   8.135  -5.414   9.030
  232    H    PHE  27           HN       PHE  27   9.360   2.401   5.087
  233    HA   PHE  27           HA       PHE  27  12.109   1.609   4.179
  234   1HB   PHE  27          HB2       PHE  27   9.488   2.016   2.706
  235   2HB   PHE  27          HB1       PHE  27  11.037   1.786   1.886
  236    HD1  PHE  27           HD1      PHE  27   8.194   0.124   3.124
  237    HD2  PHE  27           HD2      PHE  27  12.459  -0.286   2.809
  238    HE1  PHE  27           HE1      PHE  27   7.979  -2.333   3.391
  239    HE2  PHE  27           HE2      PHE  27  12.243  -2.741   3.079
  240    HZ   PHE  27           HZ       PHE  27  10.002  -3.765   3.369
  241    H    LYS  28           HN       LYS  28  11.516   3.997   5.727
  242    HA   LYS  28           HA       LYS  28  11.027   6.383   4.404
  243   1HB   LYS  28          HB2       LYS  28  11.981   5.599   6.829
  244   2HB   LYS  28          HB1       LYS  28  13.434   6.323   6.136
  245   1HG   LYS  28          HG2       LYS  28  12.614   8.359   6.622
  246   2HG   LYS  28          HG1       LYS  28  11.284   8.059   5.504
  247   1HD   LYS  28          HD2       LYS  28   9.922   7.117   7.243
  248   2HD   LYS  28          HD1       LYS  28  11.279   7.082   8.368
  249   1HE   LYS  28          HE2       LYS  28  11.050   9.767   7.453
  250   2HE   LYS  28          HE1       LYS  28   9.423   9.227   7.912
  251   1HZ   LYS  28          HZ1       LYS  28  10.747  10.044   9.822
  252   2HZ   LYS  28          HZ2       LYS  28  11.861   8.789   9.553
  253   3HZ   LYS  28          HZ3       LYS  28  10.260   8.428   9.993
  254    H    ASN  29           HN       ASN  29  13.961   4.394   4.208
  255    HA   ASN  29           HA       ASN  29  15.148   6.365   2.297
  256   1HB   ASN  29          HB2       ASN  29  16.231   4.111   3.999
  257   2HB   ASN  29          HB1       ASN  29  17.212   4.934   2.784
  258   1HD2  ASN  29          HD21      ASN  29  15.306   5.541   5.765
  259   2HD2  ASN  29          HD22      ASN  29  16.151   6.946   6.205
  260    H    GLY  30           HN       GLY  30  13.087   4.926   1.153
  261   1HA   GLY  30          HA2       GLY  30  12.758   3.726  -0.856
  262   2HA   GLY  30          HA1       GLY  30  14.496   3.427  -0.914
  263    H    MET  31           HN       MET  31  12.739   1.367  -1.532
  264    HA   MET  31           HA       MET  31  12.653  -0.350   0.915
  265   1HB   MET  31          HB2       MET  31  11.413  -0.719  -1.830
  266   2HB   MET  31          HB1       MET  31  11.032  -1.639  -0.374
  267   1HG   MET  31          HG2       MET  31   9.981   0.209   0.654
  268   2HG   MET  31          HG1       MET  31  10.725   1.360  -0.452
  269   1HE   MET  31          HE1       MET  31   8.619  -2.052  -0.812
  270   2HE   MET  31          HE2       MET  31   7.055  -1.259  -0.986
  271   3HE   MET  31          HE3       MET  31   8.036  -0.951   0.444
  272    H    LEU  32           HN       LEU  32  13.409  -2.606   0.661
  273    HA   LEU  32           HA       LEU  32  15.961  -2.793  -0.695
  274   1HB   LEU  32          HB2       LEU  32  14.140  -4.812   0.647
  275   2HB   LEU  32          HB1       LEU  32  15.804  -5.149   0.160
  276    HG   LEU  32           HG       LEU  32  15.305  -2.727   1.840
  277   1HD1  LEU  32          HD11      LEU  32  14.081  -4.910   2.730
  278   2HD1  LEU  32          HD12      LEU  32  14.990  -3.876   3.832
  279   3HD1  LEU  32          HD13      LEU  32  15.718  -5.357   3.211
  280   1HD2  LEU  32          HD21      LEU  32  17.536  -3.004   2.408
  281   2HD2  LEU  32          HD22      LEU  32  17.536  -3.741   0.807
  282   3HD2  LEU  32          HD23      LEU  32  17.468  -4.759   2.245
  283    H    HIS  33           HN       HIS  33  16.470  -4.271  -2.462
  284    HA   HIS  33           HA       HIS  33  14.494  -4.304  -4.581
  285   1HB   HIS  33          HB2       HIS  33  16.837  -4.081  -5.080
  286   2HB   HIS  33          HB1       HIS  33  17.226  -5.542  -4.167
  287    HD1  HIS  33           HD1      HIS  33  16.196  -4.368  -7.506
  288    HD2  HIS  33           HD2      HIS  33  16.243  -7.995  -5.450
  289    HE1  HIS  33           HE1      HIS  33  15.881  -6.183  -9.246
  290    H    GLY  34           HN       GLY  34  13.262  -6.056  -5.330
  291   1HA   GLY  34          HA2       GLY  34  12.334  -8.224  -5.363
  292   2HA   GLY  34          HA1       GLY  34  13.673  -8.764  -4.349
  293    H    ASP  35           HN       ASP  35  12.207  -6.042  -2.998
  294    HA   ASP  35           HA       ASP  35  11.215  -7.503  -0.715
  295   1HB   ASP  35          HB2       ASP  35  11.551  -4.763  -1.665
  296   2HB   ASP  35          HB1       ASP  35  10.062  -4.952  -0.739
  297    H    LYS  36           HN       LYS  36   8.903  -7.479  -0.004
  298    HA   LYS  36           HA       LYS  36   6.953  -7.311  -2.268
  299   1HB   LYS  36          HB2       LYS  36   7.626  -9.615  -0.447
  300   2HB   LYS  36          HB1       LYS  36   6.022  -9.494  -1.172
  301   1HG   LYS  36          HG2       LYS  36   7.485  -9.045  -3.373
  302   2HG   LYS  36          HG1       LYS  36   8.657 -10.007  -2.472
  303   1HD   LYS  36          HD2       LYS  36   5.837 -10.991  -2.578
  304   2HD   LYS  36          HD1       LYS  36   6.827 -11.164  -4.029
  305   1HE   LYS  36          HE2       LYS  36   8.112 -12.798  -3.088
  306   2HE   LYS  36          HE1       LYS  36   8.202 -11.950  -1.532
  307   1HZ   LYS  36          HZ1       LYS  36   6.313 -12.903  -0.790
  308   2HZ   LYS  36          HZ2       LYS  36   6.707 -14.117  -1.911
  309   3HZ   LYS  36          HZ3       LYS  36   5.575 -12.916  -2.317
  310    H    VAL  37           HN       VAL  37   5.225  -6.093  -1.645
  311    HA   VAL  37           HA       VAL  37   4.350  -6.174   1.214
  312    HB   VAL  37           HB       VAL  37   4.374  -3.776   1.328
  313   1HG1  VAL  37          HG11      VAL  37   6.894  -4.107  -0.218
  314   2HG1  VAL  37          HG12      VAL  37   6.649  -5.216   1.131
  315   3HG1  VAL  37          HG13      VAL  37   6.647  -3.474   1.410
  316   1HG2  VAL  37          HG21      VAL  37   5.422  -2.762  -1.000
  317   2HG2  VAL  37          HG22      VAL  37   3.705  -2.768  -0.601
  318   3HG2  VAL  37          HG23      VAL  37   4.380  -4.047  -1.611
  319    H    SER  38           HN       SER  38   2.087  -6.011   1.429
  320    HA   SER  38           HA       SER  38   0.546  -6.049  -1.123
  321   1HB   SER  38          HB2       SER  38  -0.764  -6.565   1.484
  322   2HB   SER  38          HB1       SER  38  -0.832  -7.498  -0.012
  323    HG   SER  38           HG       SER  38   1.429  -8.063   0.520
  324    H    PHE  39           HN       PHE  39  -1.087  -4.534  -1.529
  325    HA   PHE  39           HA       PHE  39  -1.189  -2.186   0.320
  326   1HB   PHE  39          HB2       PHE  39  -1.643  -2.671  -2.621
  327   2HB   PHE  39          HB1       PHE  39  -2.275  -1.213  -1.850
  328    HD1  PHE  39           HD1      PHE  39  -0.815   0.557  -1.120
  329    HD2  PHE  39           HD2      PHE  39   0.806  -3.115  -2.650
  330    HE1  PHE  39           HE1      PHE  39   1.429   1.604  -1.255
  331    HE2  PHE  39           HE2      PHE  39   3.050  -2.067  -2.787
  332    HZ   PHE  39           HZ       PHE  39   3.362   0.292  -2.089
  333    H    PHE  40           HN       PHE  40  -3.200  -1.507   1.150
  334    HA   PHE  40           HA       PHE  40  -5.363  -3.491   1.136
  335   1HB   PHE  40          HB2       PHE  40  -4.810  -0.822   2.442
  336   2HB   PHE  40          HB1       PHE  40  -6.388  -1.600   2.605
  337    HD1  PHE  40           HD1      PHE  40  -3.245  -1.270   4.100
  338    HD2  PHE  40           HD2      PHE  40  -6.200  -4.242   3.161
  339    HE1  PHE  40           HE1      PHE  40  -2.340  -2.732   5.886
  340    HE2  PHE  40           HE2      PHE  40  -5.294  -5.706   4.946
  341    HZ   PHE  40           HZ       PHE  40  -3.364  -4.951   6.309
  342    H    CYS  41           HN       CYS  41  -6.913  -3.496  -0.445
  343    HA   CYS  41           HA       CYS  41  -7.759  -0.864  -1.606
  344   1HB   CYS  41          HB2       CYS  41  -7.109  -3.492  -2.967
  345   2HB   CYS  41          HB1       CYS  41  -7.947  -2.169  -3.781
  346    H    LYS  42           HN       LYS  42 -10.003  -0.857  -2.336
  347    HA   LYS  42           HA       LYS  42 -11.658  -2.958  -0.997
  348   1HB   LYS  42          HB2       LYS  42 -13.415  -1.108  -1.207
  349   2HB   LYS  42          HB1       LYS  42 -12.053  -0.763  -0.136
  350   1HG   LYS  42          HG2       LYS  42 -10.995   0.621  -1.765
  351   2HG   LYS  42          HG1       LYS  42 -12.068   0.057  -3.046
  352   1HD   LYS  42          HD2       LYS  42 -13.242   1.953  -2.583
  353   2HD   LYS  42          HD1       LYS  42 -13.874   1.014  -1.231
  354   1HE   LYS  42          HE2       LYS  42 -12.565   2.117   0.328
  355   2HE   LYS  42          HE1       LYS  42 -11.265   2.434  -0.840
  356   1HZ   LYS  42          HZ1       LYS  42 -13.818   3.845  -0.477
  357   2HZ   LYS  42          HZ2       LYS  42 -13.131   3.781  -2.030
  358   3HZ   LYS  42          HZ3       LYS  42 -12.269   4.482  -0.745
  359    H    ASN  43           HN       ASN  43 -13.293  -3.995  -2.178
  360    HA   ASN  43           HA       ASN  43 -13.077  -3.772  -5.143
  361   1HB   ASN  43          HB2       ASN  43 -12.911  -5.903  -3.558
  362   2HB   ASN  43          HB1       ASN  43 -14.673  -5.845  -3.675
  363   1HD2  ASN  43          HD21      ASN  43 -11.932  -7.092  -5.200
  364   2HD2  ASN  43          HD22      ASN  43 -12.597  -7.371  -6.736
  365    H    LYS  44           HN       LYS  44 -14.859  -3.143  -6.383
  366    HA   LYS  44           HA       LYS  44 -17.135  -1.934  -4.933
  367   1HB   LYS  44          HB2       LYS  44 -15.835  -1.808  -7.595
  368   2HB   LYS  44          HB1       LYS  44 -17.578  -1.534  -7.591
  369   1HG   LYS  44          HG2       LYS  44 -16.158  -0.138  -5.426
  370   2HG   LYS  44          HG1       LYS  44 -15.685   0.390  -7.041
  371   1HD   LYS  44          HD2       LYS  44 -18.162   0.586  -7.579
  372   2HD   LYS  44          HD1       LYS  44 -18.470   0.349  -5.858
  373   1HE   LYS  44          HE2       LYS  44 -18.346   2.673  -5.914
  374   2HE   LYS  44          HE1       LYS  44 -16.629   2.300  -5.662
