*HEADER    PROTEIN BINDING                         15-JAN-10   2KT1              
*TITLE     SOLUTION NMR STRUCTURE OF THE SH3 DOMAIN FROM THE P85BETA             
*TITLE    2 SUBUNIT OF PHOSPHATIDYLINOSITOL 3-KINASE FROM H.SAPIENS,             
*TITLE    3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET HR5531E              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHOSPHATIDYLINOSITOL 3-KINASE REGULATORY SUBUNIT           
*COMPND   3 BETA;                                                                
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: SH3 DOMAIN;                                                
*COMPND   6 SYNONYM: PI3-KINASE P85 SUBUNIT BETA, PTDINS-3-KINASE P85-           
*COMPND   7 BETA;                                                                
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: PIK3R2;                                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) + MAGIC;                        
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: HR5531E-1-80-21.1                          
*KEYWDS    STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL GENOMICS                    
*KEYWDS   2 CONSORTIUM (NESG), TARGET HR5531E, PSI-2, PROTEIN STRUCTURE          
*KEYWDS   3 INITIATIVE, P85BETA SUBUNIT OF PI3K, SH3 DOMAIN,                     
*KEYWDS   4 PHOSPHOPROTEIN, POLYMORPHISM                                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.M.ARAMINI, L.MA, C.SCHAUDER, J.K.EVERETT, G.T.MONTELIONE,           
*AUTHOR   2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)                      
*REVDAT   1   26-JAN-10 2KT1    0                                                


! Final combined constraints used in the CNS refinement of HR5531E  01-07-2010
! Distance constraints; sum averaging
 assign (resid  59 and name HN   )   (resid  68 and name HN   )    3.80  2.00  0.38
 assign (resid  59 and name HN   )   (resid  60 and name HN   )    4.85  3.05  0.48
 assign (resid  59 and name HN   )   (resid  69 and name HA   )    4.07  2.27  0.41
 assign (resid  58 and name HA   )   (resid  59 and name HN   )    3.21  1.41  0.32
 assign (resid  58 and name HB1  )   (resid  59 and name HN   )    4.48  2.68  0.45
 assign (resid  67 and name HA   )   (resid  68 and name HN   )    3.15  1.35  0.32
 assign (resid  23 and name HD1* )   (resid  68 and name HN   )    4.09  2.29  0.41
 assign (resid  60 and name HA   )   (resid  68 and name HN   )    4.49  2.69  0.45
 assign (resid  29 and name HB*  )   (resid  61 and name HD22 )    4.52  2.72  0.45
 assign (resid  29 and name HB*  )   (resid  61 and name HD21 )    4.52  2.72  0.45
 assign (resid   8 and name HE22 )   (resid  30 and name HG1* )    4.42  2.62  0.44
 assign (resid   8 and name HE22 )   (resid  81 and name HD2* )    4.58  2.78  0.46
 assign (resid  39 and name HN   )   (resid  39 and name HG2  )    4.16  2.36  0.42
 assign (resid  39 and name HN   )   (resid  39 and name HG1  )    4.16  2.36  0.42
 assign (resid  39 and name HN   )   (resid  39 and name HB2  )    3.38  1.58  0.34
 assign (resid  38 and name HB2  )   (resid  39 and name HN   )    3.45  1.65  0.34
 assign (resid  38 and name HB1  )   (resid  39 and name HN   )    4.27  2.47  0.43
 assign (resid  25 and name HA   )   (resid  61 and name HD22 )    4.52  2.72  0.45
 assign (resid  25 and name HA   )   (resid  61 and name HD21 )    4.52  2.72  0.45
 assign (resid  25 and name HD2* )   (resid  61 and name HD21 )    4.43  2.63  0.44
 assign (resid   8 and name HN   )   (resid  79 and name HN   )    4.11  2.31  0.41
 assign (resid  78 and name HN   )   (resid  79 and name HN   )    3.36  1.56  0.34
 assign (resid  77 and name HD*  )   (resid  79 and name HN   )    4.48  2.68  0.45
 assign (resid   9 and name HA   )   (resid  79 and name HN   )    5.23  3.43  0.52
 assign (resid  77 and name HA   )   (resid  79 and name HN   )    4.51  2.71  0.45
 assign (resid   8 and name HB*  )   (resid  79 and name HN   )    4.21  2.41  0.42
 assign (resid  78 and name HG   )   (resid  79 and name HN   )    4.50  2.70  0.45
 assign (resid  78 and name HB*  )   (resid  79 and name HN   )    3.44  1.64  0.34
 assign (resid  78 and name HD1* )   (resid  79 and name HN   )    4.99  3.19  0.50
 assign (resid  78 and name HD2* )   (resid  79 and name HN   )    5.39  3.59  0.54
 assign (resid  73 and name HN   )   (resid  73 and name HG2* )    4.60  2.80  0.46
 assign (resid  64 and name HN   )   (resid  65 and name HN   )    3.25  1.45  0.33
 assign (resid  64 and name HN   )   (resid  64 and name HG1  )    4.41  2.61  0.44
 assign (resid  64 and name HN   )   (resid  65 and name HA   )    4.59  2.79  0.46
 assign (resid  63 and name HB2  )   (resid  64 and name HN   )    4.26  2.46  0.43
 assign (resid  63 and name HB1  )   (resid  64 and name HN   )    4.26  2.46  0.43
 assign (resid  64 and name HN   )   (resid  64 and name HG2* )    3.36  1.56  0.34
 assign (resid  42 and name HN   )   (resid  43 and name HN   )    3.36  1.56  0.34
 assign (resid  41 and name HN   )   (resid  42 and name HN   )    3.40  1.60  0.34
 assign (resid  41 and name HB2  )   (resid  42 and name HN   )    4.43  2.63  0.44
 assign (resid  41 and name HB1  )   (resid  42 and name HN   )    4.43  2.63  0.44
 assign (resid  42 and name HN   )   (resid  43 and name HG2* )    4.19  2.39  0.42
 assign (resid  55 and name HN   )   (resid  56 and name HN   )    4.55  2.75  0.46
 assign (resid  54 and name HB   )   (resid  55 and name HN   )    3.83  2.03  0.38
 assign (resid  54 and name HG1* )   (resid  55 and name HN   )    4.15  2.35  0.42
 assign (resid  54 and name HG2* )   (resid  55 and name HN   )    4.54  2.74  0.45
 assign (resid  59 and name HN   )   (resid  70 and name HE*  )    4.29  2.49  0.43
 assign (resid  58 and name HB2  )   (resid  59 and name HN   )    4.48  2.68  0.45
 assign (resid  23 and name HD2* )   (resid  59 and name HN   )    4.58  2.78  0.46
 assign (resid  75 and name HN   )   (resid  75 and name HG2* )    3.29  1.49  0.33
 assign (resid  75 and name HN   )   (resid  75 and name HG1* )    3.69  1.89  0.37
 assign (resid  46 and name HN   )   (resid  47 and name HN   )    3.69  1.89  0.37
 assign (resid  45 and name HA   )   (resid  47 and name HN   )    4.22  2.42  0.42
 assign (resid  44 and name HB*  )   (resid  47 and name HN   )    4.62  2.82  0.46
 assign (resid  43 and name HG1* )   (resid  47 and name HN   )    3.95  2.15  0.40
 assign (resid  27 and name HA   )   (resid  28 and name HN   )    3.08  1.28  0.31
 assign (resid  11 and name HB*  )   (resid  28 and name HN   )    3.62  1.82  0.36
 assign (resid  72 and name HN   )   (resid  73 and name HN   )    4.34  2.54  0.43
 assign (resid  56 and name HA   )   (resid  72 and name HN   )    4.30  2.50  0.43
 assign (resid  71 and name HA   )   (resid  72 and name HN   )    3.39  1.59  0.34
 assign (resid  19 and name HA   )   (resid  21 and name HN   )    4.68  2.88  0.47
 assign (resid  20 and name HD*  )   (resid  21 and name HN   )    4.03  2.23  0.40
 assign (resid  20 and name HB2  )   (resid  21 and name HN   )    4.51  2.71  0.45
 assign (resid  17 and name HB1  )   (resid  21 and name HN   )    5.11  3.31  0.51
 assign (resid  52 and name HN   )   (resid  53 and name HN   )    3.92  2.12  0.39
 assign (resid  53 and name HN   )   (resid  54 and name HN   )    3.40  1.60  0.34
 assign (resid  53 and name HN   )   (resid  54 and name HG2* )    4.31  2.51  0.43
 assign (resid  12 and name HN   )   (resid  13 and name HN   )    3.30  1.50  0.33
 assign (resid  11 and name HA   )   (resid  13 and name HN   )    4.14  2.34  0.41
 assign (resid  11 and name HB*  )   (resid  13 and name HN   )    3.96  2.16  0.40
 assign (resid  12 and name HB2  )   (resid  13 and name HN   )    4.50  2.70  0.45
 assign (resid  12 and name HD1* )   (resid  13 and name HN   )    5.05  3.25  0.51
 assign (resid  12 and name HD2* )   (resid  13 and name HN   )    5.42  3.62  0.54
 assign (resid  75 and name HA   )   (resid  76 and name HN   )    3.29  1.49  0.33
 assign (resid  11 and name HA   )   (resid  76 and name HN   )    4.69  2.89  0.47
 assign (resid   9 and name HB1  )   (resid  76 and name HN   )    4.50  2.70  0.45
 assign (resid  76 and name HN   )   (resid  76 and name HG2  )    3.72  1.92  0.37
 assign (resid  75 and name HB   )   (resid  76 and name HN   )    3.42  1.62  0.34
 assign (resid  76 and name HN   )   (resid  76 and name HG1  )    3.87  2.07  0.39
 assign (resid  10 and name HG*  )   (resid  76 and name HN   )    5.35  3.55  0.54
 assign (resid  75 and name HG2* )   (resid  76 and name HN   )    4.14  2.34  0.41
 assign (resid  75 and name HG1* )   (resid  76 and name HN   )    4.01  2.21  0.40
 assign (resid  49 and name HN   )   (resid  50 and name HN   )    3.46  1.66  0.35
 assign (resid  49 and name HN   )   (resid  49 and name HD*  )    4.48  2.68  0.45
 assign (resid  49 and name HN   )   (resid  49 and name HB2  )    4.01  2.21  0.40
 assign (resid  49 and name HN   )   (resid  49 and name HB1  )    4.01  2.21  0.40
 assign (resid  49 and name HN   )   (resid  49 and name HG2  )    4.13  2.33  0.41
 assign (resid  49 and name HN   )   (resid  49 and name HG1  )    4.13  2.33  0.41
 assign (resid  65 and name HN   )   (resid  66 and name HN   )    3.48  1.68  0.35
 assign (resid  62 and name HA   )   (resid  65 and name HN   )    4.45  2.65  0.44
 assign (resid  65 and name HN   )   (resid  66 and name HB2  )    4.68  2.88  0.47
 assign (resid  65 and name HN   )   (resid  65 and name HG2  )    4.35  2.55  0.44
 assign (resid  65 and name HN   )   (resid  65 and name HG1  )    4.35  2.55  0.44
 assign (resid  64 and name HG2* )   (resid  65 and name HN   )    4.35  2.55  0.44
 assign (resid  60 and name HD1* )   (resid  65 and name HN   )    4.88  3.08  0.49
 assign (resid  50 and name HA   )   (resid  52 and name HN   )    4.64  2.84  0.46
 assign (resid  64 and name HN   )   (resid  66 and name HN   )    4.56  2.76  0.46
 assign (resid  64 and name HG1  )   (resid  66 and name HN   )    4.13  2.33  0.41
 assign (resid  66 and name HN   )   (resid  66 and name HG2  )    5.28  3.48  0.53
 assign (resid  66 and name HN   )   (resid  66 and name HG1  )    5.28  3.48  0.53
 assign (resid  66 and name HN   )   (resid  66 and name HB2  )    3.51  1.71  0.35
 assign (resid  23 and name HD1* )   (resid  66 and name HN   )    4.54  2.74  0.45
 assign (resid  23 and name HD2* )   (resid  66 and name HN   )    5.03  3.23  0.50
 assign (resid  50 and name HN   )   (resid  50 and name HB2  )    4.00  2.20  0.40
 assign (resid  50 and name HN   )   (resid  50 and name HB1  )    4.00  2.20  0.40
 assign (resid  57 and name HN   )   (resid  70 and name HN   )    4.04  2.24  0.40
 assign (resid  70 and name HN   )   (resid  70 and name HD*  )    4.36  2.56  0.44
 assign (resid  69 and name HA   )   (resid  70 and name HN   )    3.47  1.67  0.35
 assign (resid  58 and name HA   )   (resid  70 and name HN   )    4.62  2.82  0.46
 assign (resid  38 and name HA   )   (resid  41 and name HN   )    4.01  2.21  0.40
 assign (resid  41 and name HN   )   (resid  41 and name HB2  )    3.74  1.94  0.37
 assign (resid  41 and name HN   )   (resid  41 and name HB1  )    3.74  1.94  0.37
 assign (resid  40 and name HB*  )   (resid  41 and name HN   )    3.64  1.84  0.36
 assign (resid  41 and name HN   )   (resid  41 and name HD1* )    3.94  2.14  0.39
 assign (resid  41 and name HN   )   (resid  41 and name HD2* )    4.31  2.51  0.43
 assign (resid   7 and name HN   )   (resid   7 and name HD*  )    4.26  2.46  0.43
 assign (resid   7 and name HN   )   (resid   7 and name HB2  )    4.09  2.29  0.41
 assign (resid   7 and name HN   )   (resid  33 and name HB   )    4.71  2.91  0.47
 assign (resid   7 and name HN   )   (resid  33 and name HG1* )    4.87  3.07  0.49
 assign (resid   7 and name HN   )   (resid  81 and name HD1* )    5.42  3.62  0.54
 assign (resid   7 and name HN   )   (resid   8 and name HN   )    5.07  3.27  0.51
 assign (resid   8 and name HN   )   (resid   9 and name HN   )    5.41  3.61  0.54
 assign (resid   7 and name HD*  )   (resid   8 and name HN   )    5.17  3.37  0.52
 assign (resid   7 and name HA   )   (resid   8 and name HN   )    3.32  1.52  0.33
 assign (resid   8 and name HN   )   (resid  80 and name HA   )    4.39  2.59  0.44
 assign (resid   7 and name HB1  )   (resid   8 and name HN   )    4.00  2.20  0.40
 assign (resid   7 and name HB2  )   (resid   8 and name HN   )    4.41  2.61  0.44
 assign (resid   8 and name HN   )   (resid   8 and name HG1  )    3.91  2.11  0.39
 assign (resid   8 and name HN   )   (resid   8 and name HB*  )    3.70  1.90  0.37
 assign (resid   8 and name HN   )   (resid  78 and name HB*  )    5.50  3.70  0.55
 assign (resid   8 and name HN   )   (resid  81 and name HG   )    5.50  3.70  0.55
 assign (resid   8 and name HN   )   (resid  81 and name HD2* )    4.62  2.82  0.46
 assign (resid  38 and name HN   )   (resid  39 and name HN   )    3.46  1.66  0.35
 assign (resid  37 and name HN   )   (resid  38 and name HN   )    3.47  1.67  0.35
 assign (resid  35 and name HA   )   (resid  38 and name HN   )    3.98  2.18  0.40
 assign (resid  38 and name HN   )   (resid  38 and name HB2  )    3.40  1.60  0.34
 assign (resid  38 and name HN   )   (resid  38 and name HG   )    3.36  1.56  0.34
 assign (resid  37 and name HB*  )   (resid  38 and name HN   )    3.47  1.67  0.35
 assign (resid  38 and name HN   )   (resid  38 and name HB1  )    3.64  1.84  0.36
 assign (resid  38 and name HN   )   (resid  38 and name HD1* )    4.23  2.43  0.42
 assign (resid  38 and name HN   )   (resid  41 and name HD1* )    4.63  2.83  0.46
 assign (resid  62 and name HN   )   (resid  63 and name HN   )    3.79  1.99  0.38
 assign (resid  63 and name HN   )   (resid  64 and name HN   )    3.46  1.66  0.35
 assign (resid  62 and name HB*  )   (resid  63 and name HN   )    3.46  1.66  0.35
 assign (resid  63 and name HN   )   (resid  63 and name HB2  )    3.78  1.98  0.38
 assign (resid  63 and name HN   )   (resid  63 and name HB1  )    3.78  1.98  0.38
 assign (resid  63 and name HN   )   (resid  64 and name HG2* )    4.61  2.81  0.46
 assign (resid  66 and name HA   )   (resid  67 and name HN   )    3.10  1.30  0.31
 assign (resid  66 and name HG2  )   (resid  67 and name HN   )    5.27  3.47  0.53
 assign (resid  66 and name HG1  )   (resid  67 and name HN   )    5.27  3.47  0.53
 assign (resid  66 and name HB1  )   (resid  67 and name HN   )    3.66  1.86  0.37
 assign (resid  66 and name HB2  )   (resid  67 and name HN   )    4.14  2.34  0.41
 assign (resid  23 and name HD1* )   (resid  67 and name HN   )    4.66  2.86  0.47
 assign (resid  45 and name HG2  )   (resid  46 and name HN   )    5.50  3.70  0.55
 assign (resid  45 and name HG1  )   (resid  46 and name HN   )    5.50  3.70  0.55
 assign (resid  45 and name HB*  )   (resid  46 and name HN   )    4.49  2.69  0.45
 assign (resid   5 and name HN   )   (resid   6 and name HN   )    4.52  2.72  0.45
 assign (resid  21 and name HN   )   (resid  22 and name HN   )    3.72  1.92  0.37
 assign (resid  20 and name HA   )   (resid  22 and name HN   )    4.74  2.94  0.47
 assign (resid  22 and name HN   )   (resid  22 and name HB*  )    3.36  1.56  0.34
 assign (resid  21 and name HB2  )   (resid  22 and name HN   )    4.54  2.74  0.45
 assign (resid  21 and name HB1  )   (resid  22 and name HN   )    4.54  2.74  0.45
 assign (resid  17 and name HB1  )   (resid  22 and name HN   )    4.25  2.45  0.43
 assign (resid  10 and name HN   )   (resid  76 and name HN   )    3.67  1.87  0.37
 assign (resid  10 and name HN   )   (resid  78 and name HN   )    4.98  3.18  0.50
 assign (resid   8 and name HA   )   (resid   9 and name HN   )    3.09  1.29  0.31
 assign (resid   9 and name HB1  )   (resid  10 and name HN   )    3.82  2.02  0.38
 assign (resid   9 and name HN   )   (resid   9 and name HB2  )    3.78  1.98  0.38
 assign (resid  10 and name HN   )   (resid  76 and name HG2  )    4.39  2.59  0.44
 assign (resid  10 and name HN   )   (resid  75 and name HB   )    3.85  2.05  0.38
 assign (resid   8 and name HG2  )   (resid   9 and name HN   )    4.20  2.40  0.42
 assign (resid   8 and name HB*  )   (resid   9 and name HN   )    3.92  2.12  0.39
 assign (resid  10 and name HN   )   (resid  10 and name HB2  )    3.89  2.09  0.39
 assign (resid  10 and name HN   )   (resid  78 and name HG   )    4.43  2.63  0.44
 assign (resid   9 and name HN   )   (resid  30 and name HG1* )    3.84  2.04  0.38
 assign (resid  10 and name HN   )   (resid  75 and name HG1* )    4.63  2.83  0.46
 assign (resid  10 and name HN   )   (resid  78 and name HD2* )    5.29  3.49  0.53
 assign (resid  56 and name HA   )   (resid  57 and name HN   )    3.32  1.52  0.33
 assign (resid  57 and name HN   )   (resid  71 and name HA   )    4.63  2.83  0.46
 assign (resid  57 and name HN   )   (resid  57 and name HB1  )    4.18  2.38  0.42
 assign (resid  57 and name HN   )   (resid  57 and name HB2  )    3.80  2.00  0.38
 assign (resid  31 and name HA   )   (resid  32 and name HN   )    3.24  1.44  0.32
 assign (resid  32 and name HN   )   (resid  32 and name HB   )    3.57  1.77  0.36
 assign (resid  32 and name HN   )   (resid  33 and name HG2* )    5.17  3.37  0.52
 assign (resid  31 and name HG   )   (resid  32 and name HN   )    4.41  2.61  0.44
 assign (resid  32 and name HN   )   (resid  32 and name HG1* )    4.83  3.03  0.48
 assign (resid  32 and name HN   )   (resid  60 and name HN   )    3.70  1.90  0.37
 assign (resid  59 and name HA2  )   (resid  60 and name HN   )    3.53  1.73  0.35
 assign (resid  59 and name HA1  )   (resid  60 and name HN   )    3.53  1.73  0.35
 assign (resid  32 and name HB   )   (resid  60 and name HN   )    4.08  2.28  0.41
 assign (resid  60 and name HN   )   (resid  60 and name HB2  )    3.80  2.00  0.38
 assign (resid  60 and name HN   )   (resid  60 and name HB1  )    3.80  2.00  0.38
 assign (resid  33 and name HG2* )   (resid  60 and name HN   )    4.32  2.52  0.43
 assign (resid  23 and name HD2* )   (resid  60 and name HN   )    5.05  3.25  0.51
 assign (resid  60 and name HN   )   (resid  60 and name HD2* )    5.40  3.60  0.54
 assign (resid  74 and name HN   )   (resid  75 and name HN   )    3.37  1.57  0.34
 assign (resid  74 and name HN   )   (resid  74 and name HD*  )    3.90  2.10  0.39
 assign (resid  74 and name HN   )   (resid  74 and name HB2  )    3.87  2.07  0.39
 assign (resid  74 and name HN   )   (resid  74 and name HB1  )    3.87  2.07  0.39
 assign (resid  73 and name HG2* )   (resid  74 and name HN   )    4.94  3.14  0.49
 assign (resid  74 and name HN   )   (resid  75 and name HG2* )    4.37  2.57  0.44
 assign (resid  74 and name HN   )   (resid  75 and name HG1* )    4.08  2.28  0.41
 assign (resid  46 and name HN   )   (resid  48 and name HN   )    4.49  2.69  0.45
 assign (resid  47 and name HN   )   (resid  48 and name HN   )    3.71  1.91  0.37
 assign (resid  48 and name HN   )   (resid  50 and name HN   )    4.70  2.90  0.47
 assign (resid  48 and name HN   )   (resid  49 and name HN   )    3.83  2.03  0.38
 assign (resid  48 and name HN   )   (resid  48 and name HB2  )    4.18  2.38  0.42
 assign (resid  48 and name HN   )   (resid  48 and name HB1  )    4.18  2.38  0.42
 assign (resid  43 and name HG1* )   (resid  48 and name HN   )    3.90  2.10  0.39
 assign (resid  17 and name HA   )   (resid  19 and name HN   )    4.48  2.68  0.45
 assign (resid  19 and name HN   )   (resid  22 and name HB*  )    4.81  3.01  0.48
 assign (resid  18 and name HB2  )   (resid  19 and name HN   )    4.50  2.70  0.45
 assign (resid  18 and name HG*  )   (resid  19 and name HN   )    5.01  3.21  0.50
 assign (resid  18 and name HB1  )   (resid  19 and name HN   )    4.50  2.70  0.45
 assign (resid  17 and name HB1  )   (resid  19 and name HN   )    4.08  2.28  0.41
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 assign (resid  31 and name HD2* )   (resid  70 and name HZ   )    5.05  3.25  0.51
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 assign (resid  34 and name HB*  )   (resid  35 and name HN   )    3.75  1.95  0.38
 assign (resid  34 and name HB*  )   (resid  36 and name HN   )    4.35  2.55  0.44
 assign (resid  34 and name HB*  )   (resid  36 and name HB*  )    4.34  2.54  0.43
 assign (resid  34 and name HB*  )   (resid  37 and name HN   )    3.95  2.15  0.40
 assign (resid  34 and name HB*  )   (resid  37 and name HB*  )    4.05  2.25  0.41
 assign (resid  35 and name HN   )   (resid  35 and name HB*  )    3.25  1.45  0.33
 assign (resid  35 and name HB*  )   (resid  36 and name HN   )    4.13  2.33  0.41
 assign (resid  36 and name HA   )   (resid  39 and name HG*  )    4.50  2.70  0.45
 assign (resid  37 and name HB*  )   (resid  58 and name HD*  )    3.79  1.99  0.38
 assign (resid  38 and name HA   )   (resid  41 and name HB*  )    3.90  2.10  0.39
 assign (resid  38 and name HD1* )   (resid  48 and name HB*  )    3.96  2.16  0.40
 assign (resid  38 and name HD2* )   (resid  48 and name HB*  )    4.31  2.51  0.43
 assign (resid  39 and name HN   )   (resid  39 and name HG*  )    3.47  1.67  0.35
 assign (resid  39 and name HA   )   (resid  39 and name HG*  )    3.47  1.67  0.35
 assign (resid  39 and name HA   )   (resid  39 and name HE*  )    4.79  2.99  0.48
 assign (resid  39 and name HG*  )   (resid  40 and name HN   )    4.55  2.75  0.46
 assign (resid  41 and name HN   )   (resid  41 and name HB*  )    3.08  1.28  0.31
 assign (resid  41 and name HB*  )   (resid  41 and name HD2* )    3.29  1.49  0.33
 assign (resid  41 and name HB*  )   (resid  43 and name HN   )    4.34  2.54  0.43
 assign (resid  41 and name HB*  )   (resid  43 and name HG1* )    5.34  3.54  0.53
 assign (resid  41 and name HB*  )   (resid  43 and name HG2* )    3.90  2.10  0.39
 assign (resid  41 and name HD1* )   (resid  57 and name HG*  )    3.78  1.98  0.38
 assign (resid  41 and name HD1* )   (resid  58 and name HG*  )    4.32  2.52  0.43
 assign (resid  41 and name HD2* )   (resid  58 and name HG*  )    4.46  2.66  0.45
 assign (resid  43 and name HG1* )   (resid  47 and name HA*  )    3.33  1.53  0.33
 assign (resid  45 and name HN   )   (resid  45 and name HG*  )    4.56  2.76  0.46
 assign (resid  47 and name HA*  )   (resid  49 and name HN   )    4.82  3.02  0.48
 assign (resid  48 and name HN   )   (resid  48 and name HB*  )    3.47  1.67  0.35
 assign (resid  48 and name HN   )   (resid  48 and name HG*  )    4.08  2.28  0.41
 assign (resid  48 and name HG*  )   (resid  49 and name HN   )    4.50  2.70  0.45
 assign (resid  49 and name HN   )   (resid  49 and name HB*  )    3.34  1.54  0.33
 assign (resid  49 and name HN   )   (resid  49 and name HG*  )    3.32  1.52  0.33
 assign (resid  49 and name HA   )   (resid  49 and name HG*  )    3.60  1.80  0.36
 assign (resid  49 and name HB*  )   (resid  49 and name HD*  )    3.40  1.60  0.34
 assign (resid  49 and name HB*  )   (resid  50 and name HN   )    4.24  2.44  0.42
 assign (resid  50 and name HN   )   (resid  50 and name HB*  )    3.48  1.68  0.35
 assign (resid  50 and name HA   )   (resid  51 and name HD*  )    3.19  1.39  0.32
 assign (resid  50 and name HB*  )   (resid  53 and name HN   )    4.57  2.77  0.46
 assign (resid  50 and name HB*  )   (resid  53 and name HB*  )    4.33  2.53  0.43
 assign (resid  51 and name HA   )   (resid  72 and name HA*  )    5.32  3.52  0.53
 assign (resid  51 and name HB*  )   (resid  57 and name HE*  )    3.38  1.58  0.34
 assign (resid  51 and name HB*  )   (resid  72 and name HA*  )    3.91  2.11  0.39
 assign (resid  51 and name HG*  )   (resid  52 and name HN   )    3.97  2.17  0.40
 assign (resid  51 and name HG*  )   (resid  57 and name HE*  )    3.88  2.08  0.39
 assign (resid  51 and name HG*  )   (resid  75 and name HG2* )    3.41  1.61  0.34
 assign (resid  51 and name HD*  )   (resid  52 and name HN   )    4.33  2.53  0.43
 assign (resid  51 and name HD*  )   (resid  75 and name HG2* )    4.26  2.46  0.43
 assign (resid  52 and name HN   )   (resid  52 and name HB*  )    3.43  1.63  0.34
 assign (resid  52 and name HN   )   (resid  52 and name HG*  )    4.43  2.63  0.44
 assign (resid  52 and name HB*  )   (resid  53 and name HN   )    4.36  2.56  0.44
 assign (resid  52 and name HB*  )   (resid  73 and name HA   )    4.17  2.37  0.42
 assign (resid  52 and name HB*  )   (resid  73 and name HG2* )    4.97  3.17  0.50
 assign (resid  52 and name HG*  )   (resid  53 and name HN   )    4.14  2.34  0.41
 assign (resid  53 and name HN   )   (resid  53 and name HB*  )    3.42  1.62  0.34
 assign (resid  54 and name HB   )   (resid  57 and name HG*  )    4.54  2.74  0.45
 assign (resid  54 and name HG1* )   (resid  55 and name HA*  )    4.46  2.66  0.45
 assign (resid  55 and name HA*  )   (resid  56 and name HD1  )    4.43  2.63  0.44
 assign (resid  56 and name HN   )   (resid  56 and name HB*  )    3.52  1.72  0.35
 assign (resid  56 and name HB*  )   (resid  57 and name HN   )    4.21  2.41  0.42
 assign (resid  57 and name HN   )   (resid  57 and name HG*  )    4.40  2.60  0.44
 assign (resid  57 and name HA   )   (resid  58 and name HD*  )    3.11  1.31  0.31
 assign (resid  57 and name HB1  )   (resid  58 and name HD*  )    3.62  1.82  0.36
 assign (resid  57 and name HG*  )   (resid  57 and name HE*  )    3.25  1.45  0.33
 assign (resid  57 and name HE*  )   (resid  72 and name HA*  )    3.50  1.70  0.35
 assign (resid  59 and name HA*  )   (resid  70 and name HE*  )    3.66  1.86  0.37
 assign (resid  60 and name HN   )   (resid  60 and name HB*  )    3.21  1.41  0.32
 assign (resid  60 and name HA   )   (resid  67 and name HG*  )    4.44  2.64  0.44
 assign (resid  60 and name HB*  )   (resid  60 and name HD1* )    3.29  1.49  0.33
 assign (resid  60 and name HB*  )   (resid  61 and name HN   )    4.02  2.22  0.40
 assign (resid  60 and name HD1* )   (resid  67 and name HG*  )    3.27  1.47  0.33
 assign (resid  61 and name HN   )   (resid  61 and name HB*  )    3.32  1.52  0.33
 assign (resid  61 and name HB*  )   (resid  64 and name HN   )    4.34  2.54  0.43
 assign (resid  61 and name HB*  )   (resid  64 and name HG1  )    4.25  2.45  0.43
 assign (resid  61 and name HB*  )   (resid  65 and name HN   )    4.59  2.79  0.46
 assign (resid  61 and name HB*  )   (resid  66 and name HN   )    4.07  2.27  0.41
 assign (resid  63 and name HN   )   (resid  63 and name HB*  )    3.32  1.52  0.33
 assign (resid  63 and name HB*  )   (resid  64 and name HN   )    3.57  1.77  0.36
 assign (resid  63 and name HB*  )   (resid  64 and name HA   )    4.26  2.46  0.43
 assign (resid  63 and name HB*  )   (resid  64 and name HG2* )    3.71  1.91  0.37
 assign (resid  64 and name HB   )   (resid  66 and name HG*  )    4.11  2.31  0.41
 assign (resid  65 and name HN   )   (resid  65 and name HG*  )    3.78  1.98  0.38
 assign (resid  65 and name HN   )   (resid  65 and name HD*  )    4.09  2.29  0.41
 assign (resid  65 and name HA   )   (resid  65 and name HG*  )    3.70  1.90  0.37
 assign (resid  65 and name HA   )   (resid  65 and name HD*  )    4.21  2.41  0.42
 assign (resid  66 and name HN   )   (resid  66 and name HG*  )    4.44  2.64  0.44
 assign (resid  66 and name HA   )   (resid  66 and name HG*  )    3.63  1.83  0.36
 assign (resid  66 and name HG*  )   (resid  67 and name HN   )    4.43  2.63  0.44
 assign (resid  67 and name HN   )   (resid  67 and name HB*  )    3.30  1.50  0.33
 assign (resid  67 and name HB*  )   (resid  67 and name HD*  )    3.40  1.60  0.34
 assign (resid  67 and name HB*  )   (resid  68 and name HN   )    3.70  1.90  0.37
 assign (resid  67 and name HG*  )   (resid  68 and name HN   )    4.87  3.07  0.49
 assign (resid  69 and name HN   )   (resid  69 and name HB*  )    3.62  1.82  0.36
 assign (resid  69 and name HB*  )   (resid  70 and name HN   )    4.30  2.50  0.43
 assign (resid  70 and name HA   )   (resid  71 and name HB*  )    5.23  3.43  0.52
 assign (resid  70 and name HA   )   (resid  71 and name HD*  )    3.34  1.54  0.33
 assign (resid  70 and name HB*  )   (resid  71 and name HD*  )    4.22  2.42  0.42
 assign (resid  71 and name HB*  )   (resid  73 and name HN   )    4.05  2.25  0.41
 assign (resid  71 and name HB*  )   (resid  74 and name HN   )    4.40  2.60  0.44
 assign (resid  71 and name HG*  )   (resid  74 and name HB*  )    4.30  2.50  0.43
 assign (resid  71 and name HD*  )   (resid  74 and name HD*  )    4.30  2.50  0.43
 assign (resid  72 and name HA*  )   (resid  74 and name HN   )    4.90  3.10  0.49
 assign (resid  72 and name HA*  )   (resid  75 and name HG2* )    3.49  1.69  0.35
 assign (resid  76 and name HB*  )   (resid  77 and name HN   )    3.50  1.70  0.35
 assign (resid  76 and name HB*  )   (resid  78 and name HD2* )    4.07  2.27  0.41
 assign (resid  77 and name HN   )   (resid  77 and name HB*  )    3.18  1.38  0.32
 assign (resid  77 and name HE*  )   (resid  79 and name HA*  )    4.28  2.48  0.43
 assign (resid  77 and name HZ   )   (resid  79 and name HA*  )    3.93  2.13  0.39
 assign (resid  77 and name HZ   )   (resid  80 and name HD*  )    4.15  2.35  0.42
 assign (resid  79 and name HN   )   (resid  80 and name HD*  )    4.85  3.05  0.48
 assign (resid  79 and name HA*  )   (resid  80 and name HD*  )    2.92  1.12  0.29
 assign (resid  80 and name HB*  )   (resid  81 and name HN   )    3.75  1.95  0.38
 assign (resid  80 and name HG*  )   (resid  81 and name HN   )    4.37  2.57  0.44
 assign (resid  81 and name HN   )   (resid  81 and name HB*  )    3.31  1.51  0.33
 assign (resid  81 and name HB*  )   (resid  81 and name HD1* )    3.23  1.43  0.32
!
!
!
! Dihedral angle constraints from TALOS+ (n=10; good); +/- 30 deg
!
!
! ACO file produced by PDBStat
! Version:  5.1-Exp Compiled 2008-08-11 on (europa)
!
 dihedral
   assign (resid   4 and name C   )   (resid   5 and name N   )
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   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name C   )   (resid   6 and name N   )   1.0    -17.83    30.00   2 
   assign (resid   6 and name C   )   (resid   7 and name N   )
          (resid   7 and name CA  )   (resid   7 and name C   )   1.0   -136.09    30.00   2 
   assign (resid   7 and name N   )   (resid   7 and name CA  )
          (resid   7 and name C   )   (resid   8 and name N   )   1.0    157.43    30.00   2 
   assign (resid   7 and name C   )   (resid   8 and name N   )
          (resid   8 and name CA  )   (resid   8 and name C   )   1.0   -123.36    30.00   2 
   assign (resid   8 and name N   )   (resid   8 and name CA  )
          (resid   8 and name C   )   (resid   9 and name N   )   1.0    140.85    30.00   2 
   assign (resid   8 and name C   )   (resid   9 and name N   )
          (resid   9 and name CA  )   (resid   9 and name C   )   1.0   -131.67    30.00   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name C   )   (resid  10 and name N   )   1.0    144.53    30.00   2 
   assign (resid   9 and name C   )   (resid  10 and name N   )
          (resid  10 and name CA  )   (resid  10 and name C   )   1.0   -128.61    30.00   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
          (resid  10 and name C   )   (resid  11 and name N   )   1.0    142.38    30.00   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0    -73.40    30.00   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name C   )   (resid  12 and name N   )   1.0    135.86    30.00   2 
   assign (resid  11 and name C   )   (resid  12 and name N   )
          (resid  12 and name CA  )   (resid  12 and name C   )   1.0    -90.00    30.00   2 
   assign (resid  12 and name N   )   (resid  12 and name CA  )
          (resid  12 and name C   )   (resid  13 and name N   )   1.0    -33.30    30.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    149.97    30.00   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0   -120.77    30.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0    141.86    30.00   2 
   assign (resid  15 and name C   )   (resid  16 and name N   )
          (resid  16 and name CA  )   (resid  16 and name C   )   1.0   -104.76    30.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name C   )   (resid  17 and name N   )   1.0    129.42    30.00   2 
   assign (resid  20 and name N   )   (resid  20 and name CA  )
          (resid  20 and name C   )   (resid  21 and name N   )   1.0    -25.06    30.00   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0    -66.47    30.00   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name C   )   (resid  22 and name N   )   1.0    -23.31    30.00   2 
   assign (resid  22 and name C   )   (resid  23 and name N   )
          (resid  23 and name CA  )   (resid  23 and name C   )   1.0   -130.80    30.00   2 
   assign (resid  23 and name N   )   (resid  23 and name CA  )
          (resid  23 and name C   )   (resid  24 and name N   )   1.0    150.20    30.00   2 
   assign (resid  23 and name C   )   (resid  24 and name N   )
          (resid  24 and name CA  )   (resid  24 and name C   )   1.0    -86.11    30.00   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name C   )   (resid  25 and name N   )   1.0    136.10    30.00   2 
   assign (resid  24 and name C   )   (resid  25 and name N   )
          (resid  25 and name CA  )   (resid  25 and name C   )   1.0   -118.67    30.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name C   )   (resid  26 and name N   )   1.0    149.26    30.00   2 
   assign (resid  25 and name C   )   (resid  26 and name N   )
          (resid  26 and name CA  )   (resid  26 and name C   )   1.0   -115.10    30.00   2 
   assign (resid  26 and name N   )   (resid  26 and name CA  )
          (resid  26 and name C   )   (resid  27 and name N   )   1.0    125.15    30.00   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name C   )   (resid  28 and name N   )   1.0    136.43    30.00   2 
   assign (resid  28 and name C   )   (resid  29 and name N   )
          (resid  29 and name CA  )   (resid  29 and name C   )   1.0    -75.85    30.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    142.24    30.00   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0   -105.20    30.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0    123.76    30.00   2 
   assign (resid  30 and name C   )   (resid  31 and name N   )
          (resid  31 and name CA  )   (resid  31 and name C   )   1.0   -106.10    30.00   2 
   assign (resid  31 and name N   )   (resid  31 and name CA  )
          (resid  31 and name C   )   (resid  32 and name N   )   1.0    134.39    30.00   2 
   assign (resid  31 and name C   )   (resid  32 and name N   )
          (resid  32 and name CA  )   (resid  32 and name C   )   1.0   -124.07    30.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name C   )   (resid  33 and name N   )   1.0    126.81    30.00   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0   -118.37    30.00   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name C   )   (resid  34 and name N   )   1.0    130.80    30.00   2 
   assign (resid  33 and name C   )   (resid  34 and name N   )
          (resid  34 and name CA  )   (resid  34 and name C   )   1.0    -81.72    30.00   2 
   assign (resid  34 and name N   )   (resid  34 and name CA  )
          (resid  34 and name C   )   (resid  35 and name N   )   1.0    141.95    30.00   2 
   assign (resid  34 and name C   )   (resid  35 and name N   )
          (resid  35 and name CA  )   (resid  35 and name C   )   1.0    -58.63    30.00   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name C   )   (resid  36 and name N   )   1.0    -40.43    30.00   2 
   assign (resid  35 and name C   )   (resid  36 and name N   )
          (resid  36 and name CA  )   (resid  36 and name C   )   1.0    -62.07    30.00   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name C   )   (resid  37 and name N   )   1.0    -40.81    30.00   2 
   assign (resid  36 and name C   )   (resid  37 and name N   )
          (resid  37 and name CA  )   (resid  37 and name C   )   1.0    -66.92    30.00   2 
   assign (resid  37 and name N   )   (resid  37 and name CA  )
          (resid  37 and name C   )   (resid  38 and name N   )   1.0    -40.49    30.00   2 
   assign (resid  37 and name C   )   (resid  38 and name N   )
          (resid  38 and name CA  )   (resid  38 and name C   )   1.0    -64.01    30.00   2 
   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0    -42.96    30.00   2 
   assign (resid  38 and name C   )   (resid  39 and name N   )
          (resid  39 and name CA  )   (resid  39 and name C   )   1.0    -61.05    30.00   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name C   )   (resid  40 and name N   )   1.0    -43.64    30.00   2 
   assign (resid  39 and name C   )   (resid  40 and name N   )
          (resid  40 and name CA  )   (resid  40 and name C   )   1.0    -64.96    30.00   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name C   )   (resid  41 and name N   )   1.0    -28.21    30.00   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0    -87.95    30.00   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name C   )   (resid  42 and name N   )   1.0      1.77    30.00   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0    -74.75    30.00   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    131.09    30.00   2 
   assign (resid  43 and name C   )   (resid  44 and name N   )
          (resid  44 and name CA  )   (resid  44 and name C   )   1.0    -97.83    30.00   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    119.41    30.00   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0    -63.56    30.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    129.03    30.00   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0    -64.53    30.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name C   )   (resid  49 and name N   )   1.0    -24.27    30.00   2 
   assign (resid  48 and name C   )   (resid  49 and name N   )
          (resid  49 and name CA  )   (resid  49 and name C   )   1.0    -78.85    30.00   2 
   assign (resid  49 and name N   )   (resid  49 and name CA  )
          (resid  49 and name C   )   (resid  50 and name N   )   1.0    -21.57    30.00   2 
   assign (resid  51 and name N   )   (resid  51 and name CA  )
          (resid  51 and name C   )   (resid  52 and name N   )   1.0    -22.36    30.00   2 
   assign (resid  51 and name C   )   (resid  52 and name N   )
          (resid  52 and name CA  )   (resid  52 and name C   )   1.0    -69.57    30.00   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name C   )   (resid  53 and name N   )   1.0    -20.83    30.00   2 
   assign (resid  52 and name C   )   (resid  53 and name N   )
          (resid  53 and name CA  )   (resid  53 and name C   )   1.0    -81.44    30.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name C   )   (resid  54 and name N   )   1.0    -18.56    30.00   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0    -76.12    30.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    -28.16    30.00   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0    -90.77    30.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0    133.96    30.00   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0   -125.30    30.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0    139.07    30.00   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name C   )   (resid  59 and name N   )   1.0    147.84    30.00   2 
   assign (resid  59 and name C   )   (resid  60 and name N   )
          (resid  60 and name CA  )   (resid  60 and name C   )   1.0   -127.79    30.00   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name C   )   (resid  61 and name N   )   1.0    138.59    30.00   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0    -94.35    30.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    121.44    30.00   2 
   assign (resid  61 and name C   )   (resid  62 and name N   )
          (resid  62 and name CA  )   (resid  62 and name C   )   1.0    -61.83    30.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name C   )   (resid  63 and name N   )   1.0    -29.97    30.00   2 
   assign (resid  62 and name C   )   (resid  63 and name N   )
          (resid  63 and name CA  )   (resid  63 and name C   )   1.0    -75.22    30.00   2 
   assign (resid  63 and name N   )   (resid  63 and name CA  )
          (resid  63 and name C   )   (resid  64 and name N   )   1.0    -37.60    30.00   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0    -98.57    30.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0     -2.44    30.00   2 
   assign (resid  64 and name C   )   (resid  65 and name N   )
          (resid  65 and name CA  )   (resid  65 and name C   )   1.0     59.53    30.00   2 
   assign (resid  65 and name N   )   (resid  65 and name CA  )
          (resid  65 and name C   )   (resid  66 and name N   )   1.0     35.09    30.00   2 
   assign (resid  65 and name C   )   (resid  66 and name N   )
          (resid  66 and name CA  )   (resid  66 and name C   )   1.0   -101.01    30.00   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name C   )   (resid  67 and name N   )   1.0    150.14    30.00   2 
   assign (resid  66 and name C   )   (resid  67 and name N   )
          (resid  67 and name CA  )   (resid  67 and name C   )   1.0   -122.51    30.00   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name C   )   (resid  68 and name N   )   1.0    151.71    30.00   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0   -119.34    30.00   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name C   )   (resid  70 and name N   )   1.0    138.83    30.00   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -82.65    30.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    -17.52    30.00   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0   -130.77    30.00   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    164.01    30.00   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -80.53    30.00   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    121.85    30.00   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
          (resid  78 and name CA  )   (resid  78 and name C   )   1.0    -97.30    30.00   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    -37.24    30.00   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    153.52    30.00   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -96.10    30.00   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    130.26    30.00   2 
 end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  -1.329   4.727  21.437
    2    H2   MET   1           2H       MET   1   0.137   5.404  21.947
    3    H3   MET   1           3H       MET   1  -1.268   6.339  21.961
    4    HA   MET   1           HA       MET   1  -0.711   5.659  24.182
    5    HB2  MET   1           2HB      MET   1  -3.128   4.178  23.112
    6    HB3  MET   1           1HB      MET   1  -2.846   4.595  24.796
    7    HG2  MET   1           2HG      MET   1  -4.414   6.136  23.817
    8    HG3  MET   1           1HG      MET   1  -2.913   6.977  24.202
    9    HE1  MET   1           3HE      MET   1  -5.233   5.571  21.385
   10    HE2  MET   1           1HE      MET   1  -3.779   4.603  21.135
   11    HE3  MET   1           2HE      MET   1  -4.252   5.807  19.936
   12    H    ALA   2           H        ALA   2  -1.861   2.660  22.581
   13    HA   ALA   2           HA       ALA   2  -0.270   1.043  24.385
   14    HB1  ALA   2           3HB      ALA   2  -2.526   0.335  23.760
   15    HB2  ALA   2           1HB      ALA   2  -1.328  -0.863  23.267
   16    HB3  ALA   2           2HB      ALA   2  -2.034   0.224  22.070
   17    H    GLY   3           H        GLY   3  -0.295   1.762  20.907
   18    HA2  GLY   3           2HA      GLY   3   2.379   1.870  20.440
   19    HA3  GLY   3           1HA      GLY   3   2.036   0.149  20.367
   20    HA   PRO   4           HA       PRO   4   1.057   2.039  16.184
   21    HB2  PRO   4           2HB      PRO   4   3.444   0.884  15.039
   22    HB3  PRO   4           1HB      PRO   4   3.028   2.589  15.201
   23    HG2  PRO   4           2HG      PRO   4   5.071   1.357  16.575
   24    HG3  PRO   4           1HG      PRO   4   4.249   2.832  17.115
   25    HD2  PRO   4           2HD      PRO   4   3.828  -0.005  17.994
   26    HD3  PRO   4           1HD      PRO   4   3.849   1.487  18.962
   27    H    GLU   5           H        GLU   5  -0.579   0.646  15.681
   28    HA   GLU   5           HA       GLU   5  -0.272  -2.203  15.595
   29    HB2  GLU   5           2HB      GLU   5  -2.537  -0.513  14.513
   30    HB3  GLU   5           1HB      GLU   5  -2.594  -2.238  14.855
   31    HG2  GLU   5           2HG      GLU   5  -2.225  -0.038  16.887
   32    HG3  GLU   5           1HG      GLU   5  -3.710  -0.939  16.593
   33    H    GLY   6           H        GLY   6   0.127   0.325  13.260
   34    HA2  GLY   6           2HA      GLY   6   1.273  -1.400  11.330
   35    HA3  GLY   6           1HA      GLY   6  -0.381  -1.034  10.862
   36    H    PHE   7           H        PHE   7   0.373   0.036   8.986
   37    HA   PHE   7           HA       PHE   7   1.139   2.822   9.482
   38    HB2  PHE   7           2HB      PHE   7   2.562   0.972   7.549
   39    HB3  PHE   7           1HB      PHE   7   2.702   2.724   7.493
   40    HD1  PHE   7           HD1      PHE   7   3.806   3.941   9.348
   41    HD2  PHE   7           HD2      PHE   7   3.759  -0.316   9.179
   42    HE1  PHE   7           HE1      PHE   7   5.644   3.857  10.982
   43    HE2  PHE   7           HE2      PHE   7   5.596  -0.403  10.814
   44    HZ   PHE   7           HZ       PHE   7   6.541   1.684  11.717
   45    H    GLN   8           H        GLN   8   0.622   4.254   7.685
   46    HA   GLN   8           HA       GLN   8  -1.467   3.158   5.902
   47    HB2  GLN   8           2HB      GLN   8  -1.312   5.811   7.322
   48    HB3  GLN   8           1HB      GLN   8  -2.355   5.567   5.927
   49    HG2  GLN   8           2HG      GLN   8  -3.517   3.766   7.123
   50    HG3  GLN   8           1HG      GLN   8  -2.485   4.044   8.526
   51   HE21  GLN   8          1HE2      GLN   8  -5.405   4.261   8.202
   52   HE22  GLN   8          2HE2      GLN   8  -5.808   5.866   8.692
   53    H    TYR   9           H        TYR   9  -1.246   3.418   3.798
   54    HA   TYR   9           HA       TYR   9   0.698   5.386   2.765
   55    HB2  TYR   9           2HB      TYR   9  -0.346   2.874   1.416
   56    HB3  TYR   9           1HB      TYR   9   0.849   3.984   0.751
   57    HD1  TYR   9           HD2      TYR   9   3.092   4.191   1.901
   58    HD2  TYR   9           HD1      TYR   9   0.301   1.135   2.909
   59    HE1  TYR   9           HE2      TYR   9   4.893   2.906   2.975
   60    HE2  TYR   9           HE1      TYR   9   2.095  -0.155   3.988
   61    HH   TYR   9           HH       TYR   9   4.609  -0.323   3.789
   62    H    ARG  10           H        ARG  10   0.003   6.152   0.445
   63    HA   ARG  10           HA       ARG  10  -2.900   6.440   0.201
   64    HB2  ARG  10           2HB      ARG  10  -2.102   8.226   1.747
   65    HB3  ARG  10           1HB      ARG  10  -1.079   8.839   0.459
   66    HG2  ARG  10           2HG      ARG  10  -3.057   9.339  -0.887
   67    HG3  ARG  10           1HG      ARG  10  -4.092   8.696   0.393
   68    HD2  ARG  10           2HD      ARG  10  -3.188  10.392   1.939
   69    HD3  ARG  10           1HD      ARG  10  -2.225  11.056   0.621
   70    HE   ARG  10           HE       ARG  10  -5.174  11.011   0.559
   71   HH11  ARG  10          1HH1      ARG  10  -2.160  12.597   0.050
   72   HH12  ARG  10          2HH1      ARG  10  -2.898  14.101  -0.390
   73   HH21  ARG  10          1HH2      ARG  10  -6.120  12.939  -0.004
   74   HH22  ARG  10          2HH2      ARG  10  -5.125  14.285  -0.441
   75    H    ALA  11           H        ALA  11  -3.438   6.228  -1.886
   76    HA   ALA  11           HA       ALA  11  -1.441   6.033  -3.913
   77    HB1  ALA  11           3HB      ALA  11  -4.446   6.097  -4.195
   78    HB2  ALA  11           1HB      ALA  11  -3.460   4.659  -3.932
   79    HB3  ALA  11           2HB      ALA  11  -3.296   5.578  -5.428
   80    H    LEU  12           H        LEU  12  -0.620   7.554  -5.197
   81    HA   LEU  12           HA       LEU  12  -1.731  10.256  -5.107
   82    HB2  LEU  12           2HB      LEU  12   0.883   9.250  -6.242
   83    HB3  LEU  12           1HB      LEU  12   0.406  10.934  -6.126
   84    HG   LEU  12           HG       LEU  12   0.910   9.073  -3.795
   85   HD11  LEU  12          1HD1      LEU  12   2.964   9.719  -4.927
   86   HD12  LEU  12          2HD1      LEU  12   2.841  10.515  -3.359
   87   HD13  LEU  12          3HD1      LEU  12   2.500  11.419  -4.836
   88   HD21  LEU  12          3HD2      LEU  12   0.613  11.046  -2.392
   89   HD22  LEU  12          1HD2      LEU  12  -0.856  10.696  -3.303
   90   HD23  LEU  12          2HD2      LEU  12   0.206  12.010  -3.813
   91    H    TYR  13           H        TYR  13  -1.272   7.638  -7.387
   92    HA   TYR  13           HA       TYR  13  -2.423   9.325  -9.524
   93    HB2  TYR  13           2HB      TYR  13  -0.296   7.196  -9.893
   94    HB3  TYR  13           1HB      TYR  13  -1.014   8.175 -11.167
   95    HD1  TYR  13           HD1      TYR  13  -0.610  10.678 -11.147
   96    HD2  TYR  13           HD2      TYR  13   1.559   7.983  -8.658
   97    HE1  TYR  13           HE1      TYR  13   1.134  12.381 -10.823
   98    HE2  TYR  13           HE2      TYR  13   3.304   9.680  -8.333
   99    HH   TYR  13           HH       TYR  13   2.898  12.931  -9.182
  100    HA   PRO  14           HA       PRO  14  -5.392   6.022  -9.808
  101    HB2  PRO  14           2HB      PRO  14  -6.619   6.698 -12.119
  102    HB3  PRO  14           1HB      PRO  14  -6.824   7.623 -10.627
  103    HG2  PRO  14           2HG      PRO  14  -5.093   8.209 -13.000
  104    HG3  PRO  14           1HG      PRO  14  -6.064   9.322 -12.021
  105    HD2  PRO  14           2HD      PRO  14  -3.341   8.983 -11.745
  106    HD3  PRO  14           1HD      PRO  14  -4.408   9.566 -10.451
  107    H    PHE  15           H        PHE  15  -4.809   3.995 -10.249
  108    HA   PHE  15           HA       PHE  15  -4.184   3.266 -13.026
  109    HB2  PHE  15           2HB      PHE  15  -2.586   2.515 -10.579
  110    HB3  PHE  15           1HB      PHE  15  -2.568   1.510 -12.023
  111    HD1  PHE  15           HD1      PHE  15  -1.606   4.769 -10.616
  112    HD2  PHE  15           HD2      PHE  15  -1.446   2.215 -14.023
  113    HE1  PHE  15           HE1      PHE  15   0.128   6.204 -11.610
  114    HE2  PHE  15           HE2      PHE  15   0.289   3.645 -15.019
  115    HZ   PHE  15           HZ       PHE  15   1.078   5.644 -13.813
  116    H    ARG  16           H        ARG  16  -5.422   1.663 -13.743
  117    HA   ARG  16           HA       ARG  16  -7.398   0.477 -12.036
  118    HB2  ARG  16           2HB      ARG  16  -7.803   1.108 -14.417
  119    HB3  ARG  16           1HB      ARG  16  -6.711  -0.177 -14.910
  120    HG2  ARG  16           2HG      ARG  16  -8.288  -1.754 -13.644
  121    HG3  ARG  16           1HG      ARG  16  -9.428  -0.404 -13.655
  122    HD2  ARG  16           2HD      ARG  16  -9.894  -1.822 -15.544
  123    HD3  ARG  16           1HD      ARG  16  -9.206  -0.307 -16.134
  124    HE   ARG  16           HE       ARG  16  -7.450  -2.627 -15.752
  125   HH11  ARG  16          1HH1      ARG  16  -8.989  -0.420 -17.904
  126   HH12  ARG  16          2HH1      ARG  16  -7.994  -0.871 -19.243
  127   HH21  ARG  16          1HH2      ARG  16  -6.213  -3.220 -17.478
  128   HH22  ARG  16          2HH2      ARG  16  -6.427  -2.431 -19.006
  129    H    ARG  17           H        ARG  17  -7.632  -1.695 -11.458
  130    HA   ARG  17           HA       ARG  17  -5.376  -3.217 -10.866
  131    HB2  ARG  17           2HB      ARG  17  -8.282  -3.965 -11.161
  132    HB3  ARG  17           1HB      ARG  17  -7.066  -5.146 -10.686
  133    HG2  ARG  17           2HG      ARG  17  -6.634  -4.076  -8.663
  134    HG3  ARG  17           1HG      ARG  17  -7.359  -2.562  -9.201
  135    HD2  ARG  17           2HD      ARG  17  -8.902  -5.117  -8.764
  136    HD3  ARG  17           1HD      ARG  17  -8.741  -3.837  -7.560
  137    HE   ARG  17           HE       ARG  17  -9.682  -2.481  -9.661
  138   HH11  ARG  17          1HH1      ARG  17 -10.740  -5.429  -8.224
  139   HH12  ARG  17          2HH1      ARG  17 -12.387  -5.184  -8.687
  140   HH21  ARG  17          1HH2      ARG  17 -11.768  -2.172 -10.248
  141   HH22  ARG  17          2HH2      ARG  17 -12.970  -3.342  -9.818
  142    H    GLU  18           H        GLU  18  -3.966  -4.108 -12.211
  143    HA   GLU  18           HA       GLU  18  -4.462  -4.763 -14.928
  144    HB2  GLU  18           2HB      GLU  18  -2.305  -5.874 -13.113
  145    HB3  GLU  18           1HB      GLU  18  -2.287  -5.879 -14.872
  146    HG2  GLU  18           2HG      GLU  18  -2.193  -3.430 -14.875
  147    HG3  GLU  18           1HG      GLU  18  -2.203  -3.431 -13.110
  148    H    ARG  19           H        ARG  19  -4.417  -6.680 -11.973
  149    HA   ARG  19           HA       ARG  19  -5.651  -8.952 -13.409
  150    HB2  ARG  19           2HB      ARG  19  -3.840  -9.204 -10.997
  151    HB3  ARG  19           1HB      ARG  19  -4.406 -10.490 -12.048
  152    HG2  ARG  19           2HG      ARG  19  -2.487  -8.308 -12.860
  153    HG3  ARG  19           1HG      ARG  19  -2.029  -9.939 -12.376
  154    HD2  ARG  19           2HD      ARG  19  -3.312 -10.845 -14.274
  155    HD3  ARG  19           1HD      ARG  19  -3.723  -9.199 -14.765
  156    HE   ARG  19           HE       ARG  19  -0.922  -9.453 -14.547
  157   HH11  ARG  19          1HH1      ARG  19  -3.534 -10.397 -16.603
  158   HH12  ARG  19          2HH1      ARG  19  -2.509 -10.583 -17.986
  159   HH21  ARG  19          1HH2      ARG  19   0.358  -9.658 -16.329
  160   HH22  ARG  19          2HH2      ARG  19  -0.337 -10.148 -17.837
  161    HA   PRO  20           HA       PRO  20  -9.010  -8.822 -10.390
  162    HB2  PRO  20           2HB      PRO  20  -8.496 -11.761 -10.119
  163    HB3  PRO  20           1HB      PRO  20 -10.022 -10.905 -10.385
  164    HG2  PRO  20           2HG      PRO  20  -8.837 -12.159 -12.401
  165    HG3  PRO  20           1HG      PRO  20  -9.583 -10.568 -12.655
  166    HD2  PRO  20           2HD      PRO  20  -6.687 -11.285 -12.386
  167    HD3  PRO  20           1HD      PRO  20  -7.456 -10.077 -13.437
  168    H    GLU  21           H        GLU  21  -6.019 -10.554  -9.586
  169    HA   GLU  21           HA       GLU  21  -6.502 -10.229  -6.717
  170    HB2  GLU  21           2HB      GLU  21  -4.272 -11.435  -6.505
  171    HB3  GLU  21           1HB      GLU  21  -5.602 -12.350  -7.188
  172    HG2  GLU  21           2HG      GLU  21  -3.661 -10.966  -9.002
  173    HG3  GLU  21           1HG      GLU  21  -3.235 -12.502  -8.252
  174    H    ASP  22           H        ASP  22  -5.500  -8.174  -8.969
  175    HA   ASP  22           HA       ASP  22  -3.283  -6.952  -7.498
  176    HB2  ASP  22           2HB      ASP  22  -3.227  -7.095  -9.980
  177    HB3  ASP  22           1HB      ASP  22  -4.692  -6.127 -10.062
  178    H    LEU  23           H        LEU  23  -3.459  -4.771  -6.605
  179    HA   LEU  23           HA       LEU  23  -6.248  -4.087  -5.896
  180    HB2  LEU  23           2HB      LEU  23  -4.740  -4.657  -4.021
  181    HB3  LEU  23           1HB      LEU  23  -3.709  -3.311  -4.458
  182    HG   LEU  23           HG       LEU  23  -5.541  -1.735  -3.954
  183   HD11  LEU  23          1HD1      LEU  23  -7.064  -4.203  -3.097
  184   HD12  LEU  23          2HD1      LEU  23  -7.448  -3.159  -4.467
  185   HD13  LEU  23          3HD1      LEU  23  -7.572  -2.535  -2.823
  186   HD21  LEU  23          3HD2      LEU  23  -5.552  -2.037  -1.508
  187   HD22  LEU  23          1HD2      LEU  23  -3.946  -2.264  -2.199
  188   HD23  LEU  23          2HD2      LEU  23  -4.903  -3.663  -1.718
  189    H    GLU  24           H        GLU  24  -7.090  -2.090  -6.251
  190    HA   GLU  24           HA       GLU  24  -5.792  -0.607  -8.374
  191    HB2  GLU  24           2HB      GLU  24  -8.230  -1.401  -8.303
  192    HB3  GLU  24           1HB      GLU  24  -8.520  -0.057  -7.209
  193    HG2  GLU  24           2HG      GLU  24  -8.104   1.535  -8.861
  194    HG3  GLU  24           1HG      GLU  24  -7.252   0.380  -9.889
  195    H    LEU  25           H        LEU  25  -5.349   1.596  -8.407