  375   1HZ   LYS  44          HZ1       LYS  44 -17.944   2.609  -8.311
  376   2HZ   LYS  44          HZ2       LYS  44 -16.299   2.281  -8.044
  377   3HZ   LYS  44          HZ3       LYS  44 -16.956   3.774  -7.574
  378    H    GLU  45           HN       GLU  45 -16.434  -4.773  -6.871
  379    HA   GLU  45           HA       GLU  45 -19.286  -5.378  -7.346
  380   1HB   GLU  45          HB2       GLU  45 -16.720  -6.064  -8.415
  381   2HB   GLU  45          HB1       GLU  45 -17.517  -7.555  -7.910
  382   1HG   GLU  45          HG2       GLU  45 -19.550  -6.860  -9.172
  383   2HG   GLU  45          HG1       GLU  45 -18.677  -5.437  -9.742
  384    H    LYS  46           HN       LYS  46 -16.839  -6.074  -4.982
  385    HA   LYS  46           HA       LYS  46 -18.472  -8.326  -3.877
  386   1HB   LYS  46          HB2       LYS  46 -15.645  -7.466  -3.203
  387   2HB   LYS  46          HB1       LYS  46 -16.410  -9.015  -2.831
  388   1HG   LYS  46          HG2       LYS  46 -16.673  -9.373  -5.323
  389   2HG   LYS  46          HG1       LYS  46 -15.663  -7.947  -5.565
  390   1HD   LYS  46          HD2       LYS  46 -13.937  -9.086  -4.061
  391   2HD   LYS  46          HD1       LYS  46 -14.903 -10.552  -4.232
  392   1HE   LYS  46          HE2       LYS  46 -13.968  -8.991  -6.653
  393   2HE   LYS  46          HE1       LYS  46 -12.976 -10.267  -5.917
  394   1HZ   LYS  46          HZ1       LYS  46 -15.179 -11.589  -5.957
  395   2HZ   LYS  46          HZ2       LYS  46 -14.274 -11.459  -7.389
  396   3HZ   LYS  46          HZ3       LYS  46 -15.643 -10.480  -7.155
  397    H    LYS  47           HN       LYS  47 -17.498  -5.053  -3.333
  398    HA   LYS  47           HA       LYS  47 -18.067  -3.547  -1.606
  399   1HB   LYS  47          HB2       LYS  47 -19.716  -5.835  -0.513
  400   2HB   LYS  47          HB1       LYS  47 -20.020  -4.104  -0.348
  401   1HG   LYS  47          HG2       LYS  47 -20.011  -4.269  -3.032
  402   2HG   LYS  47          HG1       LYS  47 -20.545  -5.908  -2.659
  403   1HD   LYS  47          HD2       LYS  47 -22.611  -4.950  -2.545
  404   2HD   LYS  47          HD1       LYS  47 -22.088  -4.465  -0.932
  405   1HE   LYS  47          HE2       LYS  47 -21.528  -2.272  -1.643
  406   2HE   LYS  47          HE1       LYS  47 -21.512  -2.743  -3.354
  407   1HZ   LYS  47          HZ1       LYS  47 -23.884  -3.302  -3.146
  408   2HZ   LYS  47          HZ2       LYS  47 -23.589  -1.655  -2.851
  409   3HZ   LYS  47          HZ3       LYS  47 -23.879  -2.714  -1.555
  410    H    CYS  48           HN       CYS  48 -15.825  -5.561  -1.370
  411    HA   CYS  48           HA       CYS  48 -15.479  -5.326   1.590
  412   1HB   CYS  48          HB2       CYS  48 -14.166  -7.692   0.800
  413   2HB   CYS  48          HB1       CYS  48 -15.618  -7.568   1.785
  414    H    SER  49           HN       SER  49 -13.026  -5.920   2.062
  415    HA   SER  49           HA       SER  49 -11.403  -4.534  -0.045
  416   1HB   SER  49          HB2       SER  49  -9.969  -4.006   2.036
  417   2HB   SER  49          HB1       SER  49 -11.519  -3.182   1.889
  418    HG   SER  49           HG       SER  49 -10.780  -5.353   3.530
  419    H    TYR  50           HN       TYR  50  -9.069  -5.172   0.000
  420    HA   TYR  50           HA       TYR  50  -8.383  -7.812   1.097
  421   1HB   TYR  50          HB2       TYR  50  -7.973  -8.669  -1.279
  422   2HB   TYR  50          HB1       TYR  50  -9.670  -8.484  -0.823
  423    HD1  TYR  50           HD1      TYR  50 -10.976  -6.512  -1.613
  424    HD2  TYR  50           HD2      TYR  50  -6.970  -7.275  -2.961
  425    HE1  TYR  50           HE1      TYR  50 -11.305  -4.927  -3.492
  426    HE2  TYR  50           HE2      TYR  50  -7.298  -5.689  -4.840
  427    HH   TYR  50           HH       TYR  50  -9.545  -3.435  -4.967
  428    H    THR  51           HN       THR  51  -6.063  -8.370   0.390
  429    HA   THR  51           HA       THR  51  -4.497  -5.839   0.201
  430    HB   THR  51           HB       THR  51  -2.647  -7.425   0.918
  431    HG1  THR  51           HG1      THR  51  -3.975  -9.265   0.102
  432   1HG2  THR  51          HG21      THR  51  -5.115  -7.320   2.677
  433   2HG2  THR  51          HG22      THR  51  -3.936  -6.019   2.509
  434   3HG2  THR  51          HG23      THR  51  -3.457  -7.557   3.227
  435    H    GLU  52           HN       GLU  52  -2.994  -5.517  -1.440
  436    HA   GLU  52           HA       GLU  52  -3.053  -7.505  -3.689
  437   1HB   GLU  52          HB2       GLU  52  -3.493  -4.646  -3.477
  438   2HB   GLU  52          HB1       GLU  52  -2.175  -4.984  -4.600
  439   1HG   GLU  52          HG2       GLU  52  -4.949  -6.208  -4.689
  440   2HG   GLU  52          HG1       GLU  52  -4.317  -4.992  -5.799
  441    H    ASP  53           HN       ASP  53  -1.213  -8.624  -2.674
  442    HA   ASP  53           HA       ASP  53   1.192  -7.683  -1.753
  443   1HB   ASP  53          HB2       ASP  53   0.808  -9.872  -3.812
  444   2HB   ASP  53          HB1       ASP  53   2.151  -9.740  -2.670
  445    H    ALA  54           HN       ALA  54   3.084  -6.838  -2.619
  446    HA   ALA  54           HA       ALA  54   3.104  -6.179  -5.545
  447   1HB   ALA  54          HB1       ALA  54   4.376  -4.176  -3.868
  448   2HB   ALA  54          HB2       ALA  54   2.708  -4.440  -3.361
  449   3HB   ALA  54          HB3       ALA  54   3.060  -3.975  -5.024
  450    H    GLN  55           HN       GLN  55   5.464  -5.430  -6.141
  451    HA   GLN  55           HA       GLN  55   7.466  -6.933  -4.495
  452   1HB   GLN  55          HB2       GLN  55   6.421  -8.058  -6.640
  453   2HB   GLN  55          HB1       GLN  55   7.523  -6.981  -7.499
  454   1HG   GLN  55          HG2       GLN  55   9.367  -7.862  -5.969
  455   2HG   GLN  55          HG1       GLN  55   8.224  -9.107  -5.467
  456   1HE2  GLN  55          HE21      GLN  55   7.062 -10.139  -7.591
  457   2HE2  GLN  55          HE22      GLN  55   8.148 -10.589  -8.816
  458    H    CYS  56           HN       CYS  56   9.670  -6.159  -4.788
  459    HA   CYS  56           HA       CYS  56   9.794  -3.361  -5.841
  460   1HB   CYS  56          HB2       CYS  56  10.397  -4.573  -3.364
  461   2HB   CYS  56          HB1       CYS  56  11.949  -4.183  -4.098
  462    H    ILE  57           HN       ILE  57  11.565  -2.810  -7.177
  463    HA   ILE  57           HA       ILE  57  13.451  -4.994  -7.944
  464    HB   ILE  57           HB       ILE  57  11.877  -3.239  -9.856
  465   1HG1  ILE  57          HG12      ILE  57  10.479  -4.899  -8.574
  466   2HG1  ILE  57          HG11      ILE  57  10.514  -5.193 -10.312
  467   1HG2  ILE  57          HG21      ILE  57  13.787  -5.560 -10.210
  468   2HG2  ILE  57          HG22      ILE  57  13.928  -3.932 -10.876
  469   3HG2  ILE  57          HG23      ILE  57  12.690  -5.031 -11.484
  470   1HD1  ILE  57          HD11      ILE  57  12.566  -6.527  -8.581
  471   2HD1  ILE  57          HD12      ILE  57  11.872  -7.069 -10.108
  472   3HD1  ILE  57          HD13      ILE  57  10.930  -7.183  -8.622
  473    H    ASP  58           HN       ASP  58  15.169  -3.974  -9.488
  474    HA   ASP  58           HA       ASP  58  16.825  -2.173  -8.285
  475   1HB   ASP  58          HB2       ASP  58  16.794  -3.453 -10.615
  476   2HB   ASP  58          HB1       ASP  58  16.376  -1.848 -11.222
  477    H    GLY  59           HN       GLY  59  15.941  -0.378  -7.232
  478   1HA   GLY  59          HA2       GLY  59  14.842   1.692  -6.974
  479   2HA   GLY  59          HA1       GLY  59  15.706   2.075  -8.461
  480    H    THR  60           HN       THR  60  13.308  -0.467  -8.497
  481    HA   THR  60           HA       THR  60  11.335   1.420  -9.728
  482    HB   THR  60           HB       THR  60  12.405  -1.183 -10.848
  483    HG1  THR  60           HG1      THR  60  12.581   1.538 -11.569
  484   1HG2  THR  60          HG21      THR  60   9.869  -0.648 -11.091
  485   2HG2  THR  60          HG22      THR  60  10.779  -1.085 -12.536
  486   3HG2  THR  60          HG23      THR  60  10.406   0.607 -12.207
  487    H    ILE  61           HN       ILE  61   9.147   0.726  -9.495
  488    HA   ILE  61           HA       ILE  61   8.537  -1.893  -8.318
  489    HB   ILE  61           HB       ILE  61   9.187  -0.872  -6.299
  490   1HG1  ILE  61          HG12      ILE  61   6.489   0.158  -5.907
  491   2HG1  ILE  61          HG11      ILE  61   6.478  -1.396  -6.741
  492   1HG2  ILE  61          HG21      ILE  61   9.635   1.355  -6.699
  493   2HG2  ILE  61          HG22      ILE  61   8.104   1.527  -5.841
  494   3HG2  ILE  61          HG23      ILE  61   8.141   1.602  -7.603
  495   1HD1  ILE  61          HD11      ILE  61   7.817  -2.409  -4.990
  496   2HD1  ILE  61          HD12      ILE  61   6.436  -1.608  -4.240
  497   3HD1  ILE  61          HD13      ILE  61   8.028  -0.849  -4.195
  498    H    GLU  62           HN       GLU  62   6.413  -2.442  -8.773
  499    HA   GLU  62           HA       GLU  62   4.769  -0.359 -10.156
  500   1HB   GLU  62          HB2       GLU  62   4.958  -3.375 -10.264
  501   2HB   GLU  62          HB1       GLU  62   3.629  -2.499 -11.023
  502   1HG   GLU  62          HG2       GLU  62   4.940  -2.094 -12.805
  503   2HG   GLU  62          HG1       GLU  62   6.036  -1.179 -11.769
  504    H    VAL  63           HN       VAL  63   3.248   0.498  -8.785
  505    HA   VAL  63           HA       VAL  63   2.245  -0.977  -6.462
  506    HB   VAL  63           HB       VAL  63   2.712   1.525  -6.692
  507   1HG1  VAL  63          HG11      VAL  63   1.333   2.883  -7.966
  508   2HG1  VAL  63          HG12      VAL  63  -0.024   1.758  -7.884
  509   3HG1  VAL  63          HG13      VAL  63   1.332   1.428  -8.962
  510   1HG2  VAL  63          HG21      VAL  63   1.340   0.506  -4.856
  511   2HG2  VAL  63          HG22      VAL  63  -0.100   0.767  -5.839
  512   3HG2  VAL  63          HG23      VAL  63   0.837   2.147  -5.265
  513    HA   PRO  64           HA       PRO  64  -1.147  -2.965  -8.494
  514   1HB   PRO  64          HB2       PRO  64  -2.825  -2.690  -6.173
  515   2HB   PRO  64          HB1       PRO  64  -1.933  -4.120  -6.710
  516   1HG   PRO  64          HG2       PRO  64  -1.362  -2.427  -4.462
  517   2HG   PRO  64          HG1       PRO  64  -0.475  -3.855  -5.001