  196    HA   LEU  25           HA       LEU  25  -5.201   2.904  -5.753
  197    HB2  LEU  25           2HB      LEU  25  -3.261   3.139  -8.064
  198    HB3  LEU  25           1HB      LEU  25  -3.143   4.014  -6.548
  199    HG   LEU  25           HG       LEU  25  -2.919   1.012  -6.871
  200   HD11  LEU  25          1HD1      LEU  25  -0.983   2.190  -7.756
  201   HD12  LEU  25          2HD1      LEU  25  -0.574   1.342  -6.266
  202   HD13  LEU  25          3HD1      LEU  25  -0.820   3.090  -6.247
  203   HD21  LEU  25          3HD2      LEU  25  -2.587   2.735  -4.412
  204   HD22  LEU  25          1HD2      LEU  25  -2.299   0.996  -4.509
  205   HD23  LEU  25          2HD2      LEU  25  -3.928   1.633  -4.731
  206    H    LEU  26           H        LEU  26  -6.219   4.813  -5.558
  207    HA   LEU  26           HA       LEU  26  -6.749   6.421  -7.980
  208    HB2  LEU  26           2HB      LEU  26  -8.555   5.788  -5.662
  209    HB3  LEU  26           1HB      LEU  26  -8.765   7.285  -6.543
  210    HG   LEU  26           HG       LEU  26 -10.333   5.660  -7.371
  211   HD11  LEU  26          1HD1      LEU  26  -9.809   5.670  -9.733
  212   HD12  LEU  26          2HD1      LEU  26  -8.113   6.007  -9.386
  213   HD13  LEU  26          3HD1      LEU  26  -9.348   7.207  -9.001
  214   HD21  LEU  26          3HD2      LEU  26  -9.698   3.551  -8.354
  215   HD22  LEU  26          1HD2      LEU  26  -9.103   3.631  -6.697
  216   HD23  LEU  26          2HD2      LEU  26  -7.991   3.878  -8.047
  217    HA   PRO  27           HA       PRO  27  -4.395   9.621  -6.098
  218    HB2  PRO  27           2HB      PRO  27  -5.622  11.865  -7.096
  219    HB3  PRO  27           1HB      PRO  27  -4.541  10.828  -8.038
  220    HG2  PRO  27           2HG      PRO  27  -7.539  10.854  -7.949
  221    HG3  PRO  27           1HG      PRO  27  -6.463  10.735  -9.356
  222    HD2  PRO  27           2HD      PRO  27  -7.671   8.570  -8.324
  223    HD3  PRO  27           1HD      PRO  27  -6.026   8.486  -8.987
  224    H    GLY  28           H        GLY  28  -4.458  10.093  -3.991
  225    HA2  GLY  28           2HA      GLY  28  -5.090  11.529  -2.217
  226    HA3  GLY  28           1HA      GLY  28  -6.680  11.701  -2.943
  227    H    ASP  29           H        ASP  29  -6.411   8.533  -3.190
  228    HA   ASP  29           HA       ASP  29  -8.044   8.146  -0.835
  229    HB2  ASP  29           2HB      ASP  29  -8.556   7.188  -3.130
  230    HB3  ASP  29           1HB      ASP  29  -7.253   6.033  -2.850
  231    H    VAL  30           H        VAL  30  -7.657   6.721   0.875
  232    HA   VAL  30           HA       VAL  30  -4.806   6.327   1.450
  233    HB   VAL  30           HB       VAL  30  -7.200   6.279   3.305
  234   HG11  VAL  30          1HG1      VAL  30  -5.424   4.839   4.157
  235   HG12  VAL  30          2HG1      VAL  30  -5.558   6.298   5.138
  236   HG13  VAL  30          3HG1      VAL  30  -4.250   6.140   3.963
  237   HG21  VAL  30          3HG2      VAL  30  -5.054   8.371   2.909
  238   HG22  VAL  30          1HG2      VAL  30  -6.327   8.422   4.131
  239   HG23  VAL  30          2HG2      VAL  30  -6.743   8.503   2.419
  240    H    LEU  31           H        LEU  31  -3.902   4.384   1.964
  241    HA   LEU  31           HA       LEU  31  -5.628   1.989   1.898
  242    HB2  LEU  31           2HB      LEU  31  -2.761   2.253   0.957
  243    HB3  LEU  31           1HB      LEU  31  -3.649   0.743   1.054
  244    HG   LEU  31           HG       LEU  31  -5.334   1.861  -0.562
  245   HD11  LEU  31          1HD1      LEU  31  -2.945   3.651  -0.997
  246   HD12  LEU  31          2HD1      LEU  31  -4.535   4.141  -0.417
  247   HD13  LEU  31          3HD1      LEU  31  -4.346   3.542  -2.063
  248   HD21  LEU  31          3HD2      LEU  31  -3.875  -0.001  -1.157
  249   HD22  LEU  31          1HD2      LEU  31  -2.570   1.128  -1.525
  250   HD23  LEU  31          2HD2      LEU  31  -4.045   1.135  -2.496
  251    H    VAL  32           H        VAL  32  -5.655   0.812   3.711
  252    HA   VAL  32           HA       VAL  32  -3.807   1.513   5.877
  253    HB   VAL  32           HB       VAL  32  -6.343  -0.144   5.941
  254   HG11  VAL  32          1HG1      VAL  32  -4.814  -0.741   7.756
  255   HG12  VAL  32          2HG1      VAL  32  -6.231   0.106   8.376
  256   HG13  VAL  32          3HG1      VAL  32  -4.692   0.957   8.224
  257   HG21  VAL  32          3HG2      VAL  32  -7.375   1.828   6.980
  258   HG22  VAL  32          1HG2      VAL  32  -6.789   2.185   5.355
  259   HG23  VAL  32          2HG2      VAL  32  -5.875   2.729   6.761
  260    H    VAL  33           H        VAL  33  -2.130   0.233   6.415
  261    HA   VAL  33           HA       VAL  33  -2.256  -2.660   5.798
  262    HB   VAL  33           HB       VAL  33   0.201  -0.890   5.614
  263   HG11  VAL  33          1HG1      VAL  33  -0.131  -3.834   5.009
  264   HG12  VAL  33          2HG1      VAL  33   0.744  -3.147   6.377
  265   HG13  VAL  33          3HG1      VAL  33   1.330  -2.883   4.735
  266   HG21  VAL  33          3HG2      VAL  33  -1.322  -0.500   3.747
  267   HG22  VAL  33          1HG2      VAL  33  -1.403  -2.233   3.429
  268   HG23  VAL  33          2HG2      VAL  33   0.114  -1.364   3.197
  269    H    SER  34           H        SER  34  -1.527  -4.056   7.385
  270    HA   SER  34           HA       SER  34  -1.080  -2.885  10.035
  271    HB2  SER  34           2HB      SER  34  -2.789  -4.619   9.894
  272    HB3  SER  34           1HB      SER  34  -1.621  -5.749   9.198
  273    HG   SER  34           HG       SER  34  -2.078  -5.114  11.801
  274    H    ARG  35           H        ARG  35   0.577  -3.716  11.470
  275    HA   ARG  35           HA       ARG  35   3.168  -3.745  10.431
  276    HB2  ARG  35           2HB      ARG  35   2.048  -4.739  13.054
  277    HB3  ARG  35           1HB      ARG  35   3.768  -4.810  12.701
  278    HG2  ARG  35           2HG      ARG  35   2.207  -2.245  12.550
  279    HG3  ARG  35           1HG      ARG  35   2.937  -2.824  14.047
  280    HD2  ARG  35           2HD      ARG  35   4.439  -2.308  11.472
  281    HD3  ARG  35           1HD      ARG  35   4.355  -1.191  12.835
  282    HE   ARG  35           HE       ARG  35   5.278  -3.737  13.677
  283   HH11  ARG  35          1HH1      ARG  35   6.339  -0.885  12.043
  284   HH12  ARG  35          2HH1      ARG  35   7.991  -1.107  12.502
  285   HH21  ARG  35          1HH2      ARG  35   7.397  -4.021  14.220
  286   HH22  ARG  35          2HH2      ARG  35   8.580  -2.863  13.705
  287    H    ALA  36           H        ALA  36   1.049  -6.473  11.227
  288    HA   ALA  36           HA       ALA  36   2.829  -8.586  11.001
  289    HB1  ALA  36           3HB      ALA  36  -0.076  -8.573  10.167
  290    HB2  ALA  36           1HB      ALA  36   0.522  -8.810  11.812
  291    HB3  ALA  36           2HB      ALA  36   0.892  -9.997  10.559
  292    H    ALA  37           H        ALA  37   0.950  -7.036   8.403
  293    HA   ALA  37           HA       ALA  37   1.710  -8.743   6.305
  294    HB1  ALA  37           3HB      ALA  37   0.933  -6.973   4.812
  295    HB2  ALA  37           1HB      ALA  37   0.938  -5.823   6.151
  296    HB3  ALA  37           2HB      ALA  37  -0.180  -7.187   6.162
  297    H    LEU  38           H        LEU  38   3.091  -5.590   7.273
  298    HA   LEU  38           HA       LEU  38   5.111  -5.527   5.307
  299    HB2  LEU  38           2HB      LEU  38   5.008  -4.182   8.012
  300    HB3  LEU  38           1HB      LEU  38   6.174  -3.805   6.756
  301    HG   LEU  38           HG       LEU  38   3.178  -3.416   6.560
  302   HD11  LEU  38          1HD1      LEU  38   5.407  -1.392   6.784
  303   HD12  LEU  38          2HD1      LEU  38   4.255  -1.813   8.052
  304   HD13  LEU  38          3HD1      LEU  38   3.692  -1.036   6.573
  305   HD21  LEU  38          3HD2      LEU  38   5.377  -2.802   4.582
  306   HD22  LEU  38          1HD2      LEU  38   3.705  -2.253   4.439
  307   HD23  LEU  38          2HD2      LEU  38   4.074  -3.977   4.390
  308    H    GLN  39           H        GLN  39   5.158  -6.763   8.646
  309    HA   GLN  39           HA       GLN  39   7.917  -7.418   8.681
  310    HB2  GLN  39           2HB      GLN  39   5.615  -8.584  10.260
  311    HB3  GLN  39           1HB      GLN  39   7.311  -8.900  10.598
  312    HG2  GLN  39           2HG      GLN  39   5.942  -6.215  10.725
  313    HG3  GLN  39           1HG      GLN  39   6.411  -7.212  12.099
  314   HE21  GLN  39          1HE2      GLN  39   7.221  -4.484  11.433
  315   HE22  GLN  39          2HE2      GLN  39   8.943  -4.512  11.325
  316    H    ALA  40           H        ALA  40   5.052  -9.221   7.644
  317    HA   ALA  40           HA       ALA  40   6.282 -11.707   7.148
  318    HB1  ALA  40           3HB      ALA  40   3.851 -11.402   7.183
  319    HB2  ALA  40           1HB      ALA  40   4.381 -12.167   5.686
  320    HB3  ALA  40           2HB      ALA  40   3.943 -10.457   5.696
  321    H    LEU  41           H        LEU  41   6.135  -8.755   5.242
  322    HA   LEU  41           HA       LEU  41   7.276  -9.859   2.860
  323    HB2  LEU  41           2HB      LEU  41   7.169  -6.990   3.807
  324    HB3  LEU  41           1HB      LEU  41   7.579  -7.509   2.183
  325    HG   LEU  41           HG       LEU  41   4.891  -7.928   3.509
  326   HD11  LEU  41          1HD1      LEU  41   5.272  -5.576   3.060
  327   HD12  LEU  41          2HD1      LEU  41   4.087  -6.226   1.929
  328   HD13  LEU  41          3HD1      LEU  41   5.746  -5.945   1.401
  329   HD21  LEU  41          3HD2      LEU  41   5.406  -9.668   1.881
  330   HD22  LEU  41          1HD2      LEU  41   5.799  -8.445   0.673
  331   HD23  LEU  41          2HD2      LEU  41   4.146  -8.598   1.271
  332    H    GLY  42           H        GLY  42   8.588  -8.778   5.866
  333    HA2  GLY  42           2HA      GLY  42  10.779  -9.042   6.627
  334    HA3  GLY  42           1HA      GLY  42  11.290  -9.405   4.987
  335    H    VAL  43           H        VAL  43   9.576  -6.545   6.235
  336    HA   VAL  43           HA       VAL  43  11.482  -4.803   4.903
  337    HB   VAL  43           HB       VAL  43   9.054  -4.080   6.568
  338   HG11  VAL  43          1HG1      VAL  43  10.690  -2.404   4.653
  339   HG12  VAL  43          2HG1      VAL  43  10.653  -2.241   6.408
  340   HG13  VAL  43          3HG1      VAL  43   9.208  -1.890   5.460
  341   HG21  VAL  43          3HG2      VAL  43   7.925  -3.732   4.399
  342   HG22  VAL  43          1HG2      VAL  43   8.411  -5.411   4.636
  343   HG23  VAL  43          2HG2      VAL  43   9.348  -4.364   3.570
  344    H    ALA  44           H        ALA  44  13.090  -3.654   5.862
  345    HA   ALA  44           HA       ALA  44  13.798  -4.073   8.593
  346    HB1  ALA  44           3HB      ALA  44  14.841  -2.029   6.625
  347    HB2  ALA  44           1HB      ALA  44  15.478  -3.657   6.865
  348    HB3  ALA  44           2HB      ALA  44  15.595  -2.465   8.160
  349    H    GLU  45           H        GLU  45  13.638  -2.702  10.363
  350    HA   GLU  45           HA       GLU  45  11.347  -1.083  10.544
  351    HB2  GLU  45           2HB      GLU  45  12.610  -2.283  12.419
  352    HB3  GLU  45           1HB      GLU  45  13.719  -0.919  12.410
  353    HG2  GLU  45           2HG      GLU  45  12.097  -0.625  14.160
  354    HG3  GLU  45           1HG      GLU  45  11.831   0.589  12.910
  355    H    GLY  46           H        GLY  46  11.068   0.812   9.518
  356    HA2  GLY  46           2HA      GLY  46  11.599   3.163   9.319
  357    HA3  GLY  46           1HA      GLY  46  13.302   2.758   9.469
  358    H    GLY  47           H        GLY  47  11.755   0.543   7.474
  359    HA2  GLY  47           2HA      GLY  47  12.767   1.889   5.048
  360    HA3  GLY  47           1HA      GLY  47  12.441   0.169   5.214
  361    H    GLU  48           H        GLU  48   9.845   0.645   6.500
  362    HA   GLU  48           HA       GLU  48   8.145   0.496   4.303
  363    HB2  GLU  48           2HB      GLU  48   6.315   0.637   5.883
  364    HB3  GLU  48           1HB      GLU  48   7.610  -0.328   6.572
  365    HG2  GLU  48           2HG      GLU  48   6.888   2.515   7.271
  366    HG3  GLU  48           1HG      GLU  48   6.681   1.084   8.276
  367    H    ARG  49           H        ARG  49   9.160   3.328   6.136
  368    HA   ARG  49           HA       ARG  49   7.361   5.232   5.192
  369    HB2  ARG  49           2HB      ARG  49   9.221   6.882   5.588
  370    HB3  ARG  49           1HB      ARG  49   8.853   5.828   6.946
  371    HG2  ARG  49           2HG      ARG  49  10.788   4.465   6.489
  372    HG3  ARG  49           1HG      ARG  49  11.124   5.370   5.011
  373    HD2  ARG  49           2HD      ARG  49  11.090   6.607   7.766
  374    HD3  ARG  49           1HD      ARG  49  12.546   5.992   6.984
  375    HE   ARG  49           HE       ARG  49  11.965   7.657   5.158
  376   HH11  ARG  49          1HH1      ARG  49  11.105   8.180   8.455
  377   HH12  ARG  49          2HH1      ARG  49  11.218   9.898   8.316
  378   HH21  ARG  49          1HH2      ARG  49  12.110   9.849   4.996
  379   HH22  ARG  49          2HH2      ARG  49  11.779  10.836   6.379
  380    H    CYS  50           H        CYS  50   9.768   3.550   3.438
  381    HA   CYS  50           HA       CYS  50   9.299   5.297   1.101
  382    HB2  CYS  50           2HB      CYS  50  11.680   3.485   1.602
  383    HB3  CYS  50           1HB      CYS  50  11.431   4.492   0.181
  384    HG   CYS  50           HG       CYS  50  11.213   6.470   2.755
  385    HA   PRO  51           HA       PRO  51   6.931   1.334   0.592
  386    HB2  PRO  51           2HB      PRO  51   5.231   2.408  -1.324
  387    HB3  PRO  51           1HB      PRO  51   4.936   2.415   0.417
  388    HG2  PRO  51           2HG      PRO  51   6.059   4.581  -1.324
  389    HG3  PRO  51           1HG      PRO  51   4.897   4.705   0.013
  390    HD2  PRO  51           2HD      PRO  51   7.468   5.369   0.352
  391    HD3  PRO  51           1HD      PRO  51   6.564   4.539   1.637
  392    H    GLN  52           H        GLN  52   8.130   3.434  -2.016
  393    HA   GLN  52           HA       GLN  52   8.065   1.542  -4.092
  394    HB2  GLN  52           2HB      GLN  52   9.828   3.022  -5.156
  395    HB3  GLN  52           1HB      GLN  52   8.336   3.819  -4.688
  396    HG2  GLN  52           2HG      GLN  52  10.042   5.293  -4.062
  397    HG3  GLN  52           1HG      GLN  52   9.530   4.522  -2.564
  398   HE21  GLN  52          1HE2      GLN  52  11.595   3.039  -4.997
  399   HE22  GLN  52          2HE2      GLN  52  13.013   2.987  -4.012
  400    H    SER  53           H        SER  53  10.161   1.752  -1.383
  401    HA   SER  53           HA       SER  53  12.314   0.184  -2.529
  402    HB2  SER  53           2HB      SER  53  12.860   1.808  -0.797
  403    HB3  SER  53           1HB      SER  53  11.755   1.024   0.331
  404    HG   SER  53           HG       SER  53  13.194  -0.484   0.713
  405    H    VAL  54           H        VAL  54   9.317  -0.448  -0.970
  406    HA   VAL  54           HA       VAL  54  10.053  -3.196  -0.258
  407    HB   VAL  54           HB       VAL  54   7.399  -1.784   0.138
  408   HG11  VAL  54          1HG1      VAL  54   8.493  -4.338   1.336
  409   HG12  VAL  54          2HG1      VAL  54   7.188  -4.209   0.156
  410   HG13  VAL  54          3HG1      VAL  54   6.969  -3.567   1.784
  411   HG21  VAL  54          3HG2      VAL  54   9.679  -2.144   2.094
  412   HG22  VAL  54          1HG2      VAL  54   8.091  -1.475   2.475
  413   HG23  VAL  54          2HG2      VAL  54   9.164  -0.621   1.363
  414    H    GLY  55           H        GLY  55   7.962  -1.410  -2.484
  415    HA2  GLY  55           2HA      GLY  55   7.477  -2.146  -4.687
  416    HA3  GLY  55           1HA      GLY  55   7.797  -3.799  -4.190
  417    H    TRP  56           H        TRP  56   5.950  -4.863  -4.651
  418    HA   TRP  56           HA       TRP  56   3.345  -3.741  -4.202
  419    HB2  TRP  56           2HB      TRP  56   2.647  -6.217  -4.668
  420    HB3  TRP  56           1HB      TRP  56   3.319  -5.243  -5.970
  421    HD1  TRP  56           HD1      TRP  56   4.727  -7.750  -3.335
  422    HE1  TRP  56           HE1      TRP  56   6.511  -9.186  -4.505
  423    HE3  TRP  56           HE3      TRP  56   4.595  -5.595  -7.975
  424    HZ2  TRP  56           HZ2      TRP  56   7.702  -9.388  -7.056
  425    HZ3  TRP  56           HZ3      TRP  56   6.092  -6.470  -9.724
  426    HH2  TRP  56           HH2      TRP  56   7.613  -8.327  -9.272
  427    H    MET  57           H        MET  57   2.059  -3.877  -2.457
  428    HA   MET  57           HA       MET  57   2.850  -5.671  -0.245
  429    HB2  MET  57           2HB      MET  57   2.078  -2.750   0.002
  430    HB3  MET  57           1HB      MET  57   2.351  -3.842   1.353
  431    HG2  MET  57           2HG      MET  57   4.677  -4.094   0.724
  432    HG3  MET  57           1HG      MET  57   4.426  -3.080  -0.697
  433    HE1  MET  57           3HE      MET  57   3.751   0.419   0.856
  434    HE2  MET  57           1HE      MET  57   2.614  -0.785   0.252
  435    HE3  MET  57           2HE      MET  57   4.107  -0.463  -0.627
  436    HA   PRO  58           HA       PRO  58  -1.573  -6.502  -0.170
  437    HB2  PRO  58           2HB      PRO  58  -1.670  -8.081   2.004
  438    HB3  PRO  58           1HB      PRO  58  -0.910  -8.618   0.502
  439    HG2  PRO  58           2HG      PRO  58   0.370  -7.553   2.992
  440    HG3  PRO  58           1HG      PRO  58   0.860  -8.928   1.986
  441    HD2  PRO  58           2HD      PRO  58   2.002  -6.432   1.830
  442    HD3  PRO  58           1HD      PRO  58   1.965  -7.587   0.483
  443    H    GLY  59           H        GLY  59  -3.022  -4.960   0.413
  444    HA2  GLY  59           2HA      GLY  59  -3.322  -4.260   3.234
  445    HA3  GLY  59           1HA      GLY  59  -2.881  -2.942   2.165
  446    H    LEU  60           H        LEU  60  -5.001  -2.268   3.284
  447    HA   LEU  60           HA       LEU  60  -7.341  -3.166   1.712
  448    HB2  LEU  60           2HB      LEU  60  -7.663  -3.499   4.076
  449    HB3  LEU  60           1HB      LEU  60  -7.132  -1.866   4.430
  450    HG   LEU  60           HG       LEU  60  -9.161  -0.999   3.262
  451   HD11  LEU  60          1HD1      LEU  60 -11.000  -2.502   2.755
  452   HD12  LEU  60          2HD1      LEU  60 -10.012  -3.894   3.200
  453   HD13  LEU  60          3HD1      LEU  60  -9.577  -2.915   1.798
  454   HD21  LEU  60          3HD2      LEU  60  -9.122  -1.225   5.686
  455   HD22  LEU  60          1HD2      LEU  60  -9.680  -2.893   5.555
  456   HD23  LEU  60          2HD2      LEU  60 -10.731  -1.568   5.053
  457    H    ASN  61           H        ASN  61  -8.292  -1.762   0.329
  458    HA   ASN  61           HA       ASN  61  -7.351   1.022   0.285
  459    HB2  ASN  61           2HB      ASN  61  -7.161  -0.163  -1.818
  460    HB3  ASN  61           1HB      ASN  61  -8.862  -0.615  -1.763
  461   HD21  ASN  61          1HD2      ASN  61  -6.641   2.063  -2.167
  462   HD22  ASN  61          2HD2      ASN  61  -7.775   3.122  -2.922
  463    H    GLU  62           H        GLU  62  -8.755   2.812   0.357
  464    HA   GLU  62           HA       GLU  62 -11.109   2.352   1.955
  465    HB2  GLU  62           2HB      GLU  62  -9.667   4.820   1.030
  466    HB3  GLU  62           1HB      GLU  62 -11.248   4.940   1.791
  467    HG2  GLU  62           2HG      GLU  62  -8.831   3.632   3.033
  468    HG3  GLU  62           1HG      GLU  62  -9.379   5.276   3.365
  469    H    ARG  63           H        ARG  63 -10.603   3.895  -1.253
  470    HA   ARG  63           HA       ARG  63 -13.319   4.541  -1.646
  471    HB2  ARG  63           2HB      ARG  63 -11.611   5.635  -2.952
  472    HB3  ARG  63           1HB      ARG  63 -11.124   4.109  -3.681
  473    HG2  ARG  63           2HG      ARG  63 -13.292   3.933  -4.790
  474    HG3  ARG  63           1HG      ARG  63 -13.806   5.444  -4.041
  475    HD2  ARG  63           2HD      ARG  63 -12.130   6.673  -5.259
  476    HD3  ARG  63           1HD      ARG  63 -11.440   5.178  -5.897
  477    HE   ARG  63           HE       ARG  63 -13.952   5.029  -6.787
  478   HH11  ARG  63          1HH1      ARG  63 -11.722   7.656  -6.868
  479   HH12  ARG  63          2HH1      ARG  63 -12.365   8.281  -8.348
  480   HH21  ARG  63          1HH2      ARG  63 -14.752   5.835  -8.670
  481   HH22  ARG  63          2HH2      ARG  63 -14.061   7.271  -9.354
  482    H    THR  64           H        THR  64 -11.519   1.632  -2.576
  483    HA   THR  64           HA       THR  64 -13.867   0.544  -3.949
  484    HB   THR  64           HB       THR  64 -12.420  -1.308  -4.622
  485    HG1  THR  64           HG1      THR  64 -10.147  -0.110  -3.501
  486   HG21  THR  64          3HG2      THR  64 -11.054   1.369  -4.988
  487   HG22  THR  64          1HG2      THR  64 -12.368   0.738  -5.982
  488   HG23  THR  64          2HG2      THR  64 -10.798  -0.066  -5.981
  489    H    ARG  65           H        ARG  65 -12.455   0.417  -0.848
  490    HA   ARG  65           HA       ARG  65 -12.705  -0.876   1.000
  491    HB2  ARG  65           2HB      ARG  65 -15.283  -1.567  -0.420
  492    HB3  ARG  65           1HB      ARG  65 -14.883  -2.225   1.158
  493    HG2  ARG  65           2HG      ARG  65 -16.270  -0.394   1.597
  494    HG3  ARG  65           1HG      ARG  65 -14.641   0.181   1.947
  495    HD2  ARG  65           2HD      ARG  65 -15.839   1.890   0.745
  496    HD3  ARG  65           1HD      ARG  65 -14.580   1.235  -0.301
  497    HE   ARG  65           HE       ARG  65 -16.767  -0.218  -0.968
  498   HH11  ARG  65          1HH1      ARG  65 -16.145   3.165  -0.774
  499   HH12  ARG  65          2HH1      ARG  65 -17.276   3.557  -2.021
  500   HH21  ARG  65          1HH2      ARG  65 -18.232   0.290  -2.538
  501   HH22  ARG  65          2HH2      ARG  65 -18.482   1.947  -2.979
  502    H    GLN  66           H        GLN  66 -11.450  -2.021  -1.551
  503    HA   GLN  66           HA       GLN  66 -11.878  -4.894  -1.124
  504    HB2  GLN  66           2HB      GLN  66 -10.468  -3.419  -3.359
  505    HB3  GLN  66           1HB      GLN  66 -10.648  -5.167  -3.266
  506    HG2  GLN  66           2HG      GLN  66 -13.066  -4.952  -3.385
  507    HG3  GLN  66           1HG      GLN  66 -12.924  -3.195  -3.404
  508   HE21  GLN  66          1HE2      GLN  66 -14.004  -3.074  -5.384
  509   HE22  GLN  66          2HE2      GLN  66 -13.233  -3.512  -6.866
  510    H    ARG  67           H        ARG  67 -10.032  -6.348  -1.146
  511    HA   ARG  67           HA       ARG  67  -7.661  -5.194   0.200
  512    HB2  ARG  67           2HB      ARG  67  -8.928  -7.898   0.721
  513    HB3  ARG  67           1HB      ARG  67  -7.573  -7.187   1.593
  514    HG2  ARG  67           2HG      ARG  67  -8.983  -5.486   2.529
  515    HG3  ARG  67           1HG      ARG  67 -10.343  -5.996   1.527
  516    HD2  ARG  67           2HD      ARG  67 -10.631  -6.826   3.781
  517    HD3  ARG  67           1HD      ARG  67 -10.349  -8.173   2.681
  518    HE   ARG  67           HE       ARG  67  -7.891  -7.785   3.563
  519   HH11  ARG  67          1HH1      ARG  67 -10.855  -7.858   5.315
  520   HH12  ARG  67          2HH1      ARG  67 -10.101  -8.397   6.771
  521   HH21  ARG  67          1HH2      ARG  67  -6.952  -8.501   5.431
  522   HH22  ARG  67          2HH2      ARG  67  -7.927  -8.752   6.840
  523    H    GLY  68           H        GLY  68  -5.670  -5.816  -0.556
  524    HA2  GLY  68           2HA      GLY  68  -4.970  -8.231  -1.737
  525    HA3  GLY  68           1HA      GLY  68  -5.500  -7.196  -3.055
  526    H    ASP  69           H        ASP  69  -3.155  -7.740  -3.618
  527    HA   ASP  69           HA       ASP  69  -1.167  -6.139  -2.219
  528    HB2  ASP  69           2HB      ASP  69  -0.930  -7.940  -4.644
  529    HB3  ASP  69           1HB      ASP  69   0.421  -7.158  -3.829
  530    H    PHE  70           H        PHE  70  -0.760  -4.073  -2.751
  531    HA   PHE  70           HA       PHE  70  -1.405  -3.144  -5.480
  532    HB2  PHE  70           2HB      PHE  70  -1.651  -0.896  -4.553
  533    HB3  PHE  70           1HB      PHE  70  -2.708  -2.019  -3.714
  534    HD1  PHE  70           HD1      PHE  70  -2.188  -2.721  -1.396
  535    HD2  PHE  70           HD2      PHE  70   0.107   0.257  -3.406
  536    HE1  PHE  70           HE1      PHE  70  -1.273  -1.970   0.761
  537    HE2  PHE  70           HE2      PHE  70   1.026   1.004  -1.251
  538    HZ   PHE  70           HZ       PHE  70   0.338  -0.108   0.835
  539    HA   PRO  71           HA       PRO  71   2.956  -2.300  -6.097
  540    HB2  PRO  71           2HB      PRO  71   2.731  -0.360  -8.021
  541    HB3  PRO  71           1HB      PRO  71   2.548  -2.085  -8.351
  542    HG2  PRO  71           2HG      PRO  71   0.435  -0.004  -7.920
  543    HG3  PRO  71           1HG      PRO  71   0.492  -1.310  -9.120
  544    HD2  PRO  71           2HD      PRO  71  -0.992  -1.490  -6.867
  545    HD3  PRO  71           1HD      PRO  71  -0.212  -2.909  -7.600
  546    H    GLY  72           H        GLY  72   3.761  -1.309  -4.273
  547    HA2  GLY  72           2HA      GLY  72   2.779   1.204  -3.301
  548    HA3  GLY  72           1HA      GLY  72   4.136   0.294  -2.661
  549    H    THR  73           H        THR  73   3.869   1.488  -5.989
  550    HA   THR  73           HA       THR  73   6.236   3.178  -5.506
  551    HB   THR  73           HB       THR  73   6.639   3.118  -7.895
  552    HG1  THR  73           HG1      THR  73   5.014   2.783  -9.199
  553   HG21  THR  73          3HG2      THR  73   7.009   0.711  -8.238
  554   HG22  THR  73          1HG2      THR  73   5.949   0.351  -6.874
  555   HG23  THR  73          2HG2      THR  73   7.472   1.200  -6.608
  556    H    TYR  74           H        TYR  74   2.912   3.235  -6.590
  557    HA   TYR  74           HA       TYR  74   3.057   6.042  -7.402
  558    HB2  TYR  74           2HB      TYR  74   0.613   4.260  -7.352
  559    HB3  TYR  74           1HB      TYR  74   0.831   5.756  -8.251
  560    HD1  TYR  74           HD2      TYR  74   2.806   5.703 -10.027
  561    HD2  TYR  74           HD1      TYR  74   0.877   2.243  -8.456
  562    HE1  TYR  74           HE2      TYR  74   3.527   4.410 -11.990
  563    HE2  TYR  74           HE1      TYR  74   1.596   0.950 -10.415
  564    HH   TYR  74           HH       TYR  74   2.234   1.399 -12.775
  565    H    VAL  75           H        VAL  75   3.071   4.835  -4.477
  566    HA   VAL  75           HA       VAL  75   0.834   6.464  -3.422
  567    HB   VAL  75           HB       VAL  75   0.643   4.935  -1.536
  568   HG11  VAL  75          1HG1      VAL  75  -0.191   2.927  -2.719
  569   HG12  VAL  75          2HG1      VAL  75   0.578   3.505  -4.197
  570   HG13  VAL  75          3HG1      VAL  75  -0.727   4.434  -3.461
  571   HG21  VAL  75          3HG2      VAL  75   2.943   4.212  -1.313
  572   HG22  VAL  75          1HG2      VAL  75   2.861   3.366  -2.861
  573   HG23  VAL  75          2HG2      VAL  75   1.899   2.802  -1.494
  574    H    GLU  76           H        GLU  76   1.195   7.800  -1.670
  575    HA   GLU  76           HA       GLU  76   3.966   8.260  -0.857
  576    HB2  GLU  76           2HB      GLU  76   3.206  10.319   0.116
  577    HB3  GLU  76           1HB      GLU  76   2.455  10.178  -1.467
  578    HG2  GLU  76           2HG      GLU  76   0.358   9.504  -0.459
  579    HG3  GLU  76           1HG      GLU  76   1.097   9.499   1.141
  580    H    PHE  77           H        PHE  77   4.272   8.786   1.552
  581    HA   PHE  77           HA       PHE  77   3.028   6.655   3.159
  582    HB2  PHE  77           2HB      PHE  77   5.484   6.615   2.995
  583    HB3  PHE  77           1HB      PHE  77   5.561   8.246   3.652
  584    HD1  PHE  77           HD2      PHE  77   4.293   4.837   4.491
  585    HD2  PHE  77           HD1      PHE  77   5.854   8.530   5.941
  586    HE1  PHE  77           HE2      PHE  77   4.399   3.900   6.761
  587    HE2  PHE  77           HE1      PHE  77   5.958   7.592   8.212
  588    HZ   PHE  77           HZ       PHE  77   5.233   5.277   8.624
  589    H    LEU  78           H        LEU  78   1.694   7.130   4.825
  590    HA   LEU  78           HA       LEU  78   1.208   9.969   5.430
  591    HB2  LEU  78           2HB      LEU  78  -0.443   7.512   6.044
  592    HB3  LEU  78           1HB      LEU  78  -0.901   9.155   6.454
  593    HG   LEU  78           HG       LEU  78  -0.556   8.057   3.657
  594   HD11  LEU  78          1HD1      LEU  78  -3.041   8.874   5.163
  595   HD12  LEU  78          2HD1      LEU  78  -2.558   7.226   4.769
  596   HD13  LEU  78          3HD1      LEU  78  -2.972   8.352   3.479
  597   HD21  LEU  78          3HD2      LEU  78  -1.436  10.219   2.909
  598   HD22  LEU  78          1HD2      LEU  78   0.091  10.406   3.767
  599   HD23  LEU  78          2HD2      LEU  78  -1.426  10.801   4.573
  600    H    GLY  79           H        GLY  79   1.569   6.876   7.209
  601    HA2  GLY  79           2HA      GLY  79   3.355   7.538   9.102
  602    HA3  GLY  79           1HA      GLY  79   1.908   8.314   9.722
  603    HA   PRO  80           HA       PRO  80   1.963   3.873  11.172
  604    HB2  PRO  80           2HB      PRO  80   2.441   4.221  13.784
  605    HB3  PRO  80           1HB      PRO  80   3.751   4.260  12.596
  606    HG2  PRO  80           2HG      PRO  80   2.346   6.539  13.941
  607    HG3  PRO  80           1HG      PRO  80   4.075   6.333  13.606
  608    HD2  PRO  80           2HD      PRO  80   2.341   7.838  12.057
  609    HD3  PRO  80           1HD      PRO  80   3.873   7.155  11.479
  610    H    LEU  81           H        LEU  81   0.238   2.778  12.016
  611    HA   LEU  81           HA       LEU  81  -2.177   4.189  12.687
  612    HB2  LEU  81           2HB      LEU  81  -1.461   1.255  12.630
  613    HB3  LEU  81           1HB      LEU  81  -3.053   1.838  13.078
  614    HG   LEU  81           HG       LEU  81  -1.747   2.323  10.395
  615   HD11  LEU  81          1HD1      LEU  81  -3.873   0.322  11.183
  616   HD12  LEU  81          2HD1      LEU  81  -2.213  -0.052  10.723
  617   HD13  LEU  81          3HD1      LEU  81  -3.317   0.645   9.541
  618   HD21  LEU  81          3HD2      LEU  81  -3.360   4.048  11.008
  619   HD22  LEU  81          1HD2      LEU  81  -4.565   2.812  11.376
  620   HD23  LEU  81          2HD2      LEU  81  -4.000   3.030   9.719
  621    H    GLU  82           H        GLU  82  -2.557   4.991  14.667
  622    HA   GLU  82           HA       GLU  82  -1.737   3.382  17.003
  623    HB2  GLU  82           2HB      GLU  82  -0.312   5.420  16.721
  624    HB3  GLU  82           1HB      GLU  82  -1.753   6.410  16.916
  625    HG2  GLU  82           2HG      GLU  82  -2.087   5.484  19.158
  626    HG3  GLU  82           1HG      GLU  82  -0.643   4.495  18.962
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  -3.681   6.320  21.051
    2    H2   MET   1           2H       MET   1  -3.937   4.981  20.055
    3    H3   MET   1           3H       MET   1  -2.538   5.070  21.003
    4    HA   MET   1           HA       MET   1  -3.827   4.933  23.012
    5    HB2  MET   1           2HB      MET   1  -5.849   6.041  22.141
    6    HB3  MET   1           1HB      MET   1  -6.193   4.638  21.139
    7    HG2  MET   1           2HG      MET   1  -6.533   3.274  23.117
    8    HG3  MET   1           1HG      MET   1  -6.093   4.631  24.153
    9    HE1  MET   1           3HE      MET   1  -9.060   7.117  23.535
   10    HE2  MET   1           1HE      MET   1  -7.506   7.080  22.700
   11    HE3  MET   1           2HE      MET   1  -7.575   6.822  24.442
   12    H    ALA   2           H        ALA   2  -4.584   3.091  20.042
   13    HA   ALA   2           HA       ALA   2  -4.550   0.566  21.445
   14    HB1  ALA   2           3HB      ALA   2  -6.043   0.929  19.533
   15    HB2  ALA   2           1HB      ALA   2  -4.953  -0.430  19.256
   16    HB3  ALA   2           2HB      ALA   2  -4.645   1.123  18.476
   17    H    GLY   3           H        GLY   3  -2.543   1.948  18.820
   18    HA2  GLY   3           2HA      GLY   3  -0.042   1.729  19.538
   19    HA3  GLY   3           1HA      GLY   3  -0.417   0.014  19.463
   20    HA   PRO   4           HA       PRO   4   0.988   1.481  15.215
   21    HB2  PRO   4           2HB      PRO   4   3.201  -0.056  14.992
   22    HB3  PRO   4           1HB      PRO   4   3.224   1.509  15.818
   23    HG2  PRO   4           2HG      PRO   4   3.045  -1.250  16.992
   24    HG3  PRO   4           1HG      PRO   4   4.046   0.120  17.512
   25    HD2  PRO   4           2HD      PRO   4   1.692  -0.547  18.719
   26    HD3  PRO   4           1HD      PRO   4   2.306   1.118  18.648
   27    H    GLU   5           H        GLU   5  -1.121  -0.284  15.723
   28    HA   GLU   5           HA       GLU   5  -0.812  -2.943  14.922
   29    HB2  GLU   5           2HB      GLU   5  -3.224  -1.166  14.481
   30    HB3  GLU   5           1HB      GLU   5  -3.223  -2.924  14.509
   31    HG2  GLU   5           2HG      GLU   5  -2.566  -1.124  16.840
   32    HG3  GLU   5           1HG      GLU   5  -4.091  -1.969  16.588
   33    H    GLY   6           H        GLY   6  -1.155  -0.028  13.001
   34    HA2  GLY   6           2HA      GLY   6  -0.212  -1.368  10.637
   35    HA3  GLY   6           1HA      GLY   6  -1.913  -0.934  10.531
   36    H    PHE   7           H        PHE   7   0.036   0.072   8.790
   37    HA   PHE   7           HA       PHE   7   0.272   2.895   9.615
   38    HB2  PHE   7           2HB      PHE   7   1.841   1.326   7.550
   39    HB3  PHE   7           1HB      PHE   7   2.022   3.056   7.836
   40    HD1  PHE   7           HD2      PHE   7   2.568  -0.301   9.249
   41    HD2  PHE   7           HD1      PHE   7   3.212   3.879   9.752
   42    HE1  PHE   7           HE2      PHE   7   4.216  -0.768  11.014
   43    HE2  PHE   7           HE1      PHE   7   4.856   3.416  11.520
   44    HZ   PHE   7           HZ       PHE   7   5.361   1.090  12.153
   45    H    GLN   8           H        GLN   8  -0.194   4.542   8.047
   46    HA   GLN   8           HA       GLN   8  -2.181   3.690   6.035
   47    HB2  GLN   8           2HB      GLN   8  -2.109   6.236   7.675
   48    HB3  GLN   8           1HB      GLN   8  -3.286   5.878   6.416
   49    HG2  GLN   8           2HG      GLN   8  -4.154   4.018   7.687
   50    HG3  GLN   8           1HG      GLN   8  -2.903   4.231   8.913
   51   HE21  GLN   8          1HE2      GLN   8  -3.050   5.989  10.328
   52   HE22  GLN   8          2HE2      GLN   8  -4.527   6.849  10.557
   53    H    TYR   9           H        TYR   9  -1.783   4.183   3.997
   54    HA   TYR   9           HA       TYR   9   0.282   6.195   3.352
   55    HB2  TYR   9           2HB      TYR   9  -0.648   3.874   1.637
   56    HB3  TYR   9           1HB      TYR   9   0.702   4.953   1.304
   57    HD1  TYR   9           HD1      TYR   9  -0.498   2.271   3.548
   58    HD2  TYR   9           HD2      TYR   9   2.860   4.541   2.248
   59    HE1  TYR   9           HE1      TYR   9   0.996   0.717   4.719
   60    HE2  TYR   9           HE2      TYR   9   4.370   2.988   3.417
   61    HH   TYR   9           HH       TYR   9   4.236   1.358   5.332
   62    H    ARG  10           H        ARG  10  -0.059   7.216   1.130
   63    HA   ARG  10           HA       ARG  10  -2.933   7.723   0.641
   64    HB2  ARG  10           2HB      ARG  10  -2.001   9.652   1.760
   65    HB3  ARG  10           1HB      ARG  10  -0.644   9.702   0.647
   66    HG2  ARG  10           2HG      ARG  10  -2.101  10.355  -1.172
   67    HG3  ARG  10           1HG      ARG  10  -3.522  10.175  -0.139
   68    HD2  ARG  10           2HD      ARG  10  -2.852  12.011   1.234
   69    HD3  ARG  10           1HD      ARG  10  -1.268  12.087   0.463
   70    HE   ARG  10           HE       ARG  10  -2.327  12.953  -1.505
   71   HH11  ARG  10          1HH1      ARG  10  -4.368  12.808   1.275
   72   HH12  ARG  10          2HH1      ARG  10  -5.437  14.028   0.673
   73   HH21  ARG  10          1HH2      ARG  10  -3.705  14.516  -2.243
   74   HH22  ARG  10          2HH2      ARG  10  -5.077  14.973  -1.293
   75    H    ALA  11           H        ALA  11  -3.529   7.075  -1.325
   76    HA   ALA  11           HA       ALA  11  -1.696   6.349  -3.367
   77    HB1  ALA  11           3HB      ALA  11  -3.888   5.285  -3.115
   78    HB2  ALA  11           1HB      ALA  11  -3.662   5.929  -4.741
   79    HB3  ALA  11           2HB      ALA  11  -4.673   6.793  -3.582
   80    H    LEU  12           H        LEU  12  -0.624   7.643  -4.704
   81    HA   LEU  12           HA       LEU  12  -1.437  10.428  -5.002
   82    HB2  LEU  12           2HB      LEU  12   1.024   9.036  -6.070
   83    HB3  LEU  12           1HB      LEU  12   0.759  10.767  -5.969
   84    HG   LEU  12           HG       LEU  12   1.108   8.865  -3.644
   85   HD11  LEU  12          1HD1      LEU  12   3.149  10.110  -3.209
   86   HD12  LEU  12          2HD1      LEU  12   2.846  11.133  -4.616
   87   HD13  LEU  12          3HD1      LEU  12   3.182   9.414  -4.832
   88   HD21  LEU  12          3HD2      LEU  12   0.994  10.873  -2.227
   89   HD22  LEU  12          1HD2      LEU  12  -0.525  10.566  -3.066
   90   HD23  LEU  12          2HD2      LEU  12   0.558  11.835  -3.639
   91    H    TYR  13           H        TYR  13  -0.892   7.589  -7.044
   92    HA   TYR  13           HA       TYR  13  -2.360   8.934  -9.221
   93    HB2  TYR  13           2HB      TYR  13   0.111   7.197  -9.457
   94    HB3  TYR  13           1HB      TYR  13  -0.907   7.625 -10.830
   95    HD1  TYR  13           HD2      TYR  13   1.464   8.913  -8.319
   96    HD2  TYR  13           HD1      TYR  13  -0.866   9.859 -11.757
   97    HE1  TYR  13           HE2      TYR  13   2.706  11.017  -8.576
   98    HE2  TYR  13           HE1      TYR  13   0.369  11.969 -12.019
   99    HH   TYR  13           HH       TYR  13   3.211  12.675 -10.153
  100    HA   PRO  14           HA       PRO  14  -5.017   5.420  -9.142
  101    HB2  PRO  14           2HB      PRO  14  -6.024   5.438 -11.658
  102    HB3  PRO  14           1HB      PRO  14  -6.441   6.666 -10.456
  103    HG2  PRO  14           2HG      PRO  14  -4.450   6.804 -12.695
  104    HG3  PRO  14           1HG      PRO  14  -5.626   8.023 -12.167
  105    HD2  PRO  14           2HD      PRO  14  -2.992   8.111 -11.478
  106    HD3  PRO  14           1HD      PRO  14  -4.281   8.755 -10.441
  107    H    PHE  15           H        PHE  15  -5.228   3.256  -9.739
  108    HA   PHE  15           HA       PHE  15  -3.447   2.155 -11.791
  109    HB2  PHE  15           2HB      PHE  15  -2.186   2.074  -9.649
  110    HB3  PHE  15           1HB      PHE  15  -3.496   1.147  -8.929
  111    HD1  PHE  15           HD1      PHE  15  -0.908   1.069 -11.584
  112    HD2  PHE  15           HD2      PHE  15  -3.585  -1.198  -9.164
  113    HE1  PHE  15           HE1      PHE  15   0.158  -1.010 -12.353
  114    HE2  PHE  15           HE2      PHE  15  -2.518  -3.280  -9.929
  115    HZ   PHE  15           HZ       PHE  15  -0.644  -3.187 -11.526
  116    H    ARG  16           H        ARG  16  -4.441   0.574 -12.944
  117    HA   ARG  16           HA       ARG  16  -7.064  -0.362 -11.982
  118    HB2  ARG  16           2HB      ARG  16  -5.956  -0.343 -14.797
  119    HB3  ARG  16           1HB      ARG  16  -7.585  -0.819 -14.333
  120    HG2  ARG  16           2HG      ARG  16  -7.990   1.471 -13.502
  121    HG3  ARG  16           1HG      ARG  16  -6.381   1.932 -14.059
  122    HD2  ARG  16           2HD      ARG  16  -7.030   1.307 -16.361
  123    HD3  ARG  16           1HD      ARG  16  -8.655   0.933 -15.780
  124    HE   ARG  16           HE       ARG  16  -7.620   3.627 -15.322
  125   HH11  ARG  16          1HH1      ARG  16  -9.726   1.546 -17.084
  126   HH12  ARG  16          2HH1      ARG  16 -10.666   2.853 -17.715
  127   HH21  ARG  16          1HH2      ARG  16  -8.814   5.295 -16.151
  128   HH22  ARG  16          2HH2      ARG  16 -10.155   4.958 -17.188
  129    H    ARG  17           H        ARG  17  -7.742  -2.570 -12.598
  130    HA   ARG  17           HA       ARG  17  -5.575  -4.452 -11.951
  131    HB2  ARG  17           2HB      ARG  17  -8.585  -4.711 -11.790
  132    HB3  ARG  17           1HB      ARG  17  -7.462  -6.008 -11.402
  133    HG2  ARG  17           2HG      ARG  17  -6.545  -4.713  -9.574
  134    HG3  ARG  17           1HG      ARG  17  -7.573  -3.346  -9.997
  135    HD2  ARG  17           2HD      ARG  17  -8.570  -6.071  -9.147
  136    HD3  ARG  17           1HD      ARG  17  -8.458  -4.659  -8.096
  137    HE   ARG  17           HE       ARG  17 -10.028  -3.621  -9.839
  138   HH11  ARG  17          1HH1      ARG  17 -10.085  -6.937  -8.910
  139   HH12  ARG  17          2HH1      ARG  17 -11.772  -7.107  -9.253
  140   HH21  ARG  17          1HH2      ARG  17 -12.149  -3.841 -10.280
  141   HH22  ARG  17          2HH2      ARG  17 -12.925  -5.376 -10.057
  142    H    GLU  18           H        GLU  18  -4.765  -5.784 -13.479
  143    HA   GLU  18           HA       GLU  18  -6.273  -6.403 -15.894
  144    HB2  GLU  18           2HB      GLU  18  -4.304  -7.699 -16.556
  145    HB3  GLU  18           1HB      GLU  18  -3.833  -6.088 -16.031
  146    HG2  GLU  18           2HG      GLU  18  -3.020  -6.919 -13.944
  147    HG3  GLU  18           1HG      GLU  18  -3.699  -8.516 -14.254
  148    H    ARG  19           H        ARG  19  -5.847  -7.686 -12.756
  149    HA   ARG  19           HA       ARG  19  -7.289 -10.156 -13.481
  150    HB2  ARG  19           2HB      ARG  19  -5.028  -9.978 -11.465
  151    HB3  ARG  19           1HB      ARG  19  -5.940 -11.425 -11.876
  152    HG2  ARG  19           2HG      ARG  19  -5.002 -11.474 -14.078
  153    HG3  ARG  19           1HG      ARG  19  -4.243  -9.899 -13.846
  154    HD2  ARG  19           2HD      ARG  19  -2.895 -10.887 -12.001
  155    HD3  ARG  19           1HD      ARG  19  -3.574 -12.466 -12.403
  156    HE   ARG  19           HE       ARG  19  -2.555 -11.687 -14.755
  157   HH11  ARG  19          1HH1      ARG  19  -1.202 -11.672 -11.590
  158   HH12  ARG  19          2HH1      ARG  19   0.411 -11.899 -12.165
  159   HH21  ARG  19          1HH2      ARG  19  -0.490 -11.970 -15.477
  160   HH22  ARG  19          2HH2      ARG  19   0.807 -12.071 -14.340
  161    HA   PRO  20           HA       PRO  20 -10.054  -9.158 -10.084
  162    HB2  PRO  20           2HB      PRO  20 -10.014 -12.053  -9.408
  163    HB3  PRO  20           1HB      PRO  20 -11.384 -11.009  -9.800
  164    HG2  PRO  20           2HG      PRO  20 -10.500 -12.815 -11.554
  165    HG3  PRO  20           1HG      PRO  20 -11.055 -11.217 -12.093
  166    HD2  PRO  20           2HD      PRO  20  -8.253 -12.234 -11.744
  167    HD3  PRO  20           1HD      PRO  20  -8.930 -11.227 -13.041
  168    H    GLU  21           H        GLU  21  -7.244 -11.205  -9.508
  169    HA   GLU  21           HA       GLU  21  -7.229 -10.888  -6.646
  170    HB2  GLU  21           2HB      GLU  21  -5.193 -11.948  -8.613
  171    HB3  GLU  21           1HB      GLU  21  -4.895 -11.877  -6.883
  172    HG2  GLU  21           2HG      GLU  21  -5.598 -14.104  -7.641
  173    HG3  GLU  21           1HG      GLU  21  -6.695 -13.411  -6.450
  174    H    ASP  22           H        ASP  22  -6.493  -8.745  -9.077
  175    HA   ASP  22           HA       ASP  22  -4.161  -7.505  -7.866
  176    HB2  ASP  22           2HB      ASP  22  -4.931  -7.728 -10.420
  177    HB3  ASP  22           1HB      ASP  22  -5.739  -6.214 -10.063
  178    H    LEU  23           H        LEU  23  -4.433  -4.879  -7.766
  179    HA   LEU  23           HA       LEU  23  -6.923  -4.299  -6.279
  180    HB2  LEU  23           2HB      LEU  23  -5.178  -4.760  -4.662
  181    HB3  LEU  23           1HB      LEU  23  -4.099  -3.623  -5.448
  182    HG   LEU  23           HG       LEU  23  -5.509  -1.753  -4.771
  183   HD11  LEU  23          1HD1      LEU  23  -7.429  -2.089  -3.287
  184   HD12  LEU  23          2HD1      LEU  23  -7.263  -3.837  -3.473
  185   HD13  LEU  23          3HD1      LEU  23  -7.680  -2.833  -4.865
  186   HD21  LEU  23          3HD2      LEU  23  -3.763  -2.498  -3.232
  187   HD22  LEU  23          1HD2      LEU  23  -4.900  -3.600  -2.460
  188   HD23  LEU  23          2HD2      LEU  23  -5.152  -1.857  -2.357
  189    H    GLU  24           H        GLU  24  -7.964  -2.522  -6.983
  190    HA   GLU  24           HA       GLU  24  -6.640  -0.620  -8.745
  191    HB2  GLU  24           2HB      GLU  24  -9.507  -0.954  -7.861
  192    HB3  GLU  24           1HB      GLU  24  -8.976   0.452  -8.776
  193    HG2  GLU  24           2HG      GLU  24  -8.254  -0.992 -10.601
  194    HG3  GLU  24           1HG      GLU  24  -8.747  -2.409  -9.680
  195    H    LEU  25           H        LEU  25  -5.951   1.341  -8.221
  196    HA   LEU  25           HA       LEU  25  -6.587   2.440  -5.547
  197    HB2  LEU  25           2HB      LEU  25  -4.039   2.841  -7.133
  198    HB3  LEU  25           1HB      LEU  25  -4.366   3.447  -5.519
  199    HG   LEU  25           HG       LEU  25  -4.027   0.547  -6.308
  200   HD11  LEU  25          1HD1      LEU  25  -1.933   1.782  -6.289
  201   HD12  LEU  25          2HD1      LEU  25  -2.004   0.642  -4.948
  202   HD13  LEU  25          3HD1      LEU  25  -2.270   2.361  -4.656
  203   HD21  LEU  25          3HD2      LEU  25  -4.576   1.753  -3.594
  204   HD22  LEU  25          1HD2      LEU  25  -4.164   0.065  -3.907
  205   HD23  LEU  25          2HD2      LEU  25  -5.670   0.735  -4.533
  206    H    LEU  26           H        LEU  26  -7.306   4.542  -5.458
  207    HA   LEU  26           HA       LEU  26  -7.186   6.130  -7.947
  208    HB2  LEU  26           2HB      LEU  26  -9.334   5.966  -5.839
  209    HB3  LEU  26           1HB      LEU  26  -9.209   7.350  -6.905
  210    HG   LEU  26           HG       LEU  26 -10.887   5.871  -7.771
  211   HD11  LEU  26          1HD1      LEU  26 -10.038   5.428 -10.012
  212   HD12  LEU  26          2HD1      LEU  26  -8.382   5.622  -9.437
  213   HD13  LEU  26          3HD1      LEU  26  -9.488   6.995  -9.423
  214   HD21  LEU  26          3HD2      LEU  26 -10.468   3.564  -8.392
  215   HD22  LEU  26          1HD2      LEU  26 -10.140   3.798  -6.676
  216   HD23  LEU  26          2HD2      LEU  26  -8.805   3.684  -7.821
  217    HA   PRO  27           HA       PRO  27  -4.659   9.034  -5.851
  218    HB2  PRO  27           2HB      PRO  27  -5.427  11.389  -7.030
  219    HB3  PRO  27           1HB      PRO  27  -4.393  10.188  -7.811
  220    HG2  PRO  27           2HG      PRO  27  -7.343  10.633  -8.119
  221    HG3  PRO  27           1HG      PRO  27  -6.125  10.305  -9.367
  222    HD2  PRO  27           2HD      PRO  27  -7.760   8.372  -8.444
  223    HD3  PRO  27           1HD      PRO  27  -6.080   8.028  -8.905
  224    H    GLY  28           H        GLY  28  -5.162   9.222  -3.714
  225    HA2  GLY  28           2HA      GLY  28  -5.897  11.170  -2.246
  226    HA3  GLY  28           1HA      GLY  28  -7.480  10.903  -2.957
  227    H    ASP  29           H        ASP  29  -6.822   7.893  -2.879
  228    HA   ASP  29           HA       ASP  29  -8.257   7.323  -0.525
  229    HB2  ASP  29           2HB      ASP  29  -6.565   5.469  -2.213
  230    HB3  ASP  29           1HB      ASP  29  -7.722   4.952  -0.991
  231    H    VAL  30           H        VAL  30  -7.696   6.613   1.473
  232    HA   VAL  30           HA       VAL  30  -4.876   6.734   2.257
  233    HB   VAL  30           HB       VAL  30  -7.385   6.514   3.946
  234   HG11  VAL  30          1HG1      VAL  30  -5.481   5.449   5.043
  235   HG12  VAL  30          2HG1      VAL  30  -5.932   6.942   5.865
  236   HG13  VAL  30          3HG1      VAL  30  -4.517   6.908   4.811
  237   HG21  VAL  30          3HG2      VAL  30  -6.925   8.834   4.568
  238   HG22  VAL  30          1HG2      VAL  30  -7.148   8.686   2.826
  239   HG23  VAL  30          2HG2      VAL  30  -5.525   8.856   3.496
  240    H    LEU  31           H        LEU  31  -3.910   4.823   1.715
  241    HA   LEU  31           HA       LEU  31  -5.310   2.304   1.878
  242    HB2  LEU  31           2HB      LEU  31  -2.469   3.004   1.142
  243    HB3  LEU  31           1HB      LEU  31  -3.061   1.355   1.190
  244    HG   LEU  31           HG       LEU  31  -4.768   1.976  -0.537
  245   HD11  LEU  31          1HD1      LEU  31  -4.451   4.017  -1.832
  246   HD12  LEU  31          2HD1      LEU  31  -3.183   4.537  -0.723
  247   HD13  LEU  31          3HD1      LEU  31  -4.845   4.384  -0.154
  248   HD21  LEU  31          3HD2      LEU  31  -3.159   2.025  -2.409
  249   HD22  LEU  31          1HD2      LEU  31  -2.755   0.824  -1.184
  250   HD23  LEU  31          2HD2      LEU  31  -1.863   2.341  -1.257
  251    H    VAL  32           H        VAL  32  -5.534   1.174   3.682
  252    HA   VAL  32           HA       VAL  32  -3.697   1.601   5.921
  253    HB   VAL  32           HB       VAL  32  -6.308   0.070   5.813
  254   HG11  VAL  32          1HG1      VAL  32  -4.852  -0.792   7.561
  255   HG12  VAL  32          2HG1      VAL  32  -6.190   0.108   8.274
  256   HG13  VAL  32          3HG1      VAL  32  -4.586   0.838   8.178
  257   HG21  VAL  32          3HG2      VAL  32  -7.237   1.992   7.039
  258   HG22  VAL  32          1HG2      VAL  32  -6.629   2.465   5.455
  259   HG23  VAL  32          2HG2      VAL  32  -5.689   2.827   6.903
  260    H    VAL  33           H        VAL  33  -2.004   0.292   6.160
  261    HA   VAL  33           HA       VAL  33  -2.214  -2.532   5.297
  262    HB   VAL  33           HB       VAL  33   0.254  -0.779   5.466
  263   HG11  VAL  33          1HG1      VAL  33   0.823  -3.051   6.111
  264   HG12  VAL  33          2HG1      VAL  33   1.465  -2.705   4.505
  265   HG13  VAL  33          3HG1      VAL  33   0.012  -3.689   4.682
  266   HG21  VAL  33          3HG2      VAL  33  -1.133  -0.278   3.523
  267   HG22  VAL  33          1HG2      VAL  33  -1.154  -1.986   3.080
  268   HG23  VAL  33          2HG2      VAL  33   0.357  -1.082   3.026
  269    H    SER  34           H        SER  34  -2.218  -3.981   6.915
  270    HA   SER  34           HA       SER  34  -1.720  -3.328   9.632
  271    HB2  SER  34           2HB      SER  34  -1.801  -6.068   8.329
  272    HB3  SER  34           1HB      SER  34  -1.931  -5.745  10.057
  273    HG   SER  34           HG       SER  34  -3.871  -4.600   9.618
  274    H    ARG  35           H        ARG  35   0.125  -3.403  10.845
  275    HA   ARG  35           HA       ARG  35   2.623  -3.279   9.627
  276    HB2  ARG  35           2HB      ARG  35   2.142  -2.324  11.835
  277    HB3  ARG  35           1HB      ARG  35   2.007  -3.940  12.517
  278    HG2  ARG  35           2HG      ARG  35   4.360  -4.361  12.046
  279    HG3  ARG  35           1HG      ARG  35   4.506  -2.778  11.283
  280    HD2  ARG  35           2HD      ARG  35   5.397  -2.744  13.554
  281    HD3  ARG  35           1HD      ARG  35   3.983  -1.697  13.415
  282    HE   ARG  35           HE       ARG  35   2.896  -3.979  14.298
  283   HH11  ARG  35          1HH1      ARG  35   5.660  -2.237  15.374
  284   HH12  ARG  35          2HH1      ARG  35   5.454  -2.713  17.020
  285   HH21  ARG  35          1HH2      ARG  35   2.641  -4.593  16.402
  286   HH22  ARG  35          2HH2      ARG  35   3.749  -4.027  17.599
  287    H    ALA  36           H        ALA  36   0.984  -6.077  11.018
  288    HA   ALA  36           HA       ALA  36   3.065  -7.923  11.043
  289    HB1  ALA  36           3HB      ALA  36   1.349  -9.647  10.880
  290    HB2  ALA  36           1HB      ALA  36   0.174  -8.447  10.337
  291    HB3  ALA  36           2HB      ALA  36   0.837  -8.359  11.969
  292    H    ALA  37           H        ALA  37   1.138  -6.786   8.306
  293    HA   ALA  37           HA       ALA  37   1.960  -8.715   6.412
  294    HB1  ALA  37           3HB      ALA  37   1.134  -7.161   4.729
  295    HB2  ALA  37           1HB      ALA  37   1.087  -5.868   5.930
  296    HB3  ALA  37           2HB      ALA  37   0.016  -7.261   6.090
  297    H    LEU  38           H        LEU  38   3.405  -5.665   7.450
  298    HA   LEU  38           HA       LEU  38   5.359  -5.392   5.446
  299    HB2  LEU  38           2HB      LEU  38   5.480  -4.557   8.352
  300    HB3  LEU  38           1HB      LEU  38   6.563  -3.989   7.093
  301    HG   LEU  38           HG       LEU  38   3.576  -3.499   7.181
  302   HD11  LEU  38          1HD1      LEU  38   5.890  -1.648   7.740
  303   HD12  LEU  38          2HD1      LEU  38   4.717  -2.252   8.913
  304   HD13  LEU  38          3HD1      LEU  38   4.195  -1.167   7.625
  305   HD21  LEU  38          3HD2      LEU  38   5.679  -2.469   5.269
  306   HD22  LEU  38          1HD2      LEU  38   3.988  -1.961   5.312
  307   HD23  LEU  38          2HD2      LEU  38   4.399  -3.623   4.892
  308    H    GLN  39           H        GLN  39   5.496  -7.090   8.581
  309    HA   GLN  39           HA       GLN  39   8.133  -8.094   8.237
  310    HB2  GLN  39           2HB      GLN  39   5.830  -9.041   9.955
  311    HB3  GLN  39           1HB      GLN  39   7.417  -9.799   9.984
  312    HG2  GLN  39           2HG      GLN  39   8.397  -7.607  10.621
  313    HG3  GLN  39           1HG      GLN  39   6.766  -6.945  10.709
  314   HE21  GLN  39          1HE2      GLN  39   5.433  -7.537  12.419
  315   HE22  GLN  39          2HE2      GLN  39   6.030  -8.345  13.820
  316    H    ALA  40           H        ALA  40   4.949  -9.334   7.316
  317    HA   ALA  40           HA       ALA  40   5.728 -11.862   6.369
  318    HB1  ALA  40           3HB      ALA  40   3.672 -11.806   5.026
  319    HB2  ALA  40           1HB      ALA  40   3.507 -10.081   5.357
  320    HB3  ALA  40           2HB      ALA  40   3.391 -11.246   6.674
  321    H    LEU  41           H        LEU  41   5.866  -8.686   4.841
  322    HA   LEU  41           HA       LEU  41   6.711  -9.621   2.267
  323    HB2  LEU  41           2HB      LEU  41   6.995  -6.912   3.573
  324    HB3  LEU  41           1HB      LEU  41   7.346  -7.247   1.888
  325    HG   LEU  41           HG       LEU  41   4.623  -7.524   3.174
  326   HD11  LEU  41          1HD1      LEU  41   4.056  -5.511   1.876
  327   HD12  LEU  41          2HD1      LEU  41   5.742  -5.366   1.379
  328   HD13  LEU  41          3HD1      LEU  41   5.305  -5.194   3.080
  329   HD21  LEU  41          3HD2      LEU  41   5.510  -7.743   0.293
  330   HD22  LEU  41          1HD2      LEU  41   3.836  -7.740   0.847
  331   HD23  LEU  41          2HD2      LEU  41   4.914  -9.055   1.311
  332    H    GLY  42           H        GLY  42   8.343  -8.905   5.259
  333    HA2  GLY  42           2HA      GLY  42  10.573  -9.375   5.811
  334    HA3  GLY  42           1HA      GLY  42  10.926  -9.625   4.107
  335    H    VAL  43           H        VAL  43   9.322  -6.793   5.461
  336    HA   VAL  43           HA       VAL  43  11.181  -5.006   4.193
  337    HB   VAL  43           HB       VAL  43   8.978  -4.371   6.177
  338   HG11  VAL  43          1HG1      VAL  43   9.080  -2.095   5.230
  339   HG12  VAL  43          2HG1      VAL  43  10.466  -2.576   4.250
  340   HG13  VAL  43          3HG1      VAL  43  10.595  -2.559   6.010
  341   HG21  VAL  43          3HG2      VAL  43   8.087  -5.505   4.206
  342   HG22  VAL  43          1HG2      VAL  43   8.924  -4.366   3.152
  343   HG23  VAL  43          2HG2      VAL  43   7.621  -3.803   4.201
  344    H    ALA  44           H        ALA  44  12.993  -4.141   5.028
  345    HA   ALA  44           HA       ALA  44  13.986  -4.917   7.563
  346    HB1  ALA  44           3HB      ALA  44  15.865  -3.440   7.086
  347    HB2  ALA  44           1HB      ALA  44  14.964  -2.692   5.765
  348    HB3  ALA  44           2HB      ALA  44  15.444  -4.386   5.658
  349    H    GLU  45           H        GLU  45  14.300  -3.737   9.459
  350    HA   GLU  45           HA       GLU  45  12.205  -2.058  10.267