  518   1HD   PRO  64          HD2       PRO  64   0.344  -1.098  -5.176
  519   2HD   PRO  64          HD1       PRO  64   1.231  -2.536  -5.738
  520    H    LYS  65           HN       LYS  65  -2.700  -2.087  -9.823
  521    HA   LYS  65           HA       LYS  65  -3.353   0.641  -9.953
  522   1HB   LYS  65          HB2       LYS  65  -3.936  -1.745 -11.290
  523   2HB   LYS  65          HB1       LYS  65  -5.514  -1.117 -10.814
  524   1HG   LYS  65          HG2       LYS  65  -3.395   0.533 -12.218
  525   2HG   LYS  65          HG1       LYS  65  -4.727  -0.272 -13.049
  526   1HD   LYS  65          HD2       LYS  65  -5.285   1.561 -10.728
  527   2HD   LYS  65          HD1       LYS  65  -5.019   2.226 -12.340
  528   1HE   LYS  65          HE2       LYS  65  -6.827  -0.022 -12.519
  529   2HE   LYS  65          HE1       LYS  65  -7.435   1.153 -11.336
  530   1HZ   LYS  65          HZ1       LYS  65  -8.146   2.082 -13.305
  531   2HZ   LYS  65          HZ2       LYS  65  -6.791   1.550 -14.182
  532   3HZ   LYS  65          HZ3       LYS  65  -6.650   2.858 -13.107
  533    H    CYS  66           HN       CYS  66  -4.933  -1.933  -8.083
  534    HA   CYS  66           HA       CYS  66  -7.339  -0.635  -7.379
  535   1HB   CYS  66          HB2       CYS  66  -7.397  -2.238  -5.598
  536   2HB   CYS  66          HB1       CYS  66  -6.508  -3.010  -6.911
  537    H    PHE  67           HN       PHE  67  -4.064   0.021  -6.340
  538    HA   PHE  67           HA       PHE  67  -4.766   1.495  -3.932
  539   1HB   PHE  67          HB2       PHE  67  -2.583   0.463  -4.235
  540   2HB   PHE  67          HB1       PHE  67  -2.308   1.392  -5.709
  541    HD1  PHE  67           HD1      PHE  67  -0.831   3.168  -5.453
  542    HD2  PHE  67           HD2      PHE  67  -3.449   2.141  -2.206
  543    HE1  PHE  67           HE1      PHE  67   0.106   5.030  -4.107
  544    HE2  PHE  67           HE2      PHE  67  -2.512   4.002  -0.861
  545    HZ   PHE  67           HZ       PHE  67  -0.735   5.447  -1.812
  546    H    LYS  68           HN       LYS  68  -4.716   3.812  -3.692
  547    HA   LYS  68           HA       LYS  68  -4.324   5.624  -5.911
  548   1HB   LYS  68          HB2       LYS  68  -6.555   4.236  -6.254
  549   2HB   LYS  68          HB1       LYS  68  -7.201   5.393  -5.089
  550   1HG   LYS  68          HG2       LYS  68  -6.711   7.246  -6.495
  551   2HG   LYS  68          HG1       LYS  68  -5.654   6.281  -7.528
  552   1HD   LYS  68          HD2       LYS  68  -8.547   5.522  -7.233
  553   2HD   LYS  68          HD1       LYS  68  -8.089   6.819  -8.339
  554   1HE   LYS  68          HE2       LYS  68  -6.254   4.972  -9.066
  555   2HE   LYS  68          HE1       LYS  68  -7.566   3.897  -8.545
  556   1HZ   LYS  68          HZ1       LYS  68  -9.091   4.994  -9.956
  557   2HZ   LYS  68          HZ2       LYS  68  -7.717   4.695 -10.910
  558   3HZ   LYS  68          HZ3       LYS  68  -8.005   6.251 -10.293
  559    H    GLU  69           HN       GLU  69  -3.278   7.009  -4.466
  560    HA   GLU  69           HA       GLU  69  -3.976   7.594  -1.799
  561   1HB   GLU  69          HB2       GLU  69  -2.693   9.724  -2.296
  562   2HB   GLU  69          HB1       GLU  69  -1.870   8.245  -2.799
  563   1HG   GLU  69          HG2       GLU  69  -1.937   8.839  -4.975
  564   2HG   GLU  69          HG1       GLU  69  -3.647   9.262  -4.876
  565    H    HIS  70           HN       HIS  70  -5.686   8.699  -0.927
  566    HA   HIS  70           HA       HIS  70  -7.484  10.207  -2.772
  567   1HB   HIS  70          HB2       HIS  70  -7.751   8.867  -0.078
  568   2HB   HIS  70          HB1       HIS  70  -8.990   9.970  -0.676
  569    HD1  HIS  70           HD1      HIS  70  -7.647   6.542  -1.103
  570    HD2  HIS  70           HD2      HIS  70 -10.302   9.056  -3.106
  571    HE1  HIS  70           HE1      HIS  70  -8.924   5.083  -2.734
  572    H    SER  71           HN       SER  71  -7.322  12.411  -2.714
  573    HA   SER  71           HA       SER  71  -5.664  13.863  -0.899
  574   1HB   SER  71          HB2       SER  71  -6.657  15.788  -2.010
  575   2HB   SER  71          HB1       SER  71  -6.444  14.507  -3.205
  576    HG   SER  71           HG       SER  71  -8.591  14.086  -3.135
  577    H    SER  72           HN       SER  72  -7.936  15.946  -0.529
  578    HA   SER  72           HA       SER  72  -8.451  15.784   2.166
  579   1HB   SER  72          HB2       SER  72  -9.140  17.533   0.445
  580   2HB   SER  72          HB1       SER  72 -10.538  16.521   0.097
  581    HG   SER  72           HG       SER  72 -10.901  18.172   1.704
  582    H    LEU  73           HN       LEU  73  -9.467  14.310   3.467
  583    HA   LEU  73           HA       LEU  73 -11.032  12.122   2.241
  584   1HB   LEU  73          HB2       LEU  73 -10.098  12.726   5.063
  585   2HB   LEU  73          HB1       LEU  73 -10.872  11.220   4.564
  586    HG   LEU  73           HG       LEU  73  -8.362  12.280   3.247
  587   1HD1  LEU  73          HD11      LEU  73  -7.761  10.022   4.829
  588   2HD1  LEU  73          HD12      LEU  73  -8.689  11.103   5.868
  589   3HD1  LEU  73          HD13      LEU  73  -7.216  11.679   5.089
  590   1HD2  LEU  73          HD21      LEU  73  -8.492  10.416   1.962
  591   2HD2  LEU  73          HD22      LEU  73 -10.160  10.294   2.521
  592   3HD2  LEU  73          HD23      LEU  73  -8.886   9.397   3.346
  593    H    ALA  74           HN       ALA  74 -13.245  12.122   2.230
  594    HA   ALA  74           HA       ALA  74 -14.917  14.242   2.883
  595   1HB   ALA  74          HB1       ALA  74 -16.123  12.648   1.802
  596   2HB   ALA  74          HB2       ALA  74 -16.446  11.996   3.409
  597   3HB   ALA  74          HB3       ALA  74 -15.121  11.344   2.443
  598    H    PHE  75           HN       PHE  75 -15.417  11.395   4.890
  599    HA   PHE  75           HA       PHE  75 -14.671  12.795   7.377
  600   1HB   PHE  75          HB2       PHE  75 -17.425  12.561   6.283
  601   2HB   PHE  75          HB1       PHE  75 -17.248  12.218   8.005
  602    HD1  PHE  75           HD1      PHE  75 -17.737  14.775   5.630
  603    HD2  PHE  75           HD2      PHE  75 -15.692  13.944   9.316
  604    HE1  PHE  75           HE1      PHE  75 -17.597  17.206   6.101
  605    HE2  PHE  75           HE2      PHE  75 -15.552  16.375   9.785
  606    HZ   PHE  75           HZ       PHE  75 -16.504  18.006   8.178
  607    H    TRP  76           HN       TRP  76 -16.268  10.015   5.833
  608    HA   TRP  76           HA       TRP  76 -14.801   8.165   7.586
  609   1HB   TRP  76          HB2       TRP  76 -17.402   9.151   8.246
  610   2HB   TRP  76          HB1       TRP  76 -17.547   7.438   7.841
  611    HD1  TRP  76           HD1      TRP  76 -15.841   5.754   9.163
  612    HE1  TRP  76           HE1      TRP  76 -14.937   5.900  11.577
  613    HE3  TRP  76           HE3      TRP  76 -16.706  10.682  10.117
  614    HZ2  TRP  76           HZ2      TRP  76 -14.621   7.863  13.638
  615    HZ3  TRP  76           HZ3      TRP  76 -16.094  11.672  12.306
  616    HH2  TRP  76           HH2      TRP  76 -15.052  10.269  14.066
  617    H    LYS  77           HN       LYS  77 -14.767   8.477   4.771
  618    HA   LYS  77           HA       LYS  77 -16.576   6.719   3.386
  619   1HB   LYS  77          HB2       LYS  77 -14.796   6.889   1.622
  620   2HB   LYS  77          HB1       LYS  77 -15.258   8.456   2.286
  621   1HG   LYS  77          HG2       LYS  77 -13.186   8.820   3.107
  622   2HG   LYS  77          HG1       LYS  77 -13.119   7.212   3.831
  623   1HD   LYS  77          HD2       LYS  77 -11.365   7.391   2.152
  624   2HD   LYS  77          HD1       LYS  77 -12.596   6.268   1.574
  625   1HE   LYS  77          HE2       LYS  77 -13.222   7.648  -0.144
  626   2HE   LYS  77          HE1       LYS  77 -13.038   9.113   0.843
  627   1HZ   LYS  77          HZ1       LYS  77 -11.287   9.009  -0.807
  628   2HZ   LYS  77          HZ2       LYS  77 -10.831   7.462  -0.273
  629   3HZ   LYS  77          HZ3       LYS  77 -10.626   8.809   0.742
  630    H    THR  78           HN       THR  78 -13.749   6.162   5.340
  631    HA   THR  78           HA       THR  78 -12.726   4.140   6.018
  632    HB   THR  78           HB       THR  78 -14.940   2.688   4.595
  633    HG1  THR  78           HG1      THR  78 -16.201   3.234   6.519
  634   1HG2  THR  78          HG21      THR  78 -14.358   1.041   6.012
  635   2HG2  THR  78          HG22      THR  78 -14.490   2.120   7.402
  636   3HG2  THR  78          HG23      THR  78 -12.981   2.033   6.493
  637    H    ASP  79           HN       ASP  79 -10.886   4.217   4.655
  638    HA   ASP  79           HA       ASP  79 -11.070   3.333   1.849
  639   1HB   ASP  79          HB2       ASP  79  -8.722   3.969   1.825
  640   2HB   ASP  79          HB1       ASP  79  -9.610   5.194   2.733
  641    H    ALA  80           HN       ALA  80 -10.057   1.409   1.057
  642    HA   ALA  80           HA       ALA  80 -10.357  -1.016   2.283
  643   1HB   ALA  80          HB1       ALA  80  -8.635  -1.816   0.755
  644   2HB   ALA  80          HB2       ALA  80  -7.938  -0.199   0.645
  645   3HB   ALA  80          HB3       ALA  80  -9.533  -0.520  -0.036
  646    H    SER  81           HN       SER  81  -7.780   1.292   2.939
  647    HA   SER  81           HA       SER  81  -5.906  -0.284   4.316
  648   1HB   SER  81          HB2       SER  81  -5.085   1.775   4.957
  649   2HB   SER  81          HB1       SER  81  -6.225   2.322   3.730
  650    HG   SER  81           HG       SER  81  -6.585   2.183   6.541
  651    H    ASP  82           HN       ASP  82  -9.126   0.699   5.345
  652    HA   ASP  82           HA       ASP  82  -8.663  -0.759   7.924
  653   1HB   ASP  82          HB2       ASP  82 -10.105   1.855   7.421
  654   2HB   ASP  82          HB1       ASP  82 -10.092   1.012   8.970
  655    H    VAL  83           HN       VAL  83  -9.977  -1.591   5.347
  656    HA   VAL  83           HA       VAL  83 -12.835  -1.779   6.183
  657    HB   VAL  83           HB       VAL  83 -11.401  -2.526   3.619
  658   1HG1  VAL  83          HG11      VAL  83 -14.268  -2.572   4.507
  659   2HG1  VAL  83          HG12      VAL  83 -13.379  -3.757   3.551
  660   3HG1  VAL  83          HG13      VAL  83 -13.894  -2.238   2.817