  351    HB2  GLU  45           2HB      GLU  45  14.933  -2.480  11.518
  352    HB3  GLU  45           1HB      GLU  45  13.581  -1.682  12.313
  353    HG2  GLU  45           2HG      GLU  45  12.277  -3.715  12.243
  354    HG3  GLU  45           1HG      GLU  45  13.539  -4.528  11.319
  355    H    GLY  46           H        GLY  46  11.840   0.046   9.952
  356    HA2  GLY  46           2HA      GLY  46  12.446   2.346   9.865
  357    HA3  GLY  46           1HA      GLY  46  14.096   1.883   9.481
  358    H    GLY  47           H        GLY  47  12.728  -0.096   7.484
  359    HA2  GLY  47           2HA      GLY  47  13.113   1.390   5.130
  360    HA3  GLY  47           1HA      GLY  47  12.277  -0.150   5.231
  361    H    GLU  48           H        GLU  48  10.377   1.251   7.202
  362    HA   GLU  48           HA       GLU  48   8.227   1.864   5.569
  363    HB2  GLU  48           2HB      GLU  48   8.093   1.420   7.995
  364    HB3  GLU  48           1HB      GLU  48   8.852   2.971   8.322
  365    HG2  GLU  48           2HG      GLU  48   6.479   3.121   8.697
  366    HG3  GLU  48           1HG      GLU  48   6.923   4.115   7.310
  367    H    ARG  49           H        ARG  49  10.988   3.806   6.290
  368    HA   ARG  49           HA       ARG  49   9.958   6.391   5.857
  369    HB2  ARG  49           2HB      ARG  49  12.267   7.079   5.582
  370    HB3  ARG  49           1HB      ARG  49  12.138   5.927   6.904
  371    HG2  ARG  49           2HG      ARG  49  12.856   4.141   5.258
  372    HG3  ARG  49           1HG      ARG  49  13.239   5.453   4.140
  373    HD2  ARG  49           2HD      ARG  49  14.428   5.006   6.883
  374    HD3  ARG  49           1HD      ARG  49  15.232   4.760   5.334
  375    HE   ARG  49           HE       ARG  49  14.661   7.325   5.133
  376   HH11  ARG  49          1HH1      ARG  49  15.880   5.587   7.851
  377   HH12  ARG  49          2HH1      ARG  49  16.706   6.963   8.492
  378   HH21  ARG  49          1HH2      ARG  49  15.731   9.071   5.956
  379   HH22  ARG  49          2HH2      ARG  49  16.612   8.922   7.437
  380    H    CYS  50           H        CYS  50  10.333   3.859   3.616
  381    HA   CYS  50           HA       CYS  50   9.502   5.566   1.453
  382    HB2  CYS  50           2HB      CYS  50  11.363   5.007  -0.083
  383    HB3  CYS  50           1HB      CYS  50  11.897   5.962   1.295
  384    HG   CYS  50           HG       CYS  50  13.605   4.274   2.259
  385    HA   PRO  51           HA       PRO  51   7.564   1.366   1.178
  386    HB2  PRO  51           2HB      PRO  51   5.557   2.377  -0.485
  387    HB3  PRO  51           1HB      PRO  51   5.451   2.211   1.269
  388    HG2  PRO  51           2HG      PRO  51   6.141   4.620  -0.368
  389    HG3  PRO  51           1HG      PRO  51   5.146   4.505   1.097
  390    HD2  PRO  51           2HD      PRO  51   7.646   5.430   1.216
  391    HD3  PRO  51           1HD      PRO  51   7.013   4.374   2.499
  392    H    GLN  52           H        GLN  52   8.597   3.648  -1.265
  393    HA   GLN  52           HA       GLN  52   8.297   2.180  -3.604
  394    HB2  GLN  52           2HB      GLN  52   9.094   4.587  -3.297
  395    HB3  GLN  52           1HB      GLN  52  10.688   3.929  -2.981
  396    HG2  GLN  52           2HG      GLN  52   9.199   3.353  -5.529
  397    HG3  GLN  52           1HG      GLN  52  10.187   4.794  -5.327
  398   HE21  GLN  52          1HE2      GLN  52  12.440   4.555  -5.100
  399   HE22  GLN  52          2HE2      GLN  52  13.246   3.120  -5.620
  400    H    SER  53           H        SER  53  10.924   2.059  -1.208
  401    HA   SER  53           HA       SER  53  12.605   0.262  -2.613
  402    HB2  SER  53           2HB      SER  53  12.420   0.904   0.340
  403    HB3  SER  53           1HB      SER  53  13.686  -0.101  -0.366
  404    HG   SER  53           HG       SER  53  13.645   2.524  -0.167
  405    H    VAL  54           H        VAL  54   9.662  -0.297  -0.978
  406    HA   VAL  54           HA       VAL  54  10.242  -3.060  -0.280
  407    HB   VAL  54           HB       VAL  54   7.586  -1.604  -0.216
  408   HG11  VAL  54          1HG1      VAL  54   8.472  -4.181   1.096
  409   HG12  VAL  54          2HG1      VAL  54   7.309  -4.020  -0.221
  410   HG13  VAL  54          3HG1      VAL  54   6.928  -3.374   1.375
  411   HG21  VAL  54          3HG2      VAL  54   8.000  -1.304   2.186
  412   HG22  VAL  54          1HG2      VAL  54   9.221  -0.484   1.211
  413   HG23  VAL  54          2HG2      VAL  54   9.603  -2.017   1.998
  414    H    GLY  55           H        GLY  55   8.686  -1.298  -2.886
  415    HA2  GLY  55           2HA      GLY  55   8.292  -2.090  -5.050
  416    HA3  GLY  55           1HA      GLY  55   8.596  -3.727  -4.490
  417    H    TRP  56           H        TRP  56   6.879  -4.953  -3.655
  418    HA   TRP  56           HA       TRP  56   4.194  -3.859  -4.221
  419    HB2  TRP  56           2HB      TRP  56   5.225  -6.702  -4.283
  420    HB3  TRP  56           1HB      TRP  56   3.513  -6.303  -4.354
  421    HD1  TRP  56           HD1      TRP  56   3.536  -3.932  -6.403
  422    HE1  TRP  56           HE1      TRP  56   4.111  -4.356  -8.875
  423    HE3  TRP  56           HE3      TRP  56   6.099  -8.325  -5.886
  424    HZ2  TRP  56           HZ2      TRP  56   5.472  -6.304 -10.402
  425    HZ3  TRP  56           HZ3      TRP  56   7.004  -9.407  -7.904
  426    HH2  TRP  56           HH2      TRP  56   6.696  -8.417 -10.115
  427    H    MET  57           H        MET  57   2.672  -3.793  -2.660
  428    HA   MET  57           HA       MET  57   3.291  -4.926  -0.008
  429    HB2  MET  57           2HB      MET  57   2.298  -2.099  -0.483
  430    HB3  MET  57           1HB      MET  57   2.743  -2.816   1.060
  431    HG2  MET  57           2HG      MET  57   5.051  -2.898   0.441
  432    HG3  MET  57           1HG      MET  57   4.678  -2.423  -1.214
  433    HE1  MET  57           3HE      MET  57   3.199  -0.932   2.155
  434    HE2  MET  57           1HE      MET  57   4.347   0.374   2.440
  435    HE3  MET  57           2HE      MET  57   4.883  -1.306   2.518
  436    HA   PRO  58           HA       PRO  58  -1.126  -5.834  -0.360
  437    HB2  PRO  58           2HB      PRO  58  -1.366  -7.452   1.761
  438    HB3  PRO  58           1HB      PRO  58  -0.458  -7.947   0.326
  439    HG2  PRO  58           2HG      PRO  58   0.550  -6.982   2.968
  440    HG3  PRO  58           1HG      PRO  58   1.218  -8.229   1.900
  441    HD2  PRO  58           2HD      PRO  58   2.099  -5.572   2.079
  442    HD3  PRO  58           1HD      PRO  58   2.481  -6.707   0.771
  443    H    GLY  59           H        GLY  59  -2.597  -4.276   0.132
  444    HA2  GLY  59           2HA      GLY  59  -3.097  -3.639   2.946
  445    HA3  GLY  59           1HA      GLY  59  -2.623  -2.298   1.917
  446    H    LEU  60           H        LEU  60  -4.891  -1.841   3.031
  447    HA   LEU  60           HA       LEU  60  -7.072  -2.772   1.280
  448    HB2  LEU  60           2HB      LEU  60  -7.423  -3.104   3.671
  449    HB3  LEU  60           1HB      LEU  60  -7.129  -1.404   3.975
  450    HG   LEU  60           HG       LEU  60  -9.175  -0.835   2.691
  451   HD11  LEU  60          1HD1      LEU  60  -9.263  -2.779   1.225
  452   HD12  LEU  60          2HD1      LEU  60 -10.772  -2.585   2.115
  453   HD13  LEU  60          3HD1      LEU  60  -9.612  -3.822   2.605
  454   HD21  LEU  60          3HD2      LEU  60  -9.275  -1.034   5.112
  455   HD22  LEU  60          1HD2      LEU  60  -9.593  -2.765   4.979
  456   HD23  LEU  60          2HD2      LEU  60 -10.777  -1.598   4.382
  457    H    ASN  61           H        ASN  61  -7.815  -1.442  -0.266
  458    HA   ASN  61           HA       ASN  61  -7.116   1.388  -0.274
  459    HB2  ASN  61           2HB      ASN  61  -6.920   0.167  -2.368
  460    HB3  ASN  61           1HB      ASN  61  -8.608  -0.334  -2.277
  461   HD21  ASN  61          1HD2      ASN  61  -6.441   2.322  -2.873
  462   HD22  ASN  61          2HD2      ASN  61  -7.612   3.359  -3.608
  463    H    GLU  62           H        GLU  62  -8.683   3.102  -0.362
  464    HA   GLU  62           HA       GLU  62 -11.042   2.488   1.240
  465    HB2  GLU  62           2HB      GLU  62  -9.604   5.061   0.606
  466    HB3  GLU  62           1HB      GLU  62 -11.161   5.041   1.422
  467    HG2  GLU  62           2HG      GLU  62  -8.675   3.651   2.415
  468    HG3  GLU  62           1HG      GLU  62  -9.256   5.218   2.979
  469    H    ARG  63           H        ARG  63 -10.344   3.637  -2.021
  470    HA   ARG  63           HA       ARG  63 -13.016   4.545  -2.564
  471    HB2  ARG  63           2HB      ARG  63 -10.978   5.262  -3.845
  472    HB3  ARG  63           1HB      ARG  63 -10.903   3.653  -4.545
  473    HG2  ARG  63           2HG      ARG  63 -11.970   4.825  -6.208
  474    HG3  ARG  63           1HG      ARG  63 -13.345   4.170  -5.323
  475    HD2  ARG  63           2HD      ARG  63 -12.206   6.938  -4.905
  476    HD3  ARG  63           1HD      ARG  63 -13.571   6.574  -5.958
  477    HE   ARG  63           HE       ARG  63 -14.851   5.992  -4.028
  478   HH11  ARG  63          1HH1      ARG  63 -11.764   7.335  -3.287
  479   HH12  ARG  63          2HH1      ARG  63 -12.261   7.899  -1.734
  480   HH21  ARG  63          1HH2      ARG  63 -15.475   6.703  -2.039
  481   HH22  ARG  63          2HH2      ARG  63 -14.342   7.524  -1.018
  482    H    THR  64           H        THR  64 -11.201   1.706  -3.704
  483    HA   THR  64           HA       THR  64 -13.596   0.363  -4.618
  484    HB   THR  64           HB       THR  64 -12.091  -1.451  -5.291
  485    HG1  THR  64           HG1      THR  64  -9.699  -0.363  -4.776
  486   HG21  THR  64          3HG2      THR  64 -10.982   1.286  -5.969
  487   HG22  THR  64          1HG2      THR  64 -12.306   0.467  -6.802
  488   HG23  THR  64          2HG2      THR  64 -10.674  -0.198  -6.871
  489    H    ARG  65           H        ARG  65 -11.715   0.443  -1.729
  490    HA   ARG  65           HA       ARG  65 -11.735  -0.708   0.220
  491    HB2  ARG  65           2HB      ARG  65 -14.557  -1.063  -0.738
  492    HB3  ARG  65           1HB      ARG  65 -14.032  -1.809   0.767
  493    HG2  ARG  65           2HG      ARG  65 -13.707   1.133   0.197
  494    HG3  ARG  65           1HG      ARG  65 -15.133   0.451   0.984
  495    HD2  ARG  65           2HD      ARG  65 -13.930  -0.200   2.878
  496    HD3  ARG  65           1HD      ARG  65 -12.382  -0.135   2.042
  497    HE   ARG  65           HE       ARG  65 -12.199   2.003   2.745
  498   HH11  ARG  65          1HH1      ARG  65 -15.577   1.279   2.635
  499   HH12  ARG  65          2HH1      ARG  65 -16.031   2.816   3.272
  500   HH21  ARG  65          1HH2      ARG  65 -12.806   3.950   3.604
  501   HH22  ARG  65          2HH2      ARG  65 -14.487   4.318   3.797
  502    H    GLN  66           H        GLN  66 -10.779  -2.074  -2.163
  503    HA   GLN  66           HA       GLN  66 -11.193  -4.891  -1.434
  504    HB2  GLN  66           2HB      GLN  66  -9.573  -3.685  -3.697
  505    HB3  GLN  66           1HB      GLN  66  -9.884  -5.398  -3.453
  506    HG2  GLN  66           2HG      GLN  66 -12.270  -5.023  -3.817
  507    HG3  GLN  66           1HG      GLN  66 -11.969  -3.302  -4.045
  508   HE21  GLN  66          1HE2      GLN  66 -11.645  -6.468  -5.429
  509   HE22  GLN  66          2HE2      GLN  66 -11.251  -5.947  -7.025
  510    H    ARG  67           H        ARG  67  -9.662  -6.047  -0.324
  511    HA   ARG  67           HA       ARG  67  -7.144  -4.698   0.360
  512    HB2  ARG  67           2HB      ARG  67  -6.877  -6.387   2.095
  513    HB3  ARG  67           1HB      ARG  67  -8.462  -5.640   2.224
  514    HG2  ARG  67           2HG      ARG  67  -9.479  -7.588   1.153
  515    HG3  ARG  67           1HG      ARG  67  -7.889  -8.336   0.988
  516    HD2  ARG  67           2HD      ARG  67  -7.689  -8.167   3.512
  517    HD3  ARG  67           1HD      ARG  67  -9.394  -7.719   3.532
  518    HE   ARG  67           HE       ARG  67  -8.771 -10.191   2.158
  519   HH11  ARG  67          1HH1      ARG  67  -9.766  -8.739   5.129
  520   HH12  ARG  67          2HH1      ARG  67 -10.398 -10.223   5.751
  521   HH21  ARG  67          1HH2      ARG  67  -9.591 -12.070   2.987
  522   HH22  ARG  67          2HH2      ARG  67 -10.300 -12.071   4.565
  523    H    GLY  68           H        GLY  68  -5.319  -5.187  -0.728
  524    HA2  GLY  68           2HA      GLY  68  -4.680  -7.837  -1.609
  525    HA3  GLY  68           1HA      GLY  68  -5.232  -6.841  -2.945
  526    H    ASP  69           H        ASP  69  -2.969  -7.500  -3.618
  527    HA   ASP  69           HA       ASP  69  -0.806  -6.035  -2.329
  528    HB2  ASP  69           2HB      ASP  69  -0.527  -8.397  -3.036
  529    HB3  ASP  69           1HB      ASP  69  -0.766  -7.909  -4.709
  530    H    PHE  70           H        PHE  70   0.112  -4.193  -3.111
  531    HA   PHE  70           HA       PHE  70  -0.521  -3.304  -5.841
  532    HB2  PHE  70           2HB      PHE  70  -1.086  -1.048  -5.053
  533    HB3  PHE  70           1HB      PHE  70  -2.175  -2.243  -4.357
  534    HD1  PHE  70           HD2      PHE  70   0.601   0.080  -3.654
  535    HD2  PHE  70           HD1      PHE  70  -2.196  -2.666  -1.976
  536    HE1  PHE  70           HE2      PHE  70   1.123   0.922  -1.403
  537    HE2  PHE  70           HE1      PHE  70  -1.677  -1.818   0.273
  538    HZ   PHE  70           HZ       PHE  70  -0.014  -0.027   0.562
  539    HA   PRO  71           HA       PRO  71   3.766  -1.992  -5.841
  540    HB2  PRO  71           2HB      PRO  71   3.651  -0.022  -7.734
  541    HB3  PRO  71           1HB      PRO  71   3.636  -1.746  -8.120
  542    HG2  PRO  71           2HG      PRO  71   1.343   0.175  -7.940
  543    HG3  PRO  71           1HG      PRO  71   1.649  -1.093  -9.142
  544    HD2  PRO  71           2HD      PRO  71  -0.099  -1.408  -7.093
  545    HD3  PRO  71           1HD      PRO  71   0.831  -2.762  -7.768
  546    H    GLY  72           H        GLY  72   4.422  -0.953  -4.041
  547    HA2  GLY  72           2HA      GLY  72   3.077   1.176  -2.796
  548    HA3  GLY  72           1HA      GLY  72   4.697   0.634  -2.409
  549    H    THR  73           H        THR  73   5.168   1.364  -5.489
  550    HA   THR  73           HA       THR  73   6.374   3.892  -4.912
  551    HB   THR  73           HB       THR  73   7.363   2.326  -6.546
  552    HG1  THR  73           HG1      THR  73   6.626   4.862  -7.649
  553   HG21  THR  73          3HG2      THR  73   5.036   3.098  -8.318
  554   HG22  THR  73          1HG2      THR  73   5.304   1.506  -7.604
  555   HG23  THR  73          2HG2      THR  73   6.431   2.139  -8.806
  556    H    TYR  74           H        TYR  74   3.192   3.118  -5.702
  557    HA   TYR  74           HA       TYR  74   2.642   5.661  -7.057
  558    HB2  TYR  74           2HB      TYR  74   0.902   3.268  -6.434
  559    HB3  TYR  74           1HB      TYR  74   0.263   4.760  -7.112
  560    HD1  TYR  74           HD1      TYR  74   2.840   2.139  -7.769
  561    HD2  TYR  74           HD2      TYR  74   0.169   5.008  -9.431
  562    HE1  TYR  74           HE1      TYR  74   3.355   1.307 -10.022
  563    HE2  TYR  74           HE2      TYR  74   0.682   4.183 -11.689
  564    HH   TYR  74           HH       TYR  74   2.349   1.256 -12.241
  565    H    VAL  75           H        VAL  75   3.001   4.747  -3.904
  566    HA   VAL  75           HA       VAL  75   0.942   6.648  -2.965
  567    HB   VAL  75           HB       VAL  75   0.509   5.294  -1.004
  568   HG11  VAL  75          1HG1      VAL  75   0.332   3.626  -3.519
  569   HG12  VAL  75          2HG1      VAL  75  -0.838   4.833  -2.986
  570   HG13  VAL  75          3HG1      VAL  75  -0.594   3.368  -2.039
  571   HG21  VAL  75          3HG2      VAL  75   2.716   4.300  -0.692
  572   HG22  VAL  75          1HG2      VAL  75   2.498   3.318  -2.141
  573   HG23  VAL  75          2HG2      VAL  75   1.477   3.047  -0.729
  574    H    GLU  76           H        GLU  76   1.447   7.938  -1.180
  575    HA   GLU  76           HA       GLU  76   4.268   7.920  -0.314
  576    HB2  GLU  76           2HB      GLU  76   3.967  10.200   0.405
  577    HB3  GLU  76           1HB      GLU  76   3.355  10.056  -1.236
  578    HG2  GLU  76           2HG      GLU  76   1.089  10.086  -0.474
  579    HG3  GLU  76           1HG      GLU  76   1.594   9.967   1.210
  580    H    PHE  77           H        PHE  77   4.708   8.310   2.005
  581    HA   PHE  77           HA       PHE  77   2.898   6.700   3.630
  582    HB2  PHE  77           2HB      PHE  77   5.259   6.145   3.729
  583    HB3  PHE  77           1HB      PHE  77   5.663   7.793   4.201
  584    HD1  PHE  77           HD2      PHE  77   3.257   5.167   5.368
  585    HD2  PHE  77           HD1      PHE  77   6.266   8.000   6.411
  586    HE1  PHE  77           HE2      PHE  77   3.027   4.539   7.734
  587    HE2  PHE  77           HE1      PHE  77   6.037   7.374   8.779
  588    HZ   PHE  77           HZ       PHE  77   4.419   5.642   9.442
  589    H    LEU  78           H        LEU  78   1.504   7.499   5.077
  590    HA   LEU  78           HA       LEU  78   1.623  10.358   5.767
  591    HB2  LEU  78           2HB      LEU  78  -0.585   8.336   6.221
  592    HB3  LEU  78           1HB      LEU  78  -0.682  10.048   6.589
  593    HG   LEU  78           HG       LEU  78  -0.387   8.859   3.823
  594   HD11  LEU  78          1HD1      LEU  78  -2.756  10.168   5.161
  595   HD12  LEU  78          2HD1      LEU  78  -2.590   8.454   4.768
  596   HD13  LEU  78          3HD1      LEU  78  -2.674   9.651   3.475
  597   HD21  LEU  78          3HD2      LEU  78  -0.757  11.145   3.021
  598   HD22  LEU  78          1HD2      LEU  78   0.716  11.024   3.984
  599   HD23  LEU  78          2HD2      LEU  78  -0.740  11.734   4.685
  600    H    GLY  79           H        GLY  79   0.697   7.381   7.531
  601    HA2  GLY  79           2HA      GLY  79   2.601   7.423   9.531
  602    HA3  GLY  79           1HA      GLY  79   1.336   8.507  10.087
  603    HA   PRO  80           HA       PRO  80   0.199   3.993  11.028
  604    HB2  PRO  80           2HB      PRO  80   0.814   3.840  13.648
  605    HB3  PRO  80           1HB      PRO  80   2.017   3.530  12.388
  606    HG2  PRO  80           2HG      PRO  80   1.564   6.023  13.999
  607    HG3  PRO  80           1HG      PRO  80   3.093   5.218  13.598
  608    HD2  PRO  80           2HD      PRO  80   2.149   7.396  12.244
  609    HD3  PRO  80           1HD      PRO  80   3.179   6.158  11.494
  610    H    LEU  81           H        LEU  81  -1.626   3.300  12.325
  611    HA   LEU  81           HA       LEU  81  -3.341   5.529  13.150
  612    HB2  LEU  81           2HB      LEU  81  -5.055   3.514  13.287
  613    HB3  LEU  81           1HB      LEU  81  -4.663   4.305  11.776
  614    HG   LEU  81           HG       LEU  81  -2.937   2.435  11.424
  615   HD11  LEU  81          1HD1      LEU  81  -3.410   0.311  12.541
  616   HD12  LEU  81          2HD1      LEU  81  -4.578   1.120  13.585
  617   HD13  LEU  81          3HD1      LEU  81  -2.869   1.545  13.677
  618   HD21  LEU  81          3HD2      LEU  81  -5.883   1.780  11.411
  619   HD22  LEU  81          1HD2      LEU  81  -4.632   0.913  10.517
  620   HD23  LEU  81          2HD2      LEU  81  -4.982   2.598  10.134
  621    H    GLU  82           H        GLU  82  -2.887   6.123  15.152
  622    HA   GLU  82           HA       GLU  82  -2.230   4.169  17.222
  623    HB2  GLU  82           2HB      GLU  82  -0.790   6.137  16.902
  624    HB3  GLU  82           1HB      GLU  82  -2.148   7.199  17.240
  625    HG2  GLU  82           2HG      GLU  82  -0.711   7.059  19.167
  626    HG3  GLU  82           1HG      GLU  82  -2.262   6.308  19.528
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  -3.688   0.292  24.380
    2    H2   MET   1           2H       MET   1  -3.404   1.960  24.392
    3    H3   MET   1           3H       MET   1  -3.011   1.024  25.743
    4    HA   MET   1           HA       MET   1  -1.042   1.631  24.474
    5    HB2  MET   1           2HB      MET   1  -0.081  -0.631  24.314
    6    HB3  MET   1           1HB      MET   1  -1.030  -0.436  25.780
    7    HG2  MET   1           2HG      MET   1  -2.889  -1.638  24.742
    8    HG3  MET   1           1HG      MET   1  -1.940  -1.833  23.268
    9    HE1  MET   1           3HE      MET   1  -2.373  -4.460  23.343
   10    HE2  MET   1           1HE      MET   1  -3.321  -4.266  24.818
   11    HE3  MET   1           2HE      MET   1  -2.030  -5.466  24.748
   12    H    ALA   2           H        ALA   2  -0.019   1.898  22.525
   13    HA   ALA   2           HA       ALA   2  -0.957   0.508  20.148
   14    HB1  ALA   2           3HB      ALA   2  -1.122   3.519  20.333
   15    HB2  ALA   2           1HB      ALA   2  -2.488   2.405  20.264
   16    HB3  ALA   2           2HB      ALA   2  -1.405   2.557  18.880
   17    H    GLY   3           H        GLY   3   0.698   0.082  18.822
   18    HA2  GLY   3           2HA      GLY   3   3.110   1.785  18.946
   19    HA3  GLY   3           1HA      GLY   3   3.234   0.038  19.043
   20    HA   PRO   4           HA       PRO   4   3.483   0.478  14.563
   21    HB2  PRO   4           2HB      PRO   4   5.036  -1.616  14.136
   22    HB3  PRO   4           1HB      PRO   4   5.621  -0.275  15.130
   23    HG2  PRO   4           2HG      PRO   4   4.685  -2.980  15.964
   24    HG3  PRO   4           1HG      PRO   4   5.918  -1.941  16.699
   25    HD2  PRO   4           2HD      PRO   4   3.155  -2.199  17.458
   26    HD3  PRO   4           1HD      PRO   4   4.379  -1.118  18.159
   27    H    GLU   5           H        GLU   5   0.979  -0.850  15.595
   28    HA   GLU   5           HA       GLU   5   0.590  -3.394  14.485
   29    HB2  GLU   5           2HB      GLU   5  -1.392  -1.197  15.080
   30    HB3  GLU   5           1HB      GLU   5  -1.881  -2.783  14.504
   31    HG2  GLU   5           2HG      GLU   5  -2.111  -2.636  16.905
   32    HG3  GLU   5           1HG      GLU   5  -0.878  -3.820  16.474
   33    H    GLY   6           H        GLY   6   0.402  -0.246  12.910
   34    HA2  GLY   6           2HA      GLY   6   0.510  -1.412  10.313
   35    HA3  GLY   6           1HA      GLY   6  -1.128  -0.889  10.666
   36    H    PHE   7           H        PHE   7   0.130   0.200   8.531
   37    HA   PHE   7           HA       PHE   7   0.656   2.964   9.416
   38    HB2  PHE   7           2HB      PHE   7   2.163   1.518   7.221
   39    HB3  PHE   7           1HB      PHE   7   2.382   3.203   7.682
   40    HD1  PHE   7           HD1      PHE   7   3.200   3.709  10.039
   41    HD2  PHE   7           HD2      PHE   7   3.358  -0.183   8.312
   42    HE1  PHE   7           HE1      PHE   7   4.883   3.040  11.702
   43    HE2  PHE   7           HE2      PHE   7   5.043  -0.852   9.974
   44    HZ   PHE   7           HZ       PHE   7   5.806   0.758  11.673
   45    H    GLN   8           H        GLN   8   0.242   4.605   7.776
   46    HA   GLN   8           HA       GLN   8  -1.876   3.777   5.886
   47    HB2  GLN   8           2HB      GLN   8  -1.555   6.405   7.360
   48    HB3  GLN   8           1HB      GLN   8  -2.822   6.048   6.193
   49    HG2  GLN   8           2HG      GLN   8  -3.658   4.266   7.647
   50    HG3  GLN   8           1HG      GLN   8  -2.389   4.627   8.816
   51   HE21  GLN   8          1HE2      GLN   8  -5.289   4.709   9.129
   52   HE22  GLN   8          2HE2      GLN   8  -5.663   6.311   9.646
   53    H    TYR   9           H        TYR   9  -1.615   4.215   3.789
   54    HA   TYR   9           HA       TYR   9   0.474   6.146   2.957
   55    HB2  TYR   9           2HB      TYR   9  -0.323   3.607   1.497
   56    HB3  TYR   9           1HB      TYR   9   0.963   4.719   1.041
   57    HD1  TYR   9           HD1      TYR   9  -0.038   2.061   3.366
   58    HD2  TYR   9           HD2      TYR   9   3.105   4.693   2.211
   59    HE1  TYR   9           HE1      TYR   9   1.554   0.739   4.691
   60    HE2  TYR   9           HE2      TYR   9   4.701   3.375   3.536
   61    HH   TYR   9           HH       TYR   9   3.984   0.303   4.752
   62    H    ARG  10           H        ARG  10  -0.024   7.479   1.156
   63    HA   ARG  10           HA       ARG  10  -2.865   7.471   0.367
   64    HB2  ARG  10           2HB      ARG  10  -2.023   9.564   1.377
   65    HB3  ARG  10           1HB      ARG  10  -0.829   9.698   0.091
   66    HG2  ARG  10           2HG      ARG  10  -2.629   9.898  -1.561
   67    HG3  ARG  10           1HG      ARG  10  -3.828   9.753  -0.276
   68    HD2  ARG  10           2HD      ARG  10  -3.549  12.085  -0.871
   69    HD3  ARG  10           1HD      ARG  10  -2.936  11.810   0.758
   70    HE   ARG  10           HE       ARG  10  -0.674  11.817  -0.251
   71   HH11  ARG  10          1HH1      ARG  10  -3.267  13.342  -1.940
   72   HH12  ARG  10          2HH1      ARG  10  -2.217  14.425  -2.778
   73   HH21  ARG  10          1HH2      ARG  10   0.652  13.211  -1.347
   74   HH22  ARG  10          2HH2      ARG  10  -0.038  14.353  -2.453
   75    H    ALA  11           H        ALA  11  -3.432   6.871  -1.629
   76    HA   ALA  11           HA       ALA  11  -1.489   6.144  -3.605
   77    HB1  ALA  11           3HB      ALA  11  -3.578   4.904  -3.378
   78    HB2  ALA  11           1HB      ALA  11  -3.427   5.580  -5.001
   79    HB3  ALA  11           2HB      ALA  11  -4.495   6.344  -3.823
   80    H    LEU  12           H        LEU  12  -0.465   7.554  -4.851
   81    HA   LEU  12           HA       LEU  12  -1.259  10.266  -5.173
   82    HB2  LEU  12           2HB      LEU  12   0.838   8.678  -6.662
   83    HB3  LEU  12           1HB      LEU  12   0.683  10.427  -6.683
   84    HG   LEU  12           HG       LEU  12   1.361   8.743  -4.260
   85   HD11  LEU  12          1HD1      LEU  12   3.562   9.776  -4.416
   86   HD12  LEU  12          2HD1      LEU  12   3.072  10.633  -5.877
   87   HD13  LEU  12          3HD1      LEU  12   3.188   8.872  -5.884
   88   HD21  LEU  12          3HD2      LEU  12   1.159  11.742  -4.567
   89   HD22  LEU  12          1HD2      LEU  12   1.746  10.889  -3.138
   90   HD23  LEU  12          2HD2      LEU  12   0.066  10.714  -3.641
   91    H    TYR  13           H        TYR  13  -0.890   7.691  -7.636
   92    HA   TYR  13           HA       TYR  13  -2.942   9.055  -9.264
   93    HB2  TYR  13           2HB      TYR  13  -0.413   7.781 -10.358
   94    HB3  TYR  13           1HB      TYR  13  -1.645   8.636 -11.281
   95    HD1  TYR  13           HD1      TYR  13  -1.974  11.121 -10.846
   96    HD2  TYR  13           HD2      TYR  13   1.382   8.960  -9.359
   97    HE1  TYR  13           HE1      TYR  13  -0.775  13.239 -10.485
   98    HE2  TYR  13           HE2      TYR  13   2.589  11.069  -8.999
   99    HH   TYR  13           HH       TYR  13   2.589  13.343  -9.742
  100    HA   PRO  14           HA       PRO  14  -4.869   5.098  -9.446
  101    HB2  PRO  14           2HB      PRO  14  -6.251   5.274 -11.791
  102    HB3  PRO  14           1HB      PRO  14  -6.728   6.127 -10.316
  103    HG2  PRO  14           2HG      PRO  14  -5.233   7.148 -12.707
  104    HG3  PRO  14           1HG      PRO  14  -6.518   7.935 -11.771
  105    HD2  PRO  14           2HD      PRO  14  -3.883   8.532 -11.451
  106    HD3  PRO  14           1HD      PRO  14  -5.061   8.641 -10.127
  107    H    PHE  15           H        PHE  15  -3.792   3.266  -9.802
  108    HA   PHE  15           HA       PHE  15  -2.558   2.789 -12.442
  109    HB2  PHE  15           2HB      PHE  15  -0.939   2.811 -10.588
  110    HB3  PHE  15           1HB      PHE  15  -1.862   1.568  -9.753
  111    HD1  PHE  15           HD1      PHE  15   0.313   2.263 -12.648
  112    HD2  PHE  15           HD2      PHE  15  -1.685  -0.744 -10.377
  113    HE1  PHE  15           HE1      PHE  15   1.615   0.524 -13.800
  114    HE2  PHE  15           HE2      PHE  15  -0.378  -2.482 -11.526
  115    HZ   PHE  15           HZ       PHE  15   1.275  -1.849 -13.240
  116    H    ARG  16           H        ARG  16  -3.817   1.540 -13.667
  117    HA   ARG  16           HA       ARG  16  -5.890  -0.099 -12.591
  118    HB2  ARG  16           2HB      ARG  16  -6.223  -0.800 -14.982
  119    HB3  ARG  16           1HB      ARG  16  -6.310   0.931 -14.696
  120    HG2  ARG  16           2HG      ARG  16  -4.187   1.305 -15.670
  121    HG3  ARG  16           1HG      ARG  16  -3.799  -0.416 -15.669
  122    HD2  ARG  16           2HD      ARG  16  -4.454   0.582 -17.906
  123    HD3  ARG  16           1HD      ARG  16  -5.329  -0.865 -17.415
  124    HE   ARG  16           HE       ARG  16  -7.223   0.514 -16.902
  125   HH11  ARG  16          1HH1      ARG  16  -4.711   2.110 -18.645
  126   HH12  ARG  16          2HH1      ARG  16  -5.766   3.340 -19.241
  127   HH21  ARG  16          1HH2      ARG  16  -8.553   2.084 -17.669
  128   HH22  ARG  16          2HH2      ARG  16  -7.923   3.327 -18.694
  129    H    ARG  17           H        ARG  17  -5.942  -2.221 -12.172
  130    HA   ARG  17           HA       ARG  17  -3.558  -3.841 -12.617
  131    HB2  ARG  17           2HB      ARG  17  -6.133  -4.336 -11.118
  132    HB3  ARG  17           1HB      ARG  17  -4.938  -5.601 -11.379
  133    HG2  ARG  17           2HG      ARG  17  -4.479  -3.008  -9.908
  134    HG3  ARG  17           1HG      ARG  17  -4.695  -4.601  -9.178
  135    HD2  ARG  17           2HD      ARG  17  -2.675  -5.345 -10.521
  136    HD3  ARG  17           1HD      ARG  17  -2.408  -3.642 -10.895
  137    HE   ARG  17           HE       ARG  17  -2.603  -3.716  -8.176
  138   HH11  ARG  17          1HH1      ARG  17  -0.624  -5.311 -10.511
  139   HH12  ARG  17          2HH1      ARG  17   0.695  -5.516  -9.413
  140   HH21  ARG  17          1HH2      ARG  17  -0.890  -4.012  -6.779
  141   HH22  ARG  17          2HH2      ARG  17   0.552  -4.782  -7.347
  142    H    GLU  18           H        GLU  18  -3.991  -6.171 -13.339
  143    HA   GLU  18           HA       GLU  18  -5.365  -6.054 -15.894
  144    HB2  GLU  18           2HB      GLU  18  -3.831  -8.342 -14.631
  145    HB3  GLU  18           1HB      GLU  18  -4.349  -8.236 -16.309
  146    HG2  GLU  18           2HG      GLU  18  -2.345  -6.446 -14.943
  147    HG3  GLU  18           1HG      GLU  18  -1.981  -7.729 -16.093
  148    H    ARG  19           H        ARG  19  -5.505  -8.110 -12.968
  149    HA   ARG  19           HA       ARG  19  -8.368  -8.578 -13.523
  150    HB2  ARG  19           2HB      ARG  19  -6.546 -10.688 -12.350
  151    HB3  ARG  19           1HB      ARG  19  -8.219 -10.878 -12.845
  152    HG2  ARG  19           2HG      ARG  19  -7.219 -11.852 -14.634
  153    HG3  ARG  19           1HG      ARG  19  -7.199 -10.181 -15.209
  154    HD2  ARG  19           2HD      ARG  19  -5.026 -11.297 -15.519
  155    HD3  ARG  19           1HD      ARG  19  -4.911  -9.913 -14.429
  156    HE   ARG  19           HE       ARG  19  -5.350 -12.278 -12.943
  157   HH11  ARG  19          1HH1      ARG  19  -2.882 -10.701 -14.763
  158   HH12  ARG  19          2HH1      ARG  19  -1.603 -11.407 -13.840
  159   HH21  ARG  19          1HH2      ARG  19  -3.705 -13.206 -11.794
  160   HH22  ARG  19          2HH2      ARG  19  -2.065 -12.808 -12.174
  161    HA   PRO  20           HA       PRO  20  -9.178  -7.367  -9.354
  162    HB2  PRO  20           2HB      PRO  20 -11.079  -9.130  -8.499
  163    HB3  PRO  20           1HB      PRO  20 -11.396  -7.846  -9.671
  164    HG2  PRO  20           2HG      PRO  20 -10.811 -10.749 -10.160
  165    HG3  PRO  20           1HG      PRO  20 -12.061  -9.723 -10.892
  166    HD2  PRO  20           2HD      PRO  20  -9.768 -10.284 -12.178
  167    HD3  PRO  20           1HD      PRO  20 -10.556  -8.702 -12.335
  168    H    GLU  21           H        GLU  21  -7.457 -10.195  -9.827
  169    HA   GLU  21           HA       GLU  21  -7.348 -11.248  -7.201
  170    HB2  GLU  21           2HB      GLU  21  -5.304 -11.286  -9.430
  171    HB3  GLU  21           1HB      GLU  21  -5.063 -12.110  -7.897
  172    HG2  GLU  21           2HG      GLU  21  -5.826 -13.803  -9.260
  173    HG3  GLU  21           1HG      GLU  21  -7.296 -13.293  -8.434
  174    H    ASP  22           H        ASP  22  -5.730  -8.528  -8.721
  175    HA   ASP  22           HA       ASP  22  -4.172  -8.017  -6.270
  176    HB2  ASP  22           2HB      ASP  22  -3.907  -6.762  -9.015
  177    HB3  ASP  22           1HB      ASP  22  -2.837  -6.486  -7.642
  178    H    LEU  23           H        LEU  23  -3.813  -5.390  -6.143
  179    HA   LEU  23           HA       LEU  23  -6.531  -4.372  -5.665
  180    HB2  LEU  23           2HB      LEU  23  -4.901  -4.510  -3.779
  181    HB3  LEU  23           1HB      LEU  23  -3.904  -3.328  -4.603
  182    HG   LEU  23           HG       LEU  23  -5.729  -1.669  -4.416
  183   HD11  LEU  23          1HD1      LEU  23  -7.658  -2.156  -2.969
  184   HD12  LEU  23          2HD1      LEU  23  -7.137  -3.836  -2.851
  185   HD13  LEU  23          3HD1      LEU  23  -7.637  -3.174  -4.407
  186   HD21  LEU  23          3HD2      LEU  23  -4.935  -2.948  -1.795
  187   HD22  LEU  23          1HD2      LEU  23  -5.555  -1.309  -1.997
  188   HD23  LEU  23          2HD2      LEU  23  -3.999  -1.755  -2.696
  189    H    GLU  24           H        GLU  24  -7.336  -2.645  -6.690
  190    HA   GLU  24           HA       GLU  24  -5.702  -1.321  -8.739
  191    HB2  GLU  24           2HB      GLU  24  -8.135  -2.420  -8.947
  192    HB3  GLU  24           1HB      GLU  24  -8.640  -0.822  -8.428
  193    HG2  GLU  24           2HG      GLU  24  -6.776  -1.161 -10.752
  194    HG3  GLU  24           1HG      GLU  24  -8.512  -1.374 -10.947
  195    H    LEU  25           H        LEU  25  -5.522   1.004  -8.839
  196    HA   LEU  25           HA       LEU  25  -5.719   2.152  -6.125
  197    HB2  LEU  25           2HB      LEU  25  -3.818   2.813  -8.371
  198    HB3  LEU  25           1HB      LEU  25  -3.868   3.654  -6.831
  199    HG   LEU  25           HG       LEU  25  -3.136   0.752  -7.272
  200   HD11  LEU  25          1HD1      LEU  25  -1.487   3.103  -6.339
  201   HD12  LEU  25          2HD1      LEU  25  -1.384   2.321  -7.917
  202   HD13  LEU  25          3HD1      LEU  25  -0.934   1.433  -6.461
  203   HD21  LEU  25          3HD2      LEU  25  -3.304   2.306  -4.683
  204   HD22  LEU  25          1HD2      LEU  25  -2.682   0.666  -4.868
  205   HD23  LEU  25          2HD2      LEU  25  -4.382   1.002  -5.184
  206    H    LEU  26           H        LEU  26  -6.766   3.979  -5.708
  207    HA   LEU  26           HA       LEU  26  -7.820   5.591  -7.945
  208    HB2  LEU  26           2HB      LEU  26  -8.896   5.045  -5.183
  209    HB3  LEU  26           1HB      LEU  26  -9.421   6.448  -6.089
  210    HG   LEU  26           HG       LEU  26 -11.025   4.621  -6.290
  211   HD11  LEU  26          1HD1      LEU  26 -11.177   4.529  -8.744
  212   HD12  LEU  26          2HD1      LEU  26  -9.550   5.201  -8.859
  213   HD13  LEU  26          3HD1      LEU  26 -10.852   6.155  -8.148
  214   HD21  LEU  26          3HD2      LEU  26 -10.479   2.550  -7.436
  215   HD22  LEU  26          1HD2      LEU  26  -9.472   2.741  -6.003
  216   HD23  LEU  26          2HD2      LEU  26  -8.798   3.059  -7.603
  217    HA   PRO  27           HA       PRO  27  -5.074   8.793  -6.640
  218    HB2  PRO  27           2HB      PRO  27  -6.236  10.954  -7.801
  219    HB3  PRO  27           1HB      PRO  27  -5.402   9.704  -8.730
  220    HG2  PRO  27           2HG      PRO  27  -8.341  10.051  -8.243
  221    HG3  PRO  27           1HG      PRO  27  -7.499   9.657  -9.753
  222    HD2  PRO  27           2HD      PRO  27  -8.722   7.775  -8.225
  223    HD3  PRO  27           1HD      PRO  27  -7.274   7.427  -9.192
  224    H    GLY  28           H        GLY  28  -4.872   9.693  -4.685
  225    HA2  GLY  28           2HA      GLY  28  -5.324  11.366  -3.081
  226    HA3  GLY  28           1HA      GLY  28  -6.978  11.450  -3.654
  227    H    ASP  29           H        ASP  29  -6.733   8.290  -3.407
  228    HA   ASP  29           HA       ASP  29  -8.131   8.258  -0.889
  229    HB2  ASP  29           2HB      ASP  29  -8.904   6.899  -2.787
  230    HB3  ASP  29           1HB      ASP  29  -7.398   5.983  -2.748
  231    H    VAL  30           H        VAL  30  -7.657   6.671   0.824
  232    HA   VAL  30           HA       VAL  30  -4.753   6.484   1.333
  233    HB   VAL  30           HB       VAL  30  -7.015   6.527   3.350
  234   HG11  VAL  30          1HG1      VAL  30  -5.097   5.253   4.156
  235   HG12  VAL  30          2HG1      VAL  30  -5.230   6.779   5.028
  236   HG13  VAL  30          3HG1      VAL  30  -4.019   6.594   3.760
  237   HG21  VAL  30          3HG2      VAL  30  -6.198   8.779   3.920
  238   HG22  VAL  30          1HG2      VAL  30  -6.764   8.689   2.251
  239   HG23  VAL  30          2HG2      VAL  30  -5.035   8.686   2.597
  240    H    LEU  31           H        LEU  31  -3.846   4.542   1.651
  241    HA   LEU  31           HA       LEU  31  -5.574   2.168   1.857
  242    HB2  LEU  31           2HB      LEU  31  -2.713   2.414   0.891
  243    HB3  LEU  31           1HB      LEU  31  -3.579   0.899   1.061
  244    HG   LEU  31           HG       LEU  31  -5.249   1.797  -0.635
  245   HD11  LEU  31          1HD1      LEU  31  -3.088   3.861  -1.062
  246   HD12  LEU  31          2HD1      LEU  31  -4.723   4.164  -0.474
  247   HD13  LEU  31          3HD1      LEU  31  -4.474   3.586  -2.120
  248   HD21  LEU  31          3HD2      LEU  31  -3.827   1.246  -2.545
  249   HD22  LEU  31          1HD2      LEU  31  -3.566   0.129  -1.206
  250   HD23  LEU  31          2HD2      LEU  31  -2.392   1.405  -1.530
  251    H    VAL  32           H        VAL  32  -5.633   1.150   3.761
  252    HA   VAL  32           HA       VAL  32  -3.619   1.755   5.806
  253    HB   VAL  32           HB       VAL  32  -6.217   0.213   6.057
  254   HG11  VAL  32          1HG1      VAL  32  -4.605  -0.441   7.766
  255   HG12  VAL  32          2HG1      VAL  32  -5.910   0.503   8.483
  256   HG13  VAL  32          3HG1      VAL  32  -4.339   1.250   8.189
  257   HG21  VAL  32          3HG2      VAL  32  -6.622   2.549   5.482
  258   HG22  VAL  32          1HG2      VAL  32  -5.572   3.076   6.798
  259   HG23  VAL  32          2HG2      VAL  32  -7.084   2.240   7.155
  260    H    VAL  33           H        VAL  33  -1.911   0.443   6.010
  261    HA   VAL  33           HA       VAL  33  -2.189  -2.393   5.224
  262    HB   VAL  33           HB       VAL  33   0.329  -0.708   5.250
  263   HG11  VAL  33          1HG1      VAL  33   0.817  -3.046   5.707
  264   HG12  VAL  33          2HG1      VAL  33   1.347  -2.629   4.075
  265   HG13  VAL  33          3HG1      VAL  33  -0.142  -3.545   4.313
  266   HG21  VAL  33          3HG2      VAL  33  -1.173  -0.003   3.472
  267   HG22  VAL  33          1HG2      VAL  33  -1.359  -1.674   2.935
  268   HG23  VAL  33          2HG2      VAL  33   0.205  -0.871   2.791
  269    H    SER  34           H        SER  34  -2.556  -3.512   7.076
  270    HA   SER  34           HA       SER  34  -1.438  -3.009   9.610
  271    HB2  SER  34           2HB      SER  34  -2.312  -5.682   8.460
  272    HB3  SER  34           1HB      SER  34  -2.099  -5.310  10.172
  273    HG   SER  34           HG       SER  34  -4.220  -4.997   9.870
  274    H    ARG  35           H        ARG  35   0.568  -3.389  10.440
  275    HA   ARG  35           HA       ARG  35   2.705  -3.839   8.691
  276    HB2  ARG  35           2HB      ARG  35   2.681  -2.646  10.977
  277    HB3  ARG  35           1HB      ARG  35   2.949  -4.243  11.665
  278    HG2  ARG  35           2HG      ARG  35   5.010  -4.463  10.335
  279    HG3  ARG  35           1HG      ARG  35   4.739  -2.851   9.670
  280    HD2  ARG  35           2HD      ARG  35   4.722  -2.047  12.102
  281    HD3  ARG  35           1HD      ARG  35   5.404  -3.624  12.499
  282    HE   ARG  35           HE       ARG  35   6.789  -2.072  10.465
  283   HH11  ARG  35          1HH1      ARG  35   6.653  -3.153  13.725
  284   HH12  ARG  35          2HH1      ARG  35   8.259  -2.619  14.083
  285   HH21  ARG  35          1HH2      ARG  35   8.872  -1.378  10.938
  286   HH22  ARG  35          2HH2      ARG  35   9.500  -1.652  12.530
  287    H    ALA  36           H        ALA  36   0.785  -6.134  10.431
  288    HA   ALA  36           HA       ALA  36   2.422  -8.358  10.617
  289    HB1  ALA  36           3HB      ALA  36   0.404  -9.704  10.456
  290    HB2  ALA  36           1HB      ALA  36  -0.477  -8.341   9.763
  291    HB3  ALA  36           2HB      ALA  36   0.098  -8.265  11.429
  292    H    ALA  37           H        ALA  37   0.825  -7.037   7.750
  293    HA   ALA  37           HA       ALA  37   1.587  -9.146   5.975
  294    HB1  ALA  37           3HB      ALA  37   0.847  -6.291   5.316
  295    HB2  ALA  37           1HB      ALA  37  -0.287  -7.630   5.495
  296    HB3  ALA  37           2HB      ALA  37   0.895  -7.648   4.188
  297    H    LEU  38           H        LEU  38   3.024  -6.029   6.850
  298    HA   LEU  38           HA       LEU  38   5.156  -6.073   4.987
  299    HB2  LEU  38           2HB      LEU  38   5.011  -4.744   7.699
  300    HB3  LEU  38           1HB      LEU  38   6.214  -4.401   6.469
  301    HG   LEU  38           HG       LEU  38   3.240  -3.875   6.236
  302   HD11  LEU  38          1HD1      LEU  38   5.567  -1.971   6.542
  303   HD12  LEU  38          2HD1      LEU  38   4.343  -2.328   7.762
  304   HD13  LEU  38          3HD1      LEU  38   3.887  -1.509   6.268
  305   HD21  LEU  38          3HD2      LEU  38   5.479  -3.280   4.296
  306   HD22  LEU  38          1HD2      LEU  38   3.807  -2.742   4.133
  307   HD23  LEU  38          2HD2      LEU  38   4.189  -4.462   4.072
  308    H    GLN  39           H        GLN  39   4.862  -7.317   8.293
  309    HA   GLN  39           HA       GLN  39   7.522  -8.258   8.547
  310    HB2  GLN  39           2HB      GLN  39   4.984  -9.261   9.868
  311    HB3  GLN  39           1HB      GLN  39   6.617  -9.681  10.369
  312    HG2  GLN  39           2HG      GLN  39   5.423  -6.910  10.395
  313    HG3  GLN  39           1HG      GLN  39   5.633  -7.957  11.796
  314   HE21  GLN  39          1HE2      GLN  39   7.693  -8.253  12.646
  315   HE22  GLN  39          2HE2      GLN  39   9.027  -7.249  12.210
  316    H    ALA  40           H        ALA  40   4.557  -9.745   7.301
  317    HA   ALA  40           HA       ALA  40   5.579 -12.298   6.722
  318    HB1  ALA  40           3HB      ALA  40   3.721 -12.502   5.143
  319    HB2  ALA  40           1HB      ALA  40   3.447 -10.761   5.229
  320    HB3  ALA  40           2HB      ALA  40   3.188 -11.766   6.654
  321    H    LEU  41           H        LEU  41   5.684  -9.278   4.869
  322    HA   LEU  41           HA       LEU  41   7.010 -10.396   2.584
  323    HB2  LEU  41           2HB      LEU  41   6.898  -7.532   3.551
  324    HB3  LEU  41           1HB      LEU  41   7.469  -8.044   1.975
  325    HG   LEU  41           HG       LEU  41   4.637  -8.372   2.988
  326   HD11  LEU  41          1HD1      LEU  41   5.804  -6.409   1.014
  327   HD12  LEU  41          2HD1      LEU  41   5.182  -6.034   2.622
  328   HD13  LEU  41          3HD1      LEU  41   4.088  -6.615   1.367
  329   HD21  LEU  41          3HD2      LEU  41   5.251 -10.114   1.395
  330   HD22  LEU  41          1HD2      LEU  41   5.831  -8.893   0.261
  331   HD23  LEU  41          2HD2      LEU  41   4.117  -8.976   0.669
  332    H    GLY  42           H        GLY  42   8.046  -9.211   5.679
  333    HA2  GLY  42           2HA      GLY  42  10.131  -9.401   6.693
  334    HA3  GLY  42           1HA      GLY  42  10.796  -9.971   5.170
  335    H    VAL  43           H        VAL  43   9.221  -6.955   6.273
  336    HA   VAL  43           HA       VAL  43  11.071  -5.373   4.685
  337    HB   VAL  43           HB       VAL  43   8.837  -4.474   6.526
  338   HG11  VAL  43          1HG1      VAL  43   9.006  -2.308   5.403
  339   HG12  VAL  43          2HG1      VAL  43  10.367  -2.895   4.448
  340   HG13  VAL  43          3HG1      VAL  43  10.526  -2.718   6.196
  341   HG21  VAL  43          3HG2      VAL  43   7.543  -4.129   4.477
  342   HG22  VAL  43          1HG2      VAL  43   8.027  -5.816   4.644
  343   HG23  VAL  43          2HG2      VAL  43   8.881  -4.762   3.515
  344    H    ALA  44           H        ALA  44  12.671  -4.032   5.431
  345    HA   ALA  44           HA       ALA  44  13.767  -4.580   8.035
  346    HB1  ALA  44           3HB      ALA  44  15.221  -4.318   6.095
  347    HB2  ALA  44           1HB      ALA  44  15.604  -3.124   7.334
  348    HB3  ALA  44           2HB      ALA  44  14.686  -2.648   5.903
  349    H    GLU  45           H        GLU  45  14.054  -3.154   9.750
  350    HA   GLU  45           HA       GLU  45  11.977  -1.281  10.233
  351    HB2  GLU  45           2HB      GLU  45  14.581  -1.699  11.720
  352    HB3  GLU  45           1HB      GLU  45  13.203  -0.782  12.318
  353    HG2  GLU  45           2HG      GLU  45  11.840  -2.795  12.334
  354    HG3  GLU  45           1HG      GLU  45  13.182  -3.727  11.669
  355    H    GLY  46           H        GLY  46  11.822   0.793   9.630
  356    HA2  GLY  46           2HA      GLY  46  12.728   3.012   9.376
  357    HA3  GLY  46           1HA      GLY  46  14.294   2.301   9.014
  358    H    GLY  47           H        GLY  47  12.559   0.310   7.329
  359    HA2  GLY  47           2HA      GLY  47  12.653   1.928   4.875
  360    HA3  GLY  47           1HA      GLY  47  12.612   0.174   4.956
  361    H    GLU  48           H        GLU  48  10.335   0.555   7.039
  362    HA   GLU  48           HA       GLU  48   8.204   0.146   5.220
  363    HB2  GLU  48           2HB      GLU  48   6.735   0.047   7.127
  364    HB3  GLU  48           1HB      GLU  48   8.227  -0.786   7.523
  365    HG2  GLU  48           2HG      GLU  48   7.589   2.032   8.376
  366    HG3  GLU  48           1HG      GLU  48   7.280   0.605   9.358
  367    H    ARG  49           H        ARG  49   9.370   2.995   6.886
  368    HA   ARG  49           HA       ARG  49   7.178   4.683   6.107
  369    HB2  ARG  49           2HB      ARG  49   8.688   6.540   6.859
  370    HB3  ARG  49           1HB      ARG  49   8.399   5.298   8.068
  371    HG2  ARG  49           2HG      ARG  49  10.594   4.282   7.463
  372    HG3  ARG  49           1HG      ARG  49  10.885   5.661   6.399
  373    HD2  ARG  49           2HD      ARG  49  10.798   7.185   8.268
  374    HD3  ARG  49           1HD      ARG  49  10.319   5.884   9.358
  375    HE   ARG  49           HE       ARG  49  12.905   5.690   7.998
  376   HH11  ARG  49          1HH1      ARG  49  11.150   6.250  10.918
  377   HH12  ARG  49          2HH1      ARG  49  12.535   5.997  11.920
  378   HH21  ARG  49          1HH2      ARG  49  14.664   5.365   9.321
  379   HH22  ARG  49          2HH2      ARG  49  14.474   5.490  11.037
  380    H    CYS  50           H        CYS  50   9.216   3.180   4.143
  381    HA   CYS  50           HA       CYS  50   9.083   5.320   2.129
  382    HB2  CYS  50           2HB      CYS  50  11.493   3.534   2.560
  383    HB3  CYS  50           1HB      CYS  50  11.309   4.721   1.271
  384    HG   CYS  50           HG       CYS  50  12.991   5.323   3.713
  385    HA   PRO  51           HA       PRO  51   7.023   1.370   0.762
  386    HB2  PRO  51           2HB      PRO  51   5.316   2.690  -0.985
  387    HB3  PRO  51           1HB      PRO  51   4.952   2.323   0.705
  388    HG2  PRO  51           2HG      PRO  51   5.963   4.871  -0.504
  389    HG3  PRO  51           1HG      PRO  51   4.744   4.638   0.764
  390    HD2  PRO  51           2HD      PRO  51   7.243   5.400   1.366
  391    HD3  PRO  51           1HD      PRO  51   6.350   4.275   2.415
  392    H    GLN  52           H        GLN  52   8.122   4.070  -1.267
  393    HA   GLN  52           HA       GLN  52   8.335   2.696  -3.705
  394    HB2  GLN  52           2HB      GLN  52   9.860   4.512  -4.377
  395    HB3  GLN  52           1HB      GLN  52   8.423   5.124  -3.570
  396    HG2  GLN  52           2HG      GLN  52   9.778   5.275  -1.460
  397    HG3  GLN  52           1HG      GLN  52  11.199   4.879  -2.423
  398   HE21  GLN  52          1HE2      GLN  52  11.984   6.415  -3.902
  399   HE22  GLN  52          2HE2      GLN  52  11.490   8.069  -3.841
  400    H    SER  53           H        SER  53  10.331   2.560  -0.882
  401    HA   SER  53           HA       SER  53  12.623   1.417  -2.260
  402    HB2  SER  53           2HB      SER  53  12.089   1.766   0.707
  403    HB3  SER  53           1HB      SER  53  13.614   1.229   0.000
  404    HG   SER  53           HG       SER  53  13.585   3.485   0.476
  405    H    VAL  54           H        VAL  54   9.773   0.284  -0.629
  406    HA   VAL  54           HA       VAL  54  10.783  -2.385  -0.149
  407    HB   VAL  54           HB       VAL  54   7.918  -1.403  -0.065
  408   HG11  VAL  54          1HG1      VAL  54   9.180  -3.869   1.147
  409   HG12  VAL  54          2HG1      VAL  54   8.110  -3.840  -0.256
  410   HG13  VAL  54          3HG1      VAL  54   7.499  -3.366   1.330
  411   HG21  VAL  54          3HG2      VAL  54   9.957  -1.615   2.160
  412   HG22  VAL  54          1HG2      VAL  54   8.249  -1.232   2.373
  413   HG23  VAL  54          2HG2      VAL  54   9.296  -0.126   1.483
  414    H    GLY  55           H        GLY  55   8.500  -0.901  -2.452
  415    HA2  GLY  55           2HA      GLY  55   8.693  -1.657  -4.801
  416    HA3  GLY  55           1HA      GLY  55   8.800  -3.295  -4.180
  417    H    TRP  56           H        TRP  56   6.937  -4.418  -3.753
  418    HA   TRP  56           HA       TRP  56   4.374  -2.975  -4.034
  419    HB2  TRP  56           2HB      TRP  56   3.442  -5.055  -5.061
  420    HB3  TRP  56           1HB      TRP  56   4.698  -4.296  -6.033
  421    HD1  TRP  56           HD1      TRP  56   7.104  -5.574  -6.133
  422    HE1  TRP  56           HE1      TRP  56   7.701  -8.057  -5.818
  423    HE3  TRP  56           HE3      TRP  56   2.820  -7.155  -3.824
  424    HZ2  TRP  56           HZ2      TRP  56   6.514 -10.376  -4.738
  425    HZ3  TRP  56           HZ3      TRP  56   2.629  -9.524  -3.189
  426    HH2  TRP  56           HH2      TRP  56   4.439 -11.099  -3.640
  427    H    MET  57           H        MET  57   2.863  -3.325  -2.457
  428    HA   MET  57           HA       MET  57   3.326  -5.523  -0.538
  429    HB2  MET  57           2HB      MET  57   2.619  -2.689   0.279
  430    HB3  MET  57           1HB      MET  57   2.869  -4.058   1.354
  431    HG2  MET  57           2HG      MET  57   4.826  -2.793   1.503
  432    HG3  MET  57           1HG      MET  57   5.240  -4.146   0.452
  433    HE1  MET  57           3HE      MET  57   4.429  -0.335   0.684
  434    HE2  MET  57           1HE      MET  57   3.164  -0.885  -0.417
  435    HE3  MET  57           2HE      MET  57   4.454   0.161  -1.009
  436    HA   PRO  58           HA       PRO  58  -1.167  -5.825  -0.749
  437    HB2  PRO  58           2HB      PRO  58  -1.308  -7.551   1.511
  438    HB3  PRO  58           1HB      PRO  58  -1.228  -8.023  -0.185
  439    HG2  PRO  58           2HG      PRO  58   0.757  -8.478   1.733
  440    HG3  PRO  58           1HG      PRO  58   0.966  -8.590  -0.021
  441    HD2  PRO  58           2HD      PRO  58   1.691  -6.370   1.839
  442    HD3  PRO  58           1HD      PRO  58   2.519  -6.934   0.371
  443    H    GLY  59           H        GLY  59  -2.856  -4.674   0.138
  444    HA2  GLY  59           2HA      GLY  59  -2.907  -4.011   2.964
  445    HA3  GLY  59           1HA      GLY  59  -2.592  -2.640   1.915
  446    H    LEU  60           H        LEU  60  -4.676  -2.201   3.323
  447    HA   LEU  60           HA       LEU  60  -7.097  -3.141   1.939
  448    HB2  LEU  60           2HB      LEU  60  -7.035  -3.363   4.387
  449    HB3  LEU  60           1HB      LEU  60  -6.750  -1.641   4.544
  450    HG   LEU  60           HG       LEU  60  -8.993  -1.223   3.520
  451   HD11  LEU  60          1HD1      LEU  60  -9.261  -3.298   2.290
  452   HD12  LEU  60          2HD1      LEU  60 -10.598  -3.073   3.416
  453   HD13  LEU  60          3HD1      LEU  60  -9.308  -4.214   3.798
  454   HD21  LEU  60          3HD2      LEU  60  -8.660  -1.203   5.956
  455   HD22  LEU  60          1HD2      LEU  60  -9.029  -2.927   6.019
  456   HD23  LEU  60          2HD2      LEU  60 -10.267  -1.774   5.517
  457    H    ASN  61           H        ASN  61  -7.880  -1.878   0.367
  458    HA   ASN  61           HA       ASN  61  -7.160   0.933   0.193
  459    HB2  ASN  61           2HB      ASN  61  -7.099  -0.328  -1.855
  460    HB3  ASN  61           1HB      ASN  61  -8.748  -0.895  -1.620
  461   HD21  ASN  61          1HD2      ASN  61  -6.792   1.932  -2.327
  462   HD22  ASN  61          2HD2      ASN  61  -8.057   2.841  -3.064
  463    H    GLU  62           H        GLU  62  -8.286   2.411   1.293
  464    HA   GLU  62           HA       GLU  62 -10.720   1.888   2.596
  465    HB2  GLU  62           2HB      GLU  62  -9.242   4.452   2.035
  466    HB3  GLU  62           1HB      GLU  62 -10.722   4.408   2.983
  467    HG2  GLU  62           2HG      GLU  62  -8.229   2.855   3.665
  468    HG3  GLU  62           1HG      GLU  62  -8.632   4.435   4.332
  469    H    ARG  63           H        ARG  63 -10.102   3.290  -0.565
  470    HA   ARG  63           HA       ARG  63 -12.583   4.504  -1.055
  471    HB2  ARG  63           2HB      ARG  63 -10.484   4.611  -2.480
  472    HB3  ARG  63           1HB      ARG  63 -10.920   3.034  -3.111
  473    HG2  ARG  63           2HG      ARG  63 -11.739   4.442  -4.735
  474    HG3  ARG  63           1HG      ARG  63 -13.170   4.187  -3.737
  475    HD2  ARG  63           2HD      ARG  63 -11.300   6.555  -3.528
  476    HD3  ARG  63           1HD      ARG  63 -12.840   6.558  -4.384
  477    HE   ARG  63           HE       ARG  63 -13.794   5.970  -2.092
  478   HH11  ARG  63          1HH1      ARG  63 -11.022   7.960  -2.563
  479   HH12  ARG  63          2HH1      ARG  63 -11.265   8.840  -1.098
  480   HH21  ARG  63          1HH2      ARG  63 -14.096   7.116  -0.214
  481   HH22  ARG  63          2HH2      ARG  63 -12.986   8.369   0.212
  482    H    THR  64           H        THR  64 -11.532   1.199  -1.882
  483    HA   THR  64           HA       THR  64 -14.290   0.481  -2.620
  484    HB   THR  64           HB       THR  64 -13.289  -1.512  -3.672
  485    HG1  THR  64           HG1      THR  64 -10.699  -0.484  -3.255
  486   HG21  THR  64          3HG2      THR  64 -11.899   1.060  -4.463
  487   HG22  THR  64          1HG2      THR  64 -13.490   0.532  -5.013
  488   HG23  THR  64          2HG2      THR  64 -12.052  -0.380  -5.469
  489    H    ARG  65           H        ARG  65 -12.247   0.213   0.018
  490    HA   ARG  65           HA       ARG  65 -12.223  -1.008   1.939
  491    HB2  ARG  65           2HB      ARG  65 -14.885  -2.108   0.998
  492    HB3  ARG  65           1HB      ARG  65 -14.243  -2.214   2.629
  493    HG2  ARG  65           2HG      ARG  65 -15.107   0.286   1.184
  494    HG3  ARG  65           1HG      ARG  65 -15.926  -0.502   2.534
  495    HD2  ARG  65           2HD      ARG  65 -13.245   0.885   2.569
  496    HD3  ARG  65           1HD      ARG  65 -14.726   1.408   3.366
  497    HE   ARG  65           HE       ARG  65 -14.134  -1.097   4.376
  498   HH11  ARG  65          1HH1      ARG  65 -12.816   2.066   4.386
  499   HH12  ARG  65          2HH1      ARG  65 -11.844   1.793   5.788
  500   HH21  ARG  65          1HH2      ARG  65 -12.926  -1.441   6.212
  501   HH22  ARG  65          2HH2      ARG  65 -11.923  -0.168   6.822
  502    H    GLN  66           H        GLN  66 -11.453  -2.184  -0.840
  503    HA   GLN  66           HA       GLN  66 -11.669  -5.053  -0.274
  504    HB2  GLN  66           2HB      GLN  66 -10.721  -3.629  -2.769
  505    HB3  GLN  66           1HB      GLN  66 -10.883  -5.371  -2.594
  506    HG2  GLN  66           2HG      GLN  66 -13.098  -3.325  -2.562
  507    HG3  GLN  66           1HG      GLN  66 -12.770  -4.526  -3.807
  508   HE21  GLN  66          1HE2      GLN  66 -14.116  -3.952  -0.672
  509   HE22  GLN  66          2HE2      GLN  66 -14.844  -5.505  -0.475
  510    H    ARG  67           H        ARG  67  -9.751  -6.407  -0.897
  511    HA   ARG  67           HA       ARG  67  -7.283  -5.254   0.256
  512    HB2  ARG  67           2HB      ARG  67  -8.424  -8.051   0.451
  513    HB3  ARG  67           1HB      ARG  67  -6.822  -7.604   1.024
  514    HG2  ARG  67           2HG      ARG  67  -7.659  -6.337   2.778
  515    HG3  ARG  67           1HG      ARG  67  -9.242  -6.149   2.023
  516    HD2  ARG  67           2HD      ARG  67  -9.174  -7.710   3.986
  517    HD3  ARG  67           1HD      ARG  67  -9.838  -8.398   2.507
  518    HE   ARG  67           HE       ARG  67  -7.251  -9.146   2.391
  519   HH11  ARG  67          1HH1      ARG  67  -9.618  -9.378   4.882
  520   HH12  ARG  67          2HH1      ARG  67  -8.970 -10.850   5.516
  521   HH21  ARG  67          1HH2      ARG  67  -6.442 -11.069   3.203
  522   HH22  ARG  67          2HH2      ARG  67  -7.202 -11.794   4.576
  523    H    GLY  68           H        GLY  68  -5.291  -5.817  -0.681
  524    HA2  GLY  68           2HA      GLY  68  -4.726  -7.864  -2.438
  525    HA3  GLY  68           1HA      GLY  68  -5.331  -6.563  -3.453
  526    H    ASP  69           H        ASP  69  -2.937  -7.185  -4.146
  527    HA   ASP  69           HA       ASP  69  -0.917  -5.727  -2.638
  528    HB2  ASP  69           2HB      ASP  69  -0.647  -7.135  -5.307
  529    HB3  ASP  69           1HB      ASP  69   0.659  -6.642  -4.229
  530    H    PHE  70           H        PHE  70   0.042  -3.814  -3.250
  531    HA   PHE  70           HA       PHE  70  -0.843  -2.558  -5.758
  532    HB2  PHE  70           2HB      PHE  70  -1.154  -0.406  -4.597
  533    HB3  PHE  70           1HB      PHE  70  -2.251  -1.641  -3.990
  534    HD1  PHE  70           HD1      PHE  70  -2.009  -2.524  -1.739
  535    HD2  PHE  70           HD2      PHE  70   0.634   0.476  -3.212
  536    HE1  PHE  70           HE1      PHE  70  -1.248  -2.072   0.555
  537    HE2  PHE  70           HE2      PHE  70   1.396   0.930  -0.919
  538    HZ   PHE  70           HZ       PHE  70   0.457  -0.342   0.968
  539    HA   PRO  71           HA       PRO  71   3.467  -1.503  -6.262
  540    HB2  PRO  71           2HB      PRO  71   2.583   0.867  -7.789
  541    HB3  PRO  71           1HB      PRO  71   3.518  -0.530  -8.329
  542    HG2  PRO  71           2HG      PRO  71   0.971  -0.157  -9.100
  543    HG3  PRO  71           1HG      PRO  71   1.628  -1.780  -8.804
  544    HD2  PRO  71           2HD      PRO  71  -0.105  -0.085  -7.028
  545    HD3  PRO  71           1HD      PRO  71  -0.216  -1.824  -7.377
  546    H    GLY  72           H        GLY  72   4.436  -0.730  -4.456
  547    HA2  GLY  72           2HA      GLY  72   3.586   1.450  -2.901
  548    HA3  GLY  72           1HA      GLY  72   5.171   0.706  -2.829
  549    H    THR  73           H        THR  73   5.159   1.552  -5.903
  550    HA   THR  73           HA       THR  73   6.670   3.960  -5.499
  551    HB   THR  73           HB       THR  73   6.888   3.995  -7.974
  552    HG1  THR  73           HG1      THR  73   5.976   2.128  -9.089
  553   HG21  THR  73          3HG2      THR  73   7.369   1.273  -6.740
  554   HG22  THR  73          1HG2      THR  73   8.456   2.659  -6.632
  555   HG23  THR  73          2HG2      THR  73   8.145   1.899  -8.194
  556    H    TYR  74           H        TYR  74   3.349   3.269  -6.195
  557    HA   TYR  74           HA       TYR  74   2.864   6.042  -7.061
  558    HB2  TYR  74           2HB      TYR  74   1.317   3.492  -7.375
  559    HB3  TYR  74           1HB      TYR  74   0.461   5.029  -7.434
  560    HD1  TYR  74           HD2      TYR  74   0.931   6.651  -9.219
  561    HD2  TYR  74           HD1      TYR  74   2.763   2.804  -9.198
  562    HE1  TYR  74           HE2      TYR  74   1.539   6.936 -11.580
  563    HE2  TYR  74           HE1      TYR  74   3.380   3.087 -11.564
  564    HH   TYR  74           HH       TYR  74   3.215   6.076 -13.159
  565    H    VAL  75           H        VAL  75   3.192   4.763  -4.185
  566    HA   VAL  75           HA       VAL  75   1.018   6.393  -3.037
  567    HB   VAL  75           HB       VAL  75   0.791   4.859  -1.147
  568   HG11  VAL  75          1HG1      VAL  75   0.462   3.468  -3.811
  569   HG12  VAL  75          2HG1      VAL  75  -0.707   4.535  -3.034
  570   HG13  VAL  75          3HG1      VAL  75  -0.310   2.980  -2.301
  571   HG21  VAL  75          3HG2      VAL  75   3.062   3.947  -1.125
  572   HG22  VAL  75          1HG2      VAL  75   2.734   3.070  -2.620
  573   HG23  VAL  75          2HG2      VAL  75   1.861   2.656  -1.143
  574    H    GLU  76           H        GLU  76   1.496   7.480  -1.087
  575    HA   GLU  76           HA       GLU  76   4.366   7.584  -0.378
  576    HB2  GLU  76           2HB      GLU  76   3.987   9.949   0.290
  577    HB3  GLU  76           1HB      GLU  76   3.734   9.663  -1.425
  578    HG2  GLU  76           2HG      GLU  76   1.331   9.672  -1.111
  579    HG3  GLU  76           1HG      GLU  76   1.537   9.856   0.630
  580    H    PHE  77           H        PHE  77   4.940   7.690   1.787
  581    HA   PHE  77           HA       PHE  77   3.134   6.448   3.626
  582    HB2  PHE  77           2HB      PHE  77   5.522   5.948   3.690
  583    HB3  PHE  77           1HB      PHE  77   5.893   7.632   4.044
  584    HD1  PHE  77           HD2      PHE  77   4.202   4.615   5.396
  585    HD2  PHE  77           HD1      PHE  77   5.927   8.414   6.267
  586    HE1  PHE  77           HE2      PHE  77   4.051   4.135   7.802
  587    HE2  PHE  77           HE1      PHE  77   5.783   7.930   8.673
  588    HZ   PHE  77           HZ       PHE  77   4.842   5.789   9.442
  589    H    LEU  78           H        LEU  78   1.599   7.464   4.741
  590    HA   LEU  78           HA       LEU  78   1.713  10.339   5.200
  591    HB2  LEU  78           2HB      LEU  78  -0.406   8.304   5.929
  592    HB3  LEU  78           1HB      LEU  78  -0.572  10.044   6.083
  593    HG   LEU  78           HG       LEU  78  -0.204   8.560   3.472
  594   HD11  LEU  78          1HD1      LEU  78  -2.670   9.823   4.668
  595   HD12  LEU  78          2HD1      LEU  78  -2.375   8.095   4.477
  596   HD13  LEU  78          3HD1      LEU  78  -2.546   9.122   3.055
  597   HD21  LEU  78          3HD2      LEU  78   0.726  10.822   3.413
  598   HD22  LEU  78          1HD2      LEU  78  -0.798  11.474   4.018
  599   HD23  LEU  78          2HD2      LEU  78  -0.732  10.710   2.429
  600    H    GLY  79           H        GLY  79   1.150   7.462   7.254
  601    HA2  GLY  79           2HA      GLY  79   2.998   8.005   9.239
  602    HA3  GLY  79           1HA      GLY  79   1.552   8.888   9.699
  603    HA   PRO  80           HA       PRO  80   1.086   4.524  11.274
  604    HB2  PRO  80           2HB      PRO  80   1.031   5.024  13.907
  605    HB3  PRO  80           1HB      PRO  80   2.559   4.926  13.020
  606    HG2  PRO  80           2HG      PRO  80   1.028   7.356  13.888
  607    HG3  PRO  80           1HG      PRO  80   2.771   7.042  13.976
  608    HD2  PRO  80           2HD      PRO  80   1.575   8.526  11.991
  609    HD3  PRO  80           1HD      PRO  80   3.115   7.665  11.795
  610    H    LEU  81           H        LEU  81  -0.632   3.809  13.060
  611    HA   LEU  81           HA       LEU  81  -3.173   4.956  12.228
  612    HB2  LEU  81           2HB      LEU  81  -2.531   2.583  13.988
  613    HB3  LEU  81           1HB      LEU  81  -4.146   3.041  13.478
  614    HG   LEU  81           HG       LEU  81  -1.914   2.183  11.622
  615   HD11  LEU  81          1HD1      LEU  81  -4.364   0.684  12.556
  616   HD12  LEU  81          2HD1      LEU  81  -2.692   0.331  12.999
  617   HD13  LEU  81          3HD1      LEU  81  -3.223   0.133  11.328
  618   HD21  LEU  81          3HD2      LEU  81  -3.677   2.101   9.912
  619   HD22  LEU  81          1HD2      LEU  81  -3.449   3.732  10.543
  620   HD23  LEU  81          2HD2      LEU  81  -4.827   2.767  11.072
  621    H    GLU  82           H        GLU  82  -4.065   6.597  13.329
  622    HA   GLU  82           HA       GLU  82  -3.275   7.223  16.037
  623    HB2  GLU  82           2HB      GLU  82  -5.272   8.505  14.162
  624    HB3  GLU  82           1HB      GLU  82  -4.922   9.115  15.774
  625    HG2  GLU  82           2HG      GLU  82  -2.895   8.823  13.558
  626    HG3  GLU  82           1HG      GLU  82  -3.718  10.322  13.991
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1   1.151  -1.098  26.040
    2    H2   MET   1           2H       MET   1   2.269  -1.412  24.812
    3    H3   MET   1           3H       MET   1   2.266  -2.360  26.211
    4    HA   MET   1           HA       MET   1   1.278  -3.512  24.333
    5    HB2  MET   1           2HB      MET   1  -0.501  -2.819  26.674
    6    HB3  MET   1           1HB      MET   1  -0.919  -4.063  25.502
    7    HG2  MET   1           2HG      MET   1   0.120  -4.952  27.555
    8    HG3  MET   1           1HG      MET   1   1.013  -5.356  26.090
    9    HE1  MET   1           3HE      MET   1   2.302  -5.673  28.983
   10    HE2  MET   1           1HE      MET   1   3.907  -5.011  28.672
   11    HE3  MET   1           2HE      MET   1   3.127  -6.038  27.467
   12    H    ALA   2           H        ALA   2   0.687  -2.868  22.361
   13    HA   ALA   2           HA       ALA   2  -1.843  -1.385  22.093
   14    HB1  ALA   2           3HB      ALA   2  -0.945  -0.039  20.278
   15    HB2  ALA   2           1HB      ALA   2   0.631  -0.812  20.456
   16    HB3  ALA   2           2HB      ALA   2  -0.001   0.211  21.746
   17    H    GLY   3           H        GLY   3   0.591  -2.747  19.846
   18    HA2  GLY   3           2HA      GLY   3  -0.036  -5.091  19.054
   19    HA3  GLY   3           1HA      GLY   3  -1.578  -4.361  18.642
   20    HA   PRO   4           HA       PRO   4   1.078  -3.740  14.916
   21    HB2  PRO   4           2HB      PRO   4   0.562  -5.900  13.461
   22    HB3  PRO   4           1HB      PRO   4   1.644  -6.004  14.856
   23    HG2  PRO   4           2HG      PRO   4  -1.158  -6.967  14.565
   24    HG3  PRO   4           1HG      PRO   4   0.155  -7.616  15.563
   25    HD2  PRO   4           2HD      PRO   4  -1.958  -5.836  16.367
   26    HD3  PRO   4           1HD      PRO   4  -0.619  -6.453  17.359
   27    H    GLU   5           H        GLU   5  -1.595  -2.609  15.454
   28    HA   GLU   5           HA       GLU   5  -3.485  -3.296  13.499
   29    HB2  GLU   5           2HB      GLU   5  -4.532  -1.091  13.884
   30    HB3  GLU   5           1HB      GLU   5  -4.178  -1.946  15.374
   31    HG2  GLU   5           2HG      GLU   5  -2.287   0.125  14.312
   32    HG3  GLU   5           1HG      GLU   5  -3.721   0.589  15.223
   33    H    GLY   6           H        GLY   6  -0.736  -1.077  13.282
   34    HA2  GLY   6           2HA      GLY   6   0.449  -1.218  11.160
   35    HA3  GLY   6           1HA      GLY   6  -1.100  -1.254  10.351
   36    H    PHE   7           H        PHE   7  -0.159   0.350   8.999
   37    HA   PHE   7           HA       PHE   7  -0.229   3.083  10.124
   38    HB2  PHE   7           2HB      PHE   7   1.603   2.120   7.905
   39    HB3  PHE   7           1HB      PHE   7   1.593   3.717   8.641
   40    HD1  PHE   7           HD2      PHE   7   2.549   0.201   9.089
   41    HD2  PHE   7           HD1      PHE   7   2.615   4.101  10.801
   42    HE1  PHE   7           HE2      PHE   7   4.226  -0.548  10.725
   43    HE2  PHE   7           HE1      PHE   7   4.290   3.354  12.440
   44    HZ   PHE   7           HZ       PHE   7   5.098   1.027  12.404
   45    H    GLN   8           H        GLN   8  -0.293   4.700   8.081
   46    HA   GLN   8           HA       GLN   8  -2.246   3.632   6.138
   47    HB2  GLN   8           2HB      GLN   8  -2.304   6.337   7.492
   48    HB3  GLN   8           1HB      GLN   8  -3.313   5.905   6.115
   49    HG2  GLN   8           2HG      GLN   8  -4.240   4.024   7.494
   50    HG3  GLN   8           1HG      GLN   8  -3.361   4.688   8.871
   51   HE21  GLN   8          1HE2      GLN   8  -6.234   4.352   8.461
   52   HE22  GLN   8          2HE2      GLN   8  -6.929   5.920   8.645
   53    H    TYR   9           H        TYR   9  -1.962   4.092   4.055
   54    HA   TYR   9           HA       TYR   9   0.158   5.999   3.271
   55    HB2  TYR   9           2HB      TYR   9  -0.678   3.436   1.878
   56    HB3  TYR   9           1HB      TYR   9   0.513   4.575   1.268
   57    HD1  TYR   9           HD1      TYR   9  -0.193   2.204   4.043
   58    HD2  TYR   9           HD2      TYR   9   2.775   4.444   1.961
   59    HE1  TYR   9           HE1      TYR   9   1.566   0.985   5.247
   60    HE2  TYR   9           HE2      TYR   9   4.542   3.226   3.166
   61    HH   TYR   9           HH       TYR   9   4.828   1.953   5.252
   62    H    ARG  10           H        ARG  10  -0.225   7.177   1.264
   63    HA   ARG  10           HA       ARG  10  -3.076   7.249   0.472
   64    HB2  ARG  10           2HB      ARG  10  -2.533   9.222   1.800
   65    HB3  ARG  10           1HB      ARG  10  -1.182   9.595   0.738
   66    HG2  ARG  10           2HG      ARG  10  -2.665  10.091  -1.087
   67    HG3  ARG  10           1HG      ARG  10  -4.060   9.517  -0.172
   68    HD2  ARG  10           2HD      ARG  10  -3.949  11.965  -0.202
   69    HD3  ARG  10           1HD      ARG  10  -3.778  11.328   1.433
   70    HE   ARG  10           HE       ARG  10  -1.299  11.888   0.034
   71   HH11  ARG  10          1HH1      ARG  10  -3.699  13.052   2.229
   72   HH12  ARG  10          2HH1      ARG  10  -2.634  14.216   2.929
   73   HH21  ARG  10          1HH2      ARG  10   0.024  13.410   0.923
   74   HH22  ARG  10          2HH2      ARG  10  -0.560  14.420   2.200
   75    H    ALA  11           H        ALA  11  -3.426   6.773  -1.591
   76    HA   ALA  11           HA       ALA  11  -1.287   6.461  -3.470
   77    HB1  ALA  11           3HB      ALA  11  -3.229   4.969  -3.458
   78    HB2  ALA  11           1HB      ALA  11  -3.020   5.746  -5.028
   79    HB3  ALA  11           2HB      ALA  11  -4.270   6.316  -3.921
   80    H    LEU  12           H        LEU  12  -0.461   7.930  -4.806
   81    HA   LEU  12           HA       LEU  12  -1.566  10.602  -4.897
   82    HB2  LEU  12           2HB      LEU  12   0.852   9.488  -6.333
   83    HB3  LEU  12           1HB      LEU  12   0.463  11.185  -6.100
   84    HG   LEU  12           HG       LEU  12   1.242   9.208  -3.942
   85   HD11  LEU  12          1HD1      LEU  12   3.222  10.623  -3.691
   86   HD12  LEU  12          2HD1      LEU  12   2.685  11.621  -5.045
   87   HD13  LEU  12          3HD1      LEU  12   3.121   9.930  -5.309
   88   HD21  LEU  12          3HD2      LEU  12  -0.408  10.754  -3.063
   89   HD22  LEU  12          1HD2      LEU  12   0.494  12.125  -3.710
   90   HD23  LEU  12          2HD2      LEU  12   1.186  11.143  -2.419
   91    H    TYR  13           H        TYR  13  -0.855   8.062  -7.299
   92    HA   TYR  13           HA       TYR  13  -2.726   9.385  -9.156
   93    HB2  TYR  13           2HB      TYR  13  -0.044   8.150  -9.843
   94    HB3  TYR  13           1HB      TYR  13  -1.237   8.657 -11.038
   95    HD1  TYR  13           HD1      TYR  13  -1.931  11.113 -11.077
   96    HD2  TYR  13           HD2      TYR  13   1.480   9.719  -8.940
   97    HE1  TYR  13           HE1      TYR  13  -1.050  13.406 -11.002
   98    HE2  TYR  13           HE2      TYR  13   2.369  12.012  -8.857
   99    HH   TYR  13           HH       TYR  13   0.499  14.726  -9.560
  100    HA   PRO  14           HA       PRO  14  -4.770   5.521  -9.487
  101    HB2  PRO  14           2HB      PRO  14  -5.662   5.525 -12.068
  102    HB3  PRO  14           1HB      PRO  14  -6.367   6.519 -10.786
  103    HG2  PRO  14           2HG      PRO  14  -4.387   7.279 -12.907
  104    HG3  PRO  14           1HG      PRO  14  -5.788   8.185 -12.311
  105    HD2  PRO  14           2HD      PRO  14  -3.248   8.731 -11.523
  106    HD3  PRO  14           1HD      PRO  14  -4.648   8.972 -10.459
  107    H    PHE  15           H        PHE  15  -4.102   3.512  -9.651
  108    HA   PHE  15           HA       PHE  15  -2.212   2.725 -11.775
  109    HB2  PHE  15           2HB      PHE  15  -1.156   2.388  -9.675
  110    HB3  PHE  15           1HB      PHE  15  -2.616   1.723  -8.953
  111    HD1  PHE  15           HD1      PHE  15   0.105   1.033 -11.369
  112    HD2  PHE  15           HD2      PHE  15  -3.081  -0.593  -9.053
  113    HE1  PHE  15           HE1      PHE  15   0.889  -1.243 -11.884
  114    HE2  PHE  15           HE2      PHE  15  -2.299  -2.866  -9.565
  115    HZ   PHE  15           HZ       PHE  15  -0.312  -3.195 -10.982
  116    H    ARG  16           H        ARG  16  -2.870   1.232 -13.237
  117    HA   ARG  16           HA       ARG  16  -5.370  -0.234 -12.697
  118    HB2  ARG  16           2HB      ARG  16  -5.422  -0.545 -15.230
  119    HB3  ARG  16           1HB      ARG  16  -5.725   1.069 -14.615
  120    HG2  ARG  16           2HG      ARG  16  -4.332   1.467 -16.411
  121    HG3  ARG  16           1HG      ARG  16  -3.213   1.479 -15.052
  122    HD2  ARG  16           2HD      ARG  16  -2.728  -0.944 -15.581
  123    HD3  ARG  16           1HD      ARG  16  -3.658  -0.726 -17.064
  124    HE   ARG  16           HE       ARG  16  -1.656   1.266 -16.823
  125   HH11  ARG  16          1HH1      ARG  16  -2.123  -2.036 -17.688
  126   HH12  ARG  16          2HH1      ARG  16  -0.653  -2.118 -18.591
  127   HH21  ARG  16          1HH2      ARG  16   0.211   1.156 -18.002
  128   HH22  ARG  16          2HH2      ARG  16   0.637  -0.322 -18.794
  129    H    ARG  17           H        ARG  17  -5.489  -2.420 -12.838
  130    HA   ARG  17           HA       ARG  17  -2.959  -3.880 -13.324
  131    HB2  ARG  17           2HB      ARG  17  -3.724  -3.912 -10.965
  132    HB3  ARG  17           1HB      ARG  17  -5.235  -4.644 -11.476
  133    HG2  ARG  17           2HG      ARG  17  -3.867  -6.368 -10.611
  134    HG3  ARG  17           1HG      ARG  17  -3.917  -6.573 -12.353
  135    HD2  ARG  17           2HD      ARG  17  -1.717  -5.680 -12.607
  136    HD3  ARG  17           1HD      ARG  17  -1.667  -5.169 -10.916
  137    HE   ARG  17           HE       ARG  17  -2.101  -7.889 -10.872
  138   HH11  ARG  17          1HH1      ARG  17   0.375  -5.817 -12.093
  139   HH12  ARG  17          2HH1      ARG  17   1.621  -6.978 -11.808
  140   HH21  ARG  17          1HH2      ARG  17  -0.513  -9.342 -10.492
  141   HH22  ARG  17          2HH2      ARG  17   1.121  -8.972 -10.914
  142    H    GLU  18           H        GLU  18  -2.989  -5.694 -14.623
  143    HA   GLU  18           HA       GLU  18  -5.154  -6.008 -16.470
  144    HB2  GLU  18           2HB      GLU  18  -3.768  -7.776 -17.466
  145    HB3  GLU  18           1HB      GLU  18  -2.830  -6.319 -17.163
  146    HG2  GLU  18           2HG      GLU  18  -1.935  -7.353 -15.106
  147    HG3  GLU  18           1HG      GLU  18  -2.829  -8.825 -15.481
  148    H    ARG  19           H        ARG  19  -5.215  -6.894 -13.422
  149    HA   ARG  19           HA       ARG  19  -6.925  -9.214 -13.854
  150    HB2  ARG  19           2HB      ARG  19  -4.522  -9.187 -12.010
  151    HB3  ARG  19           1HB      ARG  19  -5.844 -10.331 -11.827
  152    HG2  ARG  19           2HG      ARG  19  -5.383 -11.186 -14.101
  153    HG3  ARG  19           1HG      ARG  19  -4.009 -10.081 -14.210
  154    HD2  ARG  19           2HD      ARG  19  -2.870 -11.183 -12.439
  155    HD3  ARG  19           1HD      ARG  19  -4.301 -12.116 -12.004
  156    HE   ARG  19           HE       ARG  19  -2.724 -12.518 -14.463
  157   HH11  ARG  19          1HH1      ARG  19  -4.763 -13.704 -11.951
  158   HH12  ARG  19          2HH1      ARG  19  -4.715 -15.329 -12.536
  159   HH21  ARG  19          1HH2      ARG  19  -2.662 -14.623 -15.192
  160   HH22  ARG  19          2HH2      ARG  19  -3.544 -15.842 -14.344
  161    HA   PRO  20           HA       PRO  20  -9.229  -7.044 -10.651
  162    HB2  PRO  20           2HB      PRO  20 -11.107  -8.904 -10.110
  163    HB3  PRO  20           1HB      PRO  20 -11.091  -8.009 -11.635
  164    HG2  PRO  20           2HG      PRO  20 -10.102 -10.783 -11.055
  165    HG3  PRO  20           1HG      PRO  20 -11.043 -10.199 -12.439
  166    HD2  PRO  20           2HD      PRO  20  -8.333 -10.595 -12.513
  167    HD3  PRO  20           1HD      PRO  20  -9.179  -9.414 -13.534
  168    H    GLU  21           H        GLU  21  -7.275  -9.721 -10.143
  169    HA   GLU  21           HA       GLU  21  -7.956 -10.421  -7.462
  170    HB2  GLU  21           2HB      GLU  21  -5.412 -10.873  -9.038
  171    HB3  GLU  21           1HB      GLU  21  -5.796 -11.639  -7.503
  172    HG2  GLU  21           2HG      GLU  21  -7.073 -13.194  -8.474
  173    HG3  GLU  21           1HG      GLU  21  -7.891 -12.014  -9.494
  174    H    ASP  22           H        ASP  22  -5.236  -8.546  -8.830
  175    HA   ASP  22           HA       ASP  22  -4.123  -7.914  -6.282
  176    HB2  ASP  22           2HB      ASP  22  -3.612  -6.496  -8.905
  177    HB3  ASP  22           1HB      ASP  22  -2.550  -6.563  -7.504
  178    H    LEU  23           H        LEU  23  -3.654  -5.514  -5.729
  179    HA   LEU  23           HA       LEU  23  -6.283  -4.203  -5.605
  180    HB2  LEU  23           2HB      LEU  23  -5.204  -4.814  -3.477
  181    HB3  LEU  23           1HB      LEU  23  -3.831  -3.802  -3.885
  182    HG   LEU  23           HG       LEU  23  -5.251  -1.802  -3.793
  183   HD11  LEU  23          1HD1      LEU  23  -7.564  -1.968  -2.959
  184   HD12  LEU  23          2HD1      LEU  23  -7.459  -3.727  -3.052
  185   HD13  LEU  23          3HD1      LEU  23  -7.358  -2.757  -4.523
  186   HD21  LEU  23          3HD2      LEU  23  -5.676  -1.789  -1.381
  187   HD22  LEU  23          1HD2      LEU  23  -4.125  -2.543  -1.751
  188   HD23  LEU  23          2HD2      LEU  23  -5.516  -3.545  -1.336
  189    H    GLU  24           H        GLU  24  -6.647  -2.490  -6.821
  190    HA   GLU  24           HA       GLU  24  -4.433  -1.088  -8.100
  191    HB2  GLU  24           2HB      GLU  24  -7.426  -0.949  -8.518
  192    HB3  GLU  24           1HB      GLU  24  -6.256   0.001  -9.428
  193    HG2  GLU  24           2HG      GLU  24  -5.266  -1.981 -10.355
  194    HG3  GLU  24           1HG      GLU  24  -6.262  -3.012  -9.328
  195    H    LEU  25           H        LEU  25  -4.653   1.343  -8.346
  196    HA   LEU  25           HA       LEU  25  -5.307   2.527  -5.712
  197    HB2  LEU  25           2HB      LEU  25  -2.936   3.164  -7.481
  198    HB3  LEU  25           1HB      LEU  25  -3.307   3.938  -5.951
  199    HG   LEU  25           HG       LEU  25  -2.623   1.012  -6.292
  200   HD11  LEU  25          1HD1      LEU  25  -0.944   3.289  -5.248
  201   HD12  LEU  25          2HD1      LEU  25  -0.688   2.399  -6.748
  202   HD13  LEU  25          3HD1      LEU  25  -0.503   1.581  -5.197
  203   HD21  LEU  25          3HD2      LEU  25  -2.455   1.003  -3.842
  204   HD22  LEU  25          1HD2      LEU  25  -4.087   1.388  -4.390
  205   HD23  LEU  25          2HD2      LEU  25  -3.029   2.672  -3.802
  206    H    LEU  26           H        LEU  26  -6.097   4.642  -5.671
  207    HA   LEU  26           HA       LEU  26  -6.678   5.910  -8.278
  208    HB2  LEU  26           2HB      LEU  26  -8.417   5.630  -5.836
  209    HB3  LEU  26           1HB      LEU  26  -8.693   6.918  -6.991
  210    HG   LEU  26           HG       LEU  26 -10.221   5.135  -7.476
  211   HD11  LEU  26          1HD1      LEU  26  -9.636   4.600  -9.790
  212   HD12  LEU  26          2HD1      LEU  26  -7.983   5.140  -9.498
  213   HD13  LEU  26          3HD1      LEU  26  -9.316   6.291  -9.407
  214   HD21  LEU  26          3HD2      LEU  26  -9.538   2.869  -7.997
  215   HD22  LEU  26          1HD2      LEU  26  -8.989   3.307  -6.380
  216   HD23  LEU  26          2HD2      LEU  26  -7.848   3.288  -7.725
  217    HA   PRO  27           HA       PRO  27  -4.650   9.563  -6.813
  218    HB2  PRO  27           2HB      PRO  27  -6.176  11.572  -7.869
  219    HB3  PRO  27           1HB      PRO  27  -5.074  10.579  -8.832
  220    HG2  PRO  27           2HG      PRO  27  -8.043  10.316  -8.485
  221    HG3  PRO  27           1HG      PRO  27  -7.077  10.199  -9.967
  222    HD2  PRO  27           2HD      PRO  27  -7.966   8.008  -8.668
  223    HD3  PRO  27           1HD      PRO  27  -6.401   8.031  -9.508
  224    H    GLY  28           H        GLY  28  -4.674  10.140  -4.706
  225    HA2  GLY  28           2HA      GLY  28  -5.386  11.244  -2.784
  226    HA3  GLY  28           1HA      GLY  28  -6.906  11.614  -3.587
  227    H    ASP  29           H        ASP  29  -5.667   8.355  -3.424
  228    HA   ASP  29           HA       ASP  29  -7.993   7.533  -1.850
  229    HB2  ASP  29           2HB      ASP  29  -7.086   6.444  -4.069
  230    HB3  ASP  29           1HB      ASP  29  -5.952   5.638  -2.994
  231    H    VAL  30           H        VAL  30  -7.723   6.020  -0.037
  232    HA   VAL  30           HA       VAL  30  -5.146   6.348   1.383
  233    HB   VAL  30           HB       VAL  30  -7.904   6.259   2.645
  234   HG11  VAL  30          1HG1      VAL  30  -6.183   5.227   4.053
  235   HG12  VAL  30          2HG1      VAL  30  -6.753   6.743   4.748
  236   HG13  VAL  30          3HG1      VAL  30  -5.195   6.682   3.923
  237   HG21  VAL  30          3HG2      VAL  30  -7.471   8.605   3.269
  238   HG22  VAL  30          1HG2      VAL  30  -7.534   8.383   1.521
  239   HG23  VAL  30          2HG2      VAL  30  -5.978   8.570   2.330
  240    H    LEU  31           H        LEU  31  -4.221   4.509   2.142
  241    HA   LEU  31           HA       LEU  31  -5.839   2.042   2.188
  242    HB2  LEU  31           2HB      LEU  31  -3.002   2.316   1.176
  243    HB3  LEU  31           1HB      LEU  31  -3.829   0.791   1.422
  244    HG   LEU  31           HG       LEU  31  -5.586   1.755  -0.255
  245   HD11  LEU  31          1HD1      LEU  31  -3.182   3.438  -0.965
  246   HD12  LEU  31          2HD1      LEU  31  -4.720   4.030  -0.338
  247   HD13  LEU  31          3HD1      LEU  31  -4.652   3.271  -1.926
  248   HD21  LEU  31          3HD2      LEU  31  -4.349   0.811  -2.126
  249   HD22  LEU  31          1HD2      LEU  31  -4.163  -0.184  -0.683
  250   HD23  LEU  31          2HD2      LEU  31  -2.854   0.882  -1.194
  251    H    VAL  32           H        VAL  32  -5.848   1.059   4.090
  252    HA   VAL  32           HA       VAL  32  -3.847   1.767   6.115
  253    HB   VAL  32           HB       VAL  32  -6.370   0.113   6.420
  254   HG11  VAL  32          1HG1      VAL  32  -4.728  -0.404   8.137
  255   HG12  VAL  32          2HG1      VAL  32  -6.060   0.518   8.835
  256   HG13  VAL  32          3HG1      VAL  32  -4.521   1.312   8.493
  257   HG21  VAL  32          3HG2      VAL  32  -6.865   2.430   5.766
  258   HG22  VAL  32          1HG2      VAL  32  -5.885   3.018   7.112
  259   HG23  VAL  32          2HG2      VAL  32  -7.361   2.105   7.427
  260    H    VAL  33           H        VAL  33  -2.134   0.496   6.431
  261    HA   VAL  33           HA       VAL  33  -2.287  -2.335   5.587
  262    HB   VAL  33           HB       VAL  33   0.154  -0.543   5.630
  263   HG11  VAL  33          1HG1      VAL  33   0.712  -2.879   6.112
  264   HG12  VAL  33          2HG1      VAL  33   1.310  -2.397   4.525
  265   HG13  VAL  33          3HG1      VAL  33  -0.142  -3.390   4.654
  266   HG21  VAL  33          3HG2      VAL  33  -1.382   0.061   3.830
  267   HG22  VAL  33          1HG2      VAL  33  -1.436  -1.618   3.292
  268   HG23  VAL  33          2HG2      VAL  33   0.068  -0.703   3.177
  269    H    SER  34           H        SER  34  -2.667  -3.449   7.441
  270    HA   SER  34           HA       SER  34  -1.574  -2.926   9.978
  271    HB2  SER  34           2HB      SER  34  -2.474  -5.567   8.786
  272    HB3  SER  34           1HB      SER  34  -2.133  -5.302  10.494
  273    HG   SER  34           HG       SER  34  -3.778  -3.561  10.313
  274    H    ARG  35           H        ARG  35   0.475  -3.107  10.719
  275    HA   ARG  35           HA       ARG  35   2.530  -3.619   8.860
  276    HB2  ARG  35           2HB      ARG  35   4.082  -3.068  10.578
  277    HB3  ARG  35           1HB      ARG  35   2.682  -2.028  10.774
  278    HG2  ARG  35           2HG      ARG  35   1.878  -3.489  12.589
  279    HG3  ARG  35           1HG      ARG  35   3.339  -4.466  12.416
  280    HD2  ARG  35           2HD      ARG  35   3.124  -1.585  13.286
  281    HD3  ARG  35           1HD      ARG  35   3.713  -2.958  14.224
  282    HE   ARG  35           HE       ARG  35   5.158  -2.006  11.833
  283   HH11  ARG  35          1HH1      ARG  35   5.116  -2.829  15.181
  284   HH12  ARG  35          2HH1      ARG  35   6.814  -2.581  15.370
  285   HH21  ARG  35          1HH2      ARG  35   7.324  -1.669  12.091
  286   HH22  ARG  35          2HH2      ARG  35   8.055  -1.937  13.639
  287    H    ALA  36           H        ALA  36   0.839  -5.827  10.853
  288    HA   ALA  36           HA       ALA  36   2.688  -7.900  11.148
  289    HB1  ALA  36           3HB      ALA  36  -0.255  -8.121  10.487
  290    HB2  ALA  36           1HB      ALA  36   0.435  -7.969  12.104
  291    HB3  ALA  36           2HB      ALA  36   0.757  -9.411  11.140
  292    H    ALA  37           H        ALA  37   0.794  -6.901   8.341
  293    HA   ALA  37           HA       ALA  37   1.621  -8.965   6.575
  294    HB1  ALA  37           3HB      ALA  37   0.730  -7.566   4.812
  295    HB2  ALA  37           1HB      ALA  37   0.707  -6.168   5.888
  296    HB3  ALA  37           2HB      ALA  37  -0.360  -7.538   6.196
  297    H    LEU  38           H        LEU  38   2.965  -5.779   7.371
  298    HA   LEU  38           HA       LEU  38   5.042  -5.742   5.464
  299    HB2  LEU  38           2HB      LEU  38   4.975  -4.531   8.236
  300    HB3  LEU  38           1HB      LEU  38   6.172  -4.156   7.009
  301    HG   LEU  38           HG       LEU  38   3.207  -3.566   6.832
  302   HD11  LEU  38          1HD1      LEU  38   5.568  -1.713   7.160
  303   HD12  LEU  38          2HD1      LEU  38   4.378  -2.107   8.402
  304   HD13  LEU  38          3HD1      LEU  38   3.885  -1.224   6.957
  305   HD21  LEU  38          3HD2      LEU  38   5.429  -2.925   4.889
  306   HD22  LEU  38          1HD2      LEU  38   3.758  -2.377   4.763
  307   HD23  LEU  38          2HD2      LEU  38   4.133  -4.094   4.634
  308    H    GLN  39           H        GLN  39   4.805  -7.215   8.671
  309    HA   GLN  39           HA       GLN  39   7.442  -8.206   8.857
  310    HB2  GLN  39           2HB      GLN  39   4.858  -9.332   9.966
  311    HB3  GLN  39           1HB      GLN  39   6.459  -9.902  10.414
  312    HG2  GLN  39           2HG      GLN  39   6.998  -7.697  11.323
  313    HG3  GLN  39           1HG      GLN  39   5.404  -7.110  10.853
  314   HE21  GLN  39          1HE2      GLN  39   7.150  -9.200  13.025
  315   HE22  GLN  39          2HE2      GLN  39   5.875  -9.397  14.171
  316    H    ALA  40           H        ALA  40   4.557  -9.476   7.257
  317    HA   ALA  40           HA       ALA  40   5.667 -11.970   6.462
  318    HB1  ALA  40           3HB      ALA  40   3.791 -12.105   4.903
  319    HB2  ALA  40           1HB      ALA  40   3.425 -10.401   5.183
  320    HB3  ALA  40           2HB      ALA  40   3.255 -11.567   6.495
  321    H    LEU  41           H        LEU  41   5.881  -8.741   5.154
  322    HA   LEU  41           HA       LEU  41   7.154  -9.548   2.687
  323    HB2  LEU  41           2HB      LEU  41   7.066  -6.860   4.070
  324    HB3  LEU  41           1HB      LEU  41   7.677  -7.139   2.451
  325    HG   LEU  41           HG       LEU  41   4.807  -7.578   3.313
  326   HD11  LEU  41          1HD1      LEU  41   4.336  -5.569   1.963
  327   HD12  LEU  41          2HD1      LEU  41   6.069  -5.322   1.747
  328   HD13  LEU  41          3HD1      LEU  41   5.355  -5.218   3.357
  329   HD21  LEU  41          3HD2      LEU  41   5.452  -9.042   1.478
  330   HD22  LEU  41          1HD2      LEU  41   6.107  -7.669   0.586
  331   HD23  LEU  41          2HD2      LEU  41   4.374  -7.771   0.899
  332    H    GLY  42           H        GLY  42   8.158  -8.837   5.936
  333    HA2  GLY  42           2HA      GLY  42  10.215  -9.027   6.970
  334    HA3  GLY  42           1HA      GLY  42  10.878  -9.619   5.455
  335    H    VAL  43           H        VAL  43   9.243  -6.535   6.000
  336    HA   VAL  43           HA       VAL  43  11.050  -5.050   4.463
  337    HB   VAL  43           HB       VAL  43   9.181  -4.022   6.613
  338   HG11  VAL  43          1HG1      VAL  43  10.455  -2.593   4.273
  339   HG12  VAL  43          2HG1      VAL  43  10.830  -2.346   5.979
  340   HG13  VAL  43          3HG1      VAL  43   9.241  -1.908   5.354
  341   HG21  VAL  43          3HG2      VAL  43   8.002  -5.367   4.945
  342   HG22  VAL  43          1HG2      VAL  43   8.710  -4.400   3.649
  343   HG23  VAL  43          2HG2      VAL  43   7.584  -3.660   4.789
  344    H    ALA  44           H        ALA  44  12.901  -4.004   4.868
  345    HA   ALA  44           HA       ALA  44  14.172  -4.228   7.470
  346    HB1  ALA  44           3HB      ALA  44  15.202  -2.936   4.942
  347    HB2  ALA  44           1HB      ALA  44  15.445  -4.623   5.394
  348    HB3  ALA  44           2HB      ALA  44  16.145  -3.336   6.378
  349    H    GLU  45           H        GLU  45  14.978  -2.446   8.693
  350    HA   GLU  45           HA       GLU  45  13.225  -0.381   9.208
  351    HB2  GLU  45           2HB      GLU  45  16.218  -0.370   9.677
  352    HB3  GLU  45           1HB      GLU  45  15.080   0.746  10.413
  353    HG2  GLU  45           2HG      GLU  45  15.359  -0.773  12.101
  354    HG3  GLU  45           1HG      GLU  45  13.938  -1.432  11.299
  355    H    GLY  46           H        GLY  46  12.556   1.208   7.926
  356    HA2  GLY  46           2HA      GLY  46  13.340   3.334   6.818
  357    HA3  GLY  46           1HA      GLY  46  14.420   2.297   5.895
  358    H    GLY  47           H        GLY  47  12.871   0.206   5.145
  359    HA2  GLY  47           2HA      GLY  47  11.361   1.217   2.987
  360    HA3  GLY  47           1HA      GLY  47  11.346  -0.445   3.550
  361    H    GLU  48           H        GLU  48  10.428   0.385   6.241
  362    HA   GLU  48           HA       GLU  48   7.666   0.121   5.987
  363    HB2  GLU  48           2HB      GLU  48   8.898  -0.387   8.036
  364    HB3  GLU  48           1HB      GLU  48   9.297   1.310   8.246
  365    HG2  GLU  48           2HG      GLU  48   6.931   1.826   8.586
  366    HG3  GLU  48           1HG      GLU  48   6.531   0.120   8.368
  367    H    ARG  49           H        ARG  49   9.658   3.035   6.142
  368    HA   ARG  49           HA       ARG  49   7.267   4.746   5.936
  369    HB2  ARG  49           2HB      ARG  49   8.749   6.613   6.453
  370    HB3  ARG  49           1HB      ARG  49   8.929   5.341   7.656
  371    HG2  ARG  49           2HG      ARG  49  10.992   4.605   6.616
  372    HG3  ARG  49           1HG      ARG  49  10.800   5.802   5.335
  373    HD2  ARG  49           2HD      ARG  49  10.942   7.597   7.017
  374    HD3  ARG  49           1HD      ARG  49  11.176   6.383   8.276
  375    HE   ARG  49           HE       ARG  49  13.147   5.876   6.461
  376   HH11  ARG  49          1HH1      ARG  49  12.181   8.666   8.243
  377   HH12  ARG  49          2HH1      ARG  49  13.794   9.290   8.335
  378   HH21  ARG  49          1HH2      ARG  49  15.212   6.704   6.598
  379   HH22  ARG  49          2HH2      ARG  49  15.479   8.186   7.439
  380    H    CYS  50           H        CYS  50   9.103   3.119   3.826
  381    HA   CYS  50           HA       CYS  50   8.683   5.090   1.700
  382    HB2  CYS  50           2HB      CYS  50  11.341   3.717   2.177
  383    HB3  CYS  50           1HB      CYS  50  10.937   4.660   0.746
  384    HG   CYS  50           HG       CYS  50  10.256   6.717   3.039
  385    HA   PRO  51           HA       PRO  51   7.058   0.869   0.689
  386    HB2  PRO  51           2HB      PRO  51   5.167   1.863  -1.068
  387    HB3  PRO  51           1HB      PRO  51   4.906   1.625   0.661
  388    HG2  PRO  51           2HG      PRO  51   5.634   4.127  -0.819
  389    HG3  PRO  51           1HG      PRO  51   4.468   3.905   0.502
  390    HD2  PRO  51           2HD      PRO  51   6.894   4.942   0.960
  391    HD3  PRO  51           1HD      PRO  51   6.136   3.838   2.127
  392    H    GLN  52           H        GLN  52   8.173   3.461  -1.401
  393    HA   GLN  52           HA       GLN  52   8.240   2.168  -3.873
  394    HB2  GLN  52           2HB      GLN  52   9.993   3.763  -4.495
  395    HB3  GLN  52           1HB      GLN  52   8.709   4.563  -3.597
  396    HG2  GLN  52           2HG      GLN  52  10.066   4.595  -1.596
  397    HG3  GLN  52           1HG      GLN  52  11.327   3.659  -2.398
  398   HE21  GLN  52          1HE2      GLN  52  12.888   5.237  -2.080
  399   HE22  GLN  52          2HE2      GLN  52  12.888   6.732  -2.951
  400    H    SER  53           H        SER  53  10.286   1.718  -1.083
  401    HA   SER  53           HA       SER  53  12.400   0.366  -2.541
  402    HB2  SER  53           2HB      SER  53  12.846   1.736  -0.496
  403    HB3  SER  53           1HB      SER  53  11.980   0.534   0.459
  404    HG   SER  53           HG       SER  53  14.455   0.466   0.104
  405    H    VAL  54           H        VAL  54   9.385  -0.550  -1.281
  406    HA   VAL  54           HA       VAL  54  10.164  -3.363  -0.932
  407    HB   VAL  54           HB       VAL  54   7.481  -2.060  -0.409
  408   HG11  VAL  54          1HG1      VAL  54   8.543  -4.779   0.375
  409   HG12  VAL  54          2HG1      VAL  54   7.300  -4.454  -0.833
  410   HG13  VAL  54          3HG1      VAL  54   6.990  -4.105   0.867
  411   HG21  VAL  54          3HG2      VAL  54   9.171  -1.124   1.074
  412   HG22  VAL  54          1HG2      VAL  54   9.698  -2.746   1.531
  413   HG23  VAL  54          2HG2      VAL  54   8.087  -2.183   1.977
  414    H    GLY  55           H        GLY  55   8.089  -1.295  -2.924
  415    HA2  GLY  55           2HA      GLY  55   7.548  -1.703  -5.183
  416    HA3  GLY  55           1HA      GLY  55   8.002  -3.387  -4.973
  417    H    TRP  56           H        TRP  56   6.462  -4.869  -4.250
  418    HA   TRP  56           HA       TRP  56   3.681  -3.969  -4.372
  419    HB2  TRP  56           2HB      TRP  56   3.105  -6.347  -4.540
  420    HB3  TRP  56           1HB      TRP  56   4.309  -5.913  -5.745
  421    HD1  TRP  56           HD1      TRP  56   6.840  -6.850  -5.328
  422    HE1  TRP  56           HE1      TRP  56   7.663  -8.927  -4.049
  423    HE3  TRP  56           HE3      TRP  56   2.645  -7.822  -2.565
  424    HZ2  TRP  56           HZ2      TRP  56   6.664 -10.738  -2.129
  425    HZ3  TRP  56           HZ3      TRP  56   2.660  -9.748  -1.037
  426    HH2  TRP  56           HH2      TRP  56   4.631 -11.178  -0.824
  427    H    MET  57           H        MET  57   2.269  -4.057  -2.659
  428    HA   MET  57           HA       MET  57   3.236  -5.114  -0.092
  429    HB2  MET  57           2HB      MET  57   2.179  -2.304  -0.493
  430    HB3  MET  57           1HB      MET  57   2.565  -3.037   1.059
  431    HG2  MET  57           2HG      MET  57   4.895  -3.154   0.493
  432    HG3  MET  57           1HG      MET  57   4.568  -2.613  -1.152
  433    HE1  MET  57           3HE      MET  57   2.885  -1.208   2.130
  434    HE2  MET  57           1HE      MET  57   4.006   0.086   2.555
  435    HE3  MET  57           2HE      MET  57   4.524  -1.596   2.652
  436    HA   PRO  58           HA       PRO  58  -1.109  -6.339   0.087
  437    HB2  PRO  58           2HB      PRO  58  -0.972  -7.738   2.393
  438    HB3  PRO  58           1HB      PRO  58  -0.313  -8.365   0.877
  439    HG2  PRO  58           2HG      PRO  58   1.114  -7.045   3.160
  440    HG3  PRO  58           1HG      PRO  58   1.586  -8.476   2.225
  441    HD2  PRO  58           2HD      PRO  58   2.604  -5.980   1.783
  442    HD3  PRO  58           1HD      PRO  58   2.468  -7.217   0.518
  443    H    GLY  59           H        GLY  59  -2.571  -4.790   0.631
  444    HA2  GLY  59           2HA      GLY  59  -2.781  -3.986   3.440
  445    HA3  GLY  59           1HA      GLY  59  -2.510  -2.698   2.277
  446    H    LEU  60           H        LEU  60  -4.654  -2.215   3.566
  447    HA   LEU  60           HA       LEU  60  -6.932  -3.302   2.031
  448    HB2  LEU  60           2HB      LEU  60  -7.078  -3.732   4.432
  449    HB3  LEU  60           1HB      LEU  60  -6.875  -2.023   4.771
  450    HG   LEU  60           HG       LEU  60  -9.040  -1.562   3.641
  451   HD11  LEU  60          1HD1      LEU  60 -10.545  -3.434   3.127
  452   HD12  LEU  60          2HD1      LEU  60  -9.237  -4.570   3.461
  453   HD13  LEU  60          3HD1      LEU  60  -9.104  -3.444   2.111
  454   HD21  LEU  60          3HD2      LEU  60  -8.960  -1.857   6.065
  455   HD22  LEU  60          1HD2      LEU  60  -9.193  -3.595   5.874
  456   HD23  LEU  60          2HD2      LEU  60 -10.472  -2.475   5.403
  457    H    ASN  61           H        ASN  61  -7.618  -1.982   0.480
  458    HA   ASN  61           HA       ASN  61  -7.084   0.848   0.457
  459    HB2  ASN  61           2HB      ASN  61  -7.109  -0.462  -1.614
  460    HB3  ASN  61           1HB      ASN  61  -8.799  -0.882  -1.349
  461   HD21  ASN  61          1HD2      ASN  61  -6.592   1.603  -2.312
  462   HD22  ASN  61          2HD2      ASN  61  -7.782   2.696  -2.923
  463    H    GLU  62           H        GLU  62  -8.472   2.525   0.996
  464    HA   GLU  62           HA       GLU  62 -10.819   1.801   2.540
  465    HB2  GLU  62           2HB      GLU  62  -9.434   4.435   2.045
  466    HB3  GLU  62           1HB      GLU  62 -10.923   4.309   2.970
  467    HG2  GLU  62           2HG      GLU  62  -8.351   2.889   3.650
  468    HG3  GLU  62           1HG      GLU  62  -8.888   4.406   4.372
  469    H    ARG  63           H        ARG  63 -10.189   3.530  -0.511
  470    HA   ARG  63           HA       ARG  63 -12.812   4.592  -0.764
  471    HB2  ARG  63           2HB      ARG  63 -10.759   5.438  -1.939
  472    HB3  ARG  63           1HB      ARG  63 -10.854   4.043  -3.005
  473    HG2  ARG  63           2HG      ARG  63 -13.033   4.779  -3.808
  474    HG3  ARG  63           1HG      ARG  63 -12.985   6.155  -2.705
  475    HD2  ARG  63           2HD      ARG  63 -10.901   6.918  -3.877
  476    HD3  ARG  63           1HD      ARG  63 -11.163   5.629  -5.056
  477    HE   ARG  63           HE       ARG  63 -13.420   7.381  -4.688
  478   HH11  ARG  63          1HH1      ARG  63 -10.514   6.867  -6.450
  479   HH12  ARG  63          2HH1      ARG  63 -11.019   7.855  -7.776
  480   HH21  ARG  63          1HH2      ARG  63 -14.044   8.653  -6.391
  481   HH22  ARG  63          2HH2      ARG  63 -12.977   8.849  -7.742
  482    H    THR  64           H        THR  64 -11.422   1.519  -1.698
  483    HA   THR  64           HA       THR  64 -13.985   0.731  -2.956
  484    HB   THR  64           HB       THR  64 -12.784  -0.965  -4.212
  485    HG1  THR  64           HG1      THR  64 -10.260  -0.055  -3.432
  486   HG21  THR  64          3HG2      THR  64 -11.373   1.708  -4.390
  487   HG22  THR  64          1HG2      THR  64 -12.873   1.272  -5.210
  488   HG23  THR  64          2HG2      THR  64 -11.367   0.458  -5.634
  489    H    ARG  65           H        ARG  65 -11.629  -0.051  -0.509
  490    HA   ARG  65           HA       ARG  65 -11.516  -1.571   1.145
  491    HB2  ARG  65           2HB      ARG  65 -14.464  -1.511   0.639
  492    HB3  ARG  65           1HB      ARG  65 -13.813  -2.719   1.741
  493    HG2  ARG  65           2HG      ARG  65 -13.393   0.262   1.991
  494    HG3  ARG  65           1HG      ARG  65 -14.557  -0.690   2.918
  495    HD2  ARG  65           2HD      ARG  65 -12.794  -1.941   3.972
  496    HD3  ARG  65           1HD      ARG  65 -11.584  -1.224   2.913
  497    HE   ARG  65           HE       ARG  65 -11.712   0.768   4.140
  498   HH11  ARG  65          1HH1      ARG  65 -13.794  -1.664   5.426
  499   HH12  ARG  65          2HH1      ARG  65 -13.931  -0.877   6.960
  500   HH21  ARG  65          1HH2      ARG  65 -11.874   1.747   6.095
  501   HH22  ARG  65          2HH2      ARG  65 -12.849   1.042   7.340
  502    H    GLN  66           H        GLN  66 -11.075  -2.382  -1.640
  503    HA   GLN  66           HA       GLN  66 -11.594  -5.252  -1.539
  504    HB2  GLN  66           2HB      GLN  66 -10.258  -3.467  -3.578
  505    HB3  GLN  66           1HB      GLN  66 -10.256  -5.221  -3.716
  506    HG2  GLN  66           2HG      GLN  66 -12.745  -3.526  -3.550
  507    HG3  GLN  66           1HG      GLN  66 -12.025  -4.109  -5.051
  508   HE21  GLN  66          1HE2      GLN  66 -14.656  -4.651  -3.857
  509   HE22  GLN  66          2HE2      GLN  66 -14.754  -6.369  -3.713
  510    H    ARG  67           H        ARG  67 -10.045  -6.826  -1.239
  511    HA   ARG  67           HA       ARG  67  -7.516  -5.940  -0.050
  512    HB2  ARG  67           2HB      ARG  67  -9.203  -8.380   0.188
  513    HB3  ARG  67           1HB      ARG  67  -7.467  -8.602   0.357
  514    HG2  ARG  67           2HG      ARG  67  -9.050  -6.601   1.966
  515    HG3  ARG  67           1HG      ARG  67  -8.708  -8.249   2.503
  516    HD2  ARG  67           2HD      ARG  67  -6.634  -6.161   1.798
  517    HD3  ARG  67           1HD      ARG  67  -7.109  -6.628   3.434
  518    HE   ARG  67           HE       ARG  67  -6.269  -8.906   2.832
  519   HH11  ARG  67          1HH1      ARG  67  -5.009  -6.113   1.239
  520   HH12  ARG  67          2HH1      ARG  67  -3.562  -6.927   0.761
  521   HH21  ARG  67          1HH2      ARG  67  -4.403  -9.897   2.264
  522   HH22  ARG  67          2HH2      ARG  67  -3.217  -9.047   1.329
  523    H    GLY  68           H        GLY  68  -5.577  -7.309  -0.476
  524    HA2  GLY  68           2HA      GLY  68  -4.705  -8.854  -2.357
  525    HA3  GLY  68           1HA      GLY  68  -5.258  -7.546  -3.395
  526    H    ASP  69           H        ASP  69  -2.931  -7.606  -4.034
  527    HA   ASP  69           HA       ASP  69  -1.208  -6.132  -2.145
  528    HB2  ASP  69           2HB      ASP  69  -0.384  -7.648  -4.635
  529    HB3  ASP  69           1HB      ASP  69   0.684  -6.969  -3.408
  530    H    PHE  70           H        PHE  70  -0.547  -4.096  -2.627
  531    HA   PHE  70           HA       PHE  70  -1.169  -3.045  -5.318
  532    HB2  PHE  70           2HB      PHE  70  -1.665  -0.889  -4.340
  533    HB3  PHE  70           1HB      PHE  70  -2.632  -2.114  -3.532
  534    HD1  PHE  70           HD1      PHE  70  -2.136  -2.758  -1.204
  535    HD2  PHE  70           HD2      PHE  70   0.026   0.357  -3.155
  536    HE1  PHE  70           HE1      PHE  70  -1.307  -1.968   0.975
  537    HE2  PHE  70           HE2      PHE  70   0.859   1.143  -0.978
  538    HZ   PHE  70           HZ       PHE  70   0.194  -0.020   1.091
  539    HA   PRO  71           HA       PRO  71   3.141  -1.914  -5.560
  540    HB2  PRO  71           2HB      PRO  71   3.038  -0.054  -7.522
  541    HB3  PRO  71           1HB      PRO  71   2.797  -1.777  -7.839
  542    HG2  PRO  71           2HG      PRO  71   0.757   0.398  -7.529
  543    HG3  PRO  71           1HG      PRO  71   0.814  -0.923  -8.711
  544    HD2  PRO  71           2HD      PRO  71  -0.748  -0.978  -6.470
  545    HD3  PRO  71           1HD      PRO  71  -0.103  -2.440  -7.245
  546    H    GLY  72           H        GLY  72   3.769  -0.898  -3.701
  547    HA2  GLY  72           2HA      GLY  72   2.689   1.446  -2.612
  548    HA3  GLY  72           1HA      GLY  72   4.246   0.759  -2.190
  549    H    THR  73           H        THR  73   4.873   1.192  -5.241
  550    HA   THR  73           HA       THR  73   6.375   3.552  -4.924
  551    HB   THR  73           HB       THR  73   7.158   2.033  -6.555
  552    HG1  THR  73           HG1      THR  73   7.156   4.416  -7.107
  553   HG21  THR  73          3HG2      THR  73   4.509   2.327  -7.981
  554   HG22  THR  73          1HG2      THR  73   5.053   0.910  -7.084
  555   HG23  THR  73          2HG2      THR  73   5.891   1.395  -8.560
  556    H    TYR  74           H        TYR  74   3.031   3.199  -5.718
  557    HA   TYR  74           HA       TYR  74   2.921   5.912  -6.864
  558    HB2  TYR  74           2HB      TYR  74   0.742   3.816  -6.680
  559    HB3  TYR  74           1HB      TYR  74   0.605   5.369  -7.493
  560    HD1  TYR  74           HD2      TYR  74   1.932   5.790  -9.578
  561    HD2  TYR  74           HD1      TYR  74   1.782   1.953  -7.742
  562    HE1  TYR  74           HE2      TYR  74   2.754   4.764 -11.660
  563    HE2  TYR  74           HE1      TYR  74   2.605   0.919  -9.813
  564    HH   TYR  74           HH       TYR  74   2.677   1.404 -12.213
  565    H    VAL  75           H        VAL  75   2.908   4.727  -3.830
  566    HA   VAL  75           HA       VAL  75   0.851   6.636  -2.888
  567    HB   VAL  75           HB       VAL  75   0.389   5.250  -0.975
  568   HG11  VAL  75          1HG1      VAL  75  -0.598   3.277  -2.031
  569   HG12  VAL  75          2HG1      VAL  75   0.370   3.561  -3.478
  570   HG13  VAL  75          3HG1      VAL  75  -0.866   4.725  -3.001
  571   HG21  VAL  75          3HG2      VAL  75   2.499   3.356  -2.012
  572   HG22  VAL  75          1HG2      VAL  75   1.427   3.044  -0.648
  573   HG23  VAL  75          2HG2      VAL  75   2.610   4.348  -0.559
  574    H    GLU  76           H        GLU  76   1.241   7.653  -0.815
  575    HA   GLU  76           HA       GLU  76   4.103   7.838  -0.095
  576    HB2  GLU  76           2HB      GLU  76   3.685  10.068   0.723
  577    HB3  GLU  76           1HB      GLU  76   3.042   9.947  -0.908
  578    HG2  GLU  76           2HG      GLU  76   0.787   9.720  -0.038
  579    HG3  GLU  76           1HG      GLU  76   1.399   9.747   1.615
  580    H    PHE  77           H        PHE  77   4.668   7.922   2.149
  581    HA   PHE  77           HA       PHE  77   2.929   6.332   3.839
  582    HB2  PHE  77           2HB      PHE  77   5.326   5.853   3.804
  583    HB3  PHE  77           1HB      PHE  77   5.685   7.489   4.345
  584    HD1  PHE  77           HD2      PHE  77   3.793   4.444   5.392
  585    HD2  PHE  77           HD1      PHE  77   5.997   7.880   6.610
  586    HE1  PHE  77           HE2      PHE  77   3.695   3.679   7.724
  587    HE2  PHE  77           HE1      PHE  77   5.894   7.117   8.945
  588    HZ   PHE  77           HZ       PHE  77   4.742   5.016   9.506
  589    H    LEU  78           H        LEU  78   1.265   7.391   4.783
  590    HA   LEU  78           HA       LEU  78   1.374  10.150   5.541
  591    HB2  LEU  78           2HB      LEU  78  -0.623   8.007   6.294
  592    HB3  LEU  78           1HB      LEU  78  -0.837   9.727   6.563
  593    HG   LEU  78           HG       LEU  78  -0.621   8.392   3.857
  594   HD11  LEU  78          1HD1      LEU  78  -3.008   9.568   5.285
  595   HD12  LEU  78          2HD1      LEU  78  -2.718   7.855   4.969
  596   HD13  LEU  78          3HD1      LEU  78  -2.991   8.966   3.627
  597   HD21  LEU  78          3HD2      LEU  78   0.288  10.642   3.797
  598   HD22  LEU  78          1HD2      LEU  78  -1.152  11.272   4.599
  599   HD23  LEU  78          2HD2      LEU  78  -1.271  10.597   2.974
  600    H    GLY  79           H        GLY  79   1.190   7.138   7.452
  601    HA2  GLY  79           2HA      GLY  79   3.064   7.370   9.299
  602    HA3  GLY  79           1HA      GLY  79   1.956   8.607   9.870
  603    HA   PRO  80           HA       PRO  80   0.576   4.529  11.714
  604    HB2  PRO  80           2HB      PRO  80   1.228   5.593  14.337
  605    HB3  PRO  80           1HB      PRO  80   1.892   4.172  13.530
  606    HG2  PRO  80           2HG      PRO  80   3.340   6.440  14.031
  607    HG3  PRO  80           1HG      PRO  80   3.688   5.324  12.698
  608    HD2  PRO  80           2HD      PRO  80   2.217   7.944  12.642
  609    HD3  PRO  80           1HD      PRO  80   3.415   7.297  11.496
  610    H    LEU  81           H        LEU  81  -1.251   4.223  13.234
  611    HA   LEU  81           HA       LEU  81  -2.773   6.696  13.747
  612    HB2  LEU  81           2HB      LEU  81  -4.859   5.345  13.255
  613    HB3  LEU  81           1HB      LEU  81  -3.865   5.792  11.884
  614    HG   LEU  81           HG       LEU  81  -2.876   3.449  11.970
  615   HD11  LEU  81          1HD1      LEU  81  -5.216   2.965  13.816
  616   HD12  LEU  81          2HD1      LEU  81  -3.507   2.825  14.228
  617   HD13  LEU  81          3HD1      LEU  81  -4.224   1.714  13.063
  618   HD21  LEU  81          3HD2      LEU  81  -4.750   2.459  10.777
  619   HD22  LEU  81          1HD2      LEU  81  -4.536   4.146  10.314
  620   HD23  LEU  81          2HD2      LEU  81  -5.836   3.693  11.418
  621    H    GLU  82           H        GLU  82  -4.314   6.613  15.493
  622    HA   GLU  82           HA       GLU  82  -3.679   4.603  17.561
  623    HB2  GLU  82           2HB      GLU  82  -4.964   7.339  17.795
  624    HB3  GLU  82           1HB      GLU  82  -4.756   6.228  19.140
  625    HG2  GLU  82           2HG      GLU  82  -2.510   7.407  17.506
  626    HG3  GLU  82           1HG      GLU  82  -3.053   8.005  19.074
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  -1.853   0.994  25.053
    2    H2   MET   1           2H       MET   1  -0.947   1.855  26.193
    3    H3   MET   1           3H       MET   1  -0.196   0.692  25.222
    4    HA   MET   1           HA       MET   1  -1.427   3.210  24.260
    5    HB2  MET   1           2HB      MET   1   1.475   2.412  24.591
    6    HB3  MET   1           1HB      MET   1   0.939   3.833  23.704
    7    HG2  MET   1           2HG      MET   1  -0.025   4.768  25.726
    8    HG3  MET   1           1HG      MET   1   0.434   3.325  26.632
    9    HE1  MET   1           3HE      MET   1   3.329   2.657  25.503
   10    HE2  MET   1           1HE      MET   1   2.901   2.657  27.215
   11    HE3  MET   1           2HE      MET   1   4.323   3.540  26.662
   12    H    ALA   2           H        ALA   2  -1.396   3.535  22.034
   13    HA   ALA   2           HA       ALA   2  -1.120   1.098  20.435
   14    HB1  ALA   2           3HB      ALA   2  -3.202   2.387  20.267
   15    HB2  ALA   2           1HB      ALA   2  -2.361   2.304  18.717
   16    HB3  ALA   2           2HB      ALA   2  -2.293   3.779  19.681
   17    H    GLY   3           H        GLY   3   0.969   0.779  19.814
   18    HA2  GLY   3           2HA      GLY   3   2.696   2.964  19.046
   19    HA3  GLY   3           1HA      GLY   3   3.089   1.255  18.995
   20    HA   PRO   4           HA       PRO   4   2.480   2.870  14.629
   21    HB2  PRO   4           2HB      PRO   4   4.913   2.261  13.647
   22    HB3  PRO   4           1HB      PRO   4   4.626   3.734  14.583
   23    HG2  PRO   4           2HG      PRO   4   5.769   1.109  15.496
   24    HG3  PRO   4           1HG      PRO   4   6.365   2.752  15.807
   25    HD2  PRO   4           2HD      PRO   4   4.880   1.367  17.612
   26    HD3  PRO   4           1HD      PRO   4   4.805   3.135  17.471
   27    H    GLU   5           H        GLU   5   1.619   0.293  15.739
   28    HA   GLU   5           HA       GLU   5   2.560  -1.891  14.233
   29    HB2  GLU   5           2HB      GLU   5  -0.071  -1.371  15.610
   30    HB3  GLU   5           1HB      GLU   5   0.241  -2.870  14.749
   31    HG2  GLU   5           2HG      GLU   5   1.794  -1.814  17.107
   32    HG3  GLU   5           1HG      GLU   5   0.627  -3.136  17.127