  661   1HG2  VAL  83          HG21      VAL  83 -12.791  -0.414   2.883
  662   2HG2  VAL  83          HG22      VAL  83 -11.243  -0.193   3.698
  663   3HG2  VAL  83          HG23      VAL  83 -12.748  -0.024   4.602
  664    H    LYS  84           HN       LYS  84 -13.873  -3.923   6.119
  665    HA   LYS  84           HA       LYS  84 -12.188  -6.007   7.277
  666   1HB   LYS  84          HB2       LYS  84 -14.387  -5.759   8.138
  667   2HB   LYS  84          HB1       LYS  84 -15.096  -5.684   6.525
  668   1HG   LYS  84          HG2       LYS  84 -14.837  -7.994   6.166
  669   2HG   LYS  84          HG1       LYS  84 -13.622  -8.149   7.435
  670   1HD   LYS  84          HD2       LYS  84 -15.360  -7.634   9.134
  671   2HD   LYS  84          HD1       LYS  84 -16.568  -7.562   7.851
  672   1HE   LYS  84          HE2       LYS  84 -16.666  -9.839   7.654
  673   2HE   LYS  84          HE1       LYS  84 -14.914 -10.023   7.865
  674   1HZ   LYS  84          HZ1       LYS  84 -15.076  -9.964  10.129
  675   2HZ   LYS  84          HZ2       LYS  84 -16.565 -10.700   9.771
  676   3HZ   LYS  84          HZ3       LYS  84 -16.498  -9.039  10.127
  677    HA   PRO  85           HA       PRO  85 -11.081  -7.848   3.376
  678   1HB   PRO  85          HB2       PRO  85 -10.756 -10.412   4.649
  679   2HB   PRO  85          HB1       PRO  85  -9.497  -9.268   4.165
  680   1HG   PRO  85          HG2       PRO  85 -10.383  -9.897   6.827
  681   2HG   PRO  85          HG1       PRO  85  -9.113  -8.771   6.341
  682   1HD   PRO  85          HD2       PRO  85 -11.710  -8.136   7.409
  683   2HD   PRO  85          HD1       PRO  85 -10.447  -7.001   6.872
  684    H    CYS  86           HN       CYS  86 -12.456  -8.686   1.837
  685    HA   CYS  86           HA       CYS  86 -15.118  -9.318   2.140
  686   1HB   CYS  86          HB2       CYS  86 -13.404  -9.238   0.097
  687   2HB   CYS  86          HB1       CYS  86 -13.484 -10.994   0.273
  Start of MODEL   20
    1   1H    THR   1          HT1       THR   1  22.446  -4.668  -9.638
    2   2H    THR   1          HT2       THR   1  23.046  -4.688  -8.049
    3   3H    THR   1          HT3       THR   1  21.444  -4.209  -8.348
    4    HA   THR   1           HA       THR   1  21.458  -6.670  -9.445
    5    HB   THR   1           HB       THR   1  22.924  -7.073  -6.883
    6    HG1  THR   1           HG1      THR   1  24.850  -6.985  -8.478
    7   1HG2  THR   1          HG21      THR   1  23.066  -8.384  -9.612
    8   2HG2  THR   1          HG22      THR   1  22.087  -8.948  -8.256
    9   3HG2  THR   1          HG23      THR   1  23.847  -8.970  -8.143
   10    H    LYS   2           HN       LYS   2  21.356  -4.879  -6.385
   11    HA   LYS   2           HA       LYS   2  18.590  -5.829  -5.939
   12   1HB   LYS   2          HB2       LYS   2  19.424  -6.412  -3.508
   13   2HB   LYS   2          HB1       LYS   2  19.649  -7.584  -4.806
   14   1HG   LYS   2          HG2       LYS   2  21.734  -7.389  -3.575
   15   2HG   LYS   2          HG1       LYS   2  21.954  -6.660  -5.165
   16   1HD   LYS   2          HD2       LYS   2  22.067  -4.517  -4.323
   17   2HD   LYS   2          HD1       LYS   2  21.014  -4.886  -2.957
   18   1HE   LYS   2          HE2       LYS   2  23.480  -6.442  -2.839
   19   2HE   LYS   2          HE1       LYS   2  23.800  -4.696  -2.851
   20   1HZ   LYS   2          HZ1       LYS   2  23.306  -5.586  -0.604
   21   2HZ   LYS   2          HZ2       LYS   2  21.750  -6.006  -1.144
   22   3HZ   LYS   2          HZ3       LYS   2  22.226  -4.375  -1.098
   23    H    ALA   3           HN       ALA   3  19.614  -3.231  -6.536
   24    HA   ALA   3           HA       ALA   3  20.126  -1.572  -4.277
   25   1HB   ALA   3          HB1       ALA   3  19.532   0.210  -5.832
   26   2HB   ALA   3          HB2       ALA   3  18.635  -0.926  -6.840
   27   3HB   ALA   3          HB3       ALA   3  20.390  -1.047  -6.722
   28    H    SER   4           HN       SER   4  18.766  -0.896  -2.650
   29    HA   SER   4           HA       SER   4  16.186  -1.879  -2.176
   30   1HB   SER   4          HB2       SER   4  16.030   0.075  -0.630
   31   2HB   SER   4          HB1       SER   4  17.599  -0.721  -0.534
   32    HG   SER   4           HG       SER   4  17.359   1.736  -0.842
   33    H    CYS   5           HN       CYS   5  14.203  -0.213  -2.007
   34    HA   CYS   5           HA       CYS   5  13.791   0.833  -4.768
   35   1HB   CYS   5          HB2       CYS   5  11.791   0.428  -2.531
   36   2HB   CYS   5          HB1       CYS   5  11.456   0.559  -4.259
   37    H    LYS   6           HN       LYS   6  11.636   2.592  -3.998
   38    HA   LYS   6           HA       LYS   6  12.923   4.632  -2.251
   39   1HB   LYS   6          HB2       LYS   6  13.411   4.684  -4.885
   40   2HB   LYS   6          HB1       LYS   6  11.847   5.499  -4.903
   41   1HG   LYS   6          HG2       LYS   6  13.050   6.779  -2.823
   42   2HG   LYS   6          HG1       LYS   6  14.447   6.432  -3.844
   43   1HD   LYS   6          HD2       LYS   6  12.197   7.364  -5.429
   44   2HD   LYS   6          HD1       LYS   6  12.624   8.534  -4.179
   45   1HE   LYS   6          HE2       LYS   6  14.983   7.394  -5.509
   46   2HE   LYS   6          HE1       LYS   6  13.922   8.292  -6.613
   47   1HZ   LYS   6          HZ1       LYS   6  15.266   9.919  -5.623
   48   2HZ   LYS   6          HZ2       LYS   6  15.137   9.224  -4.078
   49   3HZ   LYS   6          HZ3       LYS   6  13.802  10.011  -4.773
   50    H    LEU   7           HN       LEU   7  11.242   4.776  -0.775
   51    HA   LEU   7           HA       LEU   7   8.560   4.286  -0.940
   52   1HB   LEU   7          HB2       LEU   7   8.336   6.196   0.713
   53   2HB   LEU   7          HB1       LEU   7   9.636   5.055   1.078
   54    HG   LEU   7           HG       LEU   7  10.681   7.052  -0.680
   55   1HD1  LEU   7          HD11      LEU   7  10.393   8.992   0.982
   56   2HD1  LEU   7          HD12      LEU   7   9.036   8.076   1.638
   57   3HD1  LEU   7          HD13      LEU   7   9.006   8.613  -0.041
   58   1HD2  LEU   7          HD21      LEU   7  11.085   6.429   2.263
   59   2HD2  LEU   7          HD22      LEU   7  12.133   7.494   1.325
   60   3HD2  LEU   7          HD23      LEU   7  12.016   5.783   0.912
   61    HA   PRO   8           HA       PRO   8   7.677   7.092  -4.441
   62   1HB   PRO   8          HB2       PRO   8   5.162   5.711  -4.667
   63   2HB   PRO   8          HB1       PRO   8   6.565   5.600  -5.740
   64   1HG   PRO   8          HG2       PRO   8   5.596   3.608  -3.934
   65   2HG   PRO   8          HG1       PRO   8   7.042   3.533  -4.947
   66   1HD   PRO   8          HD2       PRO   8   6.879   3.868  -2.065
   67   2HD   PRO   8          HD1       PRO   8   8.333   3.676  -3.074
   68    H    VAL   9           HN       VAL   9   5.537   6.090  -1.783
   69    HA   VAL   9           HA       VAL   9   4.188   8.764  -1.905
   70    HB   VAL   9           HB       VAL   9   3.243   6.285  -0.460
   71   1HG1  VAL   9          HG11      VAL   9   2.232   8.953  -0.991
   72   2HG1  VAL   9          HG12      VAL   9   1.589   7.714   0.088
   73   3HG1  VAL   9          HG13      VAL   9   1.130   7.726  -1.615
   74   1HG2  VAL   9          HG21      VAL   9   3.702   5.667  -2.812
   75   2HG2  VAL   9          HG22      VAL   9   2.734   7.036  -3.358
   76   3HG2  VAL   9          HG23      VAL   9   1.968   5.703  -2.495
   77    H    LYS  10           HN       LYS  10   3.412   9.426   0.420
   78    HA   LYS  10           HA       LYS  10   5.673   8.953   2.337
   79   1HB   LYS  10          HB2       LYS  10   4.814  11.281   1.112
   80   2HB   LYS  10          HB1       LYS  10   4.016  11.356   2.683
   81   1HG   LYS  10          HG2       LYS  10   6.098  11.158   3.851
   82   2HG   LYS  10          HG1       LYS  10   6.961  10.737   2.371
   83   1HD   LYS  10          HD2       LYS  10   6.798  12.930   1.511
   84   2HD   LYS  10          HD1       LYS  10   5.512  13.368   2.636
   85   1HE   LYS  10          HE2       LYS  10   6.980  13.807   4.350
   86   2HE   LYS  10          HE1       LYS  10   8.095  12.517   3.856
   87   1HZ   LYS  10          HZ1       LYS  10   9.246  14.335   3.124
   88   2HZ   LYS  10          HZ2       LYS  10   7.847  15.252   2.826
   89   3HZ   LYS  10          HZ3       LYS  10   8.310  14.027   1.744
   90    H    LYS  11           HN       LYS  11   2.703   7.861   1.854
   91    HA   LYS  11           HA       LYS  11   2.163   7.475   4.721
   92   1HB   LYS  11          HB2       LYS  11   0.051   8.630   4.716
   93   2HB   LYS  11          HB1       LYS  11   1.221   9.742   4.004
   94   1HG   LYS  11          HG2       LYS  11   0.452   8.520   1.756
   95   2HG   LYS  11          HG1       LYS  11  -1.011   8.247   2.701
   96   1HD   LYS  11          HD2       LYS  11  -1.650  10.387   2.433
   97   2HD   LYS  11          HD1       LYS  11  -0.104  10.967   3.054
   98   1HE   LYS  11          HE2       LYS  11   0.693  10.154   0.596
   99   2HE   LYS  11          HE1       LYS  11  -0.984  10.609   0.236
  100   1HZ   LYS  11          HZ1       LYS  11   0.756  12.325   1.900
  101   2HZ   LYS  11          HZ2       LYS  11  -0.671  12.744   1.079
  102   3HZ   LYS  11          HZ3       LYS  11   0.759  12.458   0.210
  103    H    ALA  12           HN       ALA  12   2.783   5.651   2.618
  104    HA   ALA  12           HA       ALA  12   0.242   4.440   1.717
  105   1HB   ALA  12          HB1       ALA  12   1.596   3.511   0.136
  106   2HB   ALA  12          HB2       ALA  12   2.796   3.018   1.330
  107   3HB   ALA  12          HB3       ALA  12   2.793   4.669   0.714
  108    H    THR  13           HN       THR  13  -0.276   2.194   2.238
  109    HA   THR  13           HA       THR  13   1.015   1.154   4.735
  110    HB   THR  13           HB       THR  13  -1.932   0.881   4.255
  111    HG1  THR  13           HG1      THR  13  -1.588   3.060   3.916
  112   1HG2  THR  13          HG21      THR  13  -1.542   1.514   6.874
  113   2HG2  THR  13          HG22      THR  13   0.002   0.752   6.488
  114   3HG2  THR  13          HG23      THR  13  -1.504  -0.134   6.249
  115    H    VAL  14           HN       VAL  14   1.784  -0.873   4.278