   33    H    GLY   6           H        GLY   6   0.305   0.646  13.394
   34    HA2  GLY   6           2HA      GLY   6  -0.034  -0.626  10.739
   35    HA3  GLY   6           1HA      GLY   6  -1.368   0.169  11.559
   36    H    PHE   7           H        PHE   7  -0.060   0.729   8.941
   37    HA   PHE   7           HA       PHE   7   0.620   3.564   9.425
   38    HB2  PHE   7           2HB      PHE   7   1.869   1.713   7.381
   39    HB3  PHE   7           1HB      PHE   7   2.173   3.443   7.492
   40    HD1  PHE   7           HD1      PHE   7   3.098   4.312   9.751
   41    HD2  PHE   7           HD2      PHE   7   3.227   0.229   8.546
   42    HE1  PHE   7           HE1      PHE   7   4.921   3.898  11.351
   43    HE2  PHE   7           HE2      PHE   7   5.046  -0.189  10.142
   44    HZ   PHE   7           HZ       PHE   7   5.895   1.647  11.549
   45    H    GLN   8           H        GLN   8   0.167   5.016   7.660
   46    HA   GLN   8           HA       GLN   8  -2.081   4.130   5.961
   47    HB2  GLN   8           2HB      GLN   8  -1.462   6.907   7.006
   48    HB3  GLN   8           1HB      GLN   8  -2.810   6.491   5.956
   49    HG2  GLN   8           2HG      GLN   8  -3.727   5.052   7.714
   50    HG3  GLN   8           1HG      GLN   8  -2.384   5.494   8.767
   51   HE21  GLN   8          1HE2      GLN   8  -5.248   5.898   9.141
   52   HE22  GLN   8          2HE2      GLN   8  -5.467   7.595   9.356
   53    H    TYR   9           H        TYR   9  -1.760   4.137   3.839
   54    HA   TYR   9           HA       TYR   9   0.372   5.830   2.688
   55    HB2  TYR   9           2HB      TYR   9  -0.881   3.283   1.616
   56    HB3  TYR   9           1HB      TYR   9   0.321   4.247   0.761
   57    HD1  TYR   9           HD1      TYR   9  -0.250   2.069   3.697
   58    HD2  TYR   9           HD2      TYR   9   2.657   4.102   1.335
   59    HE1  TYR   9           HE1      TYR   9   1.543   0.830   4.835
   60    HE2  TYR   9           HE2      TYR   9   4.450   2.865   2.472
   61    HH   TYR   9           HH       TYR   9   3.846   0.157   4.447
   62    H    ARG  10           H        ARG  10  -0.135   6.675   0.447
   63    HA   ARG  10           HA       ARG  10  -3.017   7.209   0.115
   64    HB2  ARG  10           2HB      ARG  10  -1.952   9.098   1.306
   65    HB3  ARG  10           1HB      ARG  10  -0.837   9.299  -0.035
   66    HG2  ARG  10           2HG      ARG  10  -2.752   9.804  -1.516
   67    HG3  ARG  10           1HG      ARG  10  -3.827   9.681  -0.120
   68    HD2  ARG  10           2HD      ARG  10  -2.592  11.502   0.977
   69    HD3  ARG  10           1HD      ARG  10  -1.533  11.626  -0.425
   70    HE   ARG  10           HE       ARG  10  -4.423  12.216  -0.492
   71   HH11  ARG  10          1HH1      ARG  10  -1.183  12.832  -1.514
   72   HH12  ARG  10          2HH1      ARG  10  -1.644  14.208  -2.459
   73   HH21  ARG  10          1HH2      ARG  10  -4.983  13.970  -1.724
   74   HH22  ARG  10          2HH2      ARG  10  -3.755  14.849  -2.572
   75    H    ALA  11           H        ALA  11  -3.695   6.766  -1.862
   76    HA   ALA  11           HA       ALA  11  -1.879   6.231  -4.031
   77    HB1  ALA  11           3HB      ALA  11  -3.956   4.940  -3.695
   78    HB2  ALA  11           1HB      ALA  11  -3.878   5.673  -5.299
   79    HB3  ALA  11           2HB      ALA  11  -4.897   6.389  -4.050
   80    H    LEU  12           H        LEU  12  -1.130   7.687  -5.461
   81    HA   LEU  12           HA       LEU  12  -1.874  10.439  -5.305
   82    HB2  LEU  12           2HB      LEU  12  -0.164   9.023  -7.359
   83    HB3  LEU  12           1HB      LEU  12  -0.238  10.758  -7.109
   84    HG   LEU  12           HG       LEU  12   0.782   8.745  -5.091
   85   HD11  LEU  12          1HD1      LEU  12   2.985   9.688  -5.549
   86   HD12  LEU  12          2HD1      LEU  12   2.293  10.719  -6.802
   87   HD13  LEU  12          3HD1      LEU  12   2.283   8.966  -6.996
   88   HD21  LEU  12          3HD2      LEU  12   1.541  10.729  -3.839
   89   HD22  LEU  12          1HD2      LEU  12  -0.216  10.662  -3.986
   90   HD23  LEU  12          2HD2      LEU  12   0.712  11.766  -5.003
   91    H    TYR  13           H        TYR  13  -2.056   8.165  -8.054
   92    HA   TYR  13           HA       TYR  13  -4.417   9.628  -9.052
   93    HB2  TYR  13           2HB      TYR  13  -2.041   8.621 -10.642
   94    HB3  TYR  13           1HB      TYR  13  -3.564   9.104 -11.384
   95    HD1  TYR  13           HD1      TYR  13  -4.266  11.457 -11.382
   96    HD2  TYR  13           HD2      TYR  13  -0.510  10.282  -9.754
   97    HE1  TYR  13           HE1      TYR  13  -3.522  13.800 -11.426
   98    HE2  TYR  13           HE2      TYR  13   0.245  12.620  -9.795
   99    HH   TYR  13           HH       TYR  13  -0.235  14.699 -10.868
  100    HA   PRO  14           HA       PRO  14  -6.524   5.775  -9.354
  101    HB2  PRO  14           2HB      PRO  14  -7.746   5.843 -11.817
  102    HB3  PRO  14           1HB      PRO  14  -8.322   6.725 -10.395
  103    HG2  PRO  14           2HG      PRO  14  -6.679   7.705 -12.705
  104    HG3  PRO  14           1HG      PRO  14  -8.023   8.504 -11.867
  105    HD2  PRO  14           2HD      PRO  14  -5.444   9.155 -11.389
  106    HD3  PRO  14           1HD      PRO  14  -6.678   9.204 -10.114
  107    H    PHE  15           H        PHE  15  -6.013   3.719  -9.784
  108    HA   PHE  15           HA       PHE  15  -4.363   3.089 -12.143
  109    HB2  PHE  15           2HB      PHE  15  -2.773   3.323 -10.361
  110    HB3  PHE  15           1HB      PHE  15  -3.772   2.384  -9.260
  111    HD1  PHE  15           HD1      PHE  15  -1.684   2.152 -12.316
  112    HD2  PHE  15           HD2      PHE  15  -3.555   0.036  -9.122
  113    HE1  PHE  15           HE1      PHE  15  -0.453   0.118 -12.944
  114    HE2  PHE  15           HE2      PHE  15  -2.326  -2.001  -9.751
  115    HZ   PHE  15           HZ       PHE  15  -0.773  -1.961 -11.663
  116    H    ARG  16           H        ARG  16  -5.026   1.336 -13.217
  117    HA   ARG  16           HA       ARG  16  -6.460  -0.803 -11.782
  118    HB2  ARG  16           2HB      ARG  16  -8.176   0.501 -12.912
  119    HB3  ARG  16           1HB      ARG  16  -7.286   0.421 -14.427
  120    HG2  ARG  16           2HG      ARG  16  -7.612  -2.011 -14.491
  121    HG3  ARG  16           1HG      ARG  16  -8.513  -1.927 -12.976
  122    HD2  ARG  16           2HD      ARG  16 -10.018  -2.052 -14.899
  123    HD3  ARG  16           1HD      ARG  16 -10.201  -0.523 -14.042
  124    HE   ARG  16           HE       ARG  16  -8.358  -0.206 -16.150
  125   HH11  ARG  16          1HH1      ARG  16 -11.722  -0.754 -15.654
  126   HH12  ARG  16          2HH1      ARG  16 -12.184   0.117 -17.075
  127   HH21  ARG  16          1HH2      ARG  16  -8.956   0.893 -17.977
  128   HH22  ARG  16          2HH2      ARG  16 -10.635   1.051 -18.373
  129    H    ARG  17           H        ARG  17  -5.972  -2.877 -12.442
  130    HA   ARG  17           HA       ARG  17  -3.910  -3.145 -14.544
  131    HB2  ARG  17           2HB      ARG  17  -3.352  -3.901 -12.201
  132    HB3  ARG  17           1HB      ARG  17  -4.607  -5.122 -12.353
  133    HG2  ARG  17           2HG      ARG  17  -2.659  -6.289 -12.844
  134    HG3  ARG  17           1HG      ARG  17  -3.309  -5.906 -14.438
  135    HD2  ARG  17           2HD      ARG  17  -0.998  -5.428 -14.563
  136    HD3  ARG  17           1HD      ARG  17  -1.787  -3.859 -14.404
  137    HE   ARG  17           HE       ARG  17  -1.164  -4.718 -11.844
  138   HH11  ARG  17          1HH1      ARG  17   0.562  -3.853 -14.702
  139   HH12  ARG  17          2HH1      ARG  17   1.967  -3.370 -13.824
  140   HH21  ARG  17          1HH2      ARG  17   0.625  -4.124 -10.747
  141   HH22  ARG  17          2HH2      ARG  17   2.008  -3.519 -11.602
  142    H    GLU  18           H        GLU  18  -4.016  -5.230 -15.821
  143    HA   GLU  18           HA       GLU  18  -6.599  -5.741 -16.904
  144    HB2  GLU  18           2HB      GLU  18  -4.082  -7.401 -17.192
  145    HB3  GLU  18           1HB      GLU  18  -5.497  -7.463 -18.237
  146    HG2  GLU  18           2HG      GLU  18  -3.681  -5.080 -17.893
  147    HG3  GLU  18           1HG      GLU  18  -3.637  -6.218 -19.236
  148    H    ARG  19           H        ARG  19  -5.109  -6.863 -14.105
  149    HA   ARG  19           HA       ARG  19  -7.160  -8.937 -13.747
  150    HB2  ARG  19           2HB      ARG  19  -4.207  -9.208 -13.124
  151    HB3  ARG  19           1HB      ARG  19  -5.431 -10.289 -12.475
  152    HG2  ARG  19           2HG      ARG  19  -4.917  -9.878 -15.418
  153    HG3  ARG  19           1HG      ARG  19  -4.224 -11.182 -14.453
  154    HD2  ARG  19           2HD      ARG  19  -7.165 -10.679 -14.934
  155    HD3  ARG  19           1HD      ARG  19  -6.194 -11.960 -15.662
  156    HE   ARG  19           HE       ARG  19  -5.854 -12.642 -13.191
  157   HH11  ARG  19          1HH1      ARG  19  -8.745 -11.365 -14.546
  158   HH12  ARG  19          2HH1      ARG  19  -9.765 -12.139 -13.390
  159   HH21  ARG  19          1HH2      ARG  19  -7.154 -13.619 -11.707
  160   HH22  ARG  19          2HH2      ARG  19  -8.868 -13.392 -11.781
  161    HA   PRO  20           HA       PRO  20  -7.755  -6.616  -9.968
  162    HB2  PRO  20           2HB      PRO  20  -9.411  -8.307  -8.655
  163    HB3  PRO  20           1HB      PRO  20  -9.932  -7.380 -10.067
  164    HG2  PRO  20           2HG      PRO  20  -9.038 -10.242  -9.912
  165    HG3  PRO  20           1HG      PRO  20 -10.426  -9.552 -10.775
  166    HD2  PRO  20           2HD      PRO  20  -8.084 -10.162 -12.015
  167    HD3  PRO  20           1HD      PRO  20  -9.127  -8.827 -12.544
  168    H    GLU  21           H        GLU  21  -5.808  -9.258 -10.211
  169    HA   GLU  21           HA       GLU  21  -5.374 -10.081  -7.556
  170    HB2  GLU  21           2HB      GLU  21  -3.189  -9.917  -9.637
  171    HB3  GLU  21           1HB      GLU  21  -3.365 -11.080  -8.330
  172    HG2  GLU  21           2HG      GLU  21  -4.954 -10.912 -10.879
  173    HG3  GLU  21           1HG      GLU  21  -3.877 -12.202 -10.354
  174    H    ASP  22           H        ASP  22  -4.329  -7.274  -9.324
  175    HA   ASP  22           HA       ASP  22  -2.588  -6.250  -7.259
  176    HB2  ASP  22           2HB      ASP  22  -3.858  -4.897  -9.663
  177    HB3  ASP  22           1HB      ASP  22  -2.612  -4.187  -8.642
  178    H    LEU  23           H        LEU  23  -3.539  -3.541  -7.212
  179    HA   LEU  23           HA       LEU  23  -6.215  -3.758  -5.991
  180    HB2  LEU  23           2HB      LEU  23  -4.492  -3.775  -4.220
  181    HB3  LEU  23           1HB      LEU  23  -3.862  -2.255  -4.825
  182    HG   LEU  23           HG       LEU  23  -5.962  -1.127  -4.224
  183   HD11  LEU  23          1HD1      LEU  23  -7.507  -2.989  -4.524
  184   HD12  LEU  23          2HD1      LEU  23  -7.672  -2.289  -2.915
  185   HD13  LEU  23          3HD1      LEU  23  -6.808  -3.812  -3.128
  186   HD21  LEU  23          3HD2      LEU  23  -5.738  -1.272  -1.782
  187   HD22  LEU  23          1HD2      LEU  23  -4.170  -1.181  -2.583
  188   HD23  LEU  23          2HD2      LEU  23  -4.755  -2.726  -1.963
  189    H    GLU  24           H        GLU  24  -7.570  -2.447  -7.043
  190    HA   GLU  24           HA       GLU  24  -6.816  -0.355  -8.763
  191    HB2  GLU  24           2HB      GLU  24  -9.433  -1.099  -7.470
  192    HB3  GLU  24           1HB      GLU  24  -9.297   0.344  -8.463
  193    HG2  GLU  24           2HG      GLU  24 -10.177  -1.520  -9.744
  194    HG3  GLU  24           1HG      GLU  24  -8.616  -1.003 -10.369
  195    H    LEU  25           H        LEU  25  -6.076   1.605  -8.335
  196    HA   LEU  25           HA       LEU  25  -6.408   2.721  -5.636
  197    HB2  LEU  25           2HB      LEU  25  -4.503   3.558  -7.830
  198    HB3  LEU  25           1HB      LEU  25  -4.523   4.176  -6.188
  199    HG   LEU  25           HG       LEU  25  -3.829   1.350  -7.018
  200   HD11  LEU  25          1HD1      LEU  25  -2.088   2.979  -7.547
  201   HD12  LEU  25          2HD1      LEU  25  -1.586   1.912  -6.235
  202   HD13  LEU  25          3HD1      LEU  25  -2.113   3.559  -5.880
  203   HD21  LEU  25          3HD2      LEU  25  -3.875   2.598  -4.265
  204   HD22  LEU  25          1HD2      LEU  25  -3.276   0.985  -4.658
  205   HD23  LEU  25          2HD2      LEU  25  -4.985   1.366  -4.866
  206    H    LEU  26           H        LEU  26  -7.275   4.739  -5.257
  207    HA   LEU  26           HA       LEU  26  -8.534   6.115  -7.547
  208    HB2  LEU  26           2HB      LEU  26  -9.356   5.811  -4.670
  209    HB3  LEU  26           1HB      LEU  26  -9.936   7.176  -5.602
  210    HG   LEU  26           HG       LEU  26 -11.577   5.345  -5.530
  211   HD11  LEU  26          1HD1      LEU  26 -12.047   5.222  -7.919
  212   HD12  LEU  26          2HD1      LEU  26 -10.414   5.786  -8.278
  213   HD13  LEU  26          3HD1      LEU  26 -11.553   6.847  -7.448
  214   HD21  LEU  26          3HD2      LEU  26 -11.186   3.236  -6.643
  215   HD22  LEU  26          1HD2      LEU  26  -9.967   3.470  -5.389
  216   HD23  LEU  26          2HD2      LEU  26  -9.550   3.733  -7.085
  217    HA   PRO  27           HA       PRO  27  -5.846   9.543  -7.045
  218    HB2  PRO  27           2HB      PRO  27  -7.480  11.662  -7.652
  219    HB3  PRO  27           1HB      PRO  27  -6.806  10.558  -8.856
  220    HG2  PRO  27           2HG      PRO  27  -9.527  10.559  -7.596
  221    HG3  PRO  27           1HG      PRO  27  -9.078  10.298  -9.294
  222    HD2  PRO  27           2HD      PRO  27  -9.678   8.244  -7.657
  223    HD3  PRO  27           1HD      PRO  27  -8.440   8.095  -8.921
  224    H    GLY  28           H        GLY  28  -5.224   9.805  -4.958
  225    HA2  GLY  28           2HA      GLY  28  -4.983  11.093  -3.042
  226    HA3  GLY  28           1HA      GLY  28  -6.476  11.925  -3.436
  227    H    ASP  29           H        ASP  29  -6.157   8.411  -3.104
  228    HA   ASP  29           HA       ASP  29  -8.034   8.543  -0.832
  229    HB2  ASP  29           2HB      ASP  29  -8.748   7.317  -2.886
  230    HB3  ASP  29           1HB      ASP  29  -7.424   6.182  -2.629
  231    H    VAL  30           H        VAL  30  -7.812   6.897   0.885
  232    HA   VAL  30           HA       VAL  30  -4.980   6.622   1.638
  233    HB   VAL  30           HB       VAL  30  -7.440   6.483   3.399
  234   HG11  VAL  30          1HG1      VAL  30  -5.572   5.208   4.323
  235   HG12  VAL  30          2HG1      VAL  30  -5.859   6.668   5.269
  236   HG13  VAL  30          3HG1      VAL  30  -4.509   6.605   4.136
  237   HG21  VAL  30          3HG2      VAL  30  -6.799   8.711   4.177
  238   HG22  VAL  30          1HG2      VAL  30  -7.115   8.718   2.443
  239   HG23  VAL  30          2HG2      VAL  30  -5.454   8.734   3.035
  240    H    LEU  31           H        LEU  31  -4.033   4.707   1.881
  241    HA   LEU  31           HA       LEU  31  -5.667   2.246   1.921
  242    HB2  LEU  31           2HB      LEU  31  -2.804   2.673   1.030
  243    HB3  LEU  31           1HB      LEU  31  -3.559   1.100   1.182
  244    HG   LEU  31           HG       LEU  31  -5.238   1.830  -0.558
  245   HD11  LEU  31          1HD1      LEU  31  -3.314   4.128  -0.913
  246   HD12  LEU  31          2HD1      LEU  31  -4.986   4.239  -0.360
  247   HD13  LEU  31          3HD1      LEU  31  -4.637   3.708  -2.004
  248   HD21  LEU  31          3HD2      LEU  31  -3.725   1.439  -2.423
  249   HD22  LEU  31          1HD2      LEU  31  -3.331   0.377  -1.072
  250   HD23  LEU  31          2HD2      LEU  31  -2.336   1.798  -1.397
  251    H    VAL  32           H        VAL  32  -5.632   1.027   3.741
  252    HA   VAL  32           HA       VAL  32  -3.756   1.765   5.877
  253    HB   VAL  32           HB       VAL  32  -6.206  -0.014   6.004
  254   HG11  VAL  32          1HG1      VAL  32  -5.963   0.201   8.455
  255   HG12  VAL  32          2HG1      VAL  32  -4.438   1.054   8.213
  256   HG13  VAL  32          3HG1      VAL  32  -4.593  -0.630   7.717
  257   HG21  VAL  32          3HG2      VAL  32  -6.764   2.329   5.538
  258   HG22  VAL  32          1HG2      VAL  32  -5.818   2.839   6.937
  259   HG23  VAL  32          2HG2      VAL  32  -7.271   1.864   7.161
  260    H    VAL  33           H        VAL  33  -1.999   0.589   6.279
  261    HA   VAL  33           HA       VAL  33  -2.008  -2.303   5.668
  262    HB   VAL  33           HB       VAL  33   0.323  -0.440   5.138
  263   HG11  VAL  33          1HG1      VAL  33   1.052  -2.658   5.855
  264   HG12  VAL  33          2HG1      VAL  33   1.407  -2.410   4.146
  265   HG13  VAL  33          3HG1      VAL  33   0.033  -3.406   4.621
  266   HG21  VAL  33          3HG2      VAL  33  -1.428  -0.132   3.473
  267   HG22  VAL  33          1HG2      VAL  33  -1.492  -1.873   3.190
  268   HG23  VAL  33          2HG2      VAL  33  -0.045  -0.961   2.759
  269    H    SER  34           H        SER  34  -1.746  -3.372   7.531
  270    HA   SER  34           HA       SER  34  -0.313  -2.167   9.769
  271    HB2  SER  34           2HB      SER  34  -1.758  -4.830   9.566
  272    HB3  SER  34           1HB      SER  34  -1.063  -4.160  11.041
  273    HG   SER  34           HG       SER  34  -3.186  -3.599  11.069
  274    H    ARG  35           H        ARG  35   1.400  -3.317  10.910
  275    HA   ARG  35           HA       ARG  35   3.375  -4.308   9.109
  276    HB2  ARG  35           2HB      ARG  35   3.404  -4.154  12.129
  277    HB3  ARG  35           1HB      ARG  35   4.783  -4.621  11.140
  278    HG2  ARG  35           2HG      ARG  35   4.464  -2.358   9.966
  279    HG3  ARG  35           1HG      ARG  35   3.441  -1.943  11.343
  280    HD2  ARG  35           2HD      ARG  35   6.328  -2.824  11.494
  281    HD3  ARG  35           1HD      ARG  35   5.758  -1.162  11.624
  282    HE   ARG  35           HE       ARG  35   4.660  -3.028  13.552
  283   HH11  ARG  35          1HH1      ARG  35   7.084  -0.679  12.852
  284   HH12  ARG  35          2HH1      ARG  35   7.413  -0.363  14.520
  285   HH21  ARG  35          1HH2      ARG  35   5.098  -2.619  15.703
  286   HH22  ARG  35          2HH2      ARG  35   6.325  -1.469  16.117
  287    H    ALA  36           H        ALA  36   0.903  -5.848  10.903
  288    HA   ALA  36           HA       ALA  36   1.810  -8.397  11.358
  289    HB1  ALA  36           3HB      ALA  36  -0.466  -9.174  10.996
  290    HB2  ALA  36           1HB      ALA  36  -0.856  -7.688  10.126
  291    HB3  ALA  36           2HB      ALA  36  -0.474  -7.629  11.846
  292    H    ALA  37           H        ALA  37   0.947  -6.970   8.231
  293    HA   ALA  37           HA       ALA  37   1.637  -9.381   6.765
  294    HB1  ALA  37           3HB      ALA  37   1.130  -8.077   4.769
  295    HB2  ALA  37           1HB      ALA  37   1.018  -6.606   5.738
  296    HB3  ALA  37           2HB      ALA  37  -0.156  -7.903   5.963
  297    H    LEU  38           H        LEU  38   3.054  -6.168   7.313
  298    HA   LEU  38           HA       LEU  38   5.191  -6.310   5.524
  299    HB2  LEU  38           2HB      LEU  38   5.080  -4.889   8.191
  300    HB3  LEU  38           1HB      LEU  38   6.266  -4.587   6.934
  301    HG   LEU  38           HG       LEU  38   3.288  -4.091   6.701
  302   HD11  LEU  38          1HD1      LEU  38   4.414  -2.499   8.179
  303   HD12  LEU  38          2HD1      LEU  38   3.887  -1.729   6.684
  304   HD13  LEU  38          3HD1      LEU  38   5.587  -2.144   6.910
  305   HD21  LEU  38          3HD2      LEU  38   3.835  -3.031   4.560
  306   HD22  LEU  38          1HD2      LEU  38   4.256  -4.742   4.557
  307   HD23  LEU  38          2HD2      LEU  38   5.519  -3.523   4.742
  308    H    GLN  39           H        GLN  39   4.994  -7.497   8.854
  309    HA   GLN  39           HA       GLN  39   7.712  -8.232   9.134
  310    HB2  GLN  39           2HB      GLN  39   5.255  -9.379  10.488
  311    HB3  GLN  39           1HB      GLN  39   6.915  -9.666  10.994
  312    HG2  GLN  39           2HG      GLN  39   5.531  -6.984  10.945
  313    HG3  GLN  39           1HG      GLN  39   5.812  -7.975  12.375
  314   HE21  GLN  39          1HE2      GLN  39   7.896  -8.122  13.213
  315   HE22  GLN  39          2HE2      GLN  39   9.146  -7.017  12.759
  316    H    ALA  40           H        ALA  40   4.889  -9.968   7.896
  317    HA   ALA  40           HA       ALA  40   6.174 -12.462   7.457
  318    HB1  ALA  40           3HB      ALA  40   4.276 -12.977   6.014
  319    HB2  ALA  40           1HB      ALA  40   3.789 -11.282   6.026
  320    HB3  ALA  40           2HB      ALA  40   3.736 -12.226   7.516
  321    H    LEU  41           H        LEU  41   5.864  -9.533   5.527
  322    HA   LEU  41           HA       LEU  41   7.046 -10.552   3.143
  323    HB2  LEU  41           2HB      LEU  41   6.972  -7.702   4.158
  324    HB3  LEU  41           1HB      LEU  41   7.318  -8.197   2.512
  325    HG   LEU  41           HG       LEU  41   4.670  -8.614   3.916
  326   HD11  LEU  41          1HD1      LEU  41   3.826  -6.844   2.473
  327   HD12  LEU  41          2HD1      LEU  41   5.438  -6.598   1.802
  328   HD13  LEU  41          3HD1      LEU  41   5.127  -6.244   3.502
  329   HD21  LEU  41          3HD2      LEU  41   5.074 -10.311   2.228
  330   HD22  LEU  41          1HD2      LEU  41   5.496  -9.070   1.046
  331   HD23  LEU  41          2HD2      LEU  41   3.848  -9.177   1.665
  332    H    GLY  42           H        GLY  42   8.343  -9.344   6.145
  333    HA2  GLY  42           2HA      GLY  42  10.536  -9.599   6.930
  334    HA3  GLY  42           1HA      GLY  42  11.057 -10.005   5.302
  335    H    VAL  43           H        VAL  43   9.277  -7.147   6.429
  336    HA   VAL  43           HA       VAL  43  11.069  -5.398   4.993
  337    HB   VAL  43           HB       VAL  43   8.749  -4.717   6.818
  338   HG11  VAL  43          1HG1      VAL  43  10.303  -2.838   6.558
  339   HG12  VAL  43          2HG1      VAL  43   8.775  -2.520   5.739
  340   HG13  VAL  43          3HG1      VAL  43  10.198  -2.984   4.804
  341   HG21  VAL  43          3HG2      VAL  43   7.469  -4.405   4.749
  342   HG22  VAL  43          1HG2      VAL  43   8.049  -6.063   4.902
  343   HG23  VAL  43          2HG2      VAL  43   8.856  -4.945   3.802
  344    H    ALA  44           H        ALA  44  12.770  -4.297   5.774
  345    HA   ALA  44           HA       ALA  44  13.633  -4.666   8.485
  346    HB1  ALA  44           3HB      ALA  44  14.804  -2.927   6.312
  347    HB2  ALA  44           1HB      ALA  44  15.227  -4.609   6.636
  348    HB3  ALA  44           2HB      ALA  44  15.590  -3.363   7.830
  349    H    GLU  45           H        GLU  45  13.935  -3.101  10.092
  350    HA   GLU  45           HA       GLU  45  11.933  -1.190  10.462
  351    HB2  GLU  45           2HB      GLU  45  13.245  -2.169  12.303
  352    HB3  GLU  45           1HB      GLU  45  14.676  -1.312  11.748
  353    HG2  GLU  45           2HG      GLU  45  13.807  -0.114  13.602
  354    HG3  GLU  45           1HG      GLU  45  13.458   0.832  12.157
  355    H    GLY  46           H        GLY  46  11.631   0.788   9.614
  356    HA2  GLY  46           2HA      GLY  46  12.298   2.983   9.012
  357    HA3  GLY  46           1HA      GLY  46  13.951   2.417   8.825
  358    H    GLY  47           H        GLY  47  12.006   0.190   7.339
  359    HA2  GLY  47           2HA      GLY  47  12.548   1.325   4.688
  360    HA3  GLY  47           1HA      GLY  47  12.084  -0.332   5.036
  361    H    GLU  48           H        GLU  48   9.841   0.570   6.767
  362    HA   GLU  48           HA       GLU  48   7.766   0.478   4.889
  363    HB2  GLU  48           2HB      GLU  48   6.256   0.846   6.732
  364    HB3  GLU  48           1HB      GLU  48   7.563  -0.197   7.270
  365    HG2  GLU  48           2HG      GLU  48   7.254   2.747   7.869
  366    HG3  GLU  48           1HG      GLU  48   6.988   1.414   8.987
  367    H    ARG  49           H        ARG  49   9.322   3.243   6.416
  368    HA   ARG  49           HA       ARG  49   7.500   5.241   5.630
  369    HB2  ARG  49           2HB      ARG  49   9.392   6.814   5.997
  370    HB3  ARG  49           1HB      ARG  49   9.135   5.697   7.329
  371    HG2  ARG  49           2HG      ARG  49  10.995   4.305   6.485
  372    HG3  ARG  49           1HG      ARG  49  11.281   5.501   5.218
  373    HD2  ARG  49           2HD      ARG  49  11.763   7.200   6.905
  374    HD3  ARG  49           1HD      ARG  49  11.411   6.043   8.192
  375    HE   ARG  49           HE       ARG  49  13.375   4.838   6.751
  376   HH11  ARG  49          1HH1      ARG  49  13.087   7.927   8.263
  377   HH12  ARG  49          2HH1      ARG  49  14.782   8.034   8.591
  378   HH21  ARG  49          1HH2      ARG  49  15.552   5.007   7.185
  379   HH22  ARG  49          2HH2      ARG  49  16.153   6.414   7.990
  380    H    CYS  50           H        CYS  50   9.599   3.388   3.718
  381    HA   CYS  50           HA       CYS  50   8.988   5.116   1.411
  382    HB2  CYS  50           2HB      CYS  50  11.650   3.776   1.949
  383    HB3  CYS  50           1HB      CYS  50  11.208   4.548   0.429
  384    HG   CYS  50           HG       CYS  50  10.641   6.745   2.744
  385    HA   PRO  51           HA       PRO  51   7.198   0.884   0.914
  386    HB2  PRO  51           2HB      PRO  51   5.457   1.729  -1.086
  387    HB3  PRO  51           1HB      PRO  51   5.092   1.715   0.641
  388    HG2  PRO  51           2HG      PRO  51   6.032   3.983  -1.081
  389    HG3  PRO  51           1HG      PRO  51   4.801   3.981   0.199
  390    HD2  PRO  51           2HD      PRO  51   7.244   4.949   0.663
  391    HD3  PRO  51           1HD      PRO  51   6.399   3.997   1.905
  392    H    GLN  52           H        GLN  52   8.458   3.061  -1.539
  393    HA   GLN  52           HA       GLN  52   8.605   1.272  -3.704
  394    HB2  GLN  52           2HB      GLN  52  10.242   2.818  -4.653
  395    HB3  GLN  52           1HB      GLN  52   8.891   3.694  -3.949
  396    HG2  GLN  52           2HG      GLN  52  10.265   4.143  -1.943
  397    HG3  GLN  52           1HG      GLN  52  11.622   3.331  -2.722
  398   HE21  GLN  52          1HE2      GLN  52  12.617   4.319  -4.502
  399   HE22  GLN  52          2HE2      GLN  52  12.419   6.004  -4.832
  400    H    SER  53           H        SER  53  10.540   1.523  -0.841
  401    HA   SER  53           HA       SER  53  12.886   0.197  -1.755
  402    HB2  SER  53           2HB      SER  53  12.953   1.496   0.296
  403    HB3  SER  53           1HB      SER  53  11.723   0.471   1.033
  404    HG   SER  53           HG       SER  53  14.371  -0.265   0.300
  405    H    VAL  54           H        VAL  54   9.958  -0.962  -0.114
  406    HA   VAL  54           HA       VAL  54  10.824  -3.701  -0.038
  407    HB   VAL  54           HB       VAL  54   8.022  -2.615   0.347
  408   HG11  VAL  54          1HG1      VAL  54   9.285  -5.229   1.197
  409   HG12  VAL  54          2HG1      VAL  54   8.036  -5.014  -0.032
  410   HG13  VAL  54          3HG1      VAL  54   7.674  -4.680   1.662
  411   HG21  VAL  54          3HG2      VAL  54  10.166  -3.117   2.421
  412   HG22  VAL  54          1HG2      VAL  54   8.511  -2.595   2.740
  413   HG23  VAL  54          2HG2      VAL  54   9.617  -1.533   1.870
  414    H    GLY  55           H        GLY  55   8.442  -1.898  -1.993
  415    HA2  GLY  55           2HA      GLY  55   8.344  -2.322  -4.385
  416    HA3  GLY  55           1HA      GLY  55   8.664  -4.014  -4.051
  417    H    TRP  56           H        TRP  56   6.961  -5.339  -3.271
  418    HA   TRP  56           HA       TRP  56   4.271  -4.242  -3.809
  419    HB2  TRP  56           2HB      TRP  56   5.396  -7.018  -4.225
  420    HB3  TRP  56           1HB      TRP  56   3.672  -6.660  -4.307
  421    HD1  TRP  56           HD1      TRP  56   6.917  -5.353  -6.013
  422    HE1  TRP  56           HE1      TRP  56   6.356  -4.857  -8.475
  423    HE3  TRP  56           HE3      TRP  56   1.938  -6.485  -5.945
  424    HZ2  TRP  56           HZ2      TRP  56   4.101  -4.947 -10.168
  425    HZ3  TRP  56           HZ3      TRP  56   0.644  -6.257  -8.029
  426    HH2  TRP  56           HH2      TRP  56   1.706  -5.503 -10.095
  427    H    MET  57           H        MET  57   3.104  -3.929  -2.030
  428    HA   MET  57           HA       MET  57   3.269  -5.922   0.149
  429    HB2  MET  57           2HB      MET  57   2.835  -2.937   0.443
  430    HB3  MET  57           1HB      MET  57   2.782  -4.106   1.753
  431    HG2  MET  57           2HG      MET  57   4.890  -2.997   1.824
  432    HG3  MET  57           1HG      MET  57   5.161  -4.655   1.295
  433    HE1  MET  57           3HE      MET  57   3.732  -1.707  -0.927
  434    HE2  MET  57           1HE      MET  57   5.233  -1.012  -1.538
  435    HE3  MET  57           2HE      MET  57   4.855  -0.922   0.182
  436    HA   PRO  58           HA       PRO  58  -1.180  -6.152  -0.439
  437    HB2  PRO  58           2HB      PRO  58  -1.779  -7.769   1.631
  438    HB3  PRO  58           1HB      PRO  58  -0.934  -8.361   0.195
  439    HG2  PRO  58           2HG      PRO  58   0.190  -7.608   2.873
  440    HG3  PRO  58           1HG      PRO  58   0.589  -8.994   1.843
  441    HD2  PRO  58           2HD      PRO  58   2.094  -6.703   1.965
  442    HD3  PRO  58           1HD      PRO  58   2.040  -7.774   0.550
  443    H    GLY  59           H        GLY  59  -2.660  -4.650   0.109
  444    HA2  GLY  59           2HA      GLY  59  -2.912  -3.822   2.917
  445    HA3  GLY  59           1HA      GLY  59  -2.581  -2.577   1.725
  446    H    LEU  60           H        LEU  60  -4.797  -2.336   3.255
  447    HA   LEU  60           HA       LEU  60  -7.052  -3.232   1.575
  448    HB2  LEU  60           2HB      LEU  60  -7.188  -3.785   3.959
  449    HB3  LEU  60           1HB      LEU  60  -7.018  -2.089   4.377
  450    HG   LEU  60           HG       LEU  60  -9.185  -1.626   3.238
  451   HD11  LEU  60          1HD1      LEU  60  -9.201  -3.479   1.658
  452   HD12  LEU  60          2HD1      LEU  60 -10.654  -3.497   2.655
  453   HD13  LEU  60          3HD1      LEU  60  -9.343  -4.631   2.987
  454   HD21  LEU  60          3HD2      LEU  60  -9.320  -3.733   5.396
  455   HD22  LEU  60          1HD2      LEU  60 -10.602  -2.599   4.966
  456   HD23  LEU  60          2HD2      LEU  60  -9.093  -2.002   5.656
  457    H    ASN  61           H        ASN  61  -7.958  -1.815   0.210
  458    HA   ASN  61           HA       ASN  61  -7.345   1.018   0.389
  459    HB2  ASN  61           2HB      ASN  61  -7.336   0.009  -1.815
  460    HB3  ASN  61           1HB      ASN  61  -8.985  -0.572  -1.602
  461   HD21  ASN  61          1HD2      ASN  61  -7.012   2.301  -1.955
  462   HD22  ASN  61          2HD2      ASN  61  -8.283   3.325  -2.510
  463    H    GLU  62           H        GLU  62  -8.539   2.420   1.527
  464    HA   GLU  62           HA       GLU  62 -10.843   1.594   2.950
  465    HB2  GLU  62           2HB      GLU  62  -9.597   4.316   2.558
  466    HB3  GLU  62           1HB      GLU  62 -10.959   4.024   3.632
  467    HG2  GLU  62           2HG      GLU  62  -8.329   2.580   3.886
  468    HG3  GLU  62           1HG      GLU  62  -8.683   4.095   4.712
  469    H    ARG  63           H        ARG  63 -10.484   3.381  -0.059
  470    HA   ARG  63           HA       ARG  63 -13.077   4.466  -0.239
  471    HB2  ARG  63           2HB      ARG  63 -11.031   4.970  -1.681
  472    HB3  ARG  63           1HB      ARG  63 -11.424   3.517  -2.583
  473    HG2  ARG  63           2HG      ARG  63 -12.367   5.203  -3.861
  474    HG3  ARG  63           1HG      ARG  63 -13.740   4.616  -2.924
  475    HD2  ARG  63           2HD      ARG  63 -12.060   6.999  -2.140
  476    HD3  ARG  63           1HD      ARG  63 -13.544   7.115  -3.078
  477    HE   ARG  63           HE       ARG  63 -14.669   6.100  -1.100
  478   HH11  ARG  63          1HH1      ARG  63 -11.635   7.676  -0.651
  479   HH12  ARG  63          2HH1      ARG  63 -12.045   8.245   0.929
  480   HH21  ARG  63          1HH2      ARG  63 -15.170   6.812   0.927
  481   HH22  ARG  63          2HH2      ARG  63 -14.021   7.743   1.823
  482    H    THR  64           H        THR  64 -11.778   1.414  -1.538
  483    HA   THR  64           HA       THR  64 -14.464   0.654  -2.480
  484    HB   THR  64           HB       THR  64 -13.308  -1.023  -3.868
  485    HG1  THR  64           HG1      THR  64 -10.790   0.054  -3.391
  486   HG21  THR  64          3HG2      THR  64 -12.160   1.767  -4.128
  487   HG22  THR  64          1HG2      THR  64 -13.687   1.202  -4.807
  488   HG23  THR  64          2HG2      THR  64 -12.162   0.538  -5.394
  489    H    ARG  65           H        ARG  65 -12.208  -0.160  -0.019
  490    HA   ARG  65           HA       ARG  65 -12.070  -1.798   1.546
  491    HB2  ARG  65           2HB      ARG  65 -14.846  -2.380   0.540
  492    HB3  ARG  65           1HB      ARG  65 -14.075  -3.471   1.680
  493    HG2  ARG  65           2HG      ARG  65 -15.491  -1.947   2.878
  494    HG3  ARG  65           1HG      ARG  65 -13.806  -1.587   3.258
  495    HD2  ARG  65           2HD      ARG  65 -15.157   0.442   2.904
  496    HD3  ARG  65           1HD      ARG  65 -13.828   0.303   1.753
  497    HE   ARG  65           HE       ARG  65 -15.699  -0.695   0.264
  498   HH11  ARG  65          1HH1      ARG  65 -16.126   1.837   2.557
  499   HH12  ARG  65          2HH1      ARG  65 -17.329   2.635   1.608
  500   HH21  ARG  65          1HH2      ARG  65 -17.240   0.343  -0.947
  501   HH22  ARG  65          2HH2      ARG  65 -17.957   1.799  -0.350
  502    H    GLN  66           H        GLN  66 -11.343  -2.188  -1.419
  503    HA   GLN  66           HA       GLN  66 -11.342  -5.078  -1.700
  504    HB2  GLN  66           2HB      GLN  66 -10.083  -2.884  -3.355
  505    HB3  GLN  66           1HB      GLN  66  -9.964  -4.593  -3.752
  506    HG2  GLN  66           2HG      GLN  66 -12.369  -4.731  -4.027
  507    HG3  GLN  66           1HG      GLN  66 -12.546  -3.049  -3.534
  508   HE21  GLN  66          1HE2      GLN  66  -9.936  -4.166  -5.581
  509   HE22  GLN  66          2HE2      GLN  66 -10.470  -3.366  -7.013
  510    H    ARG  67           H        ARG  67  -9.529  -6.423  -1.666
  511    HA   ARG  67           HA       ARG  67  -7.146  -5.334  -0.297
  512    HB2  ARG  67           2HB      ARG  67  -8.188  -8.180  -0.381
  513    HB3  ARG  67           1HB      ARG  67  -6.743  -7.649   0.469
  514    HG2  ARG  67           2HG      ARG  67  -8.123  -6.240   1.930
  515    HG3  ARG  67           1HG      ARG  67  -9.570  -6.780   1.074
  516    HD2  ARG  67           2HD      ARG  67  -9.246  -8.009   3.174
  517    HD3  ARG  67           1HD      ARG  67  -9.159  -9.075   1.772
  518    HE   ARG  67           HE       ARG  67  -6.731  -8.066   3.109
  519   HH11  ARG  67          1HH1      ARG  67  -8.622 -10.677   1.875
  520   HH12  ARG  67          2HH1      ARG  67  -7.380 -11.845   2.163
  521   HH21  ARG  67          1HH2      ARG  67  -5.155  -9.585   3.466
  522   HH22  ARG  67          2HH2      ARG  67  -5.448 -11.236   3.040
  523    H    GLY  68           H        GLY  68  -5.064  -5.969  -1.037
  524    HA2  GLY  68           2HA      GLY  68  -4.500  -7.838  -3.021
  525    HA3  GLY  68           1HA      GLY  68  -4.814  -6.324  -3.850
  526    H    ASP  69           H        ASP  69  -2.383  -7.633  -4.026
  527    HA   ASP  69           HA       ASP  69  -0.488  -6.210  -2.329
  528    HB2  ASP  69           2HB      ASP  69   0.018  -8.077  -4.669
  529    HB3  ASP  69           1HB      ASP  69   1.223  -7.499  -3.520
  530    H    PHE  70           H        PHE  70  -0.081  -4.120  -2.835
  531    HA   PHE  70           HA       PHE  70  -0.220  -3.325  -5.670
  532    HB2  PHE  70           2HB      PHE  70  -0.632  -1.033  -4.865
  533    HB3  PHE  70           1HB      PHE  70  -1.832  -2.168  -4.264
  534    HD1  PHE  70           HD1      PHE  70  -1.911  -2.765  -1.898
  535    HD2  PHE  70           HD2      PHE  70   0.926   0.056  -3.365
  536    HE1  PHE  70           HE1      PHE  70  -1.482  -2.003   0.400
  537    HE2  PHE  70           HE2      PHE  70   1.359   0.817  -1.067
  538    HZ   PHE  70           HZ       PHE  70   0.155  -0.212   0.818
  539    HA   PRO  71           HA       PRO  71   4.145  -2.293  -5.656
  540    HB2  PRO  71           2HB      PRO  71   4.154  -0.555  -7.761
  541    HB3  PRO  71           1HB      PRO  71   4.054  -2.310  -7.956
  542    HG2  PRO  71           2HG      PRO  71   1.856  -0.269  -8.022
  543    HG3  PRO  71           1HG      PRO  71   2.121  -1.663  -9.087
  544    HD2  PRO  71           2HD      PRO  71   0.328  -1.710  -7.055
  545    HD3  PRO  71           1HD      PRO  71   1.221  -3.156  -7.569
  546    H    GLY  72           H        GLY  72   4.651  -1.116  -3.879
  547    HA2  GLY  72           2HA      GLY  72   3.324   1.184  -2.990
  548    HA3  GLY  72           1HA      GLY  72   4.874   0.618  -2.404
  549    H    THR  73           H        THR  73   5.855   0.991  -5.342
  550    HA   THR  73           HA       THR  73   7.132   3.454  -4.968
  551    HB   THR  73           HB       THR  73   6.609   2.002  -7.575
  552    HG1  THR  73           HG1      THR  73   8.321   0.817  -7.074
  553   HG21  THR  73          3HG2      THR  73   8.665   4.129  -6.935
  554   HG22  THR  73          1HG2      THR  73   7.255   4.338  -7.976
  555   HG23  THR  73          2HG2      THR  73   8.544   3.233  -8.448
  556    H    TYR  74           H        TYR  74   3.953   2.797  -6.197
  557    HA   TYR  74           HA       TYR  74   3.753   5.475  -7.397
  558    HB2  TYR  74           2HB      TYR  74   1.837   3.143  -7.598
  559    HB3  TYR  74           1HB      TYR  74   1.735   4.657  -8.497
  560    HD1  TYR  74           HD2      TYR  74   3.821   5.249  -9.972
  561    HD2  TYR  74           HD1      TYR  74   2.966   1.330  -8.544
  562    HE1  TYR  74           HE2      TYR  74   5.260   4.299 -11.726
  563    HE2  TYR  74           HE1      TYR  74   4.408   0.374 -10.286
  564    HH   TYR  74           HH       TYR  74   5.217   1.115 -12.621
  565    H    VAL  75           H        VAL  75   3.421   4.465  -4.398
  566    HA   VAL  75           HA       VAL  75   1.191   6.327  -3.865
  567    HB   VAL  75           HB       VAL  75   0.482   5.010  -1.926
  568   HG11  VAL  75          1HG1      VAL  75   0.529   3.375  -4.468
  569   HG12  VAL  75          2HG1      VAL  75  -0.648   4.620  -4.049
  570   HG13  VAL  75          3HG1      VAL  75  -0.567   3.132  -3.106
  571   HG21  VAL  75          3HG2      VAL  75   2.613   3.938  -1.383
  572   HG22  VAL  75          1HG2      VAL  75   2.498   2.948  -2.838
  573   HG23  VAL  75          2HG2      VAL  75   1.326   2.744  -1.534
  574    H    GLU  76           H        GLU  76   1.377   7.579  -1.935
  575    HA   GLU  76           HA       GLU  76   4.154   7.841  -1.004
  576    HB2  GLU  76           2HB      GLU  76   3.563  10.071  -0.257
  577    HB3  GLU  76           1HB      GLU  76   3.063   9.862  -1.929
  578    HG2  GLU  76           2HG      GLU  76   0.766   9.566  -1.257
  579    HG3  GLU  76           1HG      GLU  76   1.223   9.614   0.444
  580    H    PHE  77           H        PHE  77   4.635   8.112   1.239
  581    HA   PHE  77           HA       PHE  77   2.905   6.527   2.985
  582    HB2  PHE  77           2HB      PHE  77   5.259   5.914   2.912
  583    HB3  PHE  77           1HB      PHE  77   5.738   7.553   3.335
  584    HD1  PHE  77           HD2      PHE  77   3.940   4.569   4.624
  585    HD2  PHE  77           HD1      PHE  77   5.971   8.190   5.584
  586    HE1  PHE  77           HE2      PHE  77   3.898   3.963   7.006
  587    HE2  PHE  77           HE1      PHE  77   5.927   7.587   7.968
  588    HZ   PHE  77           HZ       PHE  77   4.890   5.472   8.681
  589    H    LEU  78           H        LEU  78   1.445   7.530   4.234
  590    HA   LEU  78           HA       LEU  78   1.615  10.361   4.800
  591    HB2  LEU  78           2HB      LEU  78  -0.386   8.297   5.742
  592    HB3  LEU  78           1HB      LEU  78  -0.548  10.034   5.927
  593    HG   LEU  78           HG       LEU  78  -0.527   8.528   3.300
  594   HD11  LEU  78          1HD1      LEU  78  -2.764   9.952   4.743
  595   HD12  LEU  78          2HD1      LEU  78  -2.591   8.207   4.549
  596   HD13  LEU  78          3HD1      LEU  78  -2.865   9.227   3.137
  597   HD21  LEU  78          3HD2      LEU  78   0.521  10.732   3.088
  598   HD22  LEU  78          1HD2      LEU  78  -0.893  11.481   3.831
  599   HD23  LEU  78          2HD2      LEU  78  -1.038  10.681   2.265
  600    H    GLY  79           H        GLY  79   1.083   7.574   6.990
  601    HA2  GLY  79           2HA      GLY  79   3.158   7.984   8.769
  602    HA3  GLY  79           1HA      GLY  79   1.873   9.055   9.308
  603    HA   PRO  80           HA       PRO  80   1.264   4.689  11.039
  604    HB2  PRO  80           2HB      PRO  80   1.526   5.912  13.692
  605    HB3  PRO  80           1HB      PRO  80   2.414   4.554  12.999
  606    HG2  PRO  80           2HG      PRO  80   3.569   6.956  13.464
  607    HG3  PRO  80           1HG      PRO  80   4.058   5.912  12.117
  608    HD2  PRO  80           2HD      PRO  80   2.267   8.324  12.091
  609    HD3  PRO  80           1HD      PRO  80   3.551   7.861  10.950
  610    H    LEU  81           H        LEU  81  -0.502   3.924  12.423
  611    HA   LEU  81           HA       LEU  81  -2.880   5.533  12.190
  612    HB2  LEU  81           2HB      LEU  81  -2.392   2.803  13.391
  613    HB3  LEU  81           1HB      LEU  81  -3.974   3.556  13.313
  614    HG   LEU  81           HG       LEU  81  -2.276   2.827  10.918
  615   HD11  LEU  81          1HD1      LEU  81  -4.742   1.508  12.055
  616   HD12  LEU  81          2HD1      LEU  81  -3.109   0.840  12.033
  617   HD13  LEU  81          3HD1      LEU  81  -3.976   1.097  10.519
  618   HD21  LEU  81          3HD2      LEU  81  -4.255   3.370   9.602
  619   HD22  LEU  81          1HD2      LEU  81  -3.706   4.775  10.515
  620   HD23  LEU  81          2HD2      LEU  81  -5.110   3.860  11.065
  621    H    GLU  82           H        GLU  82  -4.227   6.266  13.854
  622    HA   GLU  82           HA       GLU  82  -3.580   5.970  16.628
  623    HB2  GLU  82           2HB      GLU  82  -1.885   7.663  15.970
  624    HB3  GLU  82           1HB      GLU  82  -3.176   8.721  15.414
  625    HG2  GLU  82           2HG      GLU  82  -4.064   8.830  17.698
  626    HG3  GLU  82           1HG      GLU  82  -2.763   7.775  18.249
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -11.790   0.793  15.185
    2    H2   MET   1           2H       MET   1 -12.693   0.442  16.567
    3    H3   MET   1           3H       MET   1 -11.124  -0.167  16.408
    4    HA   MET   1           HA       MET   1 -11.853   2.701  16.642
    5    HB2  MET   1           2HB      MET   1 -10.612   0.780  18.625
    6    HB3  MET   1           1HB      MET   1 -10.654   2.525  18.848
    7    HG2  MET   1           2HG      MET   1 -12.429   1.370  20.086
    8    HG3  MET   1           1HG      MET   1 -13.061   2.508  18.899
    9    HE1  MET   1           3HE      MET   1 -15.747  -0.369  18.941
   10    HE2  MET   1           1HE      MET   1 -15.459   1.356  19.174
   11    HE3  MET   1           2HE      MET   1 -14.800   0.188  20.320
   12    H    ALA   2           H        ALA   2  -9.520   3.585  17.793
   13    HA   ALA   2           HA       ALA   2  -7.690   3.488  15.539
   14    HB1  ALA   2           3HB      ALA   2  -7.577   5.103  18.086
   15    HB2  ALA   2           1HB      ALA   2  -8.258   5.635  16.549
   16    HB3  ALA   2           2HB      ALA   2  -6.528   5.314  16.683
   17    H    GLY   3           H        GLY   3  -5.219   3.683  16.330
   18    HA2  GLY   3           2HA      GLY   3  -3.916   2.482  18.265
   19    HA3  GLY   3           1HA      GLY   3  -4.682   1.068  17.559
   20    HA   PRO   4           HA       PRO   4  -0.767   2.477  15.115
   21    HB2  PRO   4           2HB      PRO   4   1.308   1.445  16.492
   22    HB3  PRO   4           1HB      PRO   4   0.639   3.037  16.876
   23    HG2  PRO   4           2HG      PRO   4   0.142   0.400  18.222
   24    HG3  PRO   4           1HG      PRO   4   0.468   1.982  18.955
   25    HD2  PRO   4           2HD      PRO   4  -2.046   0.941  18.704
   26    HD3  PRO   4           1HD      PRO   4  -1.716   2.687  18.702
   27    H    GLU   5           H        GLU   5  -2.508   0.441  14.579
   28    HA   GLU   5           HA       GLU   5  -1.438  -2.184  14.750
   29    HB2  GLU   5           2HB      GLU   5  -3.554  -1.168  12.840
   30    HB3  GLU   5           1HB      GLU   5  -3.306  -2.833  13.352
   31    HG2  GLU   5           2HG      GLU   5  -4.120  -0.566  15.169
   32    HG3  GLU   5           1HG      GLU   5  -5.226  -1.736  14.454
   33    H    GLY   6           H        GLY   6  -0.870   0.391  12.537
   34    HA2  GLY   6           2HA      GLY   6   1.172  -0.994  11.163
   35    HA3  GLY   6           1HA      GLY   6  -0.281  -0.986  10.176
   36    H    PHE   7           H        PHE   7   0.462   0.334   8.562
   37    HA   PHE   7           HA       PHE   7   1.025   3.135   9.298
   38    HB2  PHE   7           2HB      PHE   7   2.486   1.524   7.184
   39    HB3  PHE   7           1HB      PHE   7   2.742   3.231   7.536
   40    HD1  PHE   7           HD1      PHE   7   3.813   3.917   9.651
   41    HD2  PHE   7           HD2      PHE   7   3.427  -0.188   8.578
   42    HE1  PHE   7           HE1      PHE   7   5.502   3.319  11.335
   43    HE2  PHE   7           HE2      PHE   7   5.116  -0.789  10.261
   44    HZ   PHE   7           HZ       PHE   7   6.157   0.967  11.643
   45    H    GLN   8           H        GLN   8   0.281   4.702   7.879
   46    HA   GLN   8           HA       GLN   8  -1.832   3.850   6.043
   47    HB2  GLN   8           2HB      GLN   8  -1.097   6.564   7.164
   48    HB3  GLN   8           1HB      GLN   8  -2.392   6.309   6.003
   49    HG2  GLN   8           2HG      GLN   8  -3.575   4.899   7.592
   50    HG3  GLN   8           1HG      GLN   8  -2.260   5.076   8.751
   51   HE21  GLN   8          1HE2      GLN   8  -5.103   5.805   8.955
   52   HE22  GLN   8          2HE2      GLN   8  -5.117   7.484   9.356
   53    H    TYR   9           H        TYR   9  -1.729   4.028   3.868
   54    HA   TYR   9           HA       TYR   9   0.472   5.609   2.674
   55    HB2  TYR   9           2HB      TYR   9  -0.646   2.966   1.698
   56    HB3  TYR   9           1HB      TYR   9   0.540   3.938   0.833
   57    HD1  TYR   9           HD2      TYR   9   2.832   4.199   1.762
   58    HD2  TYR   9           HD1      TYR   9  -0.000   1.563   3.536
   59    HE1  TYR   9           HE2      TYR   9   4.650   3.051   2.954
   60    HE2  TYR   9           HE1      TYR   9   1.811   0.416   4.737
   61    HH   TYR   9           HH       TYR   9   4.283   0.071   4.446
   62    H    ARG  10           H        ARG  10  -0.209   7.206   1.350
   63    HA   ARG  10           HA       ARG  10  -3.028   7.204   0.498
   64    HB2  ARG  10           2HB      ARG  10  -2.248   9.185   1.713
   65    HB3  ARG  10           1HB      ARG  10  -0.977   9.435   0.527
   66    HG2  ARG  10           2HG      ARG  10  -2.725   9.790  -1.206
   67    HG3  ARG  10           1HG      ARG  10  -3.950   9.660   0.057
   68    HD2  ARG  10           2HD      ARG  10  -1.722  11.704   0.009
   69    HD3  ARG  10           1HD      ARG  10  -3.374  12.005  -0.521
   70    HE   ARG  10           HE       ARG  10  -4.010  11.446   1.853
   71   HH11  ARG  10          1HH1      ARG  10  -0.878  12.692   1.100
   72   HH12  ARG  10          2HH1      ARG  10  -0.707  13.463   2.643
   73   HH21  ARG  10          1HH2      ARG  10  -3.771  12.453   3.807
   74   HH22  ARG  10          2HH2      ARG  10  -2.310  13.319   4.152
   75    H    ALA  11           H        ALA  11  -3.449   6.457  -1.494
   76    HA   ALA  11           HA       ALA  11  -1.484   6.138  -3.527
   77    HB1  ALA  11           3HB      ALA  11  -3.454   4.678  -3.334
   78    HB2  ALA  11           1HB      ALA  11  -3.323   5.397  -4.940
   79    HB3  ALA  11           2HB      ALA  11  -4.492   6.031  -3.782
   80    H    LEU  12           H        LEU  12  -0.574   7.828  -4.537
   81    HA   LEU  12           HA       LEU  12  -1.997  10.327  -4.881
   82    HB2  LEU  12           2HB      LEU  12   0.781   9.522  -5.757
   83    HB3  LEU  12           1HB      LEU  12   0.131  11.152  -5.798
   84    HG   LEU  12           HG       LEU  12   0.652   9.509  -3.311
   85   HD11  LEU  12          1HD1      LEU  12   2.375  11.168  -2.835
   86   HD12  LEU  12          2HD1      LEU  12   2.033  11.981  -4.363
   87   HD13  LEU  12          3HD1      LEU  12   2.693  10.345  -4.362
   88   HD21  LEU  12          3HD2      LEU  12   0.053  11.548  -2.078
   89   HD22  LEU  12          1HD2      LEU  12  -1.305  10.915  -3.003
   90   HD23  LEU  12          2HD2      LEU  12  -0.417  12.321  -3.591
   91    H    TYR  13           H        TYR  13  -1.122   7.597  -6.882
   92    HA   TYR  13           HA       TYR  13  -2.257   8.991  -9.232
   93    HB2  TYR  13           2HB      TYR  13  -0.035   6.935  -9.290
   94    HB3  TYR  13           1HB      TYR  13  -0.698   7.804 -10.671
   95    HD1  TYR  13           HD1      TYR  13  -0.439  10.368 -10.694
   96    HD2  TYR  13           HD2      TYR  13   1.789   7.828  -8.097
   97    HE1  TYR  13           HE1      TYR  13   1.220  12.154 -10.374
   98    HE2  TYR  13           HE2      TYR  13   3.452   9.610  -7.778
   99    HH   TYR  13           HH       TYR  13   4.249  11.618  -8.948
  100    HA   PRO  14           HA       PRO  14  -5.091   5.520  -9.329
  101    HB2  PRO  14           2HB      PRO  14  -6.106   5.930 -11.832
  102    HB3  PRO  14           1HB      PRO  14  -6.599   6.865 -10.415
  103    HG2  PRO  14           2HG      PRO  14  -4.651   7.574 -12.576
  104    HG3  PRO  14           1HG      PRO  14  -5.868   8.594 -11.789
  105    HD2  PRO  14           2HD      PRO  14  -3.230   8.688 -11.145
  106    HD3  PRO  14           1HD      PRO  14  -4.517   9.016  -9.966
  107    H    PHE  15           H        PHE  15  -4.385   3.506  -9.586
  108    HA   PHE  15           HA       PHE  15  -3.008   2.757 -12.091
  109    HB2  PHE  15           2HB      PHE  15  -1.391   2.732 -10.295
  110    HB3  PHE  15           1HB      PHE  15  -2.473   1.798  -9.268
  111    HD1  PHE  15           HD1      PHE  15  -0.491   1.644 -12.407
  112    HD2  PHE  15           HD2      PHE  15  -2.445  -0.555  -9.324
  113    HE1  PHE  15           HE1      PHE  15   0.502  -0.438 -13.263
  114    HE2  PHE  15           HE2      PHE  15  -1.449  -2.638 -10.172
  115    HZ   PHE  15           HZ       PHE  15   0.026  -2.581 -12.146
  116    H    ARG  16           H        ARG  16  -4.430   1.595 -13.266
  117    HA   ARG  16           HA       ARG  16  -6.020  -0.478 -11.902
  118    HB2  ARG  16           2HB      ARG  16  -7.327  -0.605 -14.014
  119    HB3  ARG  16           1HB      ARG  16  -7.386   0.978 -13.254
  120    HG2  ARG  16           2HG      ARG  16  -5.744   1.819 -14.865
  121    HG3  ARG  16           1HG      ARG  16  -5.669   0.227 -15.620
  122    HD2  ARG  16           2HD      ARG  16  -7.123   1.744 -16.878
  123    HD3  ARG  16           1HD      ARG  16  -8.024   0.378 -16.222
  124    HE   ARG  16           HE       ARG  16  -8.106   2.661 -14.502
  125   HH11  ARG  16          1HH1      ARG  16  -9.496   1.283 -17.334
  126   HH12  ARG  16          2HH1      ARG  16 -10.995   2.117 -17.140
  127   HH21  ARG  16          1HH2      ARG  16 -10.045   3.728 -14.257
  128   HH22  ARG  16          2HH2      ARG  16 -11.308   3.480 -15.414
  129    H    ARG  17           H        ARG  17  -5.304  -2.499 -11.968
  130    HA   ARG  17           HA       ARG  17  -3.030  -3.244 -13.543
  131    HB2  ARG  17           2HB      ARG  17  -3.393  -4.126 -11.266
  132    HB3  ARG  17           1HB      ARG  17  -4.842  -4.955 -11.819
  133    HG2  ARG  17           2HG      ARG  17  -3.143  -6.589 -11.721
  134    HG3  ARG  17           1HG      ARG  17  -3.369  -6.222 -13.430
  135    HD2  ARG  17           2HD      ARG  17  -1.425  -4.578 -13.154
  136    HD3  ARG  17           1HD      ARG  17  -1.123  -5.384 -11.613
  137    HE   ARG  17           HE       ARG  17  -1.116  -6.806 -14.196
  138   HH11  ARG  17          1HH1      ARG  17   0.158  -6.374 -11.014
  139   HH12  ARG  17          2HH1      ARG  17   1.493  -7.430 -11.305
  140   HH21  ARG  17          1HH2      ARG  17   0.580  -8.170 -14.521
  141   HH22  ARG  17          2HH2      ARG  17   1.741  -8.426 -13.271
  142    H    GLU  18           H        GLU  18  -2.901  -4.825 -15.182
  143    HA   GLU  18           HA       GLU  18  -4.875  -4.985 -17.131
  144    HB2  GLU  18           2HB      GLU  18  -2.784  -7.104 -16.554
  145    HB3  GLU  18           1HB      GLU  18  -3.606  -6.837 -18.084
  146    HG2  GLU  18           2HG      GLU  18  -1.706  -4.908 -16.757
  147    HG3  GLU  18           1HG      GLU  18  -1.310  -5.988 -18.090
  148    H    ARG  19           H        ARG  19  -4.104  -7.342 -14.590
  149    HA   ARG  19           HA       ARG  19  -6.693  -8.679 -15.014
  150    HB2  ARG  19           2HB      ARG  19  -4.154  -9.567 -13.630
  151    HB3  ARG  19           1HB      ARG  19  -5.656 -10.479 -13.565
  152    HG2  ARG  19           2HG      ARG  19  -4.167  -9.796 -16.098
  153    HG3  ARG  19           1HG      ARG  19  -4.060 -11.335 -15.240
  154    HD2  ARG  19           2HD      ARG  19  -6.543 -10.142 -16.490
  155    HD3  ARG  19           1HD      ARG  19  -5.615 -11.512 -17.100
  156    HE   ARG  19           HE       ARG  19  -6.432 -12.072 -14.475
  157   HH11  ARG  19          1HH1      ARG  19  -7.765 -11.735 -17.640
  158   HH12  ARG  19          2HH1      ARG  19  -9.108 -12.766 -17.295
  159   HH21  ARG  19          1HH2      ARG  19  -8.168 -13.378 -14.053
  160   HH22  ARG  19          2HH2      ARG  19  -9.324 -13.694 -15.300
  161    HA   PRO  20           HA       PRO  20  -8.196  -7.104 -11.098
  162    HB2  PRO  20           2HB      PRO  20 -10.036  -8.986 -10.471
  163    HB3  PRO  20           1HB      PRO  20 -10.267  -7.849 -11.804
  164    HG2  PRO  20           2HG      PRO  20  -9.322 -10.697 -11.885
  165    HG3  PRO  20           1HG      PRO  20 -10.513  -9.886 -12.924
  166    HD2  PRO  20           2HD      PRO  20  -7.933 -10.292 -13.685
  167    HD3  PRO  20           1HD      PRO  20  -8.882  -8.892 -14.228
  168    H    GLU  21           H        GLU  21  -6.123  -9.627 -11.302
  169    HA   GLU  21           HA       GLU  21  -6.360 -10.963  -8.822
  170    HB2  GLU  21           2HB      GLU  21  -5.159 -11.940 -10.676
  171    HB3  GLU  21           1HB      GLU  21  -4.020 -10.604 -10.702
  172    HG2  GLU  21           2HG      GLU  21  -3.068 -11.294  -8.608
  173    HG3  GLU  21           1HG      GLU  21  -4.311 -12.528  -8.401
  174    H    ASP  22           H        ASP  22  -4.626  -8.044  -9.777
  175    HA   ASP  22           HA       ASP  22  -3.331  -7.722  -7.205
  176    HB2  ASP  22           2HB      ASP  22  -3.518  -5.852  -9.584
  177    HB3  ASP  22           1HB      ASP  22  -2.500  -5.596  -8.171
  178    H    LEU  23           H        LEU  23  -3.573  -4.918  -6.847
  179    HA   LEU  23           HA       LEU  23  -6.463  -4.510  -6.359
  180    HB2  LEU  23           2HB      LEU  23  -5.257  -4.990  -4.261
  181    HB3  LEU  23           1HB      LEU  23  -4.181  -3.642  -4.573
  182    HG   LEU  23           HG       LEU  23  -6.094  -2.080  -4.388
  183   HD11  LEU  23          1HD1      LEU  23  -7.882  -3.579  -5.105
  184   HD12  LEU  23          2HD1      LEU  23  -8.244  -2.876  -3.529
  185   HD13  LEU  23          3HD1      LEU  23  -7.676  -4.542  -3.641
  186   HD21  LEU  23          3HD2      LEU  23  -5.769  -3.920  -2.014
  187   HD22  LEU  23          1HD2      LEU  23  -6.409  -2.277  -1.967
  188   HD23  LEU  23          2HD2      LEU  23  -4.728  -2.556  -2.420
  189    H    GLU  24           H        GLU  24  -7.277  -2.764  -7.342
  190    HA   GLU  24           HA       GLU  24  -5.611  -0.964  -8.805
  191    HB2  GLU  24           2HB      GLU  24  -8.585  -0.770  -8.259
  192    HB3  GLU  24           1HB      GLU  24  -7.698   0.164  -9.453
  193    HG2  GLU  24           2HG      GLU  24  -8.649  -1.479 -10.751
  194    HG3  GLU  24           1HG      GLU  24  -7.055  -2.157 -10.433
  195    H    LEU  25           H        LEU  25  -5.050   1.127  -8.430
  196    HA   LEU  25           HA       LEU  25  -5.598   2.213  -5.741
  197    HB2  LEU  25           2HB      LEU  25  -3.371   2.861  -7.687
  198    HB3  LEU  25           1HB      LEU  25  -3.573   3.592  -6.104
  199    HG   LEU  25           HG       LEU  25  -3.022   0.663  -6.622
  200   HD11  LEU  25          1HD1      LEU  25  -1.223   2.847  -5.559
  201   HD12  LEU  25          2HD1      LEU  25  -1.085   2.053  -7.128
  202   HD13  LEU  25          3HD1      LEU  25  -0.818   1.132  -5.651
  203   HD21  LEU  25          3HD2      LEU  25  -3.216   2.208  -4.031
  204   HD22  LEU  25          1HD2      LEU  25  -2.725   0.521  -4.190
  205   HD23  LEU  25          2HD2      LEU  25  -4.366   1.004  -4.615
  206    H    LEU  26           H        LEU  26  -6.557   4.183  -5.470
  207    HA   LEU  26           HA       LEU  26  -7.133   5.807  -7.873
  208    HB2  LEU  26           2HB      LEU  26  -8.876   5.119  -5.522
  209    HB3  LEU  26           1HB      LEU  26  -9.140   6.619  -6.384
  210    HG   LEU  26           HG       LEU  26 -10.683   4.928  -7.182
  211   HD11  LEU  26          1HD1      LEU  26 -10.211   5.012  -9.569
  212   HD12  LEU  26          2HD1      LEU  26  -8.543   5.475  -9.236
  213   HD13  LEU  26          3HD1      LEU  26  -9.861   6.561  -8.800
  214   HD21  LEU  26          3HD2      LEU  26  -9.960   2.886  -8.268
  215   HD22  LEU  26          1HD2      LEU  26  -9.347   2.937  -6.617
  216   HD23  LEU  26          2HD2      LEU  26  -8.271   3.293  -7.970
  217    HA   PRO  27           HA       PRO  27  -4.857   9.044  -5.931
  218    HB2  PRO  27           2HB      PRO  27  -6.008  11.247  -7.066
  219    HB3  PRO  27           1HB      PRO  27  -4.913  10.166  -7.936
  220    HG2  PRO  27           2HG      PRO  27  -7.912  10.238  -7.954
  221    HG3  PRO  27           1HG      PRO  27  -6.789  10.062  -9.318
  222    HD2  PRO  27           2HD      PRO  27  -8.066   7.944  -8.238
  223    HD3  PRO  27           1HD      PRO  27  -6.420   7.817  -8.888
  224    H    GLY  28           H        GLY  28  -5.081   9.527  -3.828
  225    HA2  GLY  28           2HA      GLY  28  -5.924  11.052  -2.168
  226    HA3  GLY  28           1HA      GLY  28  -7.492  10.993  -2.954
  227    H    ASP  29           H        ASP  29  -6.667   7.877  -3.024
  228    HA   ASP  29           HA       ASP  29  -8.263   7.189  -0.727
  229    HB2  ASP  29           2HB      ASP  29  -8.305   5.963  -2.934
  230    HB3  ASP  29           1HB      ASP  29  -6.709   5.328  -2.546
  231    H    VAL  30           H        VAL  30  -7.588   6.287   1.207
  232    HA   VAL  30           HA       VAL  30  -4.673   6.234   1.680
  233    HB   VAL  30           HB       VAL  30  -6.888   6.701   3.696
  234   HG11  VAL  30          1HG1      VAL  30  -4.984   5.553   4.701
  235   HG12  VAL  30          2HG1      VAL  30  -5.071   7.219   5.270
  236   HG13  VAL  30          3HG1      VAL  30  -3.883   6.766   4.047
  237   HG21  VAL  30          3HG2      VAL  30  -6.002   8.994   3.813
  238   HG22  VAL  30          1HG2      VAL  30  -6.612   8.604   2.202
  239   HG23  VAL  30          2HG2      VAL  30  -4.875   8.618   2.509
  240    H    LEU  31           H        LEU  31  -4.157   4.122   1.310
  241    HA   LEU  31           HA       LEU  31  -5.842   1.965   2.238
  242    HB2  LEU  31           2HB      LEU  31  -3.105   1.892   0.951
  243    HB3  LEU  31           1HB      LEU  31  -4.102   0.487   1.282
  244    HG   LEU  31           HG       LEU  31  -5.862   1.666  -0.235
  245   HD11  LEU  31          1HD1      LEU  31  -3.349   3.082  -1.125
  246   HD12  LEU  31          2HD1      LEU  31  -4.768   3.829  -0.388
  247   HD13  LEU  31          3HD1      LEU  31  -4.892   3.085  -1.982
  248   HD21  LEU  31          3HD2      LEU  31  -4.878   0.642  -2.230
  249   HD22  LEU  31          1HD2      LEU  31  -4.738  -0.409  -0.820
  250   HD23  LEU  31          2HD2      LEU  31  -3.333   0.493  -1.393
  251    H    VAL  32           H        VAL  32  -5.701   0.924   4.118
  252    HA   VAL  32           HA       VAL  32  -3.530   1.596   5.968
  253    HB   VAL  32           HB       VAL  32  -6.074   0.033   6.494
  254   HG11  VAL  32          1HG1      VAL  32  -4.281  -0.479   8.086
  255   HG12  VAL  32          2HG1      VAL  32  -5.582   0.427   8.858
  256   HG13  VAL  32          3HG1      VAL  32  -4.081   1.243   8.421
  257   HG21  VAL  32          3HG2      VAL  32  -6.587   2.324   5.839
  258   HG22  VAL  32          1HG2      VAL  32  -5.436   2.941   7.026
  259   HG23  VAL  32          2HG2      VAL  32  -6.888   2.096   7.561
  260    H    VAL  33           H        VAL  33  -1.779   0.332   5.946
  261    HA   VAL  33           HA       VAL  33  -2.092  -2.583   5.532
  262    HB   VAL  33           HB       VAL  33   0.396  -0.874   5.217
  263   HG11  VAL  33          1HG1      VAL  33   0.925  -3.159   5.946
  264   HG12  VAL  33          2HG1      VAL  33   1.446  -2.879   4.285
  265   HG13  VAL  33          3HG1      VAL  33  -0.019  -3.808   4.602
  266   HG21  VAL  33          3HG2      VAL  33  -1.255  -0.464   3.454
  267   HG22  VAL  33          1HG2      VAL  33  -1.336  -2.193   3.116
  268   HG23  VAL  33          2HG2      VAL  33   0.160  -1.305   2.818
  269    H    SER  34           H        SER  34  -1.478  -3.986   7.139
  270    HA   SER  34           HA       SER  34  -1.010  -2.922   9.766
  271    HB2  SER  34           2HB      SER  34  -1.089  -5.204  10.540
  272    HB3  SER  34           1HB      SER  34  -2.341  -5.006   9.315
  273    HG   SER  34           HG       SER  34  -1.412  -6.722   8.492
  274    H    ARG  35           H        ARG  35   0.824  -3.191  11.103
  275    HA   ARG  35           HA       ARG  35   3.354  -2.999   9.864
  276    HB2  ARG  35           2HB      ARG  35   2.784  -2.122  12.141
  277    HB3  ARG  35           1HB      ARG  35   2.779  -3.776  12.737
  278    HG2  ARG  35           2HG      ARG  35   5.152  -3.992  12.154
  279    HG3  ARG  35           1HG      ARG  35   5.154  -2.331  11.557
  280    HD2  ARG  35           2HD      ARG  35   6.073  -2.379  13.788
  281    HD3  ARG  35           1HD      ARG  35   4.515  -1.555  13.818
  282    HE   ARG  35           HE       ARG  35   4.687  -4.394  14.554
  283   HH11  ARG  35          1HH1      ARG  35   3.933  -1.136  15.412
  284   HH12  ARG  35          2HH1      ARG  35   3.238  -1.594  16.929
  285   HH21  ARG  35          1HH2      ARG  35   3.792  -4.947  16.495
  286   HH22  ARG  35          2HH2      ARG  35   3.163  -3.713  17.535
  287    H    ALA  36           H        ALA  36   1.642  -5.708  11.336
  288    HA   ALA  36           HA       ALA  36   3.641  -7.661  11.240
  289    HB1  ALA  36           3HB      ALA  36   1.827  -9.291  11.344
  290    HB2  ALA  36           1HB      ALA  36   0.662  -8.039  10.912
  291    HB3  ALA  36           2HB      ALA  36   1.528  -7.946  12.446
  292    H    ALA  37           H        ALA  37   1.347  -6.609   8.731
  293    HA   ALA  37           HA       ALA  37   1.913  -8.541   6.781
  294    HB1  ALA  37           3HB      ALA  37   1.182  -5.638   6.359
  295    HB2  ALA  37           1HB      ALA  37   0.049  -6.970   6.591
  296    HB3  ALA  37           2HB      ALA  37   1.065  -6.918   5.150
  297    H    LEU  38           H        LEU  38   3.449  -5.365   7.323
  298    HA   LEU  38           HA       LEU  38   5.379  -5.550   5.287
  299    HB2  LEU  38           2HB      LEU  38   5.531  -4.109   7.940
  300    HB3  LEU  38           1HB      LEU  38   6.641  -3.862   6.605
  301    HG   LEU  38           HG       LEU  38   3.678  -3.243   6.586
  302   HD11  LEU  38          1HD1      LEU  38   6.087  -1.425   6.599
  303   HD12  LEU  38          2HD1      LEU  38   4.950  -1.669   7.926
  304   HD13  LEU  38          3HD1      LEU  38   4.407  -0.911   6.430
  305   HD21  LEU  38          3HD2      LEU  38   5.763  -2.847   4.434
  306   HD22  LEU  38          1HD2      LEU  38   4.110  -2.227   4.388
  307   HD23  LEU  38          2HD2      LEU  38   4.400  -3.966   4.385
  308    H    GLN  39           H        GLN  39   5.512  -6.596   8.689
  309    HA   GLN  39           HA       GLN  39   8.144  -7.579   8.694
  310    HB2  GLN  39           2HB      GLN  39   5.713  -8.514  10.241
  311    HB3  GLN  39           1HB      GLN  39   7.348  -9.081  10.553
  312    HG2  GLN  39           2HG      GLN  39   8.041  -6.791  11.088
  313    HG3  GLN  39           1HG      GLN  39   6.396  -6.230  10.782
  314   HE21  GLN  39          1HE2      GLN  39   8.451  -8.045  12.932
  315   HE22  GLN  39          2HE2      GLN  39   7.339  -8.113  14.252
  316    H    ALA  40           H        ALA  40   5.116  -9.094   7.646
  317    HA   ALA  40           HA       ALA  40   6.164 -11.659   7.070
  318    HB1  ALA  40           3HB      ALA  40   4.162 -11.974   5.699
  319    HB2  ALA  40           1HB      ALA  40   3.828 -10.244   5.772
  320    HB3  ALA  40           2HB      ALA  40   3.758 -11.218   7.241
  321    H    LEU  41           H        LEU  41   5.874  -8.711   5.130
  322    HA   LEU  41           HA       LEU  41   6.948  -9.765   2.721
  323    HB2  LEU  41           2HB      LEU  41   6.901  -6.922   3.749
  324    HB3  LEU  41           1HB      LEU  41   7.302  -7.387   2.107
  325    HG   LEU  41           HG       LEU  41   4.620  -7.829   3.432
  326   HD11  LEU  41          1HD1      LEU  41   3.810  -6.067   1.950
  327   HD12  LEU  41          2HD1      LEU  41   5.448  -5.809   1.346
  328   HD13  LEU  41          3HD1      LEU  41   5.065  -5.463   3.033
  329   HD21  LEU  41          3HD2      LEU  41   5.130  -9.525   1.751
  330   HD22  LEU  41          1HD2      LEU  41   5.498  -8.264   0.573
  331   HD23  LEU  41          2HD2      LEU  41   3.854  -8.443   1.193
  332    H    GLY  42           H        GLY  42   8.429  -8.795   5.681
  333    HA2  GLY  42           2HA      GLY  42  10.664  -9.224   6.274
  334    HA3  GLY  42           1HA      GLY  42  11.080  -9.348   4.574
  335    H    VAL  43           H        VAL  43   9.332  -6.672   6.080
  336    HA   VAL  43           HA       VAL  43  11.375  -4.802   5.159
  337    HB   VAL  43           HB       VAL  43   8.717  -4.243   6.509
  338   HG11  VAL  43          1HG1      VAL  43  10.283  -2.399   6.795
  339   HG12  VAL  43          2HG1      VAL  43   9.016  -1.950   5.653
  340   HG13  VAL  43          3HG1      VAL  43  10.619  -2.390   5.065
  341   HG21  VAL  43          3HG2      VAL  43   7.888  -3.703   4.274
  342   HG22  VAL  43          1HG2      VAL  43   8.448  -5.374   4.344
  343   HG23  VAL  43          2HG2      VAL  43   9.448  -4.140   3.575
  344    H    ALA  44           H        ALA  44  12.830  -3.819   6.442
  345    HA   ALA  44           HA       ALA  44  12.878  -4.520   9.288
  346    HB1  ALA  44           3HB      ALA  44  14.885  -4.963   7.965
  347    HB2  ALA  44           1HB      ALA  44  15.208  -3.778   9.231
  348    HB3  ALA  44           2HB      ALA  44  15.006  -3.252   7.558
  349    H    GLU  45           H        GLU  45  13.170  -2.978  10.944
  350    HA   GLU  45           HA       GLU  45  11.658  -0.685  10.934
  351    HB2  GLU  45           2HB      GLU  45  12.486  -1.724  12.982
  352    HB3  GLU  45           1HB      GLU  45  14.133  -1.258  12.586
  353    HG2  GLU  45           2HG      GLU  45  13.216   0.197  14.290
  354    HG3  GLU  45           1HG      GLU  45  13.527   1.102  12.809
  355    H    GLY  46           H        GLY  46  11.820   1.234   9.958
  356    HA2  GLY  46           2HA      GLY  46  12.932   3.240   9.345
  357    HA3  GLY  46           1HA      GLY  46  14.465   2.383   9.380
  358    H    GLY  47           H        GLY  47  12.190   0.518   7.773
  359    HA2  GLY  47           2HA      GLY  47  13.172   1.477   5.141
  360    HA3  GLY  47           1HA      GLY  47  12.731  -0.183   5.498
  361    H    GLU  48           H        GLU  48  10.323   0.672   6.969
  362    HA   GLU  48           HA       GLU  48   8.378   0.487   4.985
  363    HB2  GLU  48           2HB      GLU  48   6.771   0.990   6.722
  364    HB3  GLU  48           1HB      GLU  48   8.041  -0.018   7.398
  365    HG2  GLU  48           2HG      GLU  48   7.678   2.954   7.787
  366    HG3  GLU  48           1HG      GLU  48   7.445   1.686   8.985
  367    H    ARG  49           H        ARG  49   9.924   3.314   6.339
  368    HA   ARG  49           HA       ARG  49   8.131   5.313   5.589
  369    HB2  ARG  49           2HB      ARG  49  10.083   6.840   5.759
  370    HB3  ARG  49           1HB      ARG  49   9.931   5.746   7.127
  371    HG2  ARG  49           2HG      ARG  49  11.636   4.264   5.955
  372    HG3  ARG  49           1HG      ARG  49  11.912   5.628   4.868
  373    HD2  ARG  49           2HD      ARG  49  13.550   5.631   6.655
  374    HD3  ARG  49           1HD      ARG  49  12.492   7.034   6.802
  375    HE   ARG  49           HE       ARG  49  11.367   5.091   8.391
  376   HH11  ARG  49          1HH1      ARG  49  14.433   6.655   8.243
  377   HH12  ARG  49          2HH1      ARG  49  14.684   6.578   9.952
  378   HH21  ARG  49          1HH2      ARG  49  11.708   4.979  10.584
  379   HH22  ARG  49          2HH2      ARG  49  13.156   5.634  11.260
  380    H    CYS  50           H        CYS  50  10.060   3.367   3.536
  381    HA   CYS  50           HA       CYS  50   9.348   5.129   1.274
  382    HB2  CYS  50           2HB      CYS  50  11.380   4.373   0.087
  383    HB3  CYS  50           1HB      CYS  50  11.757   5.246   1.567
  384    HG   CYS  50           HG       CYS  50  13.538   3.053   1.084
  385    HA   PRO  51           HA       PRO  51   7.114   1.086   0.768
  386    HB2  PRO  51           2HB      PRO  51   5.191   2.238  -0.869
  387    HB3  PRO  51           1HB      PRO  51   5.068   2.098   0.887
  388    HG2  PRO  51           2HG      PRO  51   5.943   4.435  -0.772
  389    HG3  PRO  51           1HG      PRO  51   4.896   4.408   0.663
  390    HD2  PRO  51           2HD      PRO  51   7.461   5.156   0.840
  391    HD3  PRO  51           1HD      PRO  51   6.704   4.191   2.125
  392    H    GLN  52           H        GLN  52   8.034   3.502  -1.640
  393    HA   GLN  52           HA       GLN  52   7.848   1.963  -3.962
  394    HB2  GLN  52           2HB      GLN  52   9.856   4.140  -3.332
  395    HB3  GLN  52           1HB      GLN  52   9.449   3.555  -4.941
  396    HG2  GLN  52           2HG      GLN  52   7.145   4.348  -4.642
  397    HG3  GLN  52           1HG      GLN  52   7.563   4.947  -3.038
  398   HE21  GLN  52          1HE2      GLN  52   6.566   6.398  -5.363
  399   HE22  GLN  52          2HE2      GLN  52   7.738   7.623  -5.693
  400    H    SER  53           H        SER  53  10.281   1.974  -1.451
  401    HA   SER  53           HA       SER  53  12.244   0.462  -2.916
  402    HB2  SER  53           2HB      SER  53  12.966   1.892  -1.083
  403    HB3  SER  53           1HB      SER  53  11.952   1.007   0.054
  404    HG   SER  53           HG       SER  53  13.765  -0.048   0.356
  405    H    VAL  54           H        VAL  54   9.574  -0.303  -0.764
  406    HA   VAL  54           HA       VAL  54  10.281  -3.036  -0.314
  407    HB   VAL  54           HB       VAL  54   7.567  -1.710  -0.053
  408   HG11  VAL  54          1HG1      VAL  54   8.608  -4.282   1.148
  409   HG12  VAL  54          2HG1      VAL  54   7.397  -4.144  -0.128
  410   HG13  VAL  54          3HG1      VAL  54   7.042  -3.545   1.492
  411   HG21  VAL  54          3HG2      VAL  54   9.255  -0.579   1.307
  412   HG22  VAL  54          1HG2      VAL  54   9.718  -2.120   2.031
  413   HG23  VAL  54          2HG2      VAL  54   8.109  -1.456   2.322
  414    H    GLY  55           H        GLY  55   7.662  -1.581  -2.291
  415    HA2  GLY  55           2HA      GLY  55   7.450  -2.380  -4.632
  416    HA3  GLY  55           1HA      GLY  55   7.750  -3.997  -4.012
  417    H    TRP  56           H        TRP  56   5.854  -5.038  -4.489
  418    HA   TRP  56           HA       TRP  56   3.300  -3.789  -4.068
  419    HB2  TRP  56           2HB      TRP  56   2.471  -6.211  -4.534
  420    HB3  TRP  56           1HB      TRP  56   3.205  -5.285  -5.832
  421    HD1  TRP  56           HD1      TRP  56   4.547  -7.805  -3.162
  422    HE1  TRP  56           HE1      TRP  56   6.187  -9.387  -4.354
  423    HE3  TRP  56           HE3      TRP  56   4.321  -5.826  -7.876
  424    HZ2  TRP  56           HZ2      TRP  56   7.238  -9.758  -6.941
  425    HZ3  TRP  56           HZ3      TRP  56   5.672  -6.863  -9.652
  426    HH2  TRP  56           HH2      TRP  56   7.102  -8.789  -9.191
  427    H    MET  57           H        MET  57   1.917  -3.968  -2.399
  428    HA   MET  57           HA       MET  57   2.679  -5.639  -0.096
  429    HB2  MET  57           2HB      MET  57   1.824  -2.736   0.068
  430    HB3  MET  57           1HB      MET  57   2.225  -3.776   1.427
  431    HG2  MET  57           2HG      MET  57   4.533  -3.931   0.638
  432    HG3  MET  57           1HG      MET  57   4.133  -2.895  -0.732
  433    HE1  MET  57           3HE      MET  57   2.139  -0.800   0.631
  434    HE2  MET  57           1HE      MET  57   3.422  -0.340  -0.491
  435    HE3  MET  57           2HE      MET  57   3.265   0.489   1.057
  436    HA   PRO  58           HA       PRO  58  -1.756  -6.427   0.087
  437    HB2  PRO  58           2HB      PRO  58  -1.916  -7.528   2.548
  438    HB3  PRO  58           1HB      PRO  58  -1.158  -8.377   1.196
  439    HG2  PRO  58           2HG      PRO  58   0.131  -6.836   3.422
  440    HG3  PRO  58           1HG      PRO  58   0.590  -8.409   2.743
  441    HD2  PRO  58           2HD      PRO  58   1.824  -6.067   2.065
  442    HD3  PRO  58           1HD      PRO  58   1.705  -7.455   0.965
  443    H    GLY  59           H        GLY  59  -3.353  -4.956   0.471
  444    HA2  GLY  59           2HA      GLY  59  -3.467  -3.557   3.031
  445    HA3  GLY  59           1HA      GLY  59  -3.177  -2.539   1.631
  446    H    LEU  60           H        LEU  60  -5.220  -1.652   2.707
  447    HA   LEU  60           HA       LEU  60  -7.606  -2.941   1.525
  448    HB2  LEU  60           2HB      LEU  60  -7.615  -3.153   3.961
  449    HB3  LEU  60           1HB      LEU  60  -7.366  -1.426   4.134
  450    HG   LEU  60           HG       LEU  60  -9.592  -0.998   3.164
  451   HD11  LEU  60          1HD1      LEU  60  -9.772  -2.952   1.726
  452   HD12  LEU  60          2HD1      LEU  60 -11.161  -2.832   2.802
  453   HD13  LEU  60          3HD1      LEU  60  -9.885  -4.003   3.138
  454   HD21  LEU  60          3HD2      LEU  60  -9.342  -1.221   5.594
  455   HD22  LEU  60          1HD2      LEU  60  -9.662  -2.951   5.472
  456   HD23  LEU  60          2HD2      LEU  60 -10.919  -1.787   5.049
  457    H    ASN  61           H        ASN  61  -8.387  -1.740  -0.103
  458    HA   ASN  61           HA       ASN  61  -7.842   1.095  -0.334
  459    HB2  ASN  61           2HB      ASN  61  -7.888  -0.279  -2.351
  460    HB3  ASN  61           1HB      ASN  61  -9.546  -0.767  -2.020
  461   HD21  ASN  61          1HD2      ASN  61  -7.492   1.878  -2.970
  462   HD22  ASN  61          2HD2      ASN  61  -8.741   2.851  -3.650
  463    H    GLU  62           H        GLU  62  -9.195   2.770   0.193
  464    HA   GLU  62           HA       GLU  62 -11.476   1.993   1.852
  465    HB2  GLU  62           2HB      GLU  62  -9.826   4.491   1.648
  466    HB3  GLU  62           1HB      GLU  62 -11.321   4.444   2.576
  467    HG2  GLU  62           2HG      GLU  62  -9.014   2.556   3.021
  468    HG3  GLU  62           1HG      GLU  62  -9.234   4.069   3.899
  469    H    ARG  63           H        ARG  63 -11.113   3.174  -1.302
  470    HA   ARG  63           HA       ARG  63 -13.747   4.452  -1.284
  471    HB2  ARG  63           2HB      ARG  63 -11.720   4.043  -3.492
  472    HB3  ARG  63           1HB      ARG  63 -13.298   4.786  -3.748
  473    HG2  ARG  63           2HG      ARG  63 -12.734   6.550  -2.147
  474    HG3  ARG  63           1HG      ARG  63 -11.158   5.807  -1.878
  475    HD2  ARG  63           2HD      ARG  63 -10.583   6.188  -4.233
  476    HD3  ARG  63           1HD      ARG  63 -12.160   6.937  -4.495
  477    HE   ARG  63           HE       ARG  63 -10.744   8.187  -2.369
  478   HH11  ARG  63          1HH1      ARG  63 -10.994   8.073  -5.803
  479   HH12  ARG  63          2HH1      ARG  63 -10.306   9.645  -6.008
  480   HH21  ARG  63          1HH2      ARG  63  -9.916  10.208  -2.648
  481   HH22  ARG  63          2HH2      ARG  63  -9.703  10.844  -4.244
  482    H    THR  64           H        THR  64 -12.316   1.397  -2.064
  483    HA   THR  64           HA       THR  64 -14.923   0.409  -3.074
  484    HB   THR  64           HB       THR  64 -13.710  -1.517  -3.992
  485    HG1  THR  64           HG1      THR  64 -11.210  -0.353  -3.501
  486   HG21  THR  64          3HG2      THR  64 -12.413   1.102  -4.786
  487   HG22  THR  64          1HG2      THR  64 -13.938   0.477  -5.415
  488   HG23  THR  64          2HG2      THR  64 -12.431  -0.376  -5.748
  489    H    ARG  65           H        ARG  65 -12.772   0.339  -0.447
  490    HA   ARG  65           HA       ARG  65 -12.656  -0.743   1.531
  491    HB2  ARG  65           2HB      ARG  65 -15.397  -1.887   0.970
  492    HB3  ARG  65           1HB      ARG  65 -14.634  -1.649   2.534
  493    HG2  ARG  65           2HG      ARG  65 -15.870   0.375   0.704
  494    HG3  ARG  65           1HG      ARG  65 -16.210   0.056   2.402
  495    HD2  ARG  65           2HD      ARG  65 -13.778   1.416   1.243
  496    HD3  ARG  65           1HD      ARG  65 -15.051   2.156   2.201
  497    HE   ARG  65           HE       ARG  65 -12.768   0.703   3.163
  498   HH11  ARG  65          1HH1      ARG  65 -16.003   1.635   3.942
  499   HH12  ARG  65          2HH1      ARG  65 -15.691   1.659   5.641
  500   HH21  ARG  65          1HH2      ARG  65 -12.376   0.802   5.317
  501   HH22  ARG  65          2HH2      ARG  65 -13.657   1.176   6.421
  502    H    GLN  66           H        GLN  66 -11.881  -2.098  -1.028
  503    HA   GLN  66           HA       GLN  66 -12.255  -4.935  -0.333
  504    HB2  GLN  66           2HB      GLN  66 -11.158  -3.712  -2.878
  505    HB3  GLN  66           1HB      GLN  66 -11.494  -5.417  -2.610
  506    HG2  GLN  66           2HG      GLN  66 -13.536  -3.198  -2.638
  507    HG3  GLN  66           1HG      GLN  66 -13.237  -4.347  -3.940
  508   HE21  GLN  66          1HE2      GLN  66 -15.653  -3.803  -2.335
  509   HE22  GLN  66          2HE2      GLN  66 -16.108  -5.329  -1.671
  510    H    ARG  67           H        ARG  67 -10.532  -6.373  -0.154
  511    HA   ARG  67           HA       ARG  67  -7.937  -5.212   0.544
  512    HB2  ARG  67           2HB      ARG  67  -9.120  -7.976   0.879
  513    HB3  ARG  67           1HB      ARG  67  -7.442  -7.611   1.256
  514    HG2  ARG  67           2HG      ARG  67  -9.786  -6.205   2.527
  515    HG3  ARG  67           1HG      ARG  67  -8.992  -7.624   3.215
  516    HD2  ARG  67           2HD      ARG  67  -7.662  -4.979   2.610
  517    HD3  ARG  67           1HD      ARG  67  -8.160  -5.535   4.207
  518    HE   ARG  67           HE       ARG  67  -6.275  -7.202   2.727
  519   HH11  ARG  67          1HH1      ARG  67  -6.773  -4.880   5.228
  520   HH12  ARG  67          2HH1      ARG  67  -5.287  -5.263   6.020
  521   HH21  ARG  67          1HH2      ARG  67  -4.375  -7.681   3.760
  522   HH22  ARG  67          2HH2      ARG  67  -3.939  -6.811   5.192
  523    H    GLY  68           H        GLY  68  -5.938  -6.096  -0.323
  524    HA2  GLY  68           2HA      GLY  68  -5.709  -8.014  -2.318
  525    HA3  GLY  68           1HA      GLY  68  -6.015  -6.495  -3.145
  526    H    ASP  69           H        ASP  69  -3.840  -7.254  -4.008
  527    HA   ASP  69           HA       ASP  69  -1.639  -6.228  -2.321
  528    HB2  ASP  69           2HB      ASP  69  -1.839  -8.680  -3.558
  529    HB3  ASP  69           1HB      ASP  69  -0.922  -7.759  -4.746
  530    H    PHE  70           H        PHE  70  -0.655  -4.364  -2.968
  531    HA   PHE  70           HA       PHE  70  -1.083  -3.455  -5.744
  532    HB2  PHE  70           2HB      PHE  70  -1.618  -1.202  -4.986
  533    HB3  PHE  70           1HB      PHE  70  -2.749  -2.352  -4.286
  534    HD1  PHE  70           HD1      PHE  70  -2.472  -3.028  -1.880
  535    HD2  PHE  70           HD2      PHE  70  -0.255   0.172  -3.616
  536    HE1  PHE  70           HE1      PHE  70  -1.954  -2.169   0.364
  537    HE2  PHE  70           HE2      PHE  70   0.262   1.033  -1.371
  538    HZ   PHE  70           HZ       PHE  70  -0.585  -0.138   0.622
  539    HA   PRO  71           HA       PRO  71   3.269  -2.431  -5.569
  540    HB2  PRO  71           2HB      PRO  71   3.385  -0.691  -7.665
  541    HB3  PRO  71           1HB      PRO  71   3.255  -2.442  -7.874
  542    HG2  PRO  71           2HG      PRO  71   1.100  -0.356  -7.990
  543    HG3  PRO  71           1HG      PRO  71   1.377  -1.737  -9.069
  544    HD2  PRO  71           2HD      PRO  71  -0.486  -1.795  -7.106
  545    HD3  PRO  71           1HD      PRO  71   0.417  -3.245  -7.595
  546    H    GLY  72           H        GLY  72   3.954  -1.198  -3.901
  547    HA2  GLY  72           2HA      GLY  72   2.686   1.257  -3.147
  548    HA3  GLY  72           1HA      GLY  72   4.100   0.540  -2.397
  549    H    THR  73           H        THR  73   3.954   1.379  -5.815
  550    HA   THR  73           HA       THR  73   6.111   3.315  -5.425
  551    HB   THR  73           HB       THR  73   4.887   2.324  -8.021
  552    HG1  THR  73           HG1      THR  73   7.442   1.549  -7.124
  553   HG21  THR  73          3HG2      THR  73   6.958   3.182  -9.050
  554   HG22  THR  73          1HG2      THR  73   7.461   3.823  -7.484
  555   HG23  THR  73          2HG2      THR  73   6.028   4.471  -8.283
  556    H    TYR  74           H        TYR  74   2.720   3.198  -6.222
  557    HA   TYR  74           HA       TYR  74   2.670   6.003  -7.080
  558    HB2  TYR  74           2HB      TYR  74   0.433   3.959  -7.042
  559    HB3  TYR  74           1HB      TYR  74   0.371   5.554  -7.788
  560    HD1  TYR  74           HD2      TYR  74   1.759   6.026  -9.809
  561    HD2  TYR  74           HD1      TYR  74   1.457   2.106  -8.168
  562    HE1  TYR  74           HE2      TYR  74   2.627   5.086 -11.908
  563    HE2  TYR  74           HE1      TYR  74   2.332   1.157 -10.262
  564    HH   TYR  74           HH       TYR  74   2.485   1.784 -12.648
  565    H    VAL  75           H        VAL  75   2.689   4.590  -4.182
  566    HA   VAL  75           HA       VAL  75   0.643   6.391  -3.031
  567    HB   VAL  75           HB       VAL  75   0.376   4.870  -1.167
  568   HG11  VAL  75          1HG1      VAL  75   0.197   3.405  -3.802
  569   HG12  VAL  75          2HG1      VAL  75  -1.035   4.449  -3.095
  570   HG13  VAL  75          3HG1      VAL  75  -0.616   2.926  -2.312
  571   HG21  VAL  75          3HG2      VAL  75   2.647   4.008  -0.986
  572   HG22  VAL  75          1HG2      VAL  75   2.457   3.129  -2.503
  573   HG23  VAL  75          2HG2      VAL  75   1.498   2.674  -1.094
  574    H    GLU  76           H        GLU  76   1.201   7.652  -1.245
  575    HA   GLU  76           HA       GLU  76   4.073   7.797  -0.631
  576    HB2  GLU  76           2HB      GLU  76   3.682  10.001   0.227
  577    HB3  GLU  76           1HB      GLU  76   2.860   9.881  -1.324
  578    HG2  GLU  76           2HG      GLU  76   0.727   9.623  -0.231
  579    HG3  GLU  76           1HG      GLU  76   1.505   9.566   1.350
  580    H    PHE  77           H        PHE  77   4.813   7.892   1.553
  581    HA   PHE  77           HA       PHE  77   3.283   6.236   3.379
  582    HB2  PHE  77           2HB      PHE  77   5.671   5.808   3.095
  583    HB3  PHE  77           1HB      PHE  77   6.049   7.450   3.595
  584    HD1  PHE  77           HD2      PHE  77   4.217   4.447   4.891
  585    HD2  PHE  77           HD1      PHE  77   6.747   7.765   5.768
  586    HE1  PHE  77           HE2      PHE  77   4.435   3.676   7.209
  587    HE2  PHE  77           HE1      PHE  77   6.959   6.988   8.091
  588    HZ   PHE  77           HZ       PHE  77   5.803   4.939   8.811
  589    H    LEU  78           H        LEU  78   1.708   7.242   4.507
  590    HA   LEU  78           HA       LEU  78   1.878  10.012   5.272
  591    HB2  LEU  78           2HB      LEU  78  -0.118   7.898   6.102
  592    HB3  LEU  78           1HB      LEU  78  -0.283   9.624   6.375
  593    HG   LEU  78           HG       LEU  78  -0.297   8.211   3.703
  594   HD11  LEU  78          1HD1      LEU  78  -2.386   8.011   4.933
  595   HD12  LEU  78          2HD1      LEU  78  -2.579   9.074   3.539
  596   HD13  LEU  78          3HD1      LEU  78  -2.440   9.759   5.159
  597   HD21  LEU  78          3HD2      LEU  78   0.895  10.313   3.490
  598   HD22  LEU  78          1HD2      LEU  78  -0.414  11.169   4.304
  599   HD23  LEU  78          2HD2      LEU  78  -0.688  10.432   2.726
  600    H    GLY  79           H        GLY  79   2.228   6.911   6.924
  601    HA2  GLY  79           2HA      GLY  79   4.054   7.094   8.695
  602    HA3  GLY  79           1HA      GLY  79   3.033   8.346   9.383
  603    HA   PRO  80           HA       PRO  80   1.869   4.208  11.306
  604    HB2  PRO  80           2HB      PRO  80   2.509   5.564  13.839
  605    HB3  PRO  80           1HB      PRO  80   3.080   4.008  13.232
  606    HG2  PRO  80           2HG      PRO  80   4.699   6.162  13.412
  607    HG3  PRO  80           1HG      PRO  80   4.877   4.947  12.133
  608    HD2  PRO  80           2HD      PRO  80   3.600   7.662  12.000
  609    HD3  PRO  80           1HD      PRO  80   4.665   6.857  10.826
  610    H    LEU  81           H        LEU  81  -0.111   3.845  12.343
  611    HA   LEU  81           HA       LEU  81  -1.982   6.017  12.355
  612    HB2  LEU  81           2HB      LEU  81  -2.223   3.120  13.174
  613    HB3  LEU  81           1HB      LEU  81  -3.551   4.256  13.331
  614    HG   LEU  81           HG       LEU  81  -3.461   4.646  10.869
  615   HD11  LEU  81          1HD1      LEU  81  -2.238   3.087   9.451
  616   HD12  LEU  81          2HD1      LEU  81  -1.503   2.354  10.877
  617   HD13  LEU  81          3HD1      LEU  81  -1.142   4.029  10.460
  618   HD21  LEU  81          3HD2      LEU  81  -5.070   3.085  11.793
  619   HD22  LEU  81          1HD2      LEU  81  -3.875   1.786  11.736
  620   HD23  LEU  81          2HD2      LEU  81  -4.473   2.500  10.239
  621    H    GLU  82           H        GLU  82  -3.187   6.796  14.123
  622    HA   GLU  82           HA       GLU  82  -1.641   7.384  16.421
  623    HB2  GLU  82           2HB      GLU  82  -3.731   8.542  17.203
  624    HB3  GLU  82           1HB      GLU  82  -3.161   9.030  15.614
  625    HG2  GLU  82           2HG      GLU  82  -4.842   7.511  14.597
  626    HG3  GLU  82           1HG      GLU  82  -5.463   7.177  16.212
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  -8.180   6.553  19.733
    2    H2   MET   1           2H       MET   1  -8.048   4.962  20.282
    3    H3   MET   1           3H       MET   1  -8.571   5.270  18.705
    4    HA   MET   1           HA       MET   1  -6.413   6.252  18.175
    5    HB2  MET   1           2HB      MET   1  -5.953   6.799  20.627
    6    HB3  MET   1           1HB      MET   1  -5.522   5.108  20.835
    7    HG2  MET   1           2HG      MET   1  -3.499   6.273  20.538
    8    HG3  MET   1           1HG      MET   1  -3.809   5.445  19.012
    9    HE1  MET   1           3HE      MET   1  -2.092   8.700  17.740
   10    HE2  MET   1           1HE      MET   1  -2.104   6.937  17.697
   11    HE3  MET   1           2HE      MET   1  -1.682   7.779  19.187
   12    H    ALA   2           H        ALA   2  -6.047   4.819  16.579
   13    HA   ALA   2           HA       ALA   2  -5.952   1.957  17.041
   14    HB1  ALA   2           3HB      ALA   2  -5.533   1.791  14.634
   15    HB2  ALA   2           1HB      ALA   2  -5.361   3.544  14.535
   16    HB3  ALA   2           2HB      ALA   2  -6.916   2.833  14.965
   17    H    GLY   3           H        GLY   3  -3.660   4.537  16.183
   18    HA2  GLY   3           2HA      GLY   3  -1.392   4.709  16.389
   19    HA3  GLY   3           1HA      GLY   3  -1.555   3.593  17.728
   20    HA   PRO   4           HA       PRO   4   1.245   1.191  15.277
   21    HB2  PRO   4           2HB      PRO   4   1.547  -0.923  16.912
   22    HB3  PRO   4           1HB      PRO   4   2.151   0.684  17.335
   23    HG2  PRO   4           2HG      PRO   4  -0.376  -0.677  18.212
   24    HG3  PRO   4           1HG      PRO   4   0.801   0.224  19.185
   25    HD2  PRO   4           2HD      PRO   4  -1.537   1.313  18.288
   26    HD3  PRO   4           1HD      PRO   4  -0.068   2.268  18.572
   27    H    GLU   5           H        GLU   5  -1.856   0.678  14.933
   28    HA   GLU   5           HA       GLU   5  -2.202  -2.030  14.288
   29    HB2  GLU   5           2HB      GLU   5  -3.443   0.480  13.159
   30    HB3  GLU   5           1HB      GLU   5  -3.897  -1.117  12.575
   31    HG2  GLU   5           2HG      GLU   5  -4.117  -0.211  15.445
   32    HG3  GLU   5           1HG      GLU   5  -5.440  -0.203  14.279
   33    H    GLY   6           H        GLY   6  -0.565   0.529  12.568
   34    HA2  GLY   6           2HA      GLY   6   1.129  -0.961  11.058
   35    HA3  GLY   6           1HA      GLY   6  -0.334  -0.926  10.085
   36    H    PHE   7           H        PHE   7   0.562   0.280   8.415
   37    HA   PHE   7           HA       PHE   7   0.971   3.130   9.036
   38    HB2  PHE   7           2HB      PHE   7   2.678   1.461   7.167
   39    HB3  PHE   7           1HB      PHE   7   2.757   3.215   7.291
   40    HD1  PHE   7           HD1      PHE   7   3.583   4.274   9.377
   41    HD2  PHE   7           HD2      PHE   7   3.732   0.057   8.785
   42    HE1  PHE   7           HE1      PHE   7   5.205   4.075  11.214
   43    HE2  PHE   7           HE2      PHE   7   5.364  -0.144  10.615
   44    HZ   PHE   7           HZ       PHE   7   6.100   1.865  11.834
   45    H    GLN   8           H        GLN   8  -0.011   4.544   7.667
   46    HA   GLN   8           HA       GLN   8  -1.728   3.410   5.586
   47    HB2  GLN   8           2HB      GLN   8  -1.694   6.120   6.923
   48    HB3  GLN   8           1HB      GLN   8  -2.775   5.707   5.600
   49    HG2  GLN   8           2HG      GLN   8  -3.747   3.910   6.967
   50    HG3  GLN   8           1HG      GLN   8  -2.678   4.359   8.295
   51   HE21  GLN   8          1HE2      GLN   8  -5.613   4.336   8.135
   52   HE22  GLN   8          2HE2      GLN   8  -6.116   5.940   8.528
   53    H    TYR   9           H        TYR   9  -1.303   3.572   3.496
   54    HA   TYR   9           HA       TYR   9   0.584   5.637   2.527
   55    HB2  TYR   9           2HB      TYR   9  -0.050   2.943   1.284
   56    HB3  TYR   9           1HB      TYR   9   1.129   4.108   0.692
   57    HD1  TYR   9           HD1      TYR   9   0.405   1.601   3.283
   58    HD2  TYR   9           HD2      TYR   9   3.298   4.344   1.777
   59    HE1  TYR   9           HE1      TYR   9   2.136   0.526   4.657
   60    HE2  TYR   9           HE2      TYR   9   5.033   3.270   3.149
   61    HH   TYR   9           HH       TYR   9   4.559   0.279   4.712
   62    H    ARG  10           H        ARG  10  -0.269   7.136   1.181
   63    HA   ARG  10           HA       ARG  10  -3.057   6.768   0.337
   64    HB2  ARG  10           2HB      ARG  10  -2.648   8.731   1.669
   65    HB3  ARG  10           1HB      ARG  10  -1.343   9.240   0.608
   66    HG2  ARG  10           2HG      ARG  10  -2.935   9.631  -1.197
   67    HG3  ARG  10           1HG      ARG  10  -4.256   9.072  -0.165
   68    HD2  ARG  10           2HD      ARG  10  -3.923  10.917   1.348
   69    HD3  ARG  10           1HD      ARG  10  -2.476  11.426   0.476
   70    HE   ARG  10           HE       ARG  10  -3.980  11.898  -1.432
   71   HH11  ARG  10          1HH1      ARG  10  -5.321  11.804   1.750
   72   HH12  ARG  10          2HH1      ARG  10  -6.616  12.875   1.338
   73   HH21  ARG  10          1HH2      ARG  10  -5.627  13.246  -1.936
   74   HH22  ARG  10          2HH2      ARG  10  -6.792  13.682  -0.732
   75    H    ALA  11           H        ALA  11  -3.574   6.368  -1.715
   76    HA   ALA  11           HA       ALA  11  -1.651   6.229  -3.807
   77    HB1  ALA  11           3HB      ALA  11  -3.615   4.764  -3.707
   78    HB2  ALA  11           1HB      ALA  11  -3.525   5.632  -5.241
   79    HB3  ALA  11           2HB      ALA  11  -4.664   6.153  -3.998
   80    H    LEU  12           H        LEU  12  -0.982   7.729  -5.224
   81    HA   LEU  12           HA       LEU  12  -2.025  10.430  -4.993
   82    HB2  LEU  12           2HB      LEU  12   0.269   9.385  -6.663
   83    HB3  LEU  12           1HB      LEU  12  -0.090  11.073  -6.337
   84    HG   LEU  12           HG       LEU  12   0.786   9.013  -4.300
   85   HD11  LEU  12          1HD1      LEU  12   2.823  10.338  -4.143
   86   HD12  LEU  12          2HD1      LEU  12   2.227  11.429  -5.396
   87   HD13  LEU  12          3HD1      LEU  12   2.586   9.745  -5.788
   88   HD21  LEU  12          3HD2      LEU  12  -0.776  10.600  -3.306
   89   HD22  LEU  12          1HD2      LEU  12   0.174  11.948  -3.933
   90   HD23  LEU  12          2HD2      LEU  12   0.860  10.877  -2.712
   91    H    TYR  13           H        TYR  13  -1.417   8.188  -7.727
   92    HA   TYR  13           HA       TYR  13  -3.403   9.715  -9.302
   93    HB2  TYR  13           2HB      TYR  13  -0.995   8.157 -10.283
   94    HB3  TYR  13           1HB      TYR  13  -2.189   8.924 -11.324
   95    HD1  TYR  13           HD1      TYR  13  -2.358  11.414 -11.390
   96    HD2  TYR  13           HD2      TYR  13   0.753   9.434  -9.252
   97    HE1  TYR  13           HE1      TYR  13  -1.069  13.509 -11.330
   98    HE2  TYR  13           HE2      TYR  13   2.039  11.527  -9.182
   99    HH   TYR  13           HH       TYR  13   0.705  14.543  -9.937
  100    HA   PRO  14           HA       PRO  14  -5.833   6.016  -9.594
  101    HB2  PRO  14           2HB      PRO  14  -7.228   6.469 -11.871
  102    HB3  PRO  14           1HB      PRO  14  -7.522   7.361 -10.374
  103    HG2  PRO  14           2HG      PRO  14  -5.952   8.177 -12.794
  104    HG3  PRO  14           1HG      PRO  14  -7.083   9.135 -11.822
  105    HD2  PRO  14           2HD      PRO  14  -4.369   9.301 -11.564
  106    HD3  PRO  14           1HD      PRO  14  -5.494   9.620 -10.229
  107    H    PHE  15           H        PHE  15  -4.996   4.078 -10.037
  108    HA   PHE  15           HA       PHE  15  -4.321   3.435 -12.838
  109    HB2  PHE  15           2HB      PHE  15  -2.839   2.531 -10.353
  110    HB3  PHE  15           1HB      PHE  15  -2.594   1.831 -11.950
  111    HD1  PHE  15           HD2      PHE  15  -1.619   3.207 -13.767
  112    HD2  PHE  15           HD1      PHE  15  -1.868   4.626  -9.758
  113    HE1  PHE  15           HE2      PHE  15   0.036   4.951 -14.284
  114    HE2  PHE  15           HE1      PHE  15  -0.215   6.371 -10.272
  115    HZ   PHE  15           HZ       PHE  15   0.740   6.538 -12.535
  116    H    ARG  16           H        ARG  16  -5.881   2.135 -13.538
  117    HA   ARG  16           HA       ARG  16  -7.234   0.278 -11.755
  118    HB2  ARG  16           2HB      ARG  16  -7.652   0.864 -14.698
  119    HB3  ARG  16           1HB      ARG  16  -8.666  -0.198 -13.724
  120    HG2  ARG  16           2HG      ARG  16  -9.316   1.675 -12.308
  121    HG3  ARG  16           1HG      ARG  16  -8.258   2.752 -13.223
  122    HD2  ARG  16           2HD      ARG  16 -10.675   1.284 -14.294
  123    HD3  ARG  16           1HD      ARG  16 -10.582   3.006 -13.925
  124    HE   ARG  16           HE       ARG  16  -9.198   1.639 -16.131
  125   HH11  ARG  16          1HH1      ARG  16 -10.305   4.555 -14.648
  126   HH12  ARG  16          2HH1      ARG  16  -9.891   5.522 -16.023
  127   HH21  ARG  16          1HH2      ARG  16  -8.700   2.900 -17.870
  128   HH22  ARG  16          2HH2      ARG  16  -9.002   4.603 -17.813
  129    H    ARG  17           H        ARG  17  -7.555  -2.021 -12.453
  130    HA   ARG  17           HA       ARG  17  -4.947  -3.077 -13.349
  131    HB2  ARG  17           2HB      ARG  17  -6.874  -3.934 -11.251
  132    HB3  ARG  17           1HB      ARG  17  -6.001  -5.204 -12.097
  133    HG2  ARG  17           2HG      ARG  17  -4.904  -4.493 -10.007
  134    HG3  ARG  17           1HG      ARG  17  -3.888  -4.283 -11.432
  135    HD2  ARG  17           2HD      ARG  17  -4.623  -1.872 -11.471
  136    HD3  ARG  17           1HD      ARG  17  -5.382  -2.155  -9.905
  137    HE   ARG  17           HE       ARG  17  -3.117  -2.731  -9.086
  138   HH11  ARG  17          1HH1      ARG  17  -3.469  -0.730 -11.866
  139   HH12  ARG  17          2HH1      ARG  17  -1.883  -0.059 -11.716
  140   HH21  ARG  17          1HH2      ARG  17  -1.115  -1.897  -8.901
  141   HH22  ARG  17          2HH2      ARG  17  -0.568  -0.689 -10.018
  142    H    GLU  18           H        GLU  18  -4.766  -4.359 -15.057
  143    HA   GLU  18           HA       GLU  18  -6.988  -5.266 -16.616
  144    HB2  GLU  18           2HB      GLU  18  -4.776  -4.798 -17.598
  145    HB3  GLU  18           1HB      GLU  18  -4.068  -6.090 -16.644
  146    HG2  GLU  18           2HG      GLU  18  -4.355  -6.870 -18.878
  147    HG3  GLU  18           1HG      GLU  18  -5.513  -7.710 -17.851
  148    H    ARG  19           H        ARG  19  -4.677  -6.832 -14.420
  149    HA   ARG  19           HA       ARG  19  -6.539  -9.101 -14.093
  150    HB2  ARG  19           2HB      ARG  19  -3.570  -8.938 -13.511
  151    HB3  ARG  19           1HB      ARG  19  -4.579 -10.345 -13.208
  152    HG2  ARG  19           2HG      ARG  19  -4.099  -9.127 -15.928
  153    HG3  ARG  19           1HG      ARG  19  -3.233 -10.522 -15.278
  154    HD2  ARG  19           2HD      ARG  19  -5.307 -11.784 -15.152
  155    HD3  ARG  19           1HD      ARG  19  -6.224 -10.378 -15.694
  156    HE   ARG  19           HE       ARG  19  -4.408 -10.804 -17.682
  157   HH11  ARG  19          1HH1      ARG  19  -6.781 -12.776 -16.147
  158   HH12  ARG  19          2HH1      ARG  19  -7.098 -13.690 -17.578
  159   HH21  ARG  19          1HH2      ARG  19  -4.844 -11.989 -19.513
  160   HH22  ARG  19          2HH2      ARG  19  -6.022 -13.253 -19.449
  161    HA   PRO  20           HA       PRO  20  -7.474  -7.162 -10.126
  162    HB2  PRO  20           2HB      PRO  20  -8.635  -9.842  -9.557
  163    HB3  PRO  20           1HB      PRO  20  -9.381  -8.243  -9.454
  164    HG2  PRO  20           2HG      PRO  20  -9.989  -9.901 -11.450
  165    HG3  PRO  20           1HG      PRO  20  -9.824  -8.159 -11.733
  166    HD2  PRO  20           2HD      PRO  20  -7.899 -10.372 -12.353
  167    HD3  PRO  20           1HD      PRO  20  -8.318  -8.942 -13.320
  168    H    GLU  21           H        GLU  21  -5.351  -9.716 -10.668
  169    HA   GLU  21           HA       GLU  21  -4.667 -10.659  -8.143
  170    HB2  GLU  21           2HB      GLU  21  -2.705 -10.005 -10.355
  171    HB3  GLU  21           1HB      GLU  21  -2.482 -11.176  -9.062
  172    HG2  GLU  21           2HG      GLU  21  -4.407 -11.343 -11.372
  173    HG3  GLU  21           1HG      GLU  21  -2.988 -12.346 -11.085
  174    H    ASP  22           H        ASP  22  -3.675  -7.667  -9.746
  175    HA   ASP  22           HA       ASP  22  -2.133  -6.766  -7.431
  176    HB2  ASP  22           2HB      ASP  22  -1.472  -6.399  -9.891
  177    HB3  ASP  22           1HB      ASP  22  -2.764  -5.209  -9.958
  178    H    LEU  23           H        LEU  23  -2.650  -4.496  -6.560
  179    HA   LEU  23           HA       LEU  23  -5.568  -4.317  -6.162
  180    HB2  LEU  23           2HB      LEU  23  -4.116  -4.571  -4.167
  181    HB3  LEU  23           1HB      LEU  23  -3.337  -3.050  -4.558
  182    HG   LEU  23           HG       LEU  23  -5.465  -1.855  -4.206
  183   HD11  LEU  23          1HD1      LEU  23  -7.381  -3.037  -3.209
  184   HD12  LEU  23          2HD1      LEU  23  -6.546  -4.573  -3.454
  185   HD13  LEU  23          3HD1      LEU  23  -7.027  -3.597  -4.843
  186   HD21  LEU  23          3HD2      LEU  23  -4.707  -3.639  -1.886
  187   HD22  LEU  23          1HD2      LEU  23  -5.591  -2.116  -1.780
  188   HD23  LEU  23          2HD2      LEU  23  -3.916  -2.127  -2.327
  189    H    GLU  24           H        GLU  24  -6.745  -2.557  -6.746
  190    HA   GLU  24           HA       GLU  24  -5.532  -0.713  -8.595
  191    HB2  GLU  24           2HB      GLU  24  -8.389  -0.811  -7.598
  192    HB3  GLU  24           1HB      GLU  24  -7.806   0.093  -8.991
  193    HG2  GLU  24           2HG      GLU  24  -7.108  -2.089 -10.009
  194    HG3  GLU  24           1HG      GLU  24  -7.919  -2.904  -8.675
  195    H    LEU  25           H        LEU  25  -5.567   1.568  -8.475
  196    HA   LEU  25           HA       LEU  25  -5.711   2.680  -5.738
  197    HB2  LEU  25           2HB      LEU  25  -3.621   3.288  -7.842
  198    HB3  LEU  25           1HB      LEU  25  -3.726   4.044  -6.265
  199    HG   LEU  25           HG       LEU  25  -3.161   1.110  -6.753
  200   HD11  LEU  25          1HD1      LEU  25  -1.311   2.546  -7.469
  201   HD12  LEU  25          2HD1      LEU  25  -0.889   1.616  -6.030
  202   HD13  LEU  25          3HD1      LEU  25  -1.300   3.327  -5.886
  203   HD21  LEU  25          3HD2      LEU  25  -3.136   2.724  -4.197
  204   HD22  LEU  25          1HD2      LEU  25  -2.636   1.040  -4.359
  205   HD23  LEU  25          2HD2      LEU  25  -4.317   1.489  -4.639
  206    H    LEU  26           H        LEU  26  -7.101   4.374  -5.613
  207    HA   LEU  26           HA       LEU  26  -7.434   6.100  -7.993
  208    HB2  LEU  26           2HB      LEU  26  -9.302   5.473  -5.708
  209    HB3  LEU  26           1HB      LEU  26  -9.528   6.898  -6.700
  210    HG   LEU  26           HG       LEU  26 -11.000   5.135  -7.459
  211   HD11  LEU  26          1HD1      LEU  26 -10.370   5.026  -9.812
  212   HD12  LEU  26          2HD1      LEU  26  -8.735   5.553  -9.408
  213   HD13  LEU  26          3HD1      LEU  26 -10.102   6.637  -9.150
  214   HD21  LEU  26          3HD2      LEU  26  -9.717   3.206  -6.648
  215   HD22  LEU  26          1HD2      LEU  26  -8.531   3.462  -7.928
  216   HD23  LEU  26          2HD2      LEU  26 -10.189   3.019  -8.335
  217    HA   PRO  27           HA       PRO  27  -5.372   9.390  -5.956
  218    HB2  PRO  27           2HB      PRO  27  -6.769  11.605  -6.752
  219    HB3  PRO  27           1HB      PRO  27  -5.683  10.705  -7.818
  220    HG2  PRO  27           2HG      PRO  27  -8.669  10.546  -7.589
  221    HG3  PRO  27           1HG      PRO  27  -7.661  10.584  -9.048
  222    HD2  PRO  27           2HD      PRO  27  -8.695   8.282  -8.085
  223    HD3  PRO  27           1HD      PRO  27  -7.107   8.340  -8.875
  224    H    GLY  28           H        GLY  28  -5.580   9.259  -3.758
  225    HA2  GLY  28           2HA      GLY  28  -6.385  10.701  -1.898
  226    HA3  GLY  28           1HA      GLY  28  -8.000  10.482  -2.548
  227    H    ASP  29           H        ASP  29  -7.052   7.537  -3.071
  228    HA   ASP  29           HA       ASP  29  -8.268   6.347  -0.846
  229    HB2  ASP  29           2HB      ASP  29  -6.317   5.178  -2.843
  230    HB3  ASP  29           1HB      ASP  29  -7.220   4.222  -1.676
  231    H    VAL  30           H        VAL  30  -7.553   6.262   1.207
  232    HA   VAL  30           HA       VAL  30  -4.678   6.282   1.771
  233    HB   VAL  30           HB       VAL  30  -7.008   6.380   3.707
  234   HG11  VAL  30          1HG1      VAL  30  -4.982   5.537   4.759
  235   HG12  VAL  30          2HG1      VAL  30  -5.326   7.170   5.329
  236   HG13  VAL  30          3HG1      VAL  30  -4.060   6.904   4.131
  237   HG21  VAL  30          3HG2      VAL  30  -5.287   8.635   2.654
  238   HG22  VAL  30          1HG2      VAL  30  -6.548   8.778   3.880
  239   HG23  VAL  30          2HG2      VAL  30  -6.973   8.337   2.225
  240    H    LEU  31           H        LEU  31  -3.979   4.211   1.259
  241    HA   LEU  31           HA       LEU  31  -5.497   1.896   2.054
  242    HB2  LEU  31           2HB      LEU  31  -2.775   2.129   0.770
  243    HB3  LEU  31           1HB      LEU  31  -3.580   0.606   1.100
  244    HG   LEU  31           HG       LEU  31  -5.505   1.518  -0.360
  245   HD11  LEU  31          1HD1      LEU  31  -4.848   3.135  -2.071
  246   HD12  LEU  31          2HD1      LEU  31  -3.298   3.365  -1.261
  247   HD13  LEU  31          3HD1      LEU  31  -4.794   3.840  -0.456
  248   HD21  LEU  31          3HD2      LEU  31  -4.027  -0.314  -1.023
  249   HD22  LEU  31          1HD2      LEU  31  -2.860   0.851  -1.650
  250   HD23  LEU  31          2HD2      LEU  31  -4.454   0.706  -2.395
  251    H    VAL  32           H        VAL  32  -5.422   0.915   3.935
  252    HA   VAL  32           HA       VAL  32  -3.300   1.564   5.842
  253    HB   VAL  32           HB       VAL  32  -5.851  -0.016   6.277
  254   HG11  VAL  32          1HG1      VAL  32  -4.141  -0.537   7.934
  255   HG12  VAL  32          2HG1      VAL  32  -5.431   0.416   8.669
  256   HG13  VAL  32          3HG1      VAL  32  -3.897   1.179   8.251
  257   HG21  VAL  32          3HG2      VAL  32  -6.371   2.267   5.610
  258   HG22  VAL  32          1HG2      VAL  32  -5.256   2.900   6.820
  259   HG23  VAL  32          2HG2      VAL  32  -6.713   2.048   7.325
  260    H    VAL  33           H        VAL  33  -1.540   0.307   5.791
  261    HA   VAL  33           HA       VAL  33  -1.820  -2.587   5.312
  262    HB   VAL  33           HB       VAL  33   0.701  -0.905   5.362
  263   HG11  VAL  33          1HG1      VAL  33   0.269  -3.779   4.522
  264   HG12  VAL  33          2HG1      VAL  33   1.128  -3.229   5.960
  265   HG13  VAL  33          3HG1      VAL  33   1.778  -2.879   4.359
  266   HG21  VAL  33          3HG2      VAL  33  -0.708  -0.286   3.480
  267   HG22  VAL  33          1HG2      VAL  33  -0.873  -1.979   3.016
  268   HG23  VAL  33          2HG2      VAL  33   0.700  -1.186   2.912
  269    H    SER  34           H        SER  34  -1.763  -3.932   7.012
  270    HA   SER  34           HA       SER  34  -1.290  -3.024   9.666
  271    HB2  SER  34           2HB      SER  34  -1.588  -5.372  10.332
  272    HB3  SER  34           1HB      SER  34  -2.828  -4.894   9.172
  273    HG   SER  34           HG       SER  34  -2.165  -6.707   8.267
  274    H    ARG  35           H        ARG  35   0.469  -3.269  11.019
  275    HA   ARG  35           HA       ARG  35   3.030  -3.393   9.825
  276    HB2  ARG  35           2HB      ARG  35   2.589  -2.130  11.894
  277    HB3  ARG  35           1HB      ARG  35   2.308  -3.636  12.759
  278    HG2  ARG  35           2HG      ARG  35   4.595  -4.299  12.485
  279    HG3  ARG  35           1HG      ARG  35   4.909  -2.942  11.404
  280    HD2  ARG  35           2HD      ARG  35   4.511  -1.376  13.254
  281    HD3  ARG  35           1HD      ARG  35   4.191  -2.737  14.332
  282    HE   ARG  35           HE       ARG  35   6.473  -3.318  14.248
  283   HH11  ARG  35          1HH1      ARG  35   5.786  -0.375  12.596
  284   HH12  ARG  35          2HH1      ARG  35   7.452   0.068  12.474
  285   HH21  ARG  35          1HH2      ARG  35   8.597  -2.736  14.093
  286   HH22  ARG  35          2HH2      ARG  35   9.022  -1.238  13.337
  287    H    ALA  36           H        ALA  36   1.067  -5.803  11.473
  288    HA   ALA  36           HA       ALA  36   2.903  -7.894  11.680
  289    HB1  ALA  36           3HB      ALA  36  -0.051  -8.032  11.080
  290    HB2  ALA  36           1HB      ALA  36   0.689  -7.994  12.679
  291    HB3  ALA  36           2HB      ALA  36   0.944  -9.384  11.621
  292    H    ALA  37           H        ALA  37   0.867  -6.929   8.909
  293    HA   ALA  37           HA       ALA  37   1.605  -8.962   7.123
  294    HB1  ALA  37           3HB      ALA  37   0.860  -7.461   5.356
  295    HB2  ALA  37           1HB      ALA  37   0.917  -6.093   6.470
  296    HB3  ALA  37           2HB      ALA  37  -0.246  -7.393   6.727
  297    H    LEU  38           H        LEU  38   3.107  -5.800   7.744
  298    HA   LEU  38           HA       LEU  38   5.168  -5.929   5.849
  299    HB2  LEU  38           2HB      LEU  38   5.173  -4.625   8.577
  300    HB3  LEU  38           1HB      LEU  38   6.363  -4.321   7.325
  301    HG   LEU  38           HG       LEU  38   3.410  -3.690   7.129
  302   HD11  LEU  38          1HD1      LEU  38   4.568  -2.227   8.700
  303   HD12  LEU  38          2HD1      LEU  38   4.121  -1.351   7.236
  304   HD13  LEU  38          3HD1      LEU  38   5.792  -1.865   7.483
  305   HD21  LEU  38          3HD2      LEU  38   5.674  -3.103   5.212
  306   HD22  LEU  38          1HD2      LEU  38   4.014  -2.528   5.055
  307   HD23  LEU  38          2HD2      LEU  38   4.360  -4.254   4.957
  308    H    GLN  39           H        GLN  39   5.090  -7.107   9.212
  309    HA   GLN  39           HA       GLN  39   7.731  -8.114   9.279
  310    HB2  GLN  39           2HB      GLN  39   5.292  -9.053  10.813
  311    HB3  GLN  39           1HB      GLN  39   6.953  -9.485  11.193
  312    HG2  GLN  39           2HG      GLN  39   5.756  -6.720  11.303
  313    HG3  GLN  39           1HG      GLN  39   6.151  -7.746  12.679
  314   HE21  GLN  39          1HE2      GLN  39   7.116  -5.089  12.095
  315   HE22  GLN  39          2HE2      GLN  39   8.835  -5.202  11.993
  316    H    ALA  40           H        ALA  40   4.673  -9.553   8.230
  317    HA   ALA  40           HA       ALA  40   5.637 -12.173   7.744
  318    HB1  ALA  40           3HB      ALA  40   3.247 -11.622   7.929
  319    HB2  ALA  40           1HB      ALA  40   3.609 -12.487   6.435
  320    HB3  ALA  40           2HB      ALA  40   3.339 -10.744   6.403
  321    H    LEU  41           H        LEU  41   5.577  -9.253   5.769
  322    HA   LEU  41           HA       LEU  41   6.527 -10.471   3.362
  323    HB2  LEU  41           2HB      LEU  41   6.708  -7.599   4.281
  324    HB3  LEU  41           1HB      LEU  41   7.022  -8.159   2.650
  325    HG   LEU  41           HG       LEU  41   4.347  -8.309   4.056
  326   HD11  LEU  41          1HD1      LEU  41   5.320  -6.449   1.883
  327   HD12  LEU  41          2HD1      LEU  41   5.006  -6.012   3.563
  328   HD13  LEU  41          3HD1      LEU  41   3.678  -6.526   2.526
  329   HD21  LEU  41          3HD2      LEU  41   4.605 -10.103   2.437
  330   HD22  LEU  41          1HD2      LEU  41   5.140  -8.952   1.209
  331   HD23  LEU  41          2HD2      LEU  41   3.485  -8.888   1.819
  332    H    GLY  42           H        GLY  42   8.062  -9.546   6.296
  333    HA2  GLY  42           2HA      GLY  42  10.278  -9.865   6.941
  334    HA3  GLY  42           1HA      GLY  42  10.684 -10.268   5.280
  335    H    VAL  43           H        VAL  43   8.992  -7.326   6.131
  336    HA   VAL  43           HA       VAL  43  11.019  -5.722   4.845
  337    HB   VAL  43           HB       VAL  43   8.511  -4.844   6.305
  338   HG11  VAL  43          1HG1      VAL  43  10.141  -3.034   6.117
  339   HG12  VAL  43          2HG1      VAL  43   8.760  -2.741   5.062
  340   HG13  VAL  43          3HG1      VAL  43  10.281  -3.320   4.381