  116    HA   VAL  14           HA       VAL  14   0.187  -2.591   2.409
  117    HB   VAL  14           HB       VAL  14   2.529  -3.416   1.701
  118   1HG1  VAL  14          HG11      VAL  14   1.117  -0.914   1.022
  119   2HG1  VAL  14          HG12      VAL  14   1.674  -2.215  -0.030
  120   3HG1  VAL  14          HG13      VAL  14   2.802  -0.970   0.506
  121   1HG2  VAL  14          HG21      VAL  14   4.407  -2.256   2.360
  122   2HG2  VAL  14          HG22      VAL  14   3.417  -1.972   3.791
  123   3HG2  VAL  14          HG23      VAL  14   3.533  -0.735   2.540
  124    H    VAL  15           HN       VAL  15   1.000  -4.966   2.648
  125    HA   VAL  15           HA       VAL  15   1.334  -5.538   5.570
  126    HB   VAL  15           HB       VAL  15   0.148  -7.177   3.305
  127   1HG1  VAL  15          HG11      VAL  15  -0.470  -7.764   6.142
  128   2HG1  VAL  15          HG12      VAL  15   1.178  -8.132   5.635
  129   3HG1  VAL  15          HG13      VAL  15  -0.187  -8.872   4.799
  130   1HG2  VAL  15          HG21      VAL  15  -0.961  -4.952   4.341
  131   2HG2  VAL  15          HG22      VAL  15  -1.481  -6.112   5.563
  132   3HG2  VAL  15          HG23      VAL  15  -1.926  -6.353   3.874
  133    H    TYR  16           HN       TYR  16   3.648  -5.593   5.598
  134    HA   TYR  16           HA       TYR  16   5.066  -7.344   3.677
  135   1HB   TYR  16          HB2       TYR  16   5.831  -5.057   4.480
  136   2HB   TYR  16          HB1       TYR  16   6.109  -5.788   6.061
  137    HD1  TYR  16           HD1      TYR  16   8.414  -6.015   6.377
  138    HD2  TYR  16           HD2      TYR  16   6.693  -7.058   2.581
  139    HE1  TYR  16           HE1      TYR  16  10.619  -6.850   5.607
  140    HE2  TYR  16           HE2      TYR  16   8.898  -7.892   1.810
  141    HH   TYR  16           HH       TYR  16  11.414  -7.339   2.498
  142    H    GLN  17           HN       GLN  17   5.247  -9.498   4.150
  143    HA   GLN  17           HA       GLN  17   5.462 -11.490   5.401
  144   1HB   GLN  17          HB2       GLN  17   6.545  -9.545   7.457
  145   2HB   GLN  17          HB1       GLN  17   6.917 -11.267   7.335
  146   1HG   GLN  17          HG2       GLN  17   7.438 -10.117   4.787
  147   2HG   GLN  17          HG1       GLN  17   8.188  -9.071   5.992
  148   1HE2  GLN  17          HE21      GLN  17  10.108  -9.813   6.968
  149   2HE2  GLN  17          HE22      GLN  17  10.751 -11.367   6.743
  150    H    GLY  18           HN       GLY  18   2.909 -10.102   5.563
  151   1HA   GLY  18          HA2       GLY  18   0.918 -10.363   6.789
  152   2HA   GLY  18          HA1       GLY  18   1.801 -11.439   7.873
  153    H    GLU  19           HN       GLU  19   2.921  -8.178   7.246
  154    HA   GLU  19           HA       GLU  19   1.934  -7.344   9.952
  155   1HB   GLU  19          HB2       GLU  19   4.708  -7.142   8.740
  156   2HB   GLU  19          HB1       GLU  19   4.229  -6.299  10.213
  157   1HG   GLU  19          HG2       GLU  19   3.390  -8.777  10.851
  158   2HG   GLU  19          HG1       GLU  19   4.712  -9.201   9.764
  159    H    ARG  20           HN       ARG  20   0.831  -5.437   9.775
  160    HA   ARG  20           HA       ARG  20   0.897  -3.886   7.293
  161   1HB   ARG  20          HB2       ARG  20  -0.577  -3.910   9.904
  162   2HB   ARG  20          HB1       ARG  20  -0.658  -2.454   8.904
  163   1HG   ARG  20          HG2       ARG  20  -1.529  -3.703   7.033
  164   2HG   ARG  20          HG1       ARG  20  -1.250  -5.235   7.858
  165   1HD   ARG  20          HD2       ARG  20  -2.955  -3.253   9.294
  166   2HD   ARG  20          HD1       ARG  20  -3.665  -4.051   7.875
  167    HE   ARG  20           HE       ARG  20  -3.506  -6.141   9.009
  168   1HH1  ARG  20          HH11      ARG  20  -3.636  -3.929  11.322
  169   2HH1  ARG  20          HH12      ARG  20  -2.584  -4.695  12.464
  170   1HH2  ARG  20          HH21      ARG  20  -1.362  -7.006  10.186
  171   2HH2  ARG  20          HH22      ARG  20  -1.295  -6.438  11.820
  172    H    VAL  21           HN       VAL  21   2.055  -2.021   6.951
  173    HA   VAL  21           HA       VAL  21   3.109  -0.464   9.237
  174    HB   VAL  21           HB       VAL  21   5.433  -0.741   8.440
  175   1HG1  VAL  21          HG11      VAL  21   4.162  -3.474   8.718
  176   2HG1  VAL  21          HG12      VAL  21   4.330  -2.365  10.080
  177   3HG1  VAL  21          HG13      VAL  21   5.766  -2.966   9.249
  178   1HG2  VAL  21          HG21      VAL  21   4.796  -3.023   6.689
  179   2HG2  VAL  21          HG22      VAL  21   5.950  -1.712   6.449
  180   3HG2  VAL  21          HG23      VAL  21   4.247  -1.469   6.060
  181    H    LYS  22           HN       LYS  22   4.019   1.620   8.484
  182    HA   LYS  22           HA       LYS  22   2.718   2.520   5.971
  183   1HB   LYS  22          HB2       LYS  22   3.798   3.738   8.487
  184   2HB   LYS  22          HB1       LYS  22   3.662   4.758   7.054
  185   1HG   LYS  22          HG2       LYS  22   1.317   3.047   7.746
  186   2HG   LYS  22          HG1       LYS  22   1.622   4.456   8.763
  187   1HD   LYS  22          HD2       LYS  22   1.861   5.736   6.501
  188   2HD   LYS  22          HD1       LYS  22   1.003   4.355   5.817
  189   1HE   LYS  22          HE2       LYS  22  -0.821   4.695   7.493
  190   2HE   LYS  22          HE1       LYS  22   0.019   6.151   8.063
  191   1HZ   LYS  22          HZ1       LYS  22   0.072   6.536   5.429
  192   2HZ   LYS  22          HZ2       LYS  22  -1.164   7.133   6.429
  193   3HZ   LYS  22          HZ3       LYS  22  -1.392   5.689   5.563
  194    H    ILE  23           HN       ILE  23   3.988   2.335   4.165
  195    HA   ILE  23           HA       ILE  23   6.725   1.881   3.959
  196    HB   ILE  23           HB       ILE  23   4.975   1.881   2.156
  197   1HG1  ILE  23          HG12      ILE  23   7.432   3.573   1.586
  198   2HG1  ILE  23          HG11      ILE  23   7.387   1.810   1.596
  199   1HG2  ILE  23          HG21      ILE  23   3.862   3.972   2.613
  200   2HG2  ILE  23          HG22      ILE  23   4.605   4.111   1.020
  201   3HG2  ILE  23          HG23      ILE  23   5.364   4.875   2.416
  202   1HD1  ILE  23          HD11      ILE  23   5.856   3.646  -0.267
  203   2HD1  ILE  23          HD12      ILE  23   5.637   1.898  -0.196
  204   3HD1  ILE  23          HD13      ILE  23   7.185   2.573  -0.703
  205    H    GLN  24           HN       GLN  24   5.124   4.868   4.812
  206    HA   GLN  24           HA       GLN  24   7.439   6.577   4.250
  207   1HB   GLN  24          HB2       GLN  24   5.975   8.282   5.296
  208   2HB   GLN  24          HB1       GLN  24   5.095   7.335   4.093
  209   1HG   GLN  24          HG2       GLN  24   3.671   6.523   5.643
  210   2HG   GLN  24          HG1       GLN  24   4.993   6.096   6.730
  211   1HE2  GLN  24          HE21      GLN  24   2.553   7.277   7.700
  212   2HE2  GLN  24          HE22      GLN  24   2.919   8.822   8.302
  213    H    GLU  25           HN       GLU  25   6.709   4.369   6.698
  214    HA   GLU  25           HA       GLU  25   8.526   5.805   8.605
  215   1HB   GLU  25          HB2       GLU  25   5.976   4.240   9.035
  216   2HB   GLU  25          HB1       GLU  25   7.093   4.584  10.355
  217   1HG   GLU  25          HG2       GLU  25   6.931   7.028   9.749
  218   2HG   GLU  25          HG1       GLU  25   5.647   6.599   8.618
  219    H    LYS  26           HN       LYS  26   7.307   2.651   7.479
  220    HA   LYS  26           HA       LYS  26   9.364   1.146   8.915
  221   1HB   LYS  26          HB2       LYS  26   6.908   0.575   8.027
  222   2HB   LYS  26          HB1       LYS  26   7.810   0.060   6.597
  223   1HG   LYS  26          HG2       LYS  26   8.539  -0.844   9.390
  224   2HG   LYS  26          HG1       LYS  26   7.415  -1.739   8.367
  225   1HD   LYS  26          HD2       LYS  26   9.146  -1.937   6.624
  226   2HD   LYS  26          HD1       LYS  26  10.274  -1.034   7.637
  227   1HE   LYS  26          HE2       LYS  26  10.900  -3.045   8.495
  228   2HE   LYS  26          HE1       LYS  26   9.324  -3.075   9.310
  229   1HZ   LYS  26          HZ1       LYS  26   8.343  -4.214   7.545
  230   2HZ   LYS  26          HZ2       LYS  26   9.845  -4.987   7.726
  231   3HZ   LYS  26          HZ3       LYS  26   9.611  -3.860   6.476
  232    H    PHE  27           HN       PHE  27   8.818   2.236   5.570
  233    HA   PHE  27           HA       PHE  27  11.501   1.161   4.804
  234   1HB   PHE  27          HB2       PHE  27   9.039   2.064   3.285
  235   2HB   PHE  27          HB1       PHE  27  10.557   1.646   2.484
  236    HD1  PHE  27           HD1      PHE  27   7.518   0.327   2.889
  237    HD2  PHE  27           HD2      PHE  27  11.561  -0.625   3.981
  238    HE1  PHE  27           HE1      PHE  27   6.920  -2.078   3.005
  239    HE2  PHE  27           HE2      PHE  27  10.965  -3.028   4.096
  240    HZ   PHE  27           HZ       PHE  27   8.645  -3.755   3.609
  241    H    LYS  28           HN       LYS  28  11.316   3.566   6.424
  242    HA   LYS  28           HA       LYS  28  11.296   6.048   5.210
  243   1HB   LYS  28          HB2       LYS  28  12.489   4.760   7.490
  244   2HB   LYS  28          HB1       LYS  28  13.633   5.924   6.822
  245   1HG   LYS  28          HG2       LYS  28  12.378   7.693   7.471
  246   2HG   LYS  28          HG1       LYS  28  10.883   6.938   6.917
  247   1HD   LYS  28          HD2       LYS  28  10.355   6.305   9.010
  248   2HD   LYS  28          HD1       LYS  28  11.924   5.528   9.217
  249   1HE   LYS  28          HE2       LYS  28  12.855   7.375  10.248
  250   2HE   LYS  28          HE1       LYS  28  11.851   8.517   9.332
  251   1HZ   LYS  28          HZ1       LYS  28  10.604   6.609  11.200
  252   2HZ   LYS  28          HZ2       LYS  28  10.013   8.101  10.642
  253   3HZ   LYS  28          HZ3       LYS  28  11.264   8.055  11.789
  254    H    ASN  29           HN       ASN  29  13.966   3.674   5.068
  255    HA   ASN  29           HA       ASN  29  15.408   5.434   3.141
  256   1HB   ASN  29          HB2       ASN  29  16.244   2.831   4.450
  257   2HB   ASN  29          HB1       ASN  29  17.298   4.008   3.662
  258   1HD2  ASN  29          HD21      ASN  29  16.217   6.418   4.753