  341   HG21  VAL  43          3HG2      VAL  43   8.984  -5.318   3.357
  342   HG22  VAL  43          1HG2      VAL  43   7.517  -4.639   4.065
  343   HG23  VAL  43          2HG2      VAL  43   7.984  -6.301   4.426
  344    H    ALA  44           H        ALA  44  12.705  -4.778   5.809
  345    HA   ALA  44           HA       ALA  44  13.185  -4.961   8.604
  346    HB1  ALA  44           3HB      ALA  44  14.625  -3.289   6.543
  347    HB2  ALA  44           1HB      ALA  44  14.974  -4.976   6.920
  348    HB3  ALA  44           2HB      ALA  44  15.226  -3.730   8.142
  349    H    GLU  45           H        GLU  45  12.982  -3.488  10.216
  350    HA   GLU  45           HA       GLU  45  11.168  -1.384  10.088
  351    HB2  GLU  45           2HB      GLU  45  11.967  -0.721  12.290
  352    HB3  GLU  45           1HB      GLU  45  11.846  -2.469  12.189
  353    HG2  GLU  45           2HG      GLU  45  14.385  -0.846  12.032
  354    HG3  GLU  45           1HG      GLU  45  13.832  -1.788  13.413
  355    H    GLY  46           H        GLY  46  11.267   0.634   9.283
  356    HA2  GLY  46           2HA      GLY  46  12.491   2.731   8.994
  357    HA3  GLY  46           1HA      GLY  46  13.944   1.781   8.712
  358    H    GLY  47           H        GLY  47  11.940  -0.047   7.104
  359    HA2  GLY  47           2HA      GLY  47  12.524   1.171   4.535
  360    HA3  GLY  47           1HA      GLY  47  11.785  -0.399   4.808
  361    H    GLU  48           H        GLU  48   9.740   0.917   6.613
  362    HA   GLU  48           HA       GLU  48   7.677   1.153   4.734
  363    HB2  GLU  48           2HB      GLU  48   6.253   1.835   6.555
  364    HB3  GLU  48           1HB      GLU  48   7.337   0.578   7.120
  365    HG2  GLU  48           2HG      GLU  48   7.630   3.533   7.648
  366    HG3  GLU  48           1HG      GLU  48   7.030   2.329   8.786
  367    H    ARG  49           H        ARG  49   9.809   3.599   6.053
  368    HA   ARG  49           HA       ARG  49   8.475   5.940   5.352
  369    HB2  ARG  49           2HB      ARG  49  11.441   5.355   5.244
  370    HB3  ARG  49           1HB      ARG  49  10.738   6.965   5.169
  371    HG2  ARG  49           2HG      ARG  49   9.893   6.768   7.408
  372    HG3  ARG  49           1HG      ARG  49  10.385   5.074   7.488
  373    HD2  ARG  49           2HD      ARG  49  12.208   7.470   7.240
  374    HD3  ARG  49           1HD      ARG  49  11.984   6.466   8.675
  375    HE   ARG  49           HE       ARG  49  12.852   4.604   7.132
  376   HH11  ARG  49          1HH1      ARG  49  13.866   7.889   6.955
  377   HH12  ARG  49          2HH1      ARG  49  15.424   7.487   6.326
  378   HH21  ARG  49          1HH2      ARG  49  14.856   4.105   6.296
  379   HH22  ARG  49          2HH2      ARG  49  15.986   5.375   5.977
  380    H    CYS  50           H        CYS  50  10.117   3.641   3.287
  381    HA   CYS  50           HA       CYS  50   9.306   5.218   0.931
  382    HB2  CYS  50           2HB      CYS  50  11.985   3.836   1.267
  383    HB3  CYS  50           1HB      CYS  50  11.397   4.536  -0.237
  384    HG   CYS  50           HG       CYS  50  13.041   6.485   0.429
  385    HA   PRO  51           HA       PRO  51   7.441   0.987   0.828
  386    HB2  PRO  51           2HB      PRO  51   5.440   1.767  -0.927
  387    HB3  PRO  51           1HB      PRO  51   5.324   1.840   0.832
  388    HG2  PRO  51           2HG      PRO  51   6.028   4.010  -1.113
  389    HG3  PRO  51           1HG      PRO  51   4.975   4.084   0.315
  390    HD2  PRO  51           2HD      PRO  51   7.467   5.045   0.400
  391    HD3  PRO  51           1HD      PRO  51   6.780   4.179   1.792
  392    H    GLN  52           H        GLN  52   8.510   3.074  -1.778
  393    HA   GLN  52           HA       GLN  52   8.231   1.335  -3.957
  394    HB2  GLN  52           2HB      GLN  52   9.914   2.701  -5.078
  395    HB3  GLN  52           1HB      GLN  52   8.781   3.717  -4.198
  396    HG2  GLN  52           2HG      GLN  52  10.371   4.119  -2.462
  397    HG3  GLN  52           1HG      GLN  52  11.481   2.923  -3.125
  398   HE21  GLN  52          1HE2      GLN  52  11.069   3.759  -5.882
  399   HE22  GLN  52          2HE2      GLN  52  11.889   5.268  -6.056
  400    H    SER  53           H        SER  53  10.505   1.268  -1.342
  401    HA   SER  53           HA       SER  53  12.601  -0.177  -2.596
  402    HB2  SER  53           2HB      SER  53  12.921   1.033  -0.474
  403    HB3  SER  53           1HB      SER  53  11.833  -0.092   0.338
  404    HG   SER  53           HG       SER  53  13.969  -0.718   0.689
  405    H    VAL  54           H        VAL  54   9.596  -1.167  -1.107
  406    HA   VAL  54           HA       VAL  54  10.322  -4.000  -1.179
  407    HB   VAL  54           HB       VAL  54   7.727  -2.722  -0.277
  408   HG11  VAL  54          1HG1      VAL  54   8.796  -5.514   0.182
  409   HG12  VAL  54          2HG1      VAL  54   7.487  -5.079  -0.919
  410   HG13  VAL  54          3HG1      VAL  54   7.285  -4.860   0.820
  411   HG21  VAL  54          3HG2      VAL  54   9.611  -1.969   1.094
  412   HG22  VAL  54          1HG2      VAL  54  10.084  -3.644   1.378
  413   HG23  VAL  54          2HG2      VAL  54   8.551  -3.041   2.006
  414    H    GLY  55           H        GLY  55   7.614  -1.993  -2.410
  415    HA2  GLY  55           2HA      GLY  55   7.057  -2.093  -4.789
  416    HA3  GLY  55           1HA      GLY  55   7.456  -3.802  -4.757
  417    H    TRP  56           H        TRP  56   5.967  -5.272  -3.776
  418    HA   TRP  56           HA       TRP  56   3.212  -4.245  -3.792
  419    HB2  TRP  56           2HB      TRP  56   4.345  -6.994  -4.304
  420    HB3  TRP  56           1HB      TRP  56   2.623  -6.713  -4.073
  421    HD1  TRP  56           HD1      TRP  56   2.026  -4.262  -5.798
  422    HE1  TRP  56           HE1      TRP  56   2.275  -4.310  -8.352
  423    HE3  TRP  56           HE3      TRP  56   5.306  -8.169  -6.224
  424    HZ2  TRP  56           HZ2      TRP  56   3.679  -5.791 -10.296
  425    HZ3  TRP  56           HZ3      TRP  56   6.049  -8.838  -8.477
  426    HH2  TRP  56           HH2      TRP  56   5.250  -7.671 -10.470
  427    H    MET  57           H        MET  57   2.569  -3.721  -1.806
  428    HA   MET  57           HA       MET  57   2.905  -5.713   0.355
  429    HB2  MET  57           2HB      MET  57   2.462  -2.725   0.610
  430    HB3  MET  57           1HB      MET  57   2.591  -3.852   1.952
  431    HG2  MET  57           2HG      MET  57   4.669  -2.715   1.739
  432    HG3  MET  57           1HG      MET  57   4.909  -4.377   1.204
  433    HE1  MET  57           3HE      MET  57   3.131  -1.495  -0.795
  434    HE2  MET  57           1HE      MET  57   4.480  -0.821  -1.707
  435    HE3  MET  57           2HE      MET  57   4.424  -0.642   0.048
  436    HA   PRO  58           HA       PRO  58  -1.558  -6.077   0.175
  437    HB2  PRO  58           2HB      PRO  58  -1.959  -7.513   2.436
  438    HB3  PRO  58           1HB      PRO  58  -1.248  -8.217   0.977
  439    HG2  PRO  58           2HG      PRO  58   0.108  -7.243   3.466
  440    HG3  PRO  58           1HG      PRO  58   0.434  -8.701   2.511
  441    HD2  PRO  58           2HD      PRO  58   1.914  -6.410   2.323
  442    HD3  PRO  58           1HD      PRO  58   1.724  -7.561   0.987
  443    H    GLY  59           H        GLY  59  -2.815  -4.349   0.560
  444    HA2  GLY  59           2HA      GLY  59  -3.045  -3.357   3.333
  445    HA3  GLY  59           1HA      GLY  59  -2.756  -2.223   2.027
  446    H    LEU  60           H        LEU  60  -4.896  -1.752   3.532
  447    HA   LEU  60           HA       LEU  60  -7.249  -2.896   2.201
  448    HB2  LEU  60           2HB      LEU  60  -7.271  -2.850   4.636
  449    HB3  LEU  60           1HB      LEU  60  -7.002  -1.118   4.634
  450    HG   LEU  60           HG       LEU  60  -9.218  -0.782   3.583
  451   HD11  LEU  60          1HD1      LEU  60 -10.799  -2.645   3.438
  452   HD12  LEU  60          2HD1      LEU  60  -9.523  -3.766   3.916
  453   HD13  LEU  60          3HD1      LEU  60  -9.406  -2.895   2.386
  454   HD21  LEU  60          3HD2      LEU  60  -9.311  -2.427   6.113
  455   HD22  LEU  60          1HD2      LEU  60 -10.576  -1.341   5.537
  456   HD23  LEU  60          2HD2      LEU  60  -9.008  -0.691   6.022
  457    H    ASN  61           H        ASN  61  -7.950  -1.893   0.433
  458    HA   ASN  61           HA       ASN  61  -7.351   0.836  -0.193
  459    HB2  ASN  61           2HB      ASN  61  -7.533  -0.778  -1.981
  460    HB3  ASN  61           1HB      ASN  61  -9.173  -1.204  -1.498
  461   HD21  ASN  61          1HD2      ASN  61  -7.182   1.186  -3.057
  462   HD22  ASN  61          2HD2      ASN  61  -8.481   2.077  -3.768
  463    H    GLU  62           H        GLU  62  -8.455   2.629   0.440
  464    HA   GLU  62           HA       GLU  62 -10.834   2.429   2.007
  465    HB2  GLU  62           2HB      GLU  62  -9.170   4.714   1.015
  466    HB3  GLU  62           1HB      GLU  62 -10.753   5.036   1.710
  467    HG2  GLU  62           2HG      GLU  62  -8.503   3.580   3.088
  468    HG3  GLU  62           1HG      GLU  62  -8.954   5.264   3.353
  469    H    ARG  63           H        ARG  63 -10.365   2.787  -1.393
  470    HA   ARG  63           HA       ARG  63 -12.681   4.287  -2.030
  471    HB2  ARG  63           2HB      ARG  63 -10.681   3.802  -3.527
  472    HB3  ARG  63           1HB      ARG  63 -11.371   2.211  -3.795
  473    HG2  ARG  63           2HG      ARG  63 -12.057   3.429  -5.650
  474    HG3  ARG  63           1HG      ARG  63 -13.468   3.467  -4.596
  475    HD2  ARG  63           2HD      ARG  63 -11.412   5.671  -4.664
  476    HD3  ARG  63           1HD      ARG  63 -12.829   5.653  -5.709
  477    HE   ARG  63           HE       ARG  63 -14.162   5.657  -3.601
  478   HH11  ARG  63          1HH1      ARG  63 -10.894   6.750  -3.480
  479   HH12  ARG  63          2HH1      ARG  63 -11.240   7.954  -2.288
  480   HH21  ARG  63          1HH2      ARG  63 -14.580   7.203  -2.049
  481   HH22  ARG  63          2HH2      ARG  63 -13.283   8.202  -1.485
  482    H    THR  64           H        THR  64 -12.122   0.764  -2.380
  483    HA   THR  64           HA       THR  64 -15.038   0.336  -2.062
  484    HB   THR  64           HB       THR  64 -14.807  -1.639  -3.550
  485    HG1  THR  64           HG1      THR  64 -12.832  -1.770  -4.781
  486   HG21  THR  64          3HG2      THR  64 -13.865   0.946  -4.813
  487   HG22  THR  64          1HG2      THR  64 -15.544   0.527  -4.472
  488   HG23  THR  64          2HG2      THR  64 -14.626  -0.407  -5.653
  489    H    ARG  65           H        ARG  65 -12.292  -0.067  -0.393
  490    HA   ARG  65           HA       ARG  65 -11.663  -1.332   1.376
  491    HB2  ARG  65           2HB      ARG  65 -14.522  -2.202   1.130
  492    HB3  ARG  65           1HB      ARG  65 -13.458  -3.053   2.240
  493    HG2  ARG  65           2HG      ARG  65 -14.663  -1.361   3.441
  494    HG3  ARG  65           1HG      ARG  65 -12.961  -0.907   3.363
  495    HD2  ARG  65           2HD      ARG  65 -14.363   1.033   2.976
  496    HD3  ARG  65           1HD      ARG  65 -13.471   0.630   1.511
  497    HE   ARG  65           HE       ARG  65 -15.725  -0.611   0.989
  498   HH11  ARG  65          1HH1      ARG  65 -15.301   2.491   2.439
  499   HH12  ARG  65          2HH1      ARG  65 -16.801   3.096   1.821
  500   HH21  ARG  65          1HH2      ARG  65 -17.630   0.192   0.194
  501   HH22  ARG  65          2HH2      ARG  65 -18.093   1.822   0.555
  502    H    GLN  66           H        GLN  66 -11.074  -2.235  -1.341
  503    HA   GLN  66           HA       GLN  66 -11.042  -5.120  -1.250
  504    HB2  GLN  66           2HB      GLN  66  -9.543  -3.170  -3.016
  505    HB3  GLN  66           1HB      GLN  66  -9.523  -4.915  -3.225
  506    HG2  GLN  66           2HG      GLN  66 -11.958  -3.154  -3.419
  507    HG3  GLN  66           1HG      GLN  66 -11.046  -3.804  -4.779
  508   HE21  GLN  66          1HE2      GLN  66 -13.838  -4.180  -4.109
  509   HE22  GLN  66          2HE2      GLN  66 -14.071  -5.881  -3.932
  510    H    ARG  67           H        ARG  67  -9.562  -6.398  -0.273
  511    HA   ARG  67           HA       ARG  67  -7.074  -5.206   0.738
  512    HB2  ARG  67           2HB      ARG  67  -8.363  -7.895   1.279
  513    HB3  ARG  67           1HB      ARG  67  -6.829  -7.376   1.965
  514    HG2  ARG  67           2HG      ARG  67  -7.968  -5.529   3.112
  515    HG3  ARG  67           1HG      ARG  67  -9.506  -6.059   2.426
  516    HD2  ARG  67           2HD      ARG  67  -9.211  -6.829   4.743
  517    HD3  ARG  67           1HD      ARG  67  -9.343  -8.172   3.607
  518    HE   ARG  67           HE       ARG  67  -6.911  -8.422   3.788
  519   HH11  ARG  67          1HH1      ARG  67  -8.547  -6.676   6.268
  520   HH12  ARG  67          2HH1      ARG  67  -7.282  -6.919   7.423
  521   HH21  ARG  67          1HH2      ARG  67  -5.293  -8.725   5.275
  522   HH22  ARG  67          2HH2      ARG  67  -5.451  -8.052   6.864
  523    H    GLY  68           H        GLY  68  -5.227  -5.443  -0.392
  524    HA2  GLY  68           2HA      GLY  68  -4.424  -7.899  -1.580
  525    HA3  GLY  68           1HA      GLY  68  -5.033  -6.813  -2.818
  526    H    ASP  69           H        ASP  69  -2.641  -7.384  -3.382
  527    HA   ASP  69           HA       ASP  69  -0.677  -5.753  -1.979
  528    HB2  ASP  69           2HB      ASP  69  -0.374  -7.553  -4.400
  529    HB3  ASP  69           1HB      ASP  69   0.948  -6.775  -3.533
  530    H    PHE  70           H        PHE  70  -0.317  -3.694  -2.509
  531    HA   PHE  70           HA       PHE  70  -0.875  -2.811  -5.276
  532    HB2  PHE  70           2HB      PHE  70  -1.352  -0.588  -4.401
  533    HB3  PHE  70           1HB      PHE  70  -2.356  -1.777  -3.580
  534    HD1  PHE  70           HD1      PHE  70  -1.832  -2.430  -1.239
  535    HD2  PHE  70           HD2      PHE  70   0.218   0.747  -3.207
  536    HE1  PHE  70           HE1      PHE  70  -1.059  -1.581   0.936
  537    HE2  PHE  70           HE2      PHE  70   0.994   1.593  -1.035
  538    HZ   PHE  70           HZ       PHE  70   0.355   0.431   1.039
  539    HA   PRO  71           HA       PRO  71   3.432  -1.757  -5.621
  540    HB2  PRO  71           2HB      PRO  71   3.322   0.033  -7.656
  541    HB3  PRO  71           1HB      PRO  71   3.070  -1.700  -7.899
  542    HG2  PRO  71           2HG      PRO  71   1.037   0.489  -7.641
  543    HG3  PRO  71           1HG      PRO  71   1.082  -0.864  -8.787
  544    HD2  PRO  71           2HD      PRO  71  -0.467  -0.878  -6.550
  545    HD3  PRO  71           1HD      PRO  71   0.221  -2.356  -7.252
  546    H    GLY  72           H        GLY  72   4.230  -0.641  -3.909
  547    HA2  GLY  72           2HA      GLY  72   3.217   1.900  -3.056
  548    HA3  GLY  72           1HA      GLY  72   4.623   1.071  -2.413
  549    H    THR  73           H        THR  73   4.260   1.977  -5.802
  550    HA   THR  73           HA       THR  73   6.535   3.818  -5.523
  551    HB   THR  73           HB       THR  73   6.746   3.635  -7.993
  552    HG1  THR  73           HG1      THR  73   5.467   2.076  -9.075
  553   HG21  THR  73          3HG2      THR  73   6.685   0.964  -6.569
  554   HG22  THR  73          1HG2      THR  73   8.024   2.112  -6.547
  555   HG23  THR  73          2HG2      THR  73   7.562   1.324  -8.057
  556    H    TYR  74           H        TYR  74   3.161   3.690  -6.374
  557    HA   TYR  74           HA       TYR  74   3.220   6.484  -7.322
  558    HB2  TYR  74           2HB      TYR  74   1.019   4.419  -7.583
  559    HB3  TYR  74           1HB      TYR  74   1.011   6.032  -8.287
  560    HD1  TYR  74           HD2      TYR  74   3.079   6.550  -9.866
  561    HD2  TYR  74           HD1      TYR  74   1.690   2.637  -8.915
  562    HE1  TYR  74           HE2      TYR  74   4.166   5.678 -11.891
  563    HE2  TYR  74           HE1      TYR  74   2.771   1.758 -10.938
  564    HH   TYR  74           HH       TYR  74   3.522   2.586 -13.129
  565    H    VAL  75           H        VAL  75   3.118   5.302  -4.441
  566    HA   VAL  75           HA       VAL  75   0.774   6.859  -3.519
  567    HB   VAL  75           HB       VAL  75   0.622   5.416  -1.567
  568   HG11  VAL  75          1HG1      VAL  75  -0.095   3.322  -2.646
  569   HG12  VAL  75          2HG1      VAL  75   0.720   3.815  -4.130
  570   HG13  VAL  75          3HG1      VAL  75  -0.652   4.743  -3.527
  571   HG21  VAL  75          3HG2      VAL  75   2.943   3.883  -2.757
  572   HG22  VAL  75          1HG2      VAL  75   1.999   3.387  -1.350
  573   HG23  VAL  75          2HG2      VAL  75   2.975   4.855  -1.285
  574    H    GLU  76           H        GLU  76   1.011   7.913  -1.407
  575    HA   GLU  76           HA       GLU  76   3.807   8.610  -0.780
  576    HB2  GLU  76           2HB      GLU  76   2.988  10.684   0.181
  577    HB3  GLU  76           1HB      GLU  76   2.395  10.518  -1.465
  578    HG2  GLU  76           2HG      GLU  76   0.206   9.931  -0.695
  579    HG3  GLU  76           1HG      GLU  76   0.767   9.823   0.973
  580    H    PHE  77           H        PHE  77   4.603   8.290   1.248
  581    HA   PHE  77           HA       PHE  77   3.126   6.620   3.068
  582    HB2  PHE  77           2HB      PHE  77   5.504   6.259   2.777
  583    HB3  PHE  77           1HB      PHE  77   5.858   7.912   3.263
  584    HD1  PHE  77           HD2      PHE  77   3.882   5.056   4.703
  585    HD2  PHE  77           HD1      PHE  77   6.839   8.064   5.324
  586    HE1  PHE  77           HE2      PHE  77   4.167   4.298   7.023
  587    HE2  PHE  77           HE1      PHE  77   7.121   7.309   7.648
  588    HZ   PHE  77           HZ       PHE  77   5.786   5.423   8.499
  589    H    LEU  78           H        LEU  78   1.657   7.397   4.457
  590    HA   LEU  78           HA       LEU  78   1.742  10.164   5.356
  591    HB2  LEU  78           2HB      LEU  78  -0.185   7.944   6.074
  592    HB3  LEU  78           1HB      LEU  78  -0.383   9.642   6.467
  593    HG   LEU  78           HG       LEU  78  -0.399   8.452   3.682
  594   HD11  LEU  78          1HD1      LEU  78  -2.623   9.621   5.361
  595   HD12  LEU  78          2HD1      LEU  78  -2.420   7.926   4.910
  596   HD13  LEU  78          3HD1      LEU  78  -2.761   9.131   3.671
  597   HD21  LEU  78          3HD2      LEU  78  -1.046  10.717   2.952
  598   HD22  LEU  78          1HD2      LEU  78   0.579  10.670   3.638
  599   HD23  LEU  78          2HD2      LEU  78  -0.763  11.310   4.589
  600    H    GLY  79           H        GLY  79   1.882   6.935   6.829
  601    HA2  GLY  79           2HA      GLY  79   3.718   6.787   8.584
  602    HA3  GLY  79           1HA      GLY  79   2.901   8.155   9.325
  603    HA   PRO  80           HA       PRO  80   1.107   4.299  11.264
  604    HB2  PRO  80           2HB      PRO  80   1.202   5.308  13.815
  605    HB3  PRO  80           1HB      PRO  80   2.506   4.363  13.084
  606    HG2  PRO  80           2HG      PRO  80   2.253   7.335  13.373
  607    HG3  PRO  80           1HG      PRO  80   3.676   6.302  13.614
  608    HD2  PRO  80           2HD      PRO  80   3.311   7.754  11.360
  609    HD3  PRO  80           1HD      PRO  80   4.124   6.175  11.346
  610    H    LEU  81           H        LEU  81  -0.909   4.251  12.626
  611    HA   LEU  81           HA       LEU  81  -2.737   6.203  11.503
  612    HB2  LEU  81           2HB      LEU  81  -3.215   3.676  13.087
  613    HB3  LEU  81           1HB      LEU  81  -4.501   4.723  12.515
  614    HG   LEU  81           HG       LEU  81  -3.662   4.330  10.167
  615   HD11  LEU  81          1HD1      LEU  81  -2.273   2.358   9.759
  616   HD12  LEU  81          2HD1      LEU  81  -2.023   2.171  11.496
  617   HD13  LEU  81          3HD1      LEU  81  -1.404   3.597  10.663
  618   HD21  LEU  81          3HD2      LEU  81  -4.701   2.132   9.961
  619   HD22  LEU  81          1HD2      LEU  81  -5.626   3.188  11.029
  620   HD23  LEU  81          2HD2      LEU  81  -4.612   1.915  11.711
  621    H    GLU  82           H        GLU  82  -4.405   7.231  12.761
  622    HA   GLU  82           HA       GLU  82  -3.397   8.267  15.288
  623    HB2  GLU  82           2HB      GLU  82  -5.378   9.837  15.055
  624    HB3  GLU  82           1HB      GLU  82  -4.159   9.943  13.793
  625    HG2  GLU  82           2HG      GLU  82  -5.580   8.568  12.326
  626    HG3  GLU  82           1HG      GLU  82  -6.809   8.513  13.587
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1   0.033   4.432  23.837
    2    H2   MET   1           2H       MET   1   1.062   4.962  22.601
    3    H3   MET   1           3H       MET   1   1.089   5.727  24.108
    4    HA   MET   1           HA       MET   1   2.999   4.313  23.901
    5    HB2  MET   1           2HB      MET   1   2.790   3.110  25.961
    6    HB3  MET   1           1HB      MET   1   1.807   4.560  26.109
    7    HG2  MET   1           2HG      MET   1   0.809   1.771  25.552
    8    HG3  MET   1           1HG      MET   1   0.651   2.663  27.064
    9    HE1  MET   1           3HE      MET   1  -1.104   4.508  27.527
   10    HE2  MET   1           1HE      MET   1  -1.961   5.387  26.261
   11    HE3  MET   1           2HE      MET   1  -0.207   5.515  26.390
   12    H    ALA   2           H        ALA   2   0.099   2.918  22.708
   13    HA   ALA   2           HA       ALA   2   0.594   0.184  22.766
   14    HB1  ALA   2           3HB      ALA   2  -1.552   1.163  22.121
   15    HB2  ALA   2           1HB      ALA   2  -0.987   0.005  20.916
   16    HB3  ALA   2           2HB      ALA   2  -0.842   1.736  20.612
   17    H    GLY   3           H        GLY   3   1.475   2.508  20.205
   18    HA2  GLY   3           2HA      GLY   3   3.742   2.334  19.289
   19    HA3  GLY   3           1HA      GLY   3   3.564   0.588  19.344
   20    HA   PRO   4           HA       PRO   4   2.317   2.408  15.107
   21    HB2  PRO   4           2HB      PRO   4   4.843   1.249  14.117
   22    HB3  PRO   4           1HB      PRO   4   4.178   2.866  13.869
   23    HG2  PRO   4           2HG      PRO   4   6.318   2.449  15.448
   24    HG3  PRO   4           1HG      PRO   4   5.111   3.696  15.818
   25    HD2  PRO   4           2HD      PRO   4   5.417   0.946  16.998
   26    HD3  PRO   4           1HD      PRO   4   5.081   2.490  17.815
   27    H    GLU   5           H        GLU   5   0.848   0.534  15.714
   28    HA   GLU   5           HA       GLU   5   1.504  -2.119  14.969
   29    HB2  GLU   5           2HB      GLU   5  -1.201  -0.778  15.204
   30    HB3  GLU   5           1HB      GLU   5  -0.952  -2.513  15.057
   31    HG2  GLU   5           2HG      GLU   5   0.148  -0.834  17.308
   32    HG3  GLU   5           1HG      GLU   5  -1.382  -1.706  17.381
   33    H    GLY   6           H        GLY   6   0.131   0.572  13.157
   34    HA2  GLY   6           2HA      GLY   6   0.630  -0.882  10.664
   35    HA3  GLY   6           1HA      GLY   6  -1.013  -0.326  10.946
   36    H    PHE   7           H        PHE   7   0.326   0.518   8.723
   37    HA   PHE   7           HA       PHE   7   0.859   3.370   9.290
   38    HB2  PHE   7           2HB      PHE   7   2.309   1.702   7.209
   39    HB3  PHE   7           1HB      PHE   7   2.614   3.391   7.604
   40    HD1  PHE   7           HD1      PHE   7   3.651   3.983   9.784
   41    HD2  PHE   7           HD2      PHE   7   3.253  -0.063   8.506
   42    HE1  PHE   7           HE1      PHE   7   5.319   3.293  11.455
   43    HE2  PHE   7           HE2      PHE   7   4.915  -0.757  10.179
   44    HZ   PHE   7           HZ       PHE   7   5.951   0.920  11.657
   45    H    GLN   8           H        GLN   8   0.124   4.857   7.692
   46    HA   GLN   8           HA       GLN   8  -1.790   3.724   5.754
   47    HB2  GLN   8           2HB      GLN   8  -1.600   6.465   7.003
   48    HB3  GLN   8           1HB      GLN   8  -2.645   6.125   5.630
   49    HG2  GLN   8           2HG      GLN   8  -3.735   4.342   7.028
   50    HG3  GLN   8           1HG      GLN   8  -2.807   4.953   8.396
   51   HE21  GLN   8          1HE2      GLN   8  -5.702   4.868   7.951
   52   HE22  GLN   8          2HE2      GLN   8  -6.252   6.496   8.113
   53    H    TYR   9           H        TYR   9  -1.765   4.238   3.605
   54    HA   TYR   9           HA       TYR   9   0.441   5.911   2.580
   55    HB2  TYR   9           2HB      TYR   9  -0.441   3.231   1.468
   56    HB3  TYR   9           1HB      TYR   9   0.780   4.278   0.756
   57    HD1  TYR   9           HD2      TYR   9   2.985   4.532   1.828
   58    HD2  TYR   9           HD1      TYR   9   0.057   1.872   3.413
   59    HE1  TYR   9           HE2      TYR   9   4.719   3.439   3.184
   60    HE2  TYR   9           HE1      TYR   9   1.786   0.773   4.771
   61    HH   TYR   9           HH       TYR   9   4.222   0.476   4.762
   62    H    ARG  10           H        ARG  10  -0.267   7.452   1.157
   63    HA   ARG  10           HA       ARG  10  -3.061   7.275   0.249
   64    HB2  ARG  10           2HB      ARG  10  -2.393   9.295   1.499
   65    HB3  ARG  10           1HB      ARG  10  -1.192   9.659   0.267
   66    HG2  ARG  10           2HG      ARG  10  -2.975   9.919  -1.398
   67    HG3  ARG  10           1HG      ARG  10  -4.180   9.555  -0.162
   68    HD2  ARG  10           2HD      ARG  10  -4.041  11.951  -0.492
   69    HD3  ARG  10           1HD      ARG  10  -3.435  11.540   1.112
   70    HE   ARG  10           HE       ARG  10  -1.689  12.157  -1.191
   71   HH11  ARG  10          1HH1      ARG  10  -2.449  12.382   2.155
   72   HH12  ARG  10          2HH1      ARG  10  -1.011  13.257   2.546
   73   HH21  ARG  10          1HH2      ARG  10   0.167  13.290  -0.683
   74   HH22  ARG  10          2HH2      ARG  10   0.472  13.725   0.961
   75    H    ALA  11           H        ALA  11  -3.427   6.563  -1.760
   76    HA   ALA  11           HA       ALA  11  -1.413   6.377  -3.767
   77    HB1  ALA  11           3HB      ALA  11  -3.261   4.781  -3.635
   78    HB2  ALA  11           1HB      ALA  11  -3.214   5.564  -5.215
   79    HB3  ALA  11           2HB      ALA  11  -4.408   6.064  -4.018
   80    H    LEU  12           H        LEU  12  -0.637   8.045  -4.900
   81    HA   LEU  12           HA       LEU  12  -2.026  10.556  -5.076
   82    HB2  LEU  12           2HB      LEU  12   0.553   9.657  -6.368
   83    HB3  LEU  12           1HB      LEU  12  -0.034  11.308  -6.323
   84    HG   LEU  12           HG       LEU  12   0.803   9.651  -3.935
   85   HD11  LEU  12          1HD1      LEU  12   2.679  10.413  -5.306
   86   HD12  LEU  12          2HD1      LEU  12   2.637  11.250  -3.754
   87   HD13  LEU  12          3HD1      LEU  12   2.080  12.071  -5.213
   88   HD21  LEU  12          3HD2      LEU  12  -1.040  11.135  -3.344
   89   HD22  LEU  12          1HD2      LEU  12  -0.189  12.504  -4.060
   90   HD23  LEU  12          2HD2      LEU  12   0.468  11.703  -2.632
   91    H    TYR  13           H        TYR  13  -1.303   7.943  -7.354
   92    HA   TYR  13           HA       TYR  13  -2.951   9.324  -9.380
   93    HB2  TYR  13           2HB      TYR  13  -0.417   7.726  -9.849
   94    HB3  TYR  13           1HB      TYR  13  -1.461   8.349 -11.123
   95    HD1  TYR  13           HD1      TYR  13  -1.714  10.843 -11.382
   96    HD2  TYR  13           HD2      TYR  13   1.215   9.121  -8.811
   97    HE1  TYR  13           HE1      TYR  13  -0.497  12.973 -11.345
   98    HE2  TYR  13           HE2      TYR  13   2.439  11.255  -8.776
   99    HH   TYR  13           HH       TYR  13   1.086  14.155  -9.841
  100    HA   PRO  14           HA       PRO  14  -5.338   5.565  -9.564
  101    HB2  PRO  14           2HB      PRO  14  -6.275   5.740 -12.137
  102    HB3  PRO  14           1HB      PRO  14  -6.929   6.672 -10.785
  103    HG2  PRO  14           2HG      PRO  14  -4.977   7.511 -12.899
  104    HG3  PRO  14           1HG      PRO  14  -6.335   8.417 -12.206
  105    HD2  PRO  14           2HD      PRO  14  -3.766   8.846 -11.455
  106    HD3  PRO  14           1HD      PRO  14  -5.131   9.039 -10.334
  107    H    PHE  15           H        PHE  15  -4.761   3.500  -9.904
  108    HA   PHE  15           HA       PHE  15  -3.041   2.845 -12.198
  109    HB2  PHE  15           2HB      PHE  15  -1.558   3.054 -10.287
  110    HB3  PHE  15           1HB      PHE  15  -2.588   2.001  -9.325
  111    HD1  PHE  15           HD1      PHE  15  -0.426   2.071 -12.343
  112    HD2  PHE  15           HD2      PHE  15  -2.251  -0.322  -9.326
  113    HE1  PHE  15           HE1      PHE  15   0.864   0.122 -13.108
  114    HE2  PHE  15           HE2      PHE  15  -0.965  -2.273 -10.091
  115    HZ   PHE  15           HZ       PHE  15   0.594  -2.051 -11.987
  116    H    ARG  16           H        ARG  16  -4.103   1.408 -13.405
  117    HA   ARG  16           HA       ARG  16  -5.971  -0.486 -12.302
  118    HB2  ARG  16           2HB      ARG  16  -6.174  -1.347 -14.565
  119    HB3  ARG  16           1HB      ARG  16  -6.227   0.408 -14.598
  120    HG2  ARG  16           2HG      ARG  16  -3.933   0.502 -15.381
  121    HG3  ARG  16           1HG      ARG  16  -3.793  -1.253 -15.248
  122    HD2  ARG  16           2HD      ARG  16  -5.584   0.296 -17.123
  123    HD3  ARG  16           1HD      ARG  16  -4.170  -0.665 -17.555
  124    HE   ARG  16           HE       ARG  16  -6.693  -1.781 -16.509
  125   HH11  ARG  16          1HH1      ARG  16  -3.865  -2.067 -18.461
  126   HH12  ARG  16          2HH1      ARG  16  -4.326  -3.620 -19.069
  127   HH21  ARG  16          1HH2      ARG  16  -7.254  -3.760 -17.290
  128   HH22  ARG  16          2HH2      ARG  16  -6.204  -4.582 -18.392
  129    H    ARG  17           H        ARG  17  -5.598  -2.569 -11.703
  130    HA   ARG  17           HA       ARG  17  -2.886  -3.233 -11.074
  131    HB2  ARG  17           2HB      ARG  17  -5.351  -3.876 -10.017
  132    HB3  ARG  17           1HB      ARG  17  -4.859  -5.393 -10.753
  133    HG2  ARG  17           2HG      ARG  17  -3.244  -3.817  -8.746
  134    HG3  ARG  17           1HG      ARG  17  -4.229  -5.232  -8.380
  135    HD2  ARG  17           2HD      ARG  17  -2.817  -6.575  -9.889
  136    HD3  ARG  17           1HD      ARG  17  -1.815  -5.155 -10.195
  137    HE   ARG  17           HE       ARG  17  -1.948  -5.605  -7.426
  138   HH11  ARG  17          1HH1      ARG  17  -0.572  -6.991 -10.265
  139   HH12  ARG  17          2HH1      ARG  17   0.712  -7.757  -9.402
  140   HH21  ARG  17          1HH2      ARG  17  -0.279  -6.581  -6.338
  141   HH22  ARG  17          2HH2      ARG  17   0.874  -7.527  -7.210
  142    H    GLU  18           H        GLU  18  -1.637  -4.981 -11.757
  143    HA   GLU  18           HA       GLU  18  -1.466  -5.839 -14.337
  144    HB2  GLU  18           2HB      GLU  18   0.075  -6.283 -12.317
  145    HB3  GLU  18           1HB      GLU  18  -0.913  -7.703 -12.024
  146    HG2  GLU  18           2HG      GLU  18   0.937  -8.485 -13.215
  147    HG3  GLU  18           1HG      GLU  18  -0.353  -8.389 -14.415
  148    H    ARG  19           H        ARG  19  -3.716  -6.939 -11.934
  149    HA   ARG  19           HA       ARG  19  -5.266  -8.378 -13.886
  150    HB2  ARG  19           2HB      ARG  19  -3.605 -10.061 -13.121
  151    HB3  ARG  19           1HB      ARG  19  -4.162  -9.840 -11.469
  152    HG2  ARG  19           2HG      ARG  19  -6.279 -10.800 -11.960
  153    HG3  ARG  19           1HG      ARG  19  -5.968 -10.752 -13.698
  154    HD2  ARG  19           2HD      ARG  19  -4.449 -12.424 -11.689
  155    HD3  ARG  19           1HD      ARG  19  -5.702 -13.021 -12.777
  156    HE   ARG  19           HE       ARG  19  -3.577 -11.704 -14.171
  157   HH11  ARG  19          1HH1      ARG  19  -4.483 -14.682 -12.703
  158   HH12  ARG  19          2HH1      ARG  19  -3.461 -15.623 -13.731
  159   HH21  ARG  19          1HH2      ARG  19  -2.274 -12.916 -15.485
  160   HH22  ARG  19          2HH2      ARG  19  -2.226 -14.636 -15.299
  161    HA   PRO  20           HA       PRO  20  -8.431  -6.405 -11.404
  162    HB2  PRO  20           2HB      PRO  20 -10.156  -8.599 -12.467
  163    HB3  PRO  20           1HB      PRO  20 -10.397  -6.848 -12.520
  164    HG2  PRO  20           2HG      PRO  20  -9.649  -8.167 -14.701
  165    HG3  PRO  20           1HG      PRO  20  -8.961  -6.574 -14.332
  166    HD2  PRO  20           2HD      PRO  20  -7.746  -9.295 -13.984
  167    HD3  PRO  20           1HD      PRO  20  -6.991  -7.788 -14.545
  168    H    GLU  21           H        GLU  21  -7.392  -9.621 -10.966
  169    HA   GLU  21           HA       GLU  21  -9.103 -10.443  -8.859
  170    HB2  GLU  21           2HB      GLU  21  -7.761 -12.017 -10.174
  171    HB3  GLU  21           1HB      GLU  21  -6.281 -11.300  -9.554
  172    HG2  GLU  21           2HG      GLU  21  -6.805 -12.078  -7.316
  173    HG3  GLU  21           1HG      GLU  21  -8.348 -12.724  -7.876
  174    H    ASP  22           H        ASP  22  -6.222  -8.454  -8.958
  175    HA   ASP  22           HA       ASP  22  -5.926  -8.523  -6.041
  176    HB2  ASP  22           2HB      ASP  22  -4.177  -7.249  -8.159
  177    HB3  ASP  22           1HB      ASP  22  -3.795  -7.369  -6.443
  178    H    LEU  23           H        LEU  23  -4.738  -5.971  -5.698
  179    HA   LEU  23           HA       LEU  23  -7.209  -4.384  -5.573
  180    HB2  LEU  23           2HB      LEU  23  -6.193  -4.894  -3.441
  181    HB3  LEU  23           1HB      LEU  23  -4.645  -4.270  -3.978
  182    HG   LEU  23           HG       LEU  23  -5.533  -1.997  -4.014
  183   HD11  LEU  23          1HD1      LEU  23  -7.777  -1.504  -3.162
  184   HD12  LEU  23          2HD1      LEU  23  -8.124  -3.232  -3.087
  185   HD13  LEU  23          3HD1      LEU  23  -7.830  -2.457  -4.644
  186   HD21  LEU  23          3HD2      LEU  23  -6.121  -3.452  -1.434
  187   HD22  LEU  23          1HD2      LEU  23  -5.903  -1.710  -1.603
  188   HD23  LEU  23          2HD2      LEU  23  -4.562  -2.801  -1.940
  189    H    GLU  24           H        GLU  24  -7.441  -2.491  -6.598
  190    HA   GLU  24           HA       GLU  24  -5.182  -1.452  -8.175
  191    HB2  GLU  24           2HB      GLU  24  -8.136  -0.844  -8.477
  192    HB3  GLU  24           1HB      GLU  24  -6.850  -0.392  -9.592
  193    HG2  GLU  24           2HG      GLU  24  -6.419  -2.792 -10.007
  194    HG3  GLU  24           1HG      GLU  24  -7.780  -3.192  -8.963
  195    H    LEU  25           H        LEU  25  -5.229   1.012  -8.514
  196    HA   LEU  25           HA       LEU  25  -5.580   2.271  -5.857
  197    HB2  LEU  25           2HB      LEU  25  -3.483   2.865  -7.954
  198    HB3  LEU  25           1HB      LEU  25  -3.650   3.701  -6.420
  199    HG   LEU  25           HG       LEU  25  -2.955   0.775  -6.755
  200   HD11  LEU  25          1HD1      LEU  25  -0.746   1.434  -5.895
  201   HD12  LEU  25          2HD1      LEU  25  -1.242   3.128  -5.949
  202   HD13  LEU  25          3HD1      LEU  25  -1.117   2.197  -7.442
  203   HD21  LEU  25          3HD2      LEU  25  -3.091   2.467  -4.257
  204   HD22  LEU  25          1HD2      LEU  25  -2.567   0.785  -4.350
  205   HD23  LEU  25          2HD2      LEU  25  -4.240   1.207  -4.713
  206    H    LEU  26           H        LEU  26  -6.465   4.287  -5.679
  207    HA   LEU  26           HA       LEU  26  -7.306   5.683  -8.148
  208    HB2  LEU  26           2HB      LEU  26  -8.797   5.179  -5.589
  209    HB3  LEU  26           1HB      LEU  26  -9.139   6.636  -6.500
  210    HG   LEU  26           HG       LEU  26 -10.763   4.903  -7.021
  211   HD11  LEU  26          1HD1      LEU  26 -10.585   4.904  -9.447
  212   HD12  LEU  26          2HD1      LEU  26  -8.894   5.389  -9.338
  213   HD13  LEU  26          3HD1      LEU  26 -10.162   6.481  -8.782
  214   HD21  LEU  26          3HD2      LEU  26 -10.183   2.826  -8.090
  215   HD22  LEU  26          1HD2      LEU  26  -9.323   2.944  -6.554
  216   HD23  LEU  26          2HD2      LEU  26  -8.471   3.247  -8.069
  217    HA   PRO  27           HA       PRO  27  -4.995   9.158  -6.679
  218    HB2  PRO  27           2HB      PRO  27  -6.325  11.255  -7.765
  219    HB3  PRO  27           1HB      PRO  27  -5.380  10.115  -8.732
  220    HG2  PRO  27           2HG      PRO  27  -8.345  10.206  -8.276
  221    HG3  PRO  27           1HG      PRO  27  -7.454   9.935  -9.786
  222    HD2  PRO  27           2HD      PRO  27  -8.541   7.909  -8.337
  223    HD3  PRO  27           1HD      PRO  27  -7.069   7.713  -9.309
  224    H    GLY  28           H        GLY  28  -4.868  10.119  -4.737
  225    HA2  GLY  28           2HA      GLY  28  -5.457  11.338  -2.863
  226    HA3  GLY  28           1HA      GLY  28  -6.998  11.699  -3.623
  227    H    ASP  29           H        ASP  29  -6.023   8.386  -3.312
  228    HA   ASP  29           HA       ASP  29  -8.093   7.982  -1.249
  229    HB2  ASP  29           2HB      ASP  29  -8.431   6.858  -3.435
  230    HB3  ASP  29           1HB      ASP  29  -6.910   6.000  -3.215
  231    H    VAL  30           H        VAL  30  -7.673   6.264   0.371
  232    HA   VAL  30           HA       VAL  30  -4.817   6.225   1.142
  233    HB   VAL  30           HB       VAL  30  -7.211   6.416   2.989
  234   HG11  VAL  30          1HG1      VAL  30  -5.409   5.134   4.007
  235   HG12  VAL  30          2HG1      VAL  30  -5.544   6.713   4.780
  236   HG13  VAL  30          3HG1      VAL  30  -4.252   6.409   3.616
  237   HG21  VAL  30          3HG2      VAL  30  -5.113   8.476   2.275
  238   HG22  VAL  30          1HG2      VAL  30  -6.355   8.670   3.512
  239   HG23  VAL  30          2HG2      VAL  30  -6.817   8.515   1.817
  240    H    LEU  31           H        LEU  31  -3.932   4.312   1.625
  241    HA   LEU  31           HA       LEU  31  -5.691   1.988   2.093
  242    HB2  LEU  31           2HB      LEU  31  -2.998   2.004   0.703
  243    HB3  LEU  31           1HB      LEU  31  -3.941   0.574   1.072
  244    HG   LEU  31           HG       LEU  31  -5.775   1.627  -0.411
  245   HD11  LEU  31          1HD1      LEU  31  -4.864   3.868  -0.587
  246   HD12  LEU  31          2HD1      LEU  31  -4.954   3.117  -2.177
  247   HD13  LEU  31          3HD1      LEU  31  -3.403   3.240  -1.348
  248   HD21  LEU  31          3HD2      LEU  31  -3.200   0.665  -1.657
  249   HD22  LEU  31          1HD2      LEU  31  -4.786   0.678  -2.430
  250   HD23  LEU  31          2HD2      LEU  31  -4.496  -0.354  -1.030
  251    H    VAL  32           H        VAL  32  -5.184   0.645   3.800
  252    HA   VAL  32           HA       VAL  32  -3.055   1.608   5.609
  253    HB   VAL  32           HB       VAL  32  -5.486  -0.068   6.282
  254   HG11  VAL  32          1HG1      VAL  32  -3.640  -0.497   7.808
  255   HG12  VAL  32          2HG1      VAL  32  -4.907   0.418   8.626
  256   HG13  VAL  32          3HG1      VAL  32  -3.438   1.233   8.085
  257   HG21  VAL  32          3HG2      VAL  32  -6.131   2.192   5.618
  258   HG22  VAL  32          1HG2      VAL  32  -4.975   2.874   6.763
  259   HG23  VAL  32          2HG2      VAL  32  -6.366   1.961   7.351
  260    H    VAL  33           H        VAL  33  -1.301   0.388   5.915
  261    HA   VAL  33           HA       VAL  33  -1.478  -2.541   5.529
  262    HB   VAL  33           HB       VAL  33   0.910  -0.797   4.866
  263   HG11  VAL  33          1HG1      VAL  33   0.492  -3.769   4.508
  264   HG12  VAL  33          2HG1      VAL  33   1.580  -3.000   5.665
  265   HG13  VAL  33          3HG1      VAL  33   1.888  -2.852   3.934
  266   HG21  VAL  33          3HG2      VAL  33  -0.868  -0.498   3.228
  267   HG22  VAL  33          1HG2      VAL  33  -1.003  -2.245   3.027
  268   HG23  VAL  33          2HG2      VAL  33   0.468  -1.410   2.523
  269    H    SER  34           H        SER  34  -0.916  -3.701   7.285
  270    HA   SER  34           HA       SER  34   0.198  -2.255   9.587
  271    HB2  SER  34           2HB      SER  34  -1.186  -4.940   9.397
  272    HB3  SER  34           1HB      SER  34  -0.535  -4.272  10.891
  273    HG   SER  34           HG       SER  34  -2.826  -3.620   9.518
  274    H    ARG  35           H        ARG  35   1.803  -3.275  10.995
  275    HA   ARG  35           HA       ARG  35   4.153  -4.049   9.769
  276    HB2  ARG  35           2HB      ARG  35   3.125  -4.407  12.563
  277    HB3  ARG  35           1HB      ARG  35   4.641  -5.170  12.108
  278    HG2  ARG  35           2HG      ARG  35   5.535  -2.955  11.467
  279    HG3  ARG  35           1HG      ARG  35   4.026  -2.216  12.013
  280    HD2  ARG  35           2HD      ARG  35   4.416  -2.887  14.269
  281    HD3  ARG  35           1HD      ARG  35   5.752  -3.934  13.798
  282    HE   ARG  35           HE       ARG  35   6.668  -1.548  13.029
  283   HH11  ARG  35          1HH1      ARG  35   5.154  -2.533  15.969
  284   HH12  ARG  35          2HH1      ARG  35   6.051  -1.416  16.932
  285   HH21  ARG  35          1HH2      ARG  35   7.822  -0.134  14.265
  286   HH22  ARG  35          2HH2      ARG  35   7.553  -0.064  15.971
  287    H    ALA  36           H        ALA  36   1.575  -6.152  10.976
  288    HA   ALA  36           HA       ALA  36   2.731  -8.645  10.771
  289    HB1  ALA  36           3HB      ALA  36  -0.103  -7.950   9.988
  290    HB2  ALA  36           1HB      ALA  36   0.465  -8.223  11.636
  291    HB3  ALA  36           2HB      ALA  36   0.494  -9.540  10.464
  292    H    ALA  37           H        ALA  37   1.452  -6.658   8.125
  293    HA   ALA  37           HA       ALA  37   1.816  -8.701   6.127
  294    HB1  ALA  37           3HB      ALA  37   1.244  -6.954   4.524
  295    HB2  ALA  37           1HB      ALA  37   1.365  -5.734   5.795
  296    HB3  ALA  37           2HB      ALA  37   0.107  -6.969   5.873
  297    H    LEU  38           H        LEU  38   3.536  -5.689   6.975
  298    HA   LEU  38           HA       LEU  38   5.516  -5.808   4.997
  299    HB2  LEU  38           2HB      LEU  38   5.661  -4.608   7.769
  300    HB3  LEU  38           1HB      LEU  38   6.817  -4.298   6.487
  301    HG   LEU  38           HG       LEU  38   3.882  -3.560   6.427
  302   HD11  LEU  38          1HD1      LEU  38   5.205  -2.189   7.972
  303   HD12  LEU  38          2HD1      LEU  38   4.659  -1.263   6.576
  304   HD13  LEU  38          3HD1      LEU  38   6.332  -1.812   6.667
  305   HD21  LEU  38          3HD2      LEU  38   6.077  -3.040   4.414
  306   HD22  LEU  38          1HD2      LEU  38   4.450  -2.358   4.353
  307   HD23  LEU  38          2HD2      LEU  38   4.683  -4.098   4.194
  308    H    GLN  39           H        GLN  39   5.601  -7.086   8.332
  309    HA   GLN  39           HA       GLN  39   8.232  -8.071   8.253
  310    HB2  GLN  39           2HB      GLN  39   5.864  -9.038   9.869
  311    HB3  GLN  39           1HB      GLN  39   7.523  -9.559  10.132
  312    HG2  GLN  39           2HG      GLN  39   8.148  -7.207  10.593
  313    HG3  GLN  39           1HG      GLN  39   6.452  -6.758  10.431
  314   HE21  GLN  39          1HE2      GLN  39   7.531  -9.740  11.912
  315   HE22  GLN  39          2HE2      GLN  39   7.062  -9.332  13.520
  316    H    ALA  40           H        ALA  40   5.182  -9.542   7.231
  317    HA   ALA  40           HA       ALA  40   6.191 -12.128   6.664
  318    HB1  ALA  40           3HB      ALA  40   3.793 -11.659   6.860
  319    HB2  ALA  40           1HB      ALA  40   4.171 -12.421   5.314
  320    HB3  ALA  40           2HB      ALA  40   3.860 -10.687   5.390
  321    H    LEU  41           H        LEU  41   6.106  -9.138   4.810
  322    HA   LEU  41           HA       LEU  41   7.097 -10.275   2.359
  323    HB2  LEU  41           2HB      LEU  41   7.174  -7.401   3.290
  324    HB3  LEU  41           1HB      LEU  41   7.378  -7.964   1.642
  325    HG   LEU  41           HG       LEU  41   4.832  -8.229   3.251
  326   HD11  LEU  41          1HD1      LEU  41   5.350  -5.894   2.750
  327   HD12  LEU  41          2HD1      LEU  41   3.959  -6.455   1.822
  328   HD13  LEU  41          3HD1      LEU  41   5.533  -6.296   1.042
  329   HD21  LEU  41          3HD2      LEU  41   5.083  -9.981   1.568
  330   HD22  LEU  41          1HD2      LEU  41   5.391  -8.760   0.331
  331   HD23  LEU  41          2HD2      LEU  41   3.813  -8.846   1.113
  332    H    GLY  42           H        GLY  42   8.522  -9.025   5.273
  333    HA2  GLY  42           2HA      GLY  42  10.791  -9.541   5.876
  334    HA3  GLY  42           1HA      GLY  42  11.223  -9.491   4.175
  335    H    VAL  43           H        VAL  43   9.150  -6.972   5.226
  336    HA   VAL  43           HA       VAL  43  11.234  -4.995   4.845
  337    HB   VAL  43           HB       VAL  43   8.320  -4.598   5.568
  338   HG11  VAL  43          1HG1      VAL  43  10.357  -2.622   4.526
  339   HG12  VAL  43          2HG1      VAL  43   9.694  -2.666   6.161
  340   HG13  VAL  43          3HG1      VAL  43   8.643  -2.294   4.794
  341   HG21  VAL  43          3HG2      VAL  43   9.675  -4.505   2.866
  342   HG22  VAL  43          1HG2      VAL  43   7.995  -4.065   3.187
  343   HG23  VAL  43          2HG2      VAL  43   8.531  -5.727   3.421
  344    H    ALA  44           H        ALA  44  12.283  -3.903   6.398
  345    HA   ALA  44           HA       ALA  44  11.604  -4.465   9.212
  346    HB1  ALA  44           3HB      ALA  44  14.284  -3.709   8.041
  347    HB2  ALA  44           1HB      ALA  44  13.771  -5.347   8.451
  348    HB3  ALA  44           2HB      ALA  44  13.957  -4.137   9.720
  349    H    GLU  45           H        GLU  45  11.775  -2.800  10.776
  350    HA   GLU  45           HA       GLU  45  10.721  -0.337  10.384
  351    HB2  GLU  45           2HB      GLU  45  12.936  -1.063  12.320
  352    HB3  GLU  45           1HB      GLU  45  12.010   0.427  12.409
  353    HG2  GLU  45           2HG      GLU  45  10.796  -2.324  12.587
  354    HG3  GLU  45           1HG      GLU  45  11.289  -1.369  13.982
  355    H    GLY  46           H        GLY  46  11.229   1.237   8.988
  356    HA2  GLY  46           2HA      GLY  46  12.903   3.047   8.562
  357    HA3  GLY  46           1HA      GLY  46  14.092   1.762   8.401
  358    H    GLY  47           H        GLY  47  11.798   0.180   7.023
  359    HA2  GLY  47           2HA      GLY  47  12.404   1.152   4.331
  360    HA3  GLY  47           1HA      GLY  47  11.649  -0.379   4.742
  361    H    GLU  48           H        GLU  48   9.629   0.848   6.468
  362    HA   GLU  48           HA       GLU  48   7.575   1.130   4.577
  363    HB2  GLU  48           2HB      GLU  48   6.113   1.634   6.423
  364    HB3  GLU  48           1HB      GLU  48   7.248   0.393   6.929
  365    HG2  GLU  48           2HG      GLU  48   7.403   3.329   7.623
  366    HG3  GLU  48           1HG      GLU  48   6.868   2.034   8.694
  367    H    ARG  49           H        ARG  49   9.539   3.573   6.169
  368    HA   ARG  49           HA       ARG  49   7.965   5.826   5.462
  369    HB2  ARG  49           2HB      ARG  49   9.932   7.157   6.066
  370    HB3  ARG  49           1HB      ARG  49   9.588   5.919   7.265
  371    HG2  ARG  49           2HG      ARG  49  11.363   4.531   5.924
  372    HG3  ARG  49           1HG      ARG  49  11.872   6.122   5.350
  373    HD2  ARG  49           2HD      ARG  49  13.158   5.486   7.320
  374    HD3  ARG  49           1HD      ARG  49  12.123   6.870   7.687
  375    HE   ARG  49           HE       ARG  49  10.847   4.410   8.321
  376   HH11  ARG  49          1HH1      ARG  49  13.204   6.626   9.515
  377   HH12  ARG  49          2HH1      ARG  49  12.933   6.164  11.157
  378   HH21  ARG  49          1HH2      ARG  49  10.528   3.839  10.428
  379   HH22  ARG  49          2HH2      ARG  49  11.455   4.616  11.663
  380    H    CYS  50           H        CYS  50   9.735   3.780   3.511
  381    HA   CYS  50           HA       CYS  50   9.349   5.635   1.278
  382    HB2  CYS  50           2HB      CYS  50  11.912   4.110   1.789
  383    HB3  CYS  50           1HB      CYS  50  11.498   4.817   0.231
  384    HG   CYS  50           HG       CYS  50  11.223   7.080   2.628
  385    HA   PRO  51           HA       PRO  51   7.250   1.533   0.737
  386    HB2  PRO  51           2HB      PRO  51   5.426   2.573  -1.083
  387    HB3  PRO  51           1HB      PRO  51   5.186   2.484   0.664
  388    HG2  PRO  51           2HG      PRO  51   6.114   4.798  -1.002
  389    HG3  PRO  51           1HG      PRO  51   4.983   4.784   0.365
  390    HD2  PRO  51           2HD      PRO  51   7.509   5.604   0.682
  391    HD3  PRO  51           1HD      PRO  51   6.700   4.644   1.941
  392    H    GLN  52           H        GLN  52   8.795   3.664  -1.507
  393    HA   GLN  52           HA       GLN  52   8.613   2.223  -3.896
  394    HB2  GLN  52           2HB      GLN  52  10.664   3.392  -4.568
  395    HB3  GLN  52           1HB      GLN  52   9.539   4.488  -3.779
  396    HG2  GLN  52           2HG      GLN  52  10.838   4.314  -1.701
  397    HG3  GLN  52           1HG      GLN  52  11.974   3.234  -2.507
  398   HE21  GLN  52          1HE2      GLN  52  13.371   4.090  -4.075
  399   HE22  GLN  52          2HE2      GLN  52  13.671   5.786  -4.201
  400    H    SER  53           H        SER  53  10.636   1.670  -1.063
  401    HA   SER  53           HA       SER  53  12.248  -0.354  -2.375
  402    HB2  SER  53           2HB      SER  53  13.236   1.007  -0.581
  403    HB3  SER  53           1HB      SER  53  12.058   0.371   0.564
  404    HG   SER  53           HG       SER  53  13.213  -1.723  -0.579
  405    H    VAL  54           H        VAL  54   9.299  -0.245  -0.542
  406    HA   VAL  54           HA       VAL  54   9.202  -3.021   0.148
  407    HB   VAL  54           HB       VAL  54   6.905  -1.068  -0.166
  408   HG11  VAL  54          1HG1      VAL  54   7.031  -3.742   1.240
  409   HG12  VAL  54          2HG1      VAL  54   6.113  -3.362  -0.217
  410   HG13  VAL  54          3HG1      VAL  54   5.674  -2.615   1.319
  411   HG21  VAL  54          3HG2      VAL  54   8.506  -1.822   2.287
  412   HG22  VAL  54          1HG2      VAL  54   7.045  -0.831   2.292
  413   HG23  VAL  54          2HG2      VAL  54   8.499  -0.255   1.476
  414    H    GLY  55           H        GLY  55   7.816  -1.087  -2.503
  415    HA2  GLY  55           2HA      GLY  55   7.441  -1.684  -4.703
  416    HA3  GLY  55           1HA      GLY  55   8.084  -3.280  -4.348
  417    H    TRP  56           H        TRP  56   6.607  -4.769  -3.151
  418    HA   TRP  56           HA       TRP  56   3.790  -4.310  -3.916
  419    HB2  TRP  56           2HB      TRP  56   3.660  -6.810  -4.273
  420    HB3  TRP  56           1HB      TRP  56   4.628  -5.928  -5.446
  421    HD1  TRP  56           HD1      TRP  56   7.357  -6.205  -5.214
  422    HE1  TRP  56           HE1      TRP  56   8.748  -8.185  -4.340
  423    HE3  TRP  56           HE3      TRP  56   3.712  -8.693  -2.620
  424    HZ2  TRP  56           HZ2      TRP  56   8.359 -10.489  -2.769
  425    HZ3  TRP  56           HZ3      TRP  56   4.309 -10.781  -1.467
  426    HH2  TRP  56           HH2      TRP  56   6.586 -11.661  -1.540
  427    H    MET  57           H        MET  57   2.297  -4.544  -2.353
  428    HA   MET  57           HA       MET  57   2.812  -6.191  -0.020
  429    HB2  MET  57           2HB      MET  57   2.391  -4.297   1.571
  430    HB3  MET  57           1HB      MET  57   3.922  -4.211   0.715
  431    HG2  MET  57           2HG      MET  57   2.937  -2.568  -0.838
  432    HG3  MET  57           1HG      MET  57   1.435  -2.629   0.089
  433    HE1  MET  57           3HE      MET  57   3.223   0.019  -0.566
  434    HE2  MET  57           1HE      MET  57   3.085   0.872   0.972
  435    HE3  MET  57           2HE      MET  57   1.671   0.083   0.272
  436    HA   PRO  58           HA       PRO  58  -1.662  -6.296  -0.160
  437    HB2  PRO  58           2HB      PRO  58  -2.083  -8.058   1.809
  438    HB3  PRO  58           1HB      PRO  58  -1.284  -8.538   0.307
  439    HG2  PRO  58           2HG      PRO  58  -0.109  -8.027   2.998
  440    HG3  PRO  58           1HG      PRO  58   0.387  -9.191   1.756
  441    HD2  PRO  58           2HD      PRO  58   1.544  -6.657   2.259
  442    HD3  PRO  58           1HD      PRO  58   1.855  -7.704   0.861
  443    H    GLY  59           H        GLY  59  -3.044  -4.774   0.572
  444    HA2  GLY  59           2HA      GLY  59  -3.180  -4.196   3.448
  445    HA3  GLY  59           1HA      GLY  59  -2.834  -2.854   2.370
  446    H    LEU  60           H        LEU  60  -4.947  -2.464   3.851
  447    HA   LEU  60           HA       LEU  60  -7.343  -3.302   2.372
  448    HB2  LEU  60           2HB      LEU  60  -7.426  -3.519   4.801
  449    HB3  LEU  60           1HB      LEU  60  -7.029  -1.823   4.992
  450    HG   LEU  60           HG       LEU  60  -9.186  -1.224   3.897
  451   HD11  LEU  60          1HD1      LEU  60 -10.909  -2.931   3.622
  452   HD12  LEU  60          2HD1      LEU  60  -9.751  -4.185   4.062
  453   HD13  LEU  60          3HD1      LEU  60  -9.519  -3.250   2.584
  454   HD21  LEU  60          3HD2      LEU  60  -8.999  -1.285   6.330
  455   HD22  LEU  60          1HD2      LEU  60  -9.439  -2.993   6.332
  456   HD23  LEU  60          2HD2      LEU  60 -10.606  -1.780   5.803
  457    H    ASN  61           H        ASN  61  -8.442  -1.962   1.067
  458    HA   ASN  61           HA       ASN  61  -7.463   0.779   0.717
  459    HB2  ASN  61           2HB      ASN  61  -7.701  -0.721  -1.255
  460    HB3  ASN  61           1HB      ASN  61  -9.433  -0.811  -0.952
  461   HD21  ASN  61          1HD2      ASN  61  -6.835   1.144  -2.119
  462   HD22  ASN  61          2HD2      ASN  61  -7.810   2.422  -2.751
  463    H    GLU  62           H        GLU  62  -8.768   2.614   0.941
  464    HA   GLU  62           HA       GLU  62 -11.080   2.302   2.668
  465    HB2  GLU  62           2HB      GLU  62  -9.566   4.710   1.666
  466    HB3  GLU  62           1HB      GLU  62 -11.038   4.858   2.617
  467    HG2  GLU  62           2HG      GLU  62  -8.547   3.416   3.525
  468    HG3  GLU  62           1HG      GLU  62  -8.961   5.079   3.944
  469    H    ARG  63           H        ARG  63 -10.521   3.924  -0.494
  470    HA   ARG  63           HA       ARG  63 -13.216   4.735  -0.801
  471    HB2  ARG  63           2HB      ARG  63 -11.309   5.794  -1.949
  472    HB3  ARG  63           1HB      ARG  63 -11.099   4.353  -2.928
  473    HG2  ARG  63           2HG      ARG  63 -13.223   4.716  -4.014
  474    HG3  ARG  63           1HG      ARG  63 -13.580   6.070  -2.938
  475    HD2  ARG  63           2HD      ARG  63 -11.693   7.316  -3.848
  476    HD3  ARG  63           1HD      ARG  63 -11.272   5.952  -4.885
  477    HE   ARG  63           HE       ARG  63 -13.710   6.405  -5.747
  478   HH11  ARG  63          1HH1      ARG  63 -11.319   8.741  -4.900
  479   HH12  ARG  63          2HH1      ARG  63 -11.867   9.883  -6.076
  480   HH21  ARG  63          1HH2      ARG  63 -14.406   7.893  -7.236
  481   HH22  ARG  63          2HH2      ARG  63 -13.579   9.409  -7.380
  482    H    THR  64           H        THR  64 -11.462   2.105  -2.495
  483    HA   THR  64           HA       THR  64 -13.918   1.047  -3.616
  484    HB   THR  64           HB       THR  64 -12.542  -0.674  -4.644
  485    HG1  THR  64           HG1      THR  64 -10.171   0.343  -3.542
  486   HG21  THR  64          3HG2      THR  64 -11.150   2.013  -4.762
  487   HG22  THR  64          1HG2      THR  64 -12.549   1.535  -5.724
  488   HG23  THR  64          2HG2      THR  64 -11.003   0.717  -5.948
  489    H    ARG  65           H        ARG  65 -12.180   0.610  -0.717
  490    HA   ARG  65           HA       ARG  65 -12.354  -0.776   1.070
  491    HB2  ARG  65           2HB      ARG  65 -14.992  -1.523  -0.212
  492    HB3  ARG  65           1HB      ARG  65 -14.524  -1.902   1.442
  493    HG2  ARG  65           2HG      ARG  65 -14.437   0.459   1.996
  494    HG3  ARG  65           1HG      ARG  65 -14.805   0.888   0.323