  259   2HD2  ASN  29          HD22      ASN  29  16.500   6.429   6.426
  260    H    GLY  30           HN       GLY  30  13.186   4.492   1.904
  261   1HA   GLY  30          HA2       GLY  30  12.552   3.351  -0.049
  262   2HA   GLY  30          HA1       GLY  30  14.242   2.889  -0.244
  263    H    MET  31           HN       MET  31  12.633   0.933  -0.940
  264    HA   MET  31           HA       MET  31  12.181  -0.821   1.438
  265   1HB   MET  31          HB2       MET  31  11.278  -1.020  -1.456
  266   2HB   MET  31          HB1       MET  31  10.748  -2.069  -0.140
  267   1HG   MET  31          HG2       MET  31   9.682  -0.226   0.995
  268   2HG   MET  31          HG1       MET  31  10.380   0.937  -0.131
  269   1HE   MET  31          HE1       MET  31   8.741  -2.246   0.233
  270   2HE   MET  31          HE2       MET  31   7.877  -2.570  -1.268
  271   3HE   MET  31          HE3       MET  31   7.062  -1.725   0.045
  272    H    LEU  32           HN       LEU  32  12.758  -3.181   1.059
  273    HA   LEU  32           HA       LEU  32  15.512  -3.387   0.084
  274   1HB   LEU  32          HB2       LEU  32  13.571  -5.488   1.091
  275   2HB   LEU  32          HB1       LEU  32  15.330  -5.636   1.020
  276    HG   LEU  32           HG       LEU  32  13.955  -3.445   2.589
  277   1HD1  LEU  32          HD11      LEU  32  13.218  -5.657   3.435
  278   2HD1  LEU  32          HD12      LEU  32  14.272  -4.838   4.588
  279   3HD1  LEU  32          HD13      LEU  32  14.905  -6.147   3.590
  280   1HD2  LEU  32          HD21      LEU  32  16.642  -4.016   1.881
  281   2HD2  LEU  32          HD22      LEU  32  16.484  -4.399   3.595
  282   3HD2  LEU  32          HD23      LEU  32  16.069  -2.787   3.010
  283    H    HIS  33           HN       HIS  33  16.190  -4.803  -1.646
  284    HA   HIS  33           HA       HIS  33  14.546  -4.788  -3.990
  285   1HB   HIS  33          HB2       HIS  33  16.958  -4.821  -4.098
  286   2HB   HIS  33          HB1       HIS  33  17.026  -6.323  -3.171
  287    HD1  HIS  33           HD1      HIS  33  15.993  -4.992  -6.559
  288    HD2  HIS  33           HD2      HIS  33  16.628  -8.661  -4.683
  289    HE1  HIS  33           HE1      HIS  33  15.893  -6.752  -8.377
  290    H    GLY  34           HN       GLY  34  13.255  -6.412  -4.898
  291   1HA   GLY  34          HA2       GLY  34  12.021  -8.408  -5.020
  292   2HA   GLY  34          HA1       GLY  34  13.238  -9.142  -3.973
  293    H    ASP  35           HN       ASP  35  11.949  -6.289  -2.655
  294    HA   ASP  35           HA       ASP  35  10.728  -7.706  -0.442
  295   1HB   ASP  35          HB2       ASP  35  11.845  -5.515  -0.268
  296   2HB   ASP  35          HB1       ASP  35  10.635  -4.805  -1.337
  297    H    LYS  36           HN       LYS  36   8.703  -8.600  -0.490
  298    HA   LYS  36           HA       LYS  36   6.756  -7.650  -2.538
  299   1HB   LYS  36          HB2       LYS  36   7.328 -10.135  -1.010
  300   2HB   LYS  36          HB1       LYS  36   5.633  -9.827  -1.392
  301   1HG   LYS  36          HG2       LYS  36   6.622  -9.285  -3.794
  302   2HG   LYS  36          HG1       LYS  36   7.931 -10.332  -3.243
  303   1HD   LYS  36          HD2       LYS  36   6.660 -12.186  -3.456
  304   2HD   LYS  36          HD1       LYS  36   5.307 -11.439  -2.605
  305   1HE   LYS  36          HE2       LYS  36   4.725 -10.203  -4.714
  306   2HE   LYS  36          HE1       LYS  36   5.992 -11.122  -5.549
  307   1HZ   LYS  36          HZ1       LYS  36   4.945 -13.171  -4.852
  308   2HZ   LYS  36          HZ2       LYS  36   3.825 -12.224  -5.711
  309   3HZ   LYS  36          HZ3       LYS  36   3.742 -12.316  -4.016
  310    H    VAL  37           HN       VAL  37   5.099  -6.360  -1.908
  311    HA   VAL  37           HA       VAL  37   4.158  -6.476   0.932
  312    HB   VAL  37           HB       VAL  37   4.189  -4.048   1.003
  313   1HG1  VAL  37          HG11      VAL  37   6.313  -4.927   1.602
  314   2HG1  VAL  37          HG12      VAL  37   6.669  -3.637   0.453
  315   3HG1  VAL  37          HG13      VAL  37   6.711  -5.321  -0.070
  316   1HG2  VAL  37          HG21      VAL  37   5.069  -4.239  -1.896
  317   2HG2  VAL  37          HG22      VAL  37   5.016  -2.748  -0.957
  318   3HG2  VAL  37          HG23      VAL  37   3.524  -3.617  -1.317
  319    H    SER  38           HN       SER  38   1.901  -6.265   1.111
  320    HA   SER  38           HA       SER  38   0.406  -6.168  -1.473
  321   1HB   SER  38          HB2       SER  38  -0.905  -6.887   1.095
  322   2HB   SER  38          HB1       SER  38  -1.008  -7.678  -0.479
  323    HG   SER  38           HG       SER  38   0.997  -7.874   1.504
  324    H    PHE  39           HN       PHE  39  -1.093  -4.546  -1.845
  325    HA   PHE  39           HA       PHE  39  -1.254  -2.363   0.179
  326   1HB   PHE  39          HB2       PHE  39  -1.734  -2.650  -2.787
  327   2HB   PHE  39          HB1       PHE  39  -2.322  -1.232  -1.911
  328    HD1  PHE  39           HD1      PHE  39  -0.707   0.253  -0.708
  329    HD2  PHE  39           HD2      PHE  39   0.600  -2.955  -3.249
  330    HE1  PHE  39           HE1      PHE  39   1.564   1.246  -0.794
  331    HE2  PHE  39           HE2      PHE  39   2.869  -1.961  -3.336
  332    HZ   PHE  39           HZ       PHE  39   3.353   0.138  -2.108
  333    H    PHE  40           HN       PHE  40  -3.292  -1.683   0.986
  334    HA   PHE  40           HA       PHE  40  -5.408  -3.707   0.936
  335   1HB   PHE  40          HB2       PHE  40  -4.775  -1.136   2.331
  336   2HB   PHE  40          HB1       PHE  40  -6.447  -1.708   2.362
  337    HD1  PHE  40           HD1      PHE  40  -3.671  -1.676   4.309
  338    HD2  PHE  40           HD2      PHE  40  -6.364  -4.534   2.569
  339    HE1  PHE  40           HE1      PHE  40  -3.082  -3.310   6.079
  340    HE2  PHE  40           HE2      PHE  40  -5.774  -6.168   4.339
  341    HZ   PHE  40           HZ       PHE  40  -4.133  -5.556   6.094
  342    H    CYS  41           HN       CYS  41  -7.301  -3.605  -0.223
  343    HA   CYS  41           HA       CYS  41  -7.993  -1.066  -1.640
  344   1HB   CYS  41          HB2       CYS  41  -7.480  -3.826  -2.747
  345   2HB   CYS  41          HB1       CYS  41  -8.523  -2.690  -3.610
  346    H    LYS  42           HN       LYS  42 -10.314  -1.423  -2.670
  347    HA   LYS  42           HA       LYS  42 -11.964  -2.938  -0.672
  348   1HB   LYS  42          HB2       LYS  42 -13.655  -1.136  -1.188
  349   2HB   LYS  42          HB1       LYS  42 -12.168  -0.537  -0.445
  350   1HG   LYS  42          HG2       LYS  42 -11.988  -0.669  -3.362
  351   2HG   LYS  42          HG1       LYS  42 -13.278   0.401  -2.810
  352   1HD   LYS  42          HD2       LYS  42 -10.441   0.506  -1.751
  353   2HD   LYS  42          HD1       LYS  42 -11.040   1.537  -3.052
  354   1HE   LYS  42          HE2       LYS  42 -12.610   1.421  -0.495
  355   2HE   LYS  42          HE1       LYS  42 -11.131   2.401  -0.549
  356   1HZ   LYS  42          HZ1       LYS  42 -12.850   2.599  -2.877
  357   2HZ   LYS  42          HZ2       LYS  42 -12.005   3.816  -2.044
  358   3HZ   LYS  42          HZ3       LYS  42 -13.497   3.257  -1.454
  359    H    ASN  43           HN       ASN  43 -13.773  -4.079  -1.466
  360    HA   ASN  43           HA       ASN  43 -13.892  -4.423  -4.448
  361   1HB   ASN  43          HB2       ASN  43 -12.980  -6.275  -2.851
  362   2HB   ASN  43          HB1       ASN  43 -14.675  -6.498  -2.402
  363   1HD2  ASN  43          HD21      ASN  43 -12.300  -7.268  -4.783
  364   2HD2  ASN  43          HD22      ASN  43 -13.346  -7.975  -5.916
  365    H    LYS  44           HN       LYS  44 -15.801  -3.595  -5.210
  366    HA   LYS  44           HA       LYS  44 -18.039  -2.946  -3.494
  367   1HB   LYS  44          HB2       LYS  44 -17.057  -2.343  -6.054
  368   2HB   LYS  44          HB1       LYS  44 -18.622  -3.107  -6.336
  369   1HG   LYS  44          HG2       LYS  44 -19.686  -1.244  -5.661
  370   2HG   LYS  44          HG1       LYS  44 -18.853  -1.307  -4.108
  371   1HD   LYS  44          HD2       LYS  44 -16.889  -0.426  -5.878
  372   2HD   LYS  44          HD1       LYS  44 -18.345   0.419  -6.406
  373   1HE   LYS  44          HE2       LYS  44 -18.453   0.583  -3.616
  374   2HE   LYS  44          HE1       LYS  44 -16.745   0.862  -4.009
  375   1HZ   LYS  44          HZ1       LYS  44 -17.233   2.647  -5.326
  376   2HZ   LYS  44          HZ2       LYS  44 -18.479   2.801  -4.183
  377   3HZ   LYS  44          HZ3       LYS  44 -18.795   2.102  -5.698
  378    H    GLU  45           HN       GLU  45 -17.450  -5.535  -5.891
  379    HA   GLU  45           HA       GLU  45 -20.058  -6.693  -5.826
  380   1HB   GLU  45          HB2       GLU  45 -18.359  -7.170  -7.521
  381   2HB   GLU  45          HB1       GLU  45 -17.310  -7.891  -6.299
  382   1HG   GLU  45          HG2       GLU  45 -19.125  -9.567  -5.826
  383   2HG   GLU  45          HG1       GLU  45 -20.020  -8.910  -7.195
  384    H    LYS  46           HN       LYS  46 -17.274  -7.075  -3.677
  385    HA   LYS  46           HA       LYS  46 -18.737  -9.172  -2.133
  386   1HB   LYS  46          HB2       LYS  46 -15.880  -8.172  -1.964
  387   2HB   LYS  46          HB1       LYS  46 -16.526  -9.627  -1.199
  388   1HG   LYS  46          HG2       LYS  46 -17.228  -9.856  -3.908
  389   2HG   LYS  46          HG1       LYS  46 -15.568  -9.260  -3.915
  390   1HD   LYS  46          HD2       LYS  46 -14.801 -11.094  -2.590
  391   2HD   LYS  46          HD1       LYS  46 -16.449 -11.588  -2.197
  392   1HE   LYS  46          HE2       LYS  46 -16.824 -12.035  -4.658
  393   2HE   LYS  46          HE1       LYS  46 -15.089 -11.756  -4.905
  394   1HZ   LYS  46          HZ1       LYS  46 -14.551 -13.481  -3.394
  395   2HZ   LYS  46          HZ2       LYS  46 -15.714 -14.125  -4.451
  396   3HZ   LYS  46          HZ3       LYS  46 -16.160 -13.643  -2.884
  397    H    LYS  47           HN       LYS  47 -17.843  -5.838  -2.045
  398    HA   LYS  47           HA       LYS  47 -18.320  -4.169  -0.449
  399   1HB   LYS  47          HB2       LYS  47 -19.670  -6.382   1.107
  400   2HB   LYS  47          HB1       LYS  47 -20.049  -4.660   1.121
  401   1HG   LYS  47          HG2       LYS  47 -21.163  -4.742  -0.904
  402   2HG   LYS  47          HG1       LYS  47 -20.228  -6.115  -1.491
  403   1HD   LYS  47          HD2       LYS  47 -21.891  -7.482  -0.850
  404   2HD   LYS  47          HD1       LYS  47 -21.598  -7.006   0.824
  405   1HE   LYS  47          HE2       LYS  47 -23.640  -6.024   0.826
  406   2HE   LYS  47          HE1       LYS  47 -23.028  -4.863  -0.369
  407   1HZ   LYS  47          HZ1       LYS  47 -24.385  -7.446  -0.837
  408   2HZ   LYS  47          HZ2       LYS  47 -23.387  -6.758  -2.028
  409   3HZ   LYS  47          HZ3       LYS  47 -24.762  -5.922  -1.480
  410    H    CYS  48           HN       CYS  48 -15.916  -5.987  -0.254
  411    HA   CYS  48           HA       CYS  48 -15.262  -5.369   2.605
  412   1HB   CYS  48          HB2       CYS  48 -14.233  -7.868   1.302
  413   2HB   CYS  48          HB1       CYS  48 -14.511  -7.539   3.012
  414    H    SER  49           HN       SER  49 -12.675  -5.981   2.717
  415    HA   SER  49           HA       SER  49 -11.471  -4.580   0.360
  416   1HB   SER  49          HB2       SER  49  -9.653  -4.276   2.313
  417   2HB   SER  49          HB1       SER  49 -11.027  -3.189   2.140
  418    HG   SER  49           HG       SER  49 -10.803  -5.465   3.825
  419    H    TYR  50           HN       TYR  50  -9.124  -5.224   0.060
  420    HA   TYR  50           HA       TYR  50  -8.363  -7.926   0.949
  421   1HB   TYR  50          HB2       TYR  50  -8.246  -8.700  -1.463
  422   2HB   TYR  50          HB1       TYR  50  -9.888  -8.434  -0.866
  423    HD1  TYR  50           HD1      TYR  50  -7.163  -7.018  -2.932
  424    HD2  TYR  50           HD2      TYR  50 -11.276  -6.670  -1.745
  425    HE1  TYR  50           HE1      TYR  50  -7.544  -5.375  -4.748
  426    HE2  TYR  50           HE2      TYR  50 -11.658  -5.028  -3.564
  427    HH   TYR  50           HH       TYR  50 -10.540  -3.586  -5.003
  428    H    THR  51           HN       THR  51  -6.114  -8.425   0.180
  429    HA   THR  51           HA       THR  51  -4.575  -5.897  -0.149
  430    HB   THR  51           HB       THR  51  -2.685  -7.456   0.519
  431    HG1  THR  51           HG1      THR  51  -3.857  -9.346  -0.214
  432   1HG2  THR  51          HG21      THR  51  -5.020  -7.494   2.440
  433   2HG2  THR  51          HG22      THR  51  -4.077  -6.041   2.105
  434   3HG2  THR  51          HG23      THR  51  -3.300  -7.447   2.832
  435    H    GLU  52           HN       GLU  52  -3.143  -5.587  -1.836
  436    HA   GLU  52           HA       GLU  52  -3.256  -7.573  -4.085
  437   1HB   GLU  52          HB2       GLU  52  -3.865  -4.820  -3.907
  438   2HB   GLU  52          HB1       GLU  52  -2.332  -4.911  -4.775
  439   1HG   GLU  52          HG2       GLU  52  -4.862  -6.430  -5.475
  440   2HG   GLU  52          HG1       GLU  52  -4.208  -5.049  -6.355
  441    H    ASP  53           HN       ASP  53  -1.417  -8.756  -3.231
  442    HA   ASP  53           HA       ASP  53   0.990  -7.877  -2.238
  443   1HB   ASP  53          HB2       ASP  53   0.576  -9.984  -4.372
  444   2HB   ASP  53          HB1       ASP  53   1.936  -9.899  -3.246
  445    H    ALA  54           HN       ALA  54   2.859  -6.984  -3.014
  446    HA   ALA  54           HA       ALA  54   3.004  -6.253  -5.916
  447   1HB   ALA  54          HB1       ALA  54   3.244  -4.034  -5.366
  448   2HB   ALA  54          HB2       ALA  54   4.147  -4.400  -3.896
  449   3HB   ALA  54          HB3       ALA  54   2.389  -4.519  -3.902
  450    H    GLN  55           HN       GLN  55   5.402  -5.567  -6.410
  451    HA   GLN  55           HA       GLN  55   7.302  -7.142  -4.706
  452   1HB   GLN  55          HB2       GLN  55   6.347  -8.230  -6.886
  453   2HB   GLN  55          HB1       GLN  55   7.436  -7.118  -7.715
  454   1HG   GLN  55          HG2       GLN  55   8.940  -8.261  -5.611
  455   2HG   GLN  55          HG1       GLN  55   8.068  -9.593  -6.371
  456   1HE2  GLN  55          HE21      GLN  55   9.199 -10.490  -8.092
  457   2HE2  GLN  55          HE22      GLN  55  10.269  -9.648  -9.106
  458    H    CYS  56           HN       CYS  56   9.383  -6.241  -4.571
  459    HA   CYS  56           HA       CYS  56   9.675  -3.510  -5.737
  460   1HB   CYS  56          HB2       CYS  56  10.034  -4.640  -3.195
  461   2HB   CYS  56          HB1       CYS  56  11.668  -4.375  -3.801
  462    H    ILE  57           HN       ILE  57  11.573  -2.986  -6.909
  463    HA   ILE  57           HA       ILE  57  13.393  -5.265  -7.600
  464    HB   ILE  57           HB       ILE  57  11.912  -3.305  -9.374
  465   1HG1  ILE  57          HG12      ILE  57  10.823  -5.465  -8.681
  466   2HG1  ILE  57          HG11      ILE  57  11.063  -5.323 -10.424
  467   1HG2  ILE  57          HG21      ILE  57  14.208  -5.145 -10.111
  468   2HG2  ILE  57          HG22      ILE  57  14.239  -3.382 -10.145
  469   3HG2  ILE  57          HG23      ILE  57  13.206  -4.266 -11.265
  470   1HD1  ILE  57          HD11      ILE  57  11.761  -7.545  -9.703
  471   2HD1  ILE  57          HD12      ILE  57  12.826  -6.846  -8.484
  472   3HD1  ILE  57          HD13      ILE  57  13.182  -6.624 -10.198
  473    H    ASP  58           HN       ASP  58  15.399  -4.312  -8.789
  474    HA   ASP  58           HA       ASP  58  16.961  -2.726  -7.177
  475   1HB   ASP  58          HB2       ASP  58  17.267  -3.992  -9.499
  476   2HB   ASP  58          HB1       ASP  58  17.146  -2.349 -10.137
  477    H    GLY  59           HN       GLY  59  16.021  -0.866  -6.279
  478   1HA   GLY  59          HA2       GLY  59  15.225   1.336  -6.175
  479   2HA   GLY  59          HA1       GLY  59  16.269   1.594  -7.570
  480    H    THR  60           HN       THR  60  13.729  -0.721  -8.018
  481    HA   THR  60           HA       THR  60  11.994   1.380  -9.258
  482    HB   THR  60           HB       THR  60  12.831  -1.201 -10.600
  483    HG1  THR  60           HG1      THR  60  14.210   0.118 -11.806
  484   1HG2  THR  60          HG21      THR  60  10.646  -0.059 -11.231
  485   2HG2  THR  60          HG22      THR  60  11.795  -0.283 -12.551
  486   3HG2  THR  60          HG23      THR  60  11.621   1.299 -11.792
  487    H    ILE  61           HN       ILE  61   9.793   0.916  -9.073
  488    HA   ILE  61           HA       ILE  61   8.931  -1.836  -8.397
  489    HB   ILE  61           HB       ILE  61   9.463  -1.031  -6.226
  490   1HG1  ILE  61          HG12      ILE  61   6.695  -0.095  -6.013
  491   2HG1  ILE  61          HG11      ILE  61   6.839  -1.585  -6.948
  492   1HG2  ILE  61          HG21      ILE  61   8.612   1.228  -5.459
  493   2HG2  ILE  61          HG22      ILE  61   8.167   1.552  -7.135
  494   3HG2  ILE  61          HG23      ILE  61   9.858   1.298  -6.706
  495   1HD1  ILE  61          HD11      ILE  61   7.660  -1.069  -4.095
  496   2HD1  ILE  61          HD12      ILE  61   8.377  -2.388  -5.017
  497   3HD1  ILE  61          HD13      ILE  61   6.638  -2.356  -4.733
  498    H    GLU  62           HN       GLU  62   6.776  -2.185  -8.990
  499    HA   GLU  62           HA       GLU  62   5.489  -0.007 -10.542
  500   1HB   GLU  62          HB2       GLU  62   4.697  -2.911 -10.154
  501   2HB   GLU  62          HB1       GLU  62   4.179  -1.834 -11.452
  502   1HG   GLU  62          HG2       GLU  62   6.930  -1.680 -11.619
  503   2HG   GLU  62          HG1       GLU  62   6.669  -3.369 -11.182
  504    H    VAL  63           HN       VAL  63   2.821  -1.189 -10.165
  505    HA   VAL  63           HA       VAL  63   2.201  -0.824  -7.298
  506    HB   VAL  63           HB       VAL  63   1.517   1.097  -9.524
  507   1HG1  VAL  63          HG11      VAL  63  -0.573   0.392  -8.286
  508   2HG1  VAL  63          HG12      VAL  63  -0.186   2.107  -8.147
  509   3HG1  VAL  63          HG13      VAL  63   0.171   1.013  -6.812
  510   1HG2  VAL  63          HG21      VAL  63   2.652   1.361  -6.724
  511   2HG2  VAL  63          HG22      VAL  63   2.228   2.734  -7.745
  512   3HG2  VAL  63          HG23      VAL  63   3.505   1.625  -8.244
  513    HA   PRO  64           HA       PRO  64  -0.851  -3.810  -8.443
  514   1HB   PRO  64          HB2       PRO  64  -2.652  -2.890  -6.388
  515   2HB   PRO  64          HB1       PRO  64  -1.603  -4.315  -6.372
  516   1HG   PRO  64          HG2       PRO  64  -1.283  -1.896  -4.872
  517   2HG   PRO  64          HG1       PRO  64  -0.213  -3.302  -4.900
  518   1HD   PRO  64          HD2       PRO  64   0.251  -0.691  -6.055
  519   2HD   PRO  64          HD1       PRO  64   1.342  -2.098  -6.049
  520    H    LYS  65           HN       LYS  65  -3.098  -3.877  -9.270
  521    HA   LYS  65           HA       LYS  65  -3.754  -1.499 -10.818
  522   1HB   LYS  65          HB2       LYS  65  -4.027  -4.210 -11.058
  523   2HB   LYS  65          HB1       LYS  65  -5.671  -3.742 -10.625
  524   1HG   LYS  65          HG2       LYS  65  -5.182  -1.841 -12.453
  525   2HG   LYS  65          HG1       LYS  65  -4.093  -3.086 -13.066
  526   1HD   LYS  65          HD2       LYS  65  -5.829  -4.596 -13.469
  527   2HD   LYS  65          HD1       LYS  65  -6.909  -3.817 -12.314
  528   1HE   LYS  65          HE2       LYS  65  -7.323  -1.976 -13.793
  529   2HE   LYS  65          HE1       LYS  65  -6.002  -2.464 -14.873
  530   1HZ   LYS  65          HZ1       LYS  65  -8.428  -3.194 -15.406
  531   2HZ   LYS  65          HZ2       LYS  65  -8.134  -4.386 -14.231
  532   3HZ   LYS  65          HZ3       LYS  65  -7.152  -4.293 -15.615
  533    H    CYS  66           HN       CYS  66  -5.032  -3.005  -7.877
  534    HA   CYS  66           HA       CYS  66  -7.492  -1.416  -7.893
  535   1HB   CYS  66          HB2       CYS  66  -7.923  -2.596  -5.840
  536   2HB   CYS  66          HB1       CYS  66  -7.134  -3.737  -6.928
  537    H    PHE  67           HN       PHE  67  -4.243  -0.981  -6.675
  538    HA   PHE  67           HA       PHE  67  -5.083   1.145  -4.788
  539   1HB   PHE  67          HB2       PHE  67  -3.339  -0.413  -4.127
  540   2HB   PHE  67          HB1       PHE  67  -2.416  -0.058  -5.587
  541    HD1  PHE  67           HD1      PHE  67  -0.498   1.164  -5.060
  542    HD2  PHE  67           HD2      PHE  67  -4.194   2.096  -3.081
  543    HE1  PHE  67           HE1      PHE  67   0.599   3.067  -3.909
  544    HE2  PHE  67           HE2      PHE  67  -3.097   4.000  -1.930
  545    HZ   PHE  67           HZ       PHE  67  -0.701   4.484  -2.343
  546    H    LYS  68           HN       LYS  68  -4.443   3.344  -5.040
  547    HA   LYS  68           HA       LYS  68  -3.084   4.193  -7.527
  548   1HB   LYS  68          HB2       LYS  68  -5.651   3.807  -7.829
  549   2HB   LYS  68          HB1       LYS  68  -5.822   5.290  -6.891
  550   1HG   LYS  68          HG2       LYS  68  -3.914   6.046  -8.687
  551   2HG   LYS  68          HG1       LYS  68  -4.851   4.912  -9.659
  552   1HD   LYS  68          HD2       LYS  68  -6.847   6.151  -9.398
  553   2HD   LYS  68          HD1       LYS  68  -6.205   7.057  -8.026
  554   1HE   LYS  68          HE2       LYS  68  -6.101   8.577  -9.873
  555   2HE   LYS  68          HE1       LYS  68  -4.443   7.970  -9.697
  556   1HZ   LYS  68          HZ1       LYS  68  -5.540   6.064 -11.210
  557   2HZ   LYS  68          HZ2       LYS  68  -4.704   7.399 -11.846
  558   3HZ   LYS  68          HZ3       LYS  68  -6.402   7.415 -11.767
  559    H    GLU  69           HN       GLU  69  -1.666   5.728  -6.786
  560    HA   GLU  69           HA       GLU  69  -1.971   7.026  -4.212
  561   1HB   GLU  69          HB2       GLU  69   0.203   6.480  -5.143
  562   2HB   GLU  69          HB1       GLU  69  -0.131   7.432  -6.589
  563   1HG   GLU  69          HG2       GLU  69  -0.568   9.274  -4.597
  564   2HG   GLU  69          HG1       GLU  69   0.753   8.319  -3.923
  565    H    HIS  70           HN       HIS  70  -3.415   8.666  -3.894
  566    HA   HIS  70           HA       HIS  70  -3.570  10.839  -5.936
  567   1HB   HIS  70          HB2       HIS  70  -5.396   9.250  -6.358
  568   2HB   HIS  70          HB1       HIS  70  -5.886   9.340  -4.667
  569    HD1  HIS  70           HD1      HIS  70  -8.100  10.543  -4.841
  570    HD2  HIS  70           HD2      HIS  70  -5.080  12.482  -6.964
  571    HE1  HIS  70           HE1      HIS  70  -9.071  12.751  -5.614
  572    H    SER  71           HN       SER  71  -3.586  12.848  -4.954
  573    HA   SER  71           HA       SER  71  -3.054  13.202  -2.194
  574   1HB   SER  71          HB2       SER  71  -2.493  14.912  -3.748
  575   2HB   SER  71          HB1       SER  71  -4.131  14.961  -4.402
  576    HG   SER  71           HG       SER  71  -3.180  15.868  -1.895
  577    H    SER  72           HN       SER  72  -4.548  14.558  -0.710
  578    HA   SER  72           HA       SER  72  -7.412  14.461  -1.034
  579   1HB   SER  72          HB2       SER  72  -6.195  12.014  -0.492
  580   2HB   SER  72          HB1       SER  72  -6.764  12.550   1.086
  581    HG   SER  72           HG       SER  72  -8.684  12.032   0.441
  582    H    LEU  73           HN       LEU  73  -8.461  14.715   1.306
  583    HA   LEU  73           HA       LEU  73  -6.692  16.584   2.842
  584   1HB   LEU  73          HB2       LEU  73  -9.584  16.449   2.097
  585   2HB   LEU  73          HB1       LEU  73  -9.174  17.214   3.637
  586    HG   LEU  73           HG       LEU  73  -9.237  18.840   1.743
  587   1HD1  LEU  73          HD11      LEU  73  -7.816  19.856   3.181
  588   2HD1  LEU  73          HD12      LEU  73  -6.518  19.270   2.139
  589   3HD1  LEU  73          HD13      LEU  73  -6.998  18.340   3.559
  590   1HD2  LEU  73          HD21      LEU  73  -7.741  18.685  -0.081
  591   2HD2  LEU  73          HD22      LEU  73  -8.309  17.028   0.127
  592   3HD2  LEU  73          HD23      LEU  73  -6.725  17.502   0.741
  593    H    ALA  74           HN       ALA  74  -8.091  16.730   5.205
  594    HA   ALA  74           HA       ALA  74  -7.186  14.618   6.789
  595   1HB   ALA  74          HB1       ALA  74  -8.311  15.762   8.434
  596   2HB   ALA  74          HB2       ALA  74  -9.805  15.834   7.499
  597   3HB   ALA  74          HB3       ALA  74  -8.494  16.964   7.157
  598    H    PHE  75           HN       PHE  75 -10.031  14.733   4.756
  599    HA   PHE  75           HA       PHE  75 -11.773  13.185   4.382
  600   1HB   PHE  75          HB2       PHE  75 -10.877  11.082   3.736
  601   2HB   PHE  75          HB1       PHE  75  -9.557  12.224   3.505
  602    HD1  PHE  75           HD1      PHE  75  -7.504  11.963   4.655
  603    HD2  PHE  75           HD2      PHE  75 -10.946   9.720   5.909
  604    HE1  PHE  75           HE1      PHE  75  -6.081  10.636   6.189
  605    HE2  PHE  75           HE2      PHE  75  -9.524   8.399   7.448
  606    HZ   PHE  75           HZ       PHE  75  -7.092   8.856   7.588
  607    H    TRP  76           HN       TRP  76 -12.664  10.926   5.313
  608    HA   TRP  76           HA       TRP  76 -12.273  10.428   8.144
  609   1HB   TRP  76          HB2       TRP  76 -13.807  12.671   7.431
  610   2HB   TRP  76          HB1       TRP  76 -14.979  11.438   7.900
  611    HD1  TRP  76           HD1      TRP  76 -14.410  10.172  10.313
  612    HE1  TRP  76           HE1      TRP  76 -13.509  11.222  12.491
  613    HE3  TRP  76           HE3      TRP  76 -12.420  14.472   8.443
  614    HZ2  TRP  76           HZ2      TRP  76 -12.117  13.583  13.323
  615    HZ3  TRP  76           HZ3      TRP  76 -11.309  16.107   9.942
  616    HH2  TRP  76           HH2      TRP  76 -11.153  15.666  12.378
  617    H    LYS  77           HN       LYS  77 -12.663   9.036   5.498
  618    HA   LYS  77           HA       LYS  77 -15.022   7.337   6.245
  619   1HB   LYS  77          HB2       LYS  77 -13.817   7.850   3.507
  620   2HB   LYS  77          HB1       LYS  77 -15.326   7.004   3.851
  621   1HG   LYS  77          HG2       LYS  77 -16.480   8.943   4.254
  622   2HG   LYS  77          HG1       LYS  77 -15.079   9.755   4.950
  623   1HD   LYS  77          HD2       LYS  77 -14.660  10.771   2.989
  624   2HD   LYS  77          HD1       LYS  77 -14.546   9.207   2.183
  625   1HE   LYS  77          HE2       LYS  77 -16.626   9.406   1.279
  626   2HE   LYS  77          HE1       LYS  77 -17.315  10.009   2.800
  627   1HZ   LYS  77          HZ1       LYS  77 -16.517  12.157   2.395
  628   2HZ   LYS  77          HZ2       LYS  77 -17.144  11.663   0.895
  629   3HZ   LYS  77          HZ3       LYS  77 -15.466  11.644   1.166
  630    H    THR  78           HN       THR  78 -14.511   5.210   6.660
  631    HA   THR  78           HA       THR  78 -11.859   4.239   6.846
  632    HB   THR  78           HB       THR  78 -13.759   2.134   6.279
  633    HG1  THR  78           HG1      THR  78 -15.255   2.831   7.942
  634   1HG2  THR  78          HG21      THR  78 -12.735   3.180   8.930
  635   2HG2  THR  78          HG22      THR  78 -11.809   2.119   7.868
  636   3HG2  THR  78          HG23      THR  78 -13.318   1.551   8.584
  637    H    ASP  79           HN       ASP  79 -10.536   4.314   5.033
  638    HA   ASP  79           HA       ASP  79 -11.572   3.517   2.384
  639   1HB   ASP  79          HB2       ASP  79  -9.461   5.118   3.509
  640   2HB   ASP  79          HB1       ASP  79  -8.756   3.930   2.413
  641    H    ALA  80           HN       ALA  80 -10.040   1.967   1.114
  642    HA   ALA  80           HA       ALA  80 -10.131  -0.636   1.997
  643   1HB   ALA  80          HB1       ALA  80  -7.942   0.749   0.415
  644   2HB   ALA  80          HB2       ALA  80  -9.431   0.067  -0.239
  645   3HB   ALA  80          HB3       ALA  80  -8.201  -0.995   0.446
  646    H    SER  81           HN       SER  81  -7.394   1.597   2.563
  647    HA   SER  81           HA       SER  81  -5.697  -0.155   3.989
  648   1HB   SER  81          HB2       SER  81  -5.122   2.190   5.109
  649   2HB   SER  81          HB1       SER  81  -4.765   1.890   3.411
  650    HG   SER  81           HG       SER  81  -7.298   2.848   4.141
  651    H    ASP  82           HN       ASP  82  -8.768   1.116   4.937
  652    HA   ASP  82           HA       ASP  82  -8.225   0.279   7.767
  653   1HB   ASP  82          HB2       ASP  82 -10.020   2.459   6.671
  654   2HB   ASP  82          HB1       ASP  82  -9.845   2.055   8.378
  655    H    VAL  83           HN       VAL  83  -9.355  -1.305   5.455
  656    HA   VAL  83           HA       VAL  83 -12.083  -1.828   6.595
  657    HB   VAL  83           HB       VAL  83 -11.025  -2.449   3.824
  658   1HG1  VAL  83          HG11      VAL  83 -12.930  -3.817   4.491
  659   2HG1  VAL  83          HG12      VAL  83 -13.465  -2.617   3.314
  660   3HG1  VAL  83          HG13      VAL  83 -13.807  -2.384   5.028
  661   1HG2  VAL  83          HG21      VAL  83 -12.012   0.048   5.025
  662   2HG2  VAL  83          HG22      VAL  83 -12.895  -0.427   3.575
  663   3HG2  VAL  83          HG23      VAL  83 -11.147  -0.201   3.508
  664    H    LYS  84           HN       LYS  84 -12.692  -4.100   6.754
  665    HA   LYS  84           HA       LYS  84 -10.376  -5.854   7.317
  666   1HB   LYS  84          HB2       LYS  84 -13.173  -5.538   8.118
  667   2HB   LYS  84          HB1       LYS  84 -12.756  -7.224   7.806
  668   1HG   LYS  84          HG2       LYS  84 -11.939  -7.199   9.926
  669   2HG   LYS  84          HG1       LYS  84 -10.561  -6.360   9.210
  670   1HD   LYS  84          HD2       LYS  84 -12.860  -4.620   9.839
  671   2HD   LYS  84          HD1       LYS  84 -12.083  -5.346  11.246
  672   1HE   LYS  84          HE2       LYS  84 -10.093  -4.396   9.346
  673   2HE   LYS  84          HE1       LYS  84 -11.178  -3.087   9.856
  674   1HZ   LYS  84          HZ1       LYS  84 -10.343  -4.965  11.917
  675   2HZ   LYS  84          HZ2       LYS  84 -10.573  -3.285  12.010
  676   3HZ   LYS  84          HZ3       LYS  84  -9.143  -3.914  11.344
  677    HA   PRO  85           HA       PRO  85 -10.592  -8.032   3.487
  678   1HB   PRO  85          HB2       PRO  85 -10.080 -10.569   4.755
  679   2HB   PRO  85          HB1       PRO  85  -8.936  -9.537   3.887
  680   1HG   PRO  85          HG2       PRO  85  -9.088 -10.011   6.718
  681   2HG   PRO  85          HG1       PRO  85  -7.939  -8.993   5.845
  682   1HD   PRO  85          HD2       PRO  85 -10.099  -8.143   7.548
  683   2HD   PRO  85          HD1       PRO  85  -8.969  -7.117   6.630
  684    H    CYS  86           HN       CYS  86 -12.352  -8.935   2.402
  685    HA   CYS  86           HA       CYS  86 -14.876  -9.298   3.467
  686   1HB   CYS  86          HB2       CYS  86 -13.722  -9.606   1.040
  687   2HB   CYS  86          HB1       CYS  86 -14.013 -11.299   1.441