  495    HD2  ARG  65           2HD      ARG  65 -16.792   1.051   1.722
  496    HD3  ARG  65           1HD      ARG  65 -16.974  -0.219   0.512
  497    HE   ARG  65           HE       ARG  65 -15.987  -1.366   2.870
  498   HH11  ARG  65          1HH1      ARG  65 -18.879   0.117   1.705
  499   HH12  ARG  65          2HH1      ARG  65 -19.888  -0.763   2.800
  500   HH21  ARG  65          1HH2      ARG  65 -17.283  -2.481   4.244
  501   HH22  ARG  65          2HH2      ARG  65 -18.994  -2.219   4.226
  502    H    GLN  66           H        GLN  66 -11.302  -1.823  -1.627
  503    HA   GLN  66           HA       GLN  66 -11.791  -4.688  -1.442
  504    HB2  GLN  66           2HB      GLN  66 -10.004  -3.091  -3.288
  505    HB3  GLN  66           1HB      GLN  66 -10.286  -4.823  -3.414
  506    HG2  GLN  66           2HG      GLN  66 -12.625  -4.444  -3.907
  507    HG3  GLN  66           1HG      GLN  66 -12.425  -2.709  -3.655
  508   HE21  GLN  66          1HE2      GLN  66 -13.320  -4.181  -6.032
  509   HE22  GLN  66          2HE2      GLN  66 -12.255  -3.704  -7.303
  510    H    ARG  67           H        ARG  67  -9.941  -6.213  -1.486
  511    HA   ARG  67           HA       ARG  67  -7.610  -5.310   0.103
  512    HB2  ARG  67           2HB      ARG  67  -9.118  -7.921   0.415
  513    HB3  ARG  67           1HB      ARG  67  -7.651  -7.483   1.278
  514    HG2  ARG  67           2HG      ARG  67  -8.799  -5.744   2.473
  515    HG3  ARG  67           1HG      ARG  67 -10.254  -5.977   1.499
  516    HD2  ARG  67           2HD      ARG  67  -9.032  -8.004   3.386
  517    HD3  ARG  67           1HD      ARG  67 -10.481  -7.045   3.691
  518    HE   ARG  67           HE       ARG  67 -11.473  -8.231   1.738
  519   HH11  ARG  67          1HH1      ARG  67  -8.909  -9.705   3.519
  520   HH12  ARG  67          2HH1      ARG  67  -9.334 -11.298   2.996
  521   HH21  ARG  67          1HH2      ARG  67 -12.005 -10.274   1.100
  522   HH22  ARG  67          2HH2      ARG  67 -11.077 -11.620   1.668
  523    H    GLY  68           H        GLY  68  -5.662  -5.903  -0.758
  524    HA2  GLY  68           2HA      GLY  68  -5.056  -8.347  -1.945
  525    HA3  GLY  68           1HA      GLY  68  -5.536  -7.281  -3.253
  526    H    ASP  69           H        ASP  69  -3.267  -7.904  -3.867
  527    HA   ASP  69           HA       ASP  69  -1.142  -6.499  -2.456
  528    HB2  ASP  69           2HB      ASP  69  -0.876  -8.816  -3.401
  529    HB3  ASP  69           1HB      ASP  69  -1.007  -8.123  -5.013
  530    H    PHE  70           H        PHE  70  -0.530  -4.469  -2.969
  531    HA   PHE  70           HA       PHE  70  -1.014  -3.489  -5.713
  532    HB2  PHE  70           2HB      PHE  70  -1.703  -1.314  -4.853
  533    HB3  PHE  70           1HB      PHE  70  -2.741  -2.572  -4.195
  534    HD1  PHE  70           HD1      PHE  70  -2.416  -3.316  -1.824
  535    HD2  PHE  70           HD2      PHE  70  -0.424   0.088  -3.438
  536    HE1  PHE  70           HE1      PHE  70  -1.949  -2.507   0.451
  537    HE2  PHE  70           HE2      PHE  70   0.043   0.899  -1.165
  538    HZ   PHE  70           HZ       PHE  70  -0.718  -0.399   0.783
  539    HA   PRO  71           HA       PRO  71   3.213  -2.112  -5.505
  540    HB2  PRO  71           2HB      PRO  71   3.268  -0.273  -7.470
  541    HB3  PRO  71           1HB      PRO  71   3.047  -1.994  -7.809
  542    HG2  PRO  71           2HG      PRO  71   0.990   0.182  -7.652
  543    HG3  PRO  71           1HG      PRO  71   1.153  -1.117  -8.851
  544    HD2  PRO  71           2HD      PRO  71  -0.591  -1.220  -6.742
  545    HD3  PRO  71           1HD      PRO  71   0.116  -2.663  -7.495
  546    H    GLY  72           H        GLY  72   4.057  -0.919  -3.908
  547    HA2  GLY  72           2HA      GLY  72   2.743   1.429  -2.877
  548    HA3  GLY  72           1HA      GLY  72   4.236   0.723  -2.284
  549    H    THR  73           H        THR  73   4.229   1.403  -5.642
  550    HA   THR  73           HA       THR  73   6.234   3.452  -5.305
  551    HB   THR  73           HB       THR  73   4.983   2.473  -7.884
  552    HG1  THR  73           HG1      THR  73   7.039   1.180  -7.858
  553   HG21  THR  73          3HG2      THR  73   7.644   3.812  -7.330
  554   HG22  THR  73          1HG2      THR  73   6.259   4.552  -8.135
  555   HG23  THR  73          2HG2      THR  73   7.107   3.206  -8.897
  556    H    TYR  74           H        TYR  74   2.827   3.400  -5.781
  557    HA   TYR  74           HA       TYR  74   2.780   6.167  -6.805
  558    HB2  TYR  74           2HB      TYR  74   0.575   4.090  -6.715
  559    HB3  TYR  74           1HB      TYR  74   0.415   5.709  -7.385
  560    HD1  TYR  74           HD1      TYR  74   2.029   2.411  -7.861
  561    HD2  TYR  74           HD2      TYR  74   1.190   6.211  -9.593
  562    HE1  TYR  74           HE1      TYR  74   2.755   1.566 -10.053
  563    HE2  TYR  74           HE2      TYR  74   1.911   5.372 -11.790
  564    HH   TYR  74           HH       TYR  74   3.338   3.612 -12.713
  565    H    VAL  75           H        VAL  75   3.017   5.086  -3.849
  566    HA   VAL  75           HA       VAL  75   0.695   6.573  -2.779
  567    HB   VAL  75           HB       VAL  75   0.611   5.048  -0.871
  568   HG11  VAL  75          1HG1      VAL  75  -0.291   3.081  -2.027
  569   HG12  VAL  75          2HG1      VAL  75   0.478   3.606  -3.526
  570   HG13  VAL  75          3HG1      VAL  75  -0.804   4.579  -2.804
  571   HG21  VAL  75          3HG2      VAL  75   2.961   4.370  -0.806
  572   HG22  VAL  75          1HG2      VAL  75   2.755   3.479  -2.316
  573   HG23  VAL  75          2HG2      VAL  75   1.903   2.961  -0.862
  574    H    GLU  76           H        GLU  76   0.950   7.855  -1.005
  575    HA   GLU  76           HA       GLU  76   3.663   8.611  -0.221
  576    HB2  GLU  76           2HB      GLU  76   0.933   9.823   0.223
  577    HB3  GLU  76           1HB      GLU  76   2.357  10.423   1.061
  578    HG2  GLU  76           2HG      GLU  76   2.293  10.216  -1.923
  579    HG3  GLU  76           1HG      GLU  76   1.570  11.591  -1.093
  580    H    PHE  77           H        PHE  77   4.570   8.008   1.691
  581    HA   PHE  77           HA       PHE  77   3.171   6.418   3.608
  582    HB2  PHE  77           2HB      PHE  77   5.572   6.151   3.335
  583    HB3  PHE  77           1HB      PHE  77   5.848   7.833   3.777
  584    HD1  PHE  77           HD2      PHE  77   4.310   4.714   5.159
  585    HD2  PHE  77           HD1      PHE  77   6.437   8.319   5.964
  586    HE1  PHE  77           HE2      PHE  77   4.542   4.053   7.514
  587    HE2  PHE  77           HE1      PHE  77   6.664   7.658   8.322
  588    HZ   PHE  77           HZ       PHE  77   5.717   5.525   9.098
  589    H    LEU  78           H        LEU  78   1.468   7.384   4.587
  590    HA   LEU  78           HA       LEU  78   1.473  10.147   5.355
  591    HB2  LEU  78           2HB      LEU  78  -0.476   7.964   6.110
  592    HB3  LEU  78           1HB      LEU  78  -0.742   9.690   6.286
  593    HG   LEU  78           HG       LEU  78  -0.486   8.157   3.696
  594   HD11  LEU  78          1HD1      LEU  78  -2.813   9.637   4.913
  595   HD12  LEU  78          2HD1      LEU  78  -2.644   7.887   4.768
  596   HD13  LEU  78          3HD1      LEU  78  -2.793   8.881   3.319
  597   HD21  LEU  78          3HD2      LEU  78  -0.927  10.294   2.568
  598   HD22  LEU  78          1HD2      LEU  78   0.599  10.318   3.449
  599   HD23  LEU  78          2HD2      LEU  78  -0.818  11.130   4.117
  600    H    GLY  79           H        GLY  79   1.568   7.090   7.203
  601    HA2  GLY  79           2HA      GLY  79   3.426   7.550   9.029
  602    HA3  GLY  79           1HA      GLY  79   2.158   8.591   9.650
  603    HA   PRO  80           HA       PRO  80   1.550   4.242  11.327
  604    HB2  PRO  80           2HB      PRO  80   2.451   5.110  13.933
  605    HB3  PRO  80           1HB      PRO  80   3.164   3.893  12.875
  606    HG2  PRO  80           2HG      PRO  80   4.353   6.297  13.470
  607    HG3  PRO  80           1HG      PRO  80   4.681   5.363  11.999
  608    HD2  PRO  80           2HD      PRO  80   2.892   7.744  12.375
  609    HD3  PRO  80           1HD      PRO  80   3.996   7.362  11.033
  610    H    LEU  81           H        LEU  81  -0.368   3.691  12.234
  611    HA   LEU  81           HA       LEU  81  -2.171   5.802  13.047
  612    HB2  LEU  81           2HB      LEU  81  -2.571   2.812  12.846
  613    HB3  LEU  81           1HB      LEU  81  -3.835   3.941  13.292
  614    HG   LEU  81           HG       LEU  81  -3.495   5.052  11.036
  615   HD11  LEU  81          1HD1      LEU  81  -1.883   2.553  10.525
  616   HD12  LEU  81          2HD1      LEU  81  -1.288   4.214  10.515
  617   HD13  LEU  81          3HD1      LEU  81  -2.437   3.683   9.288
  618   HD21  LEU  81          3HD2      LEU  81  -5.379   3.571  11.495
  619   HD22  LEU  81          1HD2      LEU  81  -4.398   2.166  11.075
  620   HD23  LEU  81          2HD2      LEU  81  -4.808   3.359   9.841
  621    H    GLU  82           H        GLU  82  -3.190   6.041  15.047
  622    HA   GLU  82           HA       GLU  82  -2.364   4.304  17.266
  623    HB2  GLU  82           2HB      GLU  82  -0.829   6.259  17.251
  624    HB3  GLU  82           1HB      GLU  82  -2.217   7.328  17.405
  625    HG2  GLU  82           2HG      GLU  82  -2.759   6.265  19.571
  626    HG3  GLU  82           1HG      GLU  82  -1.312   5.272  19.414
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  -3.660   8.607  22.801
    2    H2   MET   1           2H       MET   1  -4.753   7.421  23.312
    3    H3   MET   1           3H       MET   1  -5.321   8.890  22.696
    4    HA   MET   1           HA       MET   1  -5.550   7.118  21.068
    5    HB2  MET   1           2HB      MET   1  -3.477   9.224  20.406
    6    HB3  MET   1           1HB      MET   1  -4.304   8.243  19.205
    7    HG2  MET   1           2HG      MET   1  -5.275  10.471  19.410
    8    HG3  MET   1           1HG      MET   1  -6.431   9.205  19.827
    9    HE1  MET   1           3HE      MET   1  -6.866  12.313  20.590
   10    HE2  MET   1           1HE      MET   1  -7.507  12.106  22.219
   11    HE3  MET   1           2HE      MET   1  -8.004  11.009  20.930
   12    H    ALA   2           H        ALA   2  -4.645   5.469  19.802
   13    HA   ALA   2           HA       ALA   2  -2.216   4.257  20.819
   14    HB1  ALA   2           3HB      ALA   2  -4.214   2.923  20.296
   15    HB2  ALA   2           1HB      ALA   2  -2.805   2.384  19.382
   16    HB3  ALA   2           2HB      ALA   2  -4.051   3.355  18.594
   17    H    GLY   3           H        GLY   3  -1.317   3.008  18.329
   18    HA2  GLY   3           2HA      GLY   3  -0.677   5.005  16.400
   19    HA3  GLY   3           1HA      GLY   3   0.641   4.833  17.539
   20    HA   PRO   4           HA       PRO   4   2.582   1.936  15.077
   21    HB2  PRO   4           2HB      PRO   4   3.193   0.098  17.292
   22    HB3  PRO   4           1HB      PRO   4   4.274   1.116  16.340
   23    HG2  PRO   4           2HG      PRO   4   3.704   1.688  18.900
   24    HG3  PRO   4           1HG      PRO   4   3.943   2.965  17.692
   25    HD2  PRO   4           2HD      PRO   4   1.375   1.858  18.793
   26    HD3  PRO   4           1HD      PRO   4   1.836   3.550  18.498
   27    H    GLU   5           H        GLU   5  -0.373   0.917  15.947
   28    HA   GLU   5           HA       GLU   5  -0.305  -1.890  15.630
   29    HB2  GLU   5           2HB      GLU   5  -2.281  -0.633  16.435
   30    HB3  GLU   5           1HB      GLU   5  -2.507   0.029  14.824
   31    HG2  GLU   5           2HG      GLU   5  -4.059  -1.760  15.166
   32    HG3  GLU   5           1HG      GLU   5  -2.866  -2.261  13.967
   33    H    GLY   6           H        GLY   6  -0.185   0.718  13.334
   34    HA2  GLY   6           2HA      GLY   6   0.757  -0.894  11.207
   35    HA3  GLY   6           1HA      GLY   6  -0.955  -0.560  10.972
   36    H    PHE   7           H        PHE   7   0.200   0.446   8.982
   37    HA   PHE   7           HA       PHE   7   0.699   3.291   9.572
   38    HB2  PHE   7           2HB      PHE   7   2.254   1.597   7.597
   39    HB3  PHE   7           1HB      PHE   7   2.446   3.332   7.829
   40    HD1  PHE   7           HD1      PHE   7   3.029   4.086  10.275
   41    HD2  PHE   7           HD2      PHE   7   3.632   0.145   8.770
   42    HE1  PHE   7           HE1      PHE   7   4.692   3.669  12.039
   43    HE2  PHE   7           HE2      PHE   7   5.288  -0.279  10.538
   44    HZ   PHE   7           HZ       PHE   7   5.821   1.484  12.175
   45    H    GLN   8           H        GLN   8  -0.026   4.775   8.063
   46    HA   GLN   8           HA       GLN   8  -1.939   3.755   6.077
   47    HB2  GLN   8           2HB      GLN   8  -1.637   6.511   7.297
   48    HB3  GLN   8           1HB      GLN   8  -2.842   6.079   6.091
   49    HG2  GLN   8           2HG      GLN   8  -3.861   4.504   7.632
   50    HG3  GLN   8           1HG      GLN   8  -2.621   4.847   8.837
   51   HE21  GLN   8          1HE2      GLN   8  -4.105   5.573  10.354
   52   HE22  GLN   8          2HE2      GLN   8  -4.938   7.071  10.196
   53    H    TYR   9           H        TYR   9  -1.550   3.916   3.961
   54    HA   TYR   9           HA       TYR   9   0.563   5.764   3.018
   55    HB2  TYR   9           2HB      TYR   9  -0.191   3.041   1.919
   56    HB3  TYR   9           1HB      TYR   9   0.963   4.138   1.171
   57    HD1  TYR   9           HD1      TYR   9   0.371   1.864   4.000
   58    HD2  TYR   9           HD2      TYR   9   3.180   4.454   2.114
   59    HE1  TYR   9           HE1      TYR   9   2.171   0.915   5.379
   60    HE2  TYR   9           HE2      TYR   9   4.984   3.502   3.486
   61    HH   TYR   9           HH       TYR   9   4.688   0.670   5.223
   62    H    ARG  10           H        ARG  10  -0.042   7.243   1.504
   63    HA   ARG  10           HA       ARG  10  -2.830   7.119   0.589
   64    HB2  ARG  10           2HB      ARG  10  -2.182   9.131   1.805
   65    HB3  ARG  10           1HB      ARG  10  -0.893   9.445   0.650
   66    HG2  ARG  10           2HG      ARG  10  -2.467   9.897  -1.095
   67    HG3  ARG  10           1HG      ARG  10  -3.815   9.348  -0.099
   68    HD2  ARG  10           2HD      ARG  10  -3.744  11.782  -0.193
   69    HD3  ARG  10           1HD      ARG  10  -3.438  11.211   1.448
   70    HE   ARG  10           HE       ARG  10  -0.996  11.614   0.073
   71   HH11  ARG  10          1HH1      ARG  10  -3.574  13.369   1.542
   72   HH12  ARG  10          2HH1      ARG  10  -2.583  14.738   1.899
   73   HH21  ARG  10          1HH2      ARG  10   0.261  13.369   0.547
   74   HH22  ARG  10          2HH2      ARG  10  -0.441  14.729   1.353
   75    H    ALA  11           H        ALA  11  -3.288   6.515  -1.412
   76    HA   ALA  11           HA       ALA  11  -1.307   6.199  -3.459
   77    HB1  ALA  11           3HB      ALA  11  -3.162   5.429  -4.854
   78    HB2  ALA  11           1HB      ALA  11  -4.318   6.000  -3.648
   79    HB3  ALA  11           2HB      ALA  11  -3.220   4.676  -3.261
   80    H    LEU  12           H        LEU  12  -0.519   7.816  -4.644
   81    HA   LEU  12           HA       LEU  12  -1.875  10.364  -4.811
   82    HB2  LEU  12           2HB      LEU  12   0.741   9.452  -6.021
   83    HB3  LEU  12           1HB      LEU  12   0.162  11.107  -5.975
   84    HG   LEU  12           HG       LEU  12   0.856   9.427  -3.553
   85   HD11  LEU  12          1HD1      LEU  12   2.756  10.926  -3.304
   86   HD12  LEU  12          2HD1      LEU  12   2.313  11.760  -4.795
   87   HD13  LEU  12          3HD1      LEU  12   2.822  10.071  -4.845
   88   HD21  LEU  12          3HD2      LEU  12  -0.928  10.999  -3.052
   89   HD22  LEU  12          1HD2      LEU  12   0.003  12.319  -3.763
   90   HD23  LEU  12          2HD2      LEU  12   0.576  11.523  -2.296
   91    H    TYR  13           H        TYR  13  -0.982   7.794  -7.116
   92    HA   TYR  13           HA       TYR  13  -2.554   9.219  -9.176
   93    HB2  TYR  13           2HB      TYR  13  -0.127   7.443  -9.551
   94    HB3  TYR  13           1HB      TYR  13  -1.090   8.118 -10.864
   95    HD1  TYR  13           HD1      TYR  13  -1.180  10.612 -11.156
   96    HD2  TYR  13           HD2      TYR  13   1.548   8.740  -8.473
   97    HE1  TYR  13           HE1      TYR  13   0.164  12.666 -11.093
   98    HE2  TYR  13           HE2      TYR  13   2.898  10.792  -8.406
   99    HH   TYR  13           HH       TYR  13   3.283  12.794  -9.906
  100    HA   PRO  14           HA       PRO  14  -5.255   5.694  -9.323
  101    HB2  PRO  14           2HB      PRO  14  -6.230   6.000 -11.868
  102    HB3  PRO  14           1HB      PRO  14  -6.776   6.947 -10.482
  103    HG2  PRO  14           2HG      PRO  14  -4.804   7.672 -12.618
  104    HG3  PRO  14           1HG      PRO  14  -6.071   8.669 -11.880
  105    HD2  PRO  14           2HD      PRO  14  -3.469   8.885 -11.170
  106    HD3  PRO  14           1HD      PRO  14  -4.789   9.139 -10.009
  107    H    PHE  15           H        PHE  15  -4.647   3.647  -9.547
  108    HA   PHE  15           HA       PHE  15  -3.063   2.846 -11.908
  109    HB2  PHE  15           2HB      PHE  15  -1.711   2.640  -9.924
  110    HB3  PHE  15           1HB      PHE  15  -2.998   1.797  -9.070
  111    HD1  PHE  15           HD1      PHE  15  -0.784   1.477 -12.056
  112    HD2  PHE  15           HD2      PHE  15  -3.009  -0.527  -9.026
  113    HE1  PHE  15           HE1      PHE  15   0.148  -0.672 -12.798
  114    HE2  PHE  15           HE2      PHE  15  -2.077  -2.680  -9.764
  115    HZ   PHE  15           HZ       PHE  15  -0.495  -2.753 -11.653
  116    H    ARG  16           H        ARG  16  -4.347   1.796 -13.308
  117    HA   ARG  16           HA       ARG  16  -6.457   0.009 -12.377
  118    HB2  ARG  16           2HB      ARG  16  -6.997  -0.299 -14.744
  119    HB3  ARG  16           1HB      ARG  16  -6.884   1.413 -14.357
  120    HG2  ARG  16           2HG      ARG  16  -4.754   1.593 -15.422
  121    HG3  ARG  16           1HG      ARG  16  -4.638  -0.157 -15.614
  122    HD2  ARG  16           2HD      ARG  16  -6.698   1.615 -16.934
  123    HD3  ARG  16           1HD      ARG  16  -5.245   0.988 -17.712
  124    HE   ARG  16           HE       ARG  16  -7.289  -0.836 -16.623
  125   HH11  ARG  16          1HH1      ARG  16  -5.410   0.306 -19.289
  126   HH12  ARG  16          2HH1      ARG  16  -5.893  -0.992 -20.316
  127   HH21  ARG  16          1HH2      ARG  16  -7.896  -2.475 -17.958
  128   HH22  ARG  16          2HH2      ARG  16  -7.302  -2.544 -19.579
  129    H    ARG  17           H        ARG  17  -6.484  -2.245 -12.747
  130    HA   ARG  17           HA       ARG  17  -3.840  -3.418 -13.385
  131    HB2  ARG  17           2HB      ARG  17  -4.529  -3.612 -10.978
  132    HB3  ARG  17           1HB      ARG  17  -5.899  -4.585 -11.498
  133    HG2  ARG  17           2HG      ARG  17  -4.158  -6.048 -10.742
  134    HG3  ARG  17           1HG      ARG  17  -4.307  -6.217 -12.486
  135    HD2  ARG  17           2HD      ARG  17  -2.360  -4.852 -12.845
  136    HD3  ARG  17           1HD      ARG  17  -2.264  -4.457 -11.128
  137    HE   ARG  17           HE       ARG  17  -2.073  -7.159 -11.159
  138   HH11  ARG  17          1HH1      ARG  17  -0.392  -4.693 -12.882
  139   HH12  ARG  17          2HH1      ARG  17   1.108  -5.551 -12.862
  140   HH21  ARG  17          1HH2      ARG  17  -0.132  -8.259 -11.162
  141   HH22  ARG  17          2HH2      ARG  17   1.242  -7.549 -11.936
  142    H    GLU  18           H        GLU  18  -3.789  -4.711 -15.104
  143    HA   GLU  18           HA       GLU  18  -6.010  -5.218 -16.734
  144    HB2  GLU  18           2HB      GLU  18  -3.598  -5.199 -17.433
  145    HB3  GLU  18           1HB      GLU  18  -3.418  -6.779 -16.687
  146    HG2  GLU  18           2HG      GLU  18  -3.684  -7.032 -19.058
  147    HG3  GLU  18           1HG      GLU  18  -5.103  -7.683 -18.240
  148    H    ARG  19           H        ARG  19  -4.655  -7.081 -14.099
  149    HA   ARG  19           HA       ARG  19  -6.813  -9.075 -14.436
  150    HB2  ARG  19           2HB      ARG  19  -4.186  -9.457 -12.968
  151    HB3  ARG  19           1HB      ARG  19  -5.429 -10.677 -13.213
  152    HG2  ARG  19           2HG      ARG  19  -3.708  -9.402 -15.339
  153    HG3  ARG  19           1HG      ARG  19  -3.596 -11.056 -14.736
  154    HD2  ARG  19           2HD      ARG  19  -5.943  -9.862 -16.222
  155    HD3  ARG  19           1HD      ARG  19  -4.739 -10.956 -16.901
  156    HE   ARG  19           HE       ARG  19  -5.606 -12.530 -15.052
  157   HH11  ARG  19          1HH1      ARG  19  -7.534 -10.285 -16.815
  158   HH12  ARG  19          2HH1      ARG  19  -8.968 -11.235 -16.680
  159   HH21  ARG  19          1HH2      ARG  19  -7.430 -13.757 -14.901
  160   HH22  ARG  19          2HH2      ARG  19  -8.906 -13.204 -15.618
  161    HA   PRO  20           HA       PRO  20  -8.404  -6.789 -10.896
  162    HB2  PRO  20           2HB      PRO  20 -10.588  -8.399 -10.444
  163    HB3  PRO  20           1HB      PRO  20 -10.519  -7.140 -11.679
  164    HG2  PRO  20           2HG      PRO  20 -10.079 -10.091 -11.958
  165    HG3  PRO  20           1HG      PRO  20 -10.998  -8.992 -13.005
  166    HD2  PRO  20           2HD      PRO  20  -8.529  -9.808 -13.661
  167    HD3  PRO  20           1HD      PRO  20  -9.083  -8.159 -14.023
  168    H    GLU  21           H        GLU  21  -6.780  -9.635 -10.710
  169    HA   GLU  21           HA       GLU  21  -7.538 -10.625  -8.145
  170    HB2  GLU  21           2HB      GLU  21  -4.923 -10.985  -9.627
  171    HB3  GLU  21           1HB      GLU  21  -5.526 -11.990  -8.313
  172    HG2  GLU  21           2HG      GLU  21  -7.335 -12.788  -9.677
  173    HG3  GLU  21           1HG      GLU  21  -6.906 -11.672 -10.972
  174    H    ASP  22           H        ASP  22  -5.422  -8.069  -9.202
  175    HA   ASP  22           HA       ASP  22  -4.188  -7.796  -6.557
  176    HB2  ASP  22           2HB      ASP  22  -3.751  -6.157  -9.066
  177    HB3  ASP  22           1HB      ASP  22  -2.793  -6.078  -7.594
  178    H    LEU  23           H        LEU  23  -3.866  -5.069  -6.312
  179    HA   LEU  23           HA       LEU  23  -6.648  -4.179  -5.848
  180    HB2  LEU  23           2HB      LEU  23  -5.237  -4.501  -3.843
  181    HB3  LEU  23           1HB      LEU  23  -4.106  -3.309  -4.455
  182    HG   LEU  23           HG       LEU  23  -5.872  -1.577  -4.303
  183   HD11  LEU  23          1HD1      LEU  23  -7.940  -2.083  -3.066
  184   HD12  LEU  23          2HD1      LEU  23  -7.508  -3.793  -3.070
  185   HD13  LEU  23          3HD1      LEU  23  -7.833  -2.960  -4.591
  186   HD21  LEU  23          3HD2      LEU  23  -4.308  -1.876  -2.460
  187   HD22  LEU  23          1HD2      LEU  23  -5.367  -3.087  -1.737
  188   HD23  LEU  23          2HD2      LEU  23  -5.899  -1.410  -1.859
  189    H    GLU  24           H        GLU  24  -7.378  -2.637  -7.163
  190    HA   GLU  24           HA       GLU  24  -5.576  -0.907  -8.641
  191    HB2  GLU  24           2HB      GLU  24  -8.605  -0.978  -8.568
  192    HB3  GLU  24           1HB      GLU  24  -7.633  -0.027  -9.685
  193    HG2  GLU  24           2HG      GLU  24  -6.668  -2.145 -10.563
  194    HG3  GLU  24           1HG      GLU  24  -7.785  -3.036  -9.529
  195    H    LEU  25           H        LEU  25  -5.414   1.337  -8.421
  196    HA   LEU  25           HA       LEU  25  -6.322   2.359  -5.798
  197    HB2  LEU  25           2HB      LEU  25  -3.797   3.087  -7.291
  198    HB3  LEU  25           1HB      LEU  25  -4.268   3.673  -5.706
  199    HG   LEU  25           HG       LEU  25  -3.517   0.830  -6.422
  200   HD11  LEU  25          1HD1      LEU  25  -1.606   2.332  -6.292
  201   HD12  LEU  25          2HD1      LEU  25  -1.613   1.209  -4.933
  202   HD13  LEU  25          3HD1      LEU  25  -2.124   2.881  -4.697
  203   HD21  LEU  25          3HD2      LEU  25  -4.383   1.974  -3.764
  204   HD22  LEU  25          1HD2      LEU  25  -3.747   0.349  -4.025
  205   HD23  LEU  25          2HD2      LEU  25  -5.283   0.821  -4.750
  206    H    LEU  26           H        LEU  26  -7.187   4.390  -5.646
  207    HA   LEU  26           HA       LEU  26  -7.452   5.962  -8.135
  208    HB2  LEU  26           2HB      LEU  26  -9.335   5.539  -5.827
  209    HB3  LEU  26           1HB      LEU  26  -9.468   6.983  -6.807
  210    HG   LEU  26           HG       LEU  26 -11.069   5.330  -7.561
  211   HD11  LEU  26          1HD1      LEU  26 -10.477   5.188  -9.924
  212   HD12  LEU  26          2HD1      LEU  26  -8.804   5.599  -9.538
  213   HD13  LEU  26          3HD1      LEU  26 -10.090   6.776  -9.259
  214   HD21  LEU  26          3HD2      LEU  26 -10.409   3.171  -8.469
  215   HD22  LEU  26          1HD2      LEU  26  -9.917   3.309  -6.782
  216   HD23  LEU  26          2HD2      LEU  26  -8.723   3.496  -8.067
  217    HA   PRO  27           HA       PRO  27  -5.140   9.274  -6.430
  218    HB2  PRO  27           2HB      PRO  27  -6.579  11.496  -7.196
  219    HB3  PRO  27           1HB      PRO  27  -5.530  10.567  -8.273
  220    HG2  PRO  27           2HG      PRO  27  -8.504  10.418  -7.929
  221    HG3  PRO  27           1HG      PRO  27  -7.548  10.400  -9.424
  222    HD2  PRO  27           2HD      PRO  27  -8.551   8.141  -8.379
  223    HD3  PRO  27           1HD      PRO  27  -6.961   8.166  -9.167
  224    H    GLY  28           H        GLY  28  -5.012   9.564  -4.295
  225    HA2  GLY  28           2HA      GLY  28  -5.449  10.919  -2.402
  226    HA3  GLY  28           1HA      GLY  28  -7.096  11.142  -2.963
  227    H    ASP  29           H        ASP  29  -5.974   7.886  -3.040
  228    HA   ASP  29           HA       ASP  29  -7.833   7.124  -0.985
  229    HB2  ASP  29           2HB      ASP  29  -6.047   5.662  -2.871
  230    HB3  ASP  29           1HB      ASP  29  -6.600   4.803  -1.437
  231    H    VAL  30           H        VAL  30  -7.507   6.626   1.091
  232    HA   VAL  30           HA       VAL  30  -4.760   6.606   2.146
  233    HB   VAL  30           HB       VAL  30  -7.385   6.692   3.660
  234   HG11  VAL  30          1HG1      VAL  30  -5.585   5.673   4.967
  235   HG12  VAL  30          2HG1      VAL  30  -6.012   7.257   5.613
  236   HG13  VAL  30          3HG1      VAL  30  -4.550   7.066   4.646
  237   HG21  VAL  30          3HG2      VAL  30  -6.868   9.047   4.084
  238   HG22  VAL  30          1HG2      VAL  30  -7.012   8.735   2.354
  239   HG23  VAL  30          2HG2      VAL  30  -5.417   8.919   3.087
  240    H    LEU  31           H        LEU  31  -3.980   4.579   1.753
  241    HA   LEU  31           HA       LEU  31  -5.619   2.221   2.094
  242    HB2  LEU  31           2HB      LEU  31  -2.717   2.582   1.343
  243    HB3  LEU  31           1HB      LEU  31  -3.481   1.012   1.500
  244    HG   LEU  31           HG       LEU  31  -5.101   1.714  -0.303
  245   HD11  LEU  31          1HD1      LEU  31  -4.824   4.136  -0.101
  246   HD12  LEU  31          2HD1      LEU  31  -4.491   3.585  -1.741
  247   HD13  LEU  31          3HD1      LEU  31  -3.157   3.995  -0.661
  248   HD21  LEU  31          3HD2      LEU  31  -3.229   0.243  -0.781
  249   HD22  LEU  31          1HD2      LEU  31  -2.165   1.633  -1.002
  250   HD23  LEU  31          2HD2      LEU  31  -3.491   1.349  -2.127
  251    H    VAL  32           H        VAL  32  -5.667   0.862   3.772
  252    HA   VAL  32           HA       VAL  32  -4.072   1.485   6.150
  253    HB   VAL  32           HB       VAL  32  -6.410  -0.417   5.816
  254   HG11  VAL  32          1HG1      VAL  32  -4.980  -1.115   7.650
  255   HG12  VAL  32          2HG1      VAL  32  -6.475  -0.428   8.283
  256   HG13  VAL  32          3HG1      VAL  32  -4.987   0.520   8.314
  257   HG21  VAL  32          3HG2      VAL  32  -7.065   1.914   5.492
  258   HG22  VAL  32          1HG2      VAL  32  -6.302   2.356   7.020
  259   HG23  VAL  32          2HG2      VAL  32  -7.706   1.290   7.012
  260    H    VAL  33           H        VAL  33  -2.134   0.501   6.230
  261    HA   VAL  33           HA       VAL  33  -1.960  -2.357   5.472
  262    HB   VAL  33           HB       VAL  33   0.257  -0.289   5.385
  263   HG11  VAL  33          1HG1      VAL  33   1.093  -2.522   5.938
  264   HG12  VAL  33          2HG1      VAL  33   1.590  -2.048   4.314
  265   HG13  VAL  33          3HG1      VAL  33   0.264  -3.192   4.531
  266   HG21  VAL  33          3HG2      VAL  33  -1.360   0.076   3.604
  267   HG22  VAL  33          1HG2      VAL  33  -1.260  -1.622   3.137
  268   HG23  VAL  33          2HG2      VAL  33   0.142  -0.570   2.942
  269    H    SER  34           H        SER  34  -1.746  -3.649   7.185
  270    HA   SER  34           HA       SER  34  -1.073  -2.763   9.800
  271    HB2  SER  34           2HB      SER  34  -1.078  -5.175  10.380
  272    HB3  SER  34           1HB      SER  34  -2.499  -4.723   9.437
  273    HG   SER  34           HG       SER  34  -1.170  -6.710   8.853
  274    H    ARG  35           H        ARG  35   0.833  -2.956  10.998
  275    HA   ARG  35           HA       ARG  35   3.263  -2.895   9.519
  276    HB2  ARG  35           2HB      ARG  35   4.391  -2.668  11.678
  277    HB3  ARG  35           1HB      ARG  35   3.005  -1.600  11.570
  278    HG2  ARG  35           2HG      ARG  35   2.798  -2.389  13.714
  279    HG3  ARG  35           1HG      ARG  35   1.771  -3.523  12.843
  280    HD2  ARG  35           2HD      ARG  35   3.551  -5.178  12.825
  281    HD3  ARG  35           1HD      ARG  35   4.659  -4.027  13.572
  282    HE   ARG  35           HE       ARG  35   2.247  -4.670  15.069
  283   HH11  ARG  35          1HH1      ARG  35   5.612  -5.222  14.597
  284   HH12  ARG  35          2HH1      ARG  35   5.837  -5.910  16.166
  285   HH21  ARG  35          1HH2      ARG  35   2.547  -5.565  17.085
  286   HH22  ARG  35          2HH2      ARG  35   4.123  -6.093  17.559
  287    H    ALA  36           H        ALA  36   1.505  -5.435  11.081
  288    HA   ALA  36           HA       ALA  36   3.510  -7.405  11.259
  289    HB1  ALA  36           3HB      ALA  36   1.658  -9.024  11.213
  290    HB2  ALA  36           1HB      ALA  36   0.555  -7.738  10.719
  291    HB3  ALA  36           2HB      ALA  36   1.330  -7.676  12.301
  292    H    ALA  37           H        ALA  37   1.438  -6.409   8.558
  293    HA   ALA  37           HA       ALA  37   2.156  -8.404   6.718
  294    HB1  ALA  37           3HB      ALA  37   1.379  -6.857   4.989
  295    HB2  ALA  37           1HB      ALA  37   1.383  -5.536   6.160
  296    HB3  ALA  37           2HB      ALA  37   0.269  -6.891   6.359
  297    H    LEU  38           H        LEU  38   3.626  -5.213   7.329
  298    HA   LEU  38           HA       LEU  38   5.673  -5.332   5.419
  299    HB2  LEU  38           2HB      LEU  38   5.728  -4.039   8.156
  300    HB3  LEU  38           1HB      LEU  38   6.868  -3.713   6.863
  301    HG   LEU  38           HG       LEU  38   3.905  -3.086   6.820
  302   HD11  LEU  38          1HD1      LEU  38   6.311  -1.265   6.959
  303   HD12  LEU  38          2HD1      LEU  38   5.203  -1.617   8.285
  304   HD13  LEU  38          3HD1      LEU  38   4.624  -0.757   6.858
  305   HD21  LEU  38          3HD2      LEU  38   6.039  -2.540   4.747
  306   HD22  LEU  38          1HD2      LEU  38   4.372  -1.968   4.689
  307   HD23  LEU  38          2HD2      LEU  38   4.714  -3.694   4.592
  308    H    GLN  39           H        GLN  39   5.644  -6.434   8.807
  309    HA   GLN  39           HA       GLN  39   8.246  -7.475   8.913
  310    HB2  GLN  39           2HB      GLN  39   5.725  -8.275  10.378
  311    HB3  GLN  39           1HB      GLN  39   7.300  -8.973  10.736
  312    HG2  GLN  39           2HG      GLN  39   8.169  -6.792  11.344
  313    HG3  GLN  39           1HG      GLN  39   6.637  -6.035  10.908
  314   HE21  GLN  39          1HE2      GLN  39   8.103  -6.134  13.469
  315   HE22  GLN  39          2HE2      GLN  39   6.995  -6.800  14.616
  316    H    ALA  40           H        ALA  40   5.214  -8.990   7.844
  317    HA   ALA  40           HA       ALA  40   6.240 -11.569   7.330
  318    HB1  ALA  40           3HB      ALA  40   4.255 -11.909   5.965
  319    HB2  ALA  40           1HB      ALA  40   3.953 -10.170   5.937
  320    HB3  ALA  40           2HB      ALA  40   3.834 -11.061   7.455
  321    H    LEU  41           H        LEU  41   6.148  -8.641   5.360
  322    HA   LEU  41           HA       LEU  41   7.250  -9.848   3.000
  323    HB2  LEU  41           2HB      LEU  41   7.124  -6.947   3.854
  324    HB3  LEU  41           1HB      LEU  41   7.586  -7.501   2.255
  325    HG   LEU  41           HG       LEU  41   4.865  -7.940   3.503
  326   HD11  LEU  41          1HD1      LEU  41   4.073  -6.235   1.945
  327   HD12  LEU  41          2HD1      LEU  41   5.727  -5.953   1.399
  328   HD13  LEU  41          3HD1      LEU  41   5.268  -5.572   3.061
  329   HD21  LEU  41          3HD2      LEU  41   5.851  -8.414   0.686
  330   HD22  LEU  41          1HD2      LEU  41   4.193  -8.620   1.255
  331   HD23  LEU  41          2HD2      LEU  41   5.473  -9.662   1.875
  332    H    GLY  42           H        GLY  42   8.579  -8.793   5.973
  333    HA2  GLY  42           2HA      GLY  42  10.783  -9.277   6.669
  334    HA3  GLY  42           1HA      GLY  42  11.285  -9.339   4.989
  335    H    VAL  43           H        VAL  43   9.378  -6.624   5.929
  336    HA   VAL  43           HA       VAL  43  11.589  -4.836   5.357
  337    HB   VAL  43           HB       VAL  43   8.738  -4.139   6.111
  338   HG11  VAL  43          1HG1      VAL  43  10.268  -2.270   6.428
  339   HG12  VAL  43          2HG1      VAL  43   9.232  -1.981   5.031
  340   HG13  VAL  43          3HG1      VAL  43  10.904  -2.488   4.796
  341   HG21  VAL  43          3HG2      VAL  43   9.984  -4.479   3.377
  342   HG22  VAL  43          1HG2      VAL  43   8.367  -3.845   3.691
  343   HG23  VAL  43          2HG2      VAL  43   8.754  -5.516   4.107
  344    H    ALA  44           H        ALA  44  12.983  -4.275   6.909
  345    HA   ALA  44           HA       ALA  44  12.156  -4.130   9.706
  346    HB1  ALA  44           3HB      ALA  44  14.273  -5.252   9.116
  347    HB2  ALA  44           1HB      ALA  44  14.517  -3.891  10.212
  348    HB3  ALA  44           2HB      ALA  44  14.895  -3.722   8.498
  349    H    GLU  45           H        GLU  45  12.415  -2.239  11.000
  350    HA   GLU  45           HA       GLU  45  11.514   0.155   9.971
  351    HB2  GLU  45           2HB      GLU  45  12.274   1.208  12.055
  352    HB3  GLU  45           1HB      GLU  45  11.496  -0.340  12.355
  353    HG2  GLU  45           2HG      GLU  45  13.674  -1.402  12.630
  354    HG3  GLU  45           1HG      GLU  45  14.474   0.133  12.289
  355    H    GLY  46           H        GLY  46  12.473   2.166   9.460
  356    HA2  GLY  46           2HA      GLY  46  14.337   3.517   8.801
  357    HA3  GLY  46           1HA      GLY  46  15.317   2.064   8.677
  358    H    GLY  47           H        GLY  47  13.143   0.633   7.249
  359    HA2  GLY  47           2HA      GLY  47  13.255   2.039   4.640
  360    HA3  GLY  47           1HA      GLY  47  13.302   0.293   4.810
  361    H    GLU  48           H        GLU  48  11.155   1.443   7.067
  362    HA   GLU  48           HA       GLU  48   8.940   0.228   5.805
  363    HB2  GLU  48           2HB      GLU  48   7.642   0.885   7.709
  364    HB3  GLU  48           1HB      GLU  48   9.235   0.421   8.280
  365    HG2  GLU  48           2HG      GLU  48   8.405   3.286   7.836
  366    HG3  GLU  48           1HG      GLU  48   8.216   2.445   9.369
  367    H    ARG  49           H        ARG  49   9.914   3.602   6.112
  368    HA   ARG  49           HA       ARG  49   7.486   4.590   4.894
  369    HB2  ARG  49           2HB      ARG  49   8.544   6.807   5.056
  370    HB3  ARG  49           1HB      ARG  49   8.568   5.945   6.587
  371    HG2  ARG  49           2HG      ARG  49  10.915   5.386   6.267
  372    HG3  ARG  49           1HG      ARG  49  10.906   6.184   4.692
  373    HD2  ARG  49           2HD      ARG  49  10.357   8.317   5.785
  374    HD3  ARG  49           1HD      ARG  49  10.383   7.516   7.355
  375    HE   ARG  49           HE       ARG  49  12.821   6.973   6.588
  376   HH11  ARG  49          1HH1      ARG  49  11.090   9.929   6.201
  377   HH12  ARG  49          2HH1      ARG  49  12.525  10.895   6.195
  378   HH21  ARG  49          1HH2      ARG  49  14.649   8.230   6.560
  379   HH22  ARG  49          2HH2      ARG  49  14.509   9.944   6.377
  380    H    CYS  50           H        CYS  50   9.767   2.871   3.473
  381    HA   CYS  50           HA       CYS  50   9.688   4.465   0.978
  382    HB2  CYS  50           2HB      CYS  50  11.904   2.654   1.960
  383    HB3  CYS  50           1HB      CYS  50  11.830   3.326   0.335
  384    HG   CYS  50           HG       CYS  50  11.495   5.896   2.209
  385    HA   PRO  51           HA       PRO  51   7.400   0.408   0.365
  386    HB2  PRO  51           2HB      PRO  51   5.422   1.520  -1.188
  387    HB3  PRO  51           1HB      PRO  51   5.338   1.387   0.571
  388    HG2  PRO  51           2HG      PRO  51   6.124   3.737  -1.116
  389    HG3  PRO  51           1HG      PRO  51   5.083   3.687   0.320
  390    HD2  PRO  51           2HD      PRO  51   7.642   4.499   0.463
  391    HD3  PRO  51           1HD      PRO  51   6.887   3.574   1.777
  392    H    GLN  52           H        GLN  52   8.548   2.907  -1.800
  393    HA   GLN  52           HA       GLN  52   8.353   1.634  -4.277
  394    HB2  GLN  52           2HB      GLN  52   9.030   3.969  -4.076
  395    HB3  GLN  52           1HB      GLN  52  10.505   3.503  -3.240
  396    HG2  GLN  52           2HG      GLN  52  11.034   4.071  -5.510
  397    HG3  GLN  52           1HG      GLN  52  11.266   2.339  -5.283
  398   HE21  GLN  52          1HE2      GLN  52   9.848   0.901  -6.282
  399   HE22  GLN  52          2HE2      GLN  52   8.794   1.385  -7.562
  400    H    SER  53           H        SER  53  10.701   1.184  -1.679
  401    HA   SER  53           HA       SER  53  12.527  -0.422  -3.194
  402    HB2  SER  53           2HB      SER  53  13.241   0.754  -1.153
  403    HB3  SER  53           1HB      SER  53  12.148  -0.236  -0.189
  404    HG   SER  53           HG       SER  53  14.361  -0.972  -0.209
  405    H    VAL  54           H        VAL  54   9.838  -1.148  -1.012
  406    HA   VAL  54           HA       VAL  54  10.155  -3.962  -0.945
  407    HB   VAL  54           HB       VAL  54   7.577  -2.405  -0.604
  408   HG11  VAL  54          1HG1      VAL  54   8.408  -5.123   0.430
  409   HG12  VAL  54          2HG1      VAL  54   7.210  -4.801  -0.823
  410   HG13  VAL  54          3HG1      VAL  54   6.908  -4.287   0.836
  411   HG21  VAL  54          3HG2      VAL  54   9.314  -1.480   0.838
  412   HG22  VAL  54          1HG2      VAL  54   9.671  -3.089   1.467
  413   HG23  VAL  54          2HG2      VAL  54   8.105  -2.342   1.791
  414    H    GLY  55           H        GLY  55   8.329  -1.827  -3.099
  415    HA2  GLY  55           2HA      GLY  55   7.900  -2.305  -5.375
  416    HA3  GLY  55           1HA      GLY  55   8.116  -4.016  -5.043
  417    H    TRP  56           H        TRP  56   6.383  -5.106  -3.825
  418    HA   TRP  56           HA       TRP  56   3.744  -3.833  -4.240
  419    HB2  TRP  56           2HB      TRP  56   2.822  -6.035  -4.771
  420    HB3  TRP  56           1HB      TRP  56   4.142  -5.650  -5.868
  421    HD1  TRP  56           HD1      TRP  56   6.537  -6.954  -5.349
  422    HE1  TRP  56           HE1      TRP  56   6.938  -9.305  -4.380
  423    HE3  TRP  56           HE3      TRP  56   1.947  -7.751  -3.235
  424    HZ2  TRP  56           HZ2      TRP  56   5.490 -11.247  -2.925
  425    HZ3  TRP  56           HZ3      TRP  56   1.536  -9.882  -2.075
  426    HH2  TRP  56           HH2      TRP  56   3.274 -11.593  -1.923
  427    H    MET  57           H        MET  57   2.214  -4.046  -2.605
  428    HA   MET  57           HA       MET  57   2.913  -5.683  -0.262
  429    HB2  MET  57           2HB      MET  57   2.050  -2.783  -0.068
  430    HB3  MET  57           1HB      MET  57   2.330  -3.870   1.286
  431    HG2  MET  57           2HG      MET  57   4.701  -4.055   0.591
  432    HG3  MET  57           1HG      MET  57   4.389  -2.855  -0.664
  433    HE1  MET  57           3HE      MET  57   2.286  -0.967   0.947
  434    HE2  MET  57           1HE      MET  57   3.566  -0.332  -0.089
  435    HE3  MET  57           2HE      MET  57   3.382   0.269   1.561
  436    HA   PRO  58           HA       PRO  58  -1.525  -6.436  -0.416
  437    HB2  PRO  58           2HB      PRO  58  -1.733  -8.092   1.683
  438    HB3  PRO  58           1HB      PRO  58  -0.910  -8.591   0.199
  439    HG2  PRO  58           2HG      PRO  58   0.261  -7.658   2.794
  440    HG3  PRO  58           1HG      PRO  58   0.797  -8.977   1.737
  441    HD2  PRO  58           2HD      PRO  58   1.920  -6.445   1.783
  442    HD3  PRO  58           1HD      PRO  58   2.018  -7.566   0.410
  443    H    GLY  59           H        GLY  59  -2.931  -4.851   0.183
  444    HA2  GLY  59           2HA      GLY  59  -3.197  -4.190   3.028
  445    HA3  GLY  59           1HA      GLY  59  -2.776  -2.873   1.946
  446    H    LEU  60           H        LEU  60  -4.930  -2.366   3.264
  447    HA   LEU  60           HA       LEU  60  -7.263  -3.230   1.686
  448    HB2  LEU  60           2HB      LEU  60  -7.422  -3.593   4.091
  449    HB3  LEU  60           1HB      LEU  60  -7.089  -1.898   4.395
  450    HG   LEU  60           HG       LEU  60  -9.225  -1.285   3.321
  451   HD11  LEU  60          1HD1      LEU  60  -9.685  -4.262   3.111
  452   HD12  LEU  60          2HD1      LEU  60  -9.424  -3.155   1.764
  453   HD13  LEU  60          3HD1      LEU  60 -10.869  -3.001   2.762
  454   HD21  LEU  60          3HD2      LEU  60  -9.132  -1.638   5.736
  455   HD22  LEU  60          1HD2      LEU  60  -9.509  -3.347   5.508
  456   HD23  LEU  60          2HD2      LEU  60 -10.698  -2.116   5.082
  457    H    ASN  61           H        ASN  61  -8.364  -1.858   0.417
  458    HA   ASN  61           HA       ASN  61  -7.509   0.953   0.280
  459    HB2  ASN  61           2HB      ASN  61  -7.385  -0.350  -1.795
  460    HB3  ASN  61           1HB      ASN  61  -9.096  -0.747  -1.667
  461   HD21  ASN  61          1HD2      ASN  61  -6.784   1.729  -2.433
  462   HD22  ASN  61          2HD2      ASN  61  -7.910   2.818  -3.165
  463    H    GLU  62           H        GLU  62  -9.023   2.677   0.287
  464    HA   GLU  62           HA       GLU  62 -11.502   2.131   1.734
  465    HB2  GLU  62           2HB      GLU  62  -9.900   4.609   1.176
  466    HB3  GLU  62           1HB      GLU  62 -11.566   4.740   1.729
  467    HG2  GLU  62           2HG      GLU  62  -9.502   3.134   3.217
  468    HG3  GLU  62           1HG      GLU  62  -9.735   4.861   3.487
  469    H    ARG  63           H        ARG  63 -10.491   3.419  -1.405
  470    HA   ARG  63           HA       ARG  63 -12.893   4.528  -2.295
  471    HB2  ARG  63           2HB      ARG  63 -10.530   4.493  -3.376
  472    HB3  ARG  63           1HB      ARG  63 -11.049   2.992  -4.121
  473    HG2  ARG  63           2HG      ARG  63 -11.427   4.678  -5.715
  474    HG3  ARG  63           1HG      ARG  63 -13.015   4.281  -5.059
  475    HD2  ARG  63           2HD      ARG  63 -12.555   6.741  -5.337
  476    HD3  ARG  63           1HD      ARG  63 -13.040   6.254  -3.714
  477    HE   ARG  63           HE       ARG  63 -10.257   6.202  -3.810
  478   HH11  ARG  63          1HH1      ARG  63 -12.758   8.562  -4.073
  479   HH12  ARG  63          2HH1      ARG  63 -11.794   9.810  -3.366
  480   HH21  ARG  63          1HH2      ARG  63  -9.057   7.803  -2.891
  481   HH22  ARG  63          2HH2      ARG  63  -9.733   9.386  -2.699
  482    H    THR  64           H        THR  64 -11.670   1.222  -2.782
  483    HA   THR  64           HA       THR  64 -14.308   0.330  -3.732
  484    HB   THR  64           HB       THR  64 -13.175  -1.695  -4.494
  485    HG1  THR  64           HG1      THR  64 -10.770  -1.646  -4.261
  486   HG21  THR  64          3HG2      THR  64 -11.657   0.810  -5.260
  487   HG22  THR  64          1HG2      THR  64 -13.139   0.218  -6.013
  488   HG23  THR  64          2HG2      THR  64 -11.644  -0.707  -6.160
  489    H    ARG  65           H        ARG  65 -12.390   0.296  -0.919
  490    HA   ARG  65           HA       ARG  65 -12.518  -0.725   1.103
  491    HB2  ARG  65           2HB      ARG  65 -15.240  -1.581   0.101
  492    HB3  ARG  65           1HB      ARG  65 -14.688  -1.755   1.763
  493    HG2  ARG  65           2HG      ARG  65 -14.519   0.639   2.010
  494    HG3  ARG  65           1HG      ARG  65 -14.914   0.879   0.307
  495    HD2  ARG  65           2HD      ARG  65 -16.851   1.301   1.711
  496    HD3  ARG  65           1HD      ARG  65 -17.120  -0.103   0.682
  497    HE   ARG  65           HE       ARG  65 -16.225  -0.489   3.448
  498   HH11  ARG  65          1HH1      ARG  65 -18.604  -0.909   1.005
  499   HH12  ARG  65          2HH1      ARG  65 -19.583  -1.944   1.984
  500   HH21  ARG  65          1HH2      ARG  65 -17.480  -1.839   4.690
  501   HH22  ARG  65          2HH2      ARG  65 -18.966  -2.443   4.047
  502    H    GLN  66           H        GLN  66 -11.636  -2.235  -1.413
  503    HA   GLN  66           HA       GLN  66 -11.989  -5.004  -0.477
  504    HB2  GLN  66           2HB      GLN  66 -10.981  -3.958  -3.133
  505    HB3  GLN  66           1HB      GLN  66 -11.164  -5.655  -2.717
  506    HG2  GLN  66           2HG      GLN  66 -13.386  -3.627  -2.916
  507    HG3  GLN  66           1HG      GLN  66 -13.010  -4.883  -4.094
  508   HE21  GLN  66          1HE2      GLN  66 -13.422  -7.059  -3.544
  509   HE22  GLN  66          2HE2      GLN  66 -14.543  -7.466  -2.294
  510    H    ARG  67           H        ARG  67 -10.176  -6.456  -0.412
  511    HA   ARG  67           HA       ARG  67  -7.612  -5.159   0.211
  512    HB2  ARG  67           2HB      ARG  67  -8.661  -7.945   0.735
  513    HB3  ARG  67           1HB      ARG  67  -6.993  -7.480   1.036
  514    HG2  ARG  67           2HG      ARG  67  -7.735  -5.809   2.650
  515    HG3  ARG  67           1HG      ARG  67  -9.417  -6.239   2.331
  516    HD2  ARG  67           2HD      ARG  67  -8.559  -7.288   4.383
  517    HD3  ARG  67           1HD      ARG  67  -9.042  -8.476   3.175
  518    HE   ARG  67           HE       ARG  67  -6.588  -8.642   2.646
  519   HH11  ARG  67          1HH1      ARG  67  -7.658  -7.579   5.732
  520   HH12  ARG  67          2HH1      ARG  67  -6.287  -8.233   6.559
  521   HH21  ARG  67          1HH2      ARG  67  -4.816  -9.467   3.707
  522   HH22  ARG  67          2HH2      ARG  67  -4.676  -9.268   5.418
  523    H    GLY  68           H        GLY  68  -5.659  -5.798  -0.753
  524    HA2  GLY  68           2HA      GLY  68  -5.320  -7.904  -2.573
  525    HA3  GLY  68           1HA      GLY  68  -5.756  -6.476  -3.500
  526    H    ASP  69           H        ASP  69  -3.465  -7.301  -4.252
  527    HA   ASP  69           HA       ASP  69  -1.326  -6.119  -2.635
  528    HB2  ASP  69           2HB      ASP  69  -1.048  -7.635  -5.243
  529    HB3  ASP  69           1HB      ASP  69   0.203  -7.315  -4.042
  530    H    PHE  70           H        PHE  70  -0.538  -4.142  -3.075
  531    HA   PHE  70           HA       PHE  70  -1.038  -2.992  -5.751
  532    HB2  PHE  70           2HB      PHE  70  -1.361  -0.796  -4.703
  533    HB3  PHE  70           1HB      PHE  70  -2.524  -1.964  -4.087
  534    HD1  PHE  70           HD1      PHE  70  -2.354  -2.801  -1.788
  535    HD2  PHE  70           HD2      PHE  70   0.331   0.160  -3.270
  536    HE1  PHE  70           HE1      PHE  70  -1.665  -2.275   0.513
  537    HE2  PHE  70           HE2      PHE  70   1.015   0.688  -0.969
  538    HZ   PHE  70           HZ       PHE  70   0.022  -0.531   0.924
  539    HA   PRO  71           HA       PRO  71   3.364  -2.131  -5.867
  540    HB2  PRO  71           2HB      PRO  71   3.332  -0.182  -7.784
  541    HB3  PRO  71           1HB      PRO  71   3.186  -1.906  -8.144
  542    HG2  PRO  71           2HG      PRO  71   1.040   0.174  -7.931
  543    HG3  PRO  71           1HG      PRO  71   1.220  -1.132  -9.117
  544    HD2  PRO  71           2HD      PRO  71  -0.485  -1.297  -7.016
  545    HD3  PRO  71           1HD      PRO  71   0.336  -2.721  -7.690
  546    H    GLY  72           H        GLY  72   4.304  -1.064  -4.244
  547    HA2  GLY  72           2HA      GLY  72   3.146   1.038  -2.811
  548    HA3  GLY  72           1HA      GLY  72   4.816   0.526  -2.681
  549    H    THR  73           H        THR  73   4.988   1.254  -5.713
  550    HA   THR  73           HA       THR  73   6.283   3.705  -5.423
  551    HB   THR  73           HB       THR  73   6.816   2.383  -7.327
  552    HG1  THR  73           HG1      THR  73   6.446   3.945  -9.045
  553   HG21  THR  73          3HG2      THR  73   3.973   2.754  -8.277
  554   HG22  THR  73          1HG2      THR  73   4.649   1.263  -7.618
  555   HG23  THR  73          2HG2      THR  73   5.257   1.910  -9.142
  556    H    TYR  74           H        TYR  74   2.878   3.087  -6.091
  557    HA   TYR  74           HA       TYR  74   2.333   5.812  -6.905
  558    HB2  TYR  74           2HB      TYR  74   0.441   3.529  -6.288
  559    HB3  TYR  74           1HB      TYR  74  -0.050   5.091  -6.929
  560    HD1  TYR  74           HD1      TYR  74   1.712   1.959  -7.685
  561    HD2  TYR  74           HD2      TYR  74   0.307   5.655  -9.262
  562    HE1  TYR  74           HE1      TYR  74   2.088   1.126  -9.961
  563    HE2  TYR  74           HE2      TYR  74   0.680   4.823 -11.547
  564    HH   TYR  74           HH       TYR  74   1.408   1.501 -12.185
  565    H    VAL  75           H        VAL  75   2.593   4.249  -3.874
  566    HA   VAL  75           HA       VAL  75   0.784   6.209  -2.600
  567    HB   VAL  75           HB       VAL  75   0.596   4.707  -0.697
  568   HG11  VAL  75          1HG1      VAL  75   0.121   3.266  -3.309
  569   HG12  VAL  75          2HG1      VAL  75  -0.982   4.401  -2.530
  570   HG13  VAL  75          3HG1      VAL  75  -0.618   2.855  -1.760
  571   HG21  VAL  75          3HG2      VAL  75   1.589   2.459  -0.714
  572   HG22  VAL  75          1HG2      VAL  75   2.831   3.711  -0.740
  573   HG23  VAL  75          2HG2      VAL  75   2.428   2.839  -2.218
  574    H    GLU  76           H        GLU  76   1.451   7.457  -0.894
  575    HA   GLU  76           HA       GLU  76   4.320   7.357  -0.184
  576    HB2  GLU  76           2HB      GLU  76   4.086   9.721   0.498
  577    HB3  GLU  76           1HB      GLU  76   3.705   9.478  -1.201
  578    HG2  GLU  76           2HG      GLU  76   1.353   9.665  -0.776
  579    HG3  GLU  76           1HG      GLU  76   1.618   9.675   0.968
  580    H    PHE  77           H        PHE  77   4.895   7.752   2.056
  581    HA   PHE  77           HA       PHE  77   3.058   6.437   3.876
  582    HB2  PHE  77           2HB      PHE  77   5.353   5.735   3.976
  583    HB3  PHE  77           1HB      PHE  77   5.911   7.391   4.181
  584    HD1  PHE  77           HD2      PHE  77   3.646   4.922   5.850
  585    HD2  PHE  77           HD1      PHE  77   6.461   8.088   6.311
  586    HE1  PHE  77           HE2      PHE  77   3.545   4.660   8.292
  587    HE2  PHE  77           HE1      PHE  77   6.361   7.825   8.754
  588    HZ   PHE  77           HZ       PHE  77   4.901   6.109   9.747
  589    H    LEU  78           H        LEU  78   1.739   7.429   5.269
  590    HA   LEU  78           HA       LEU  78   2.066  10.315   5.735
  591    HB2  LEU  78           2HB      LEU  78  -0.285   8.515   6.351
  592    HB3  LEU  78           1HB      LEU  78  -0.251  10.258   6.543
  593    HG   LEU  78           HG       LEU  78  -0.065   8.767   3.915
  594   HD11  LEU  78          1HD1      LEU  78  -2.297  10.405   5.117
  595   HD12  LEU  78          2HD1      LEU  78  -2.293   8.657   4.869
  596   HD13  LEU  78          3HD1      LEU  78  -2.274   9.743   3.482
  597   HD21  LEU  78          3HD2      LEU  78  -0.236  10.980   2.877
  598   HD22  LEU  78          1HD2      LEU  78   1.223  10.838   3.856
  599   HD23  LEU  78          2HD2      LEU  78  -0.165  11.737   4.470
  600    H    GLY  79           H        GLY  79   0.885   7.591   7.739
  601    HA2  GLY  79           2HA      GLY  79   2.811   7.879   9.792
  602    HA3  GLY  79           1HA      GLY  79   1.377   8.805  10.214
  603    HA   PRO  80           HA       PRO  80   0.855   4.306  11.537
  604    HB2  PRO  80           2HB      PRO  80   0.655   5.351  14.269
  605    HB3  PRO  80           1HB      PRO  80   1.734   4.113  13.621
  606    HG2  PRO  80           2HG      PRO  80   2.627   6.548  14.390
  607    HG3  PRO  80           1HG      PRO  80   3.370   5.641  13.059
  608    HD2  PRO  80           2HD      PRO  80   1.397   7.907  12.940
  609    HD3  PRO  80           1HD      PRO  80   2.867   7.641  11.971
  610    H    LEU  81           H        LEU  81  -1.028   3.354  12.691
  611    HA   LEU  81           HA       LEU  81  -3.337   5.183  12.831
  612    HB2  LEU  81           2HB      LEU  81  -4.723   3.315  11.856
  613    HB3  LEU  81           1HB      LEU  81  -3.618   4.117  10.761
  614    HG   LEU  81           HG       LEU  81  -2.011   2.137  11.298
  615   HD11  LEU  81          1HD1      LEU  81  -4.654   0.907  12.068
  616   HD12  LEU  81          2HD1      LEU  81  -3.265   1.155  13.126
  617   HD13  LEU  81          3HD1      LEU  81  -3.155   0.026  11.778
  618   HD21  LEU  81          3HD2      LEU  81  -2.969   0.834   9.469
  619   HD22  LEU  81          1HD2      LEU  81  -2.997   2.561   9.115
  620   HD23  LEU  81          2HD2      LEU  81  -4.478   1.738   9.608
  621    H    GLU  82           H        GLU  82  -5.036   4.619  14.249
  622    HA   GLU  82           HA       GLU  82  -4.170   3.103  16.564
  623    HB2  GLU  82           2HB      GLU  82  -6.401   3.926  17.521
  624    HB3  GLU  82           1HB      GLU  82  -5.178   5.134  17.160
  625    HG2  GLU  82           2HG      GLU  82  -6.323   5.721  15.097
  626    HG3  GLU  82           1HG      GLU  82  -7.524   4.465  15.389
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1 -16.177   0.159  13.486
    2    H2   MET   1           2H       MET   1 -15.687  -1.014  12.376
    3    H3   MET   1           3H       MET   1 -16.554   0.334  11.844
    4    HA   MET   1           HA       MET   1 -14.216   0.542  11.294
    5    HB2  MET   1           2HB      MET   1 -15.146   2.443  13.464
    6    HB3  MET   1           1HB      MET   1 -13.804   2.753  12.371
    7    HG2  MET   1           2HG      MET   1 -16.701   2.427  11.615
    8    HG3  MET   1           1HG      MET   1 -15.768   3.923  11.614
    9    HE1  MET   1           3HE      MET   1 -16.511   4.434   9.137
   10    HE2  MET   1           1HE      MET   1 -17.462   2.949   9.081
   11    HE3  MET   1           2HE      MET   1 -16.312   3.309   7.791
   12    H    ALA   2           H        ALA   2 -12.011   0.945  12.081
   13    HA   ALA   2           HA       ALA   2 -11.273   0.244  14.763
   14    HB1  ALA   2           3HB      ALA   2 -10.110  -1.851  14.258
   15    HB2  ALA   2           1HB      ALA   2 -10.703  -1.788  12.598
   16    HB3  ALA   2           2HB      ALA   2 -11.838  -1.990  13.933
   17    H    GLY   3           H        GLY   3  -9.060   0.604  15.200
   18    HA2  GLY   3           2HA      GLY   3  -7.472   1.708  12.946
   19    HA3  GLY   3           1HA      GLY   3  -7.443   2.384  14.567
   20    HA   PRO   4           HA       PRO   4  -5.039  -1.874  14.537
   21    HB2  PRO   4           2HB      PRO   4  -3.796  -2.456  12.192
   22    HB3  PRO   4           1HB      PRO   4  -5.443  -2.985  12.561
   23    HG2  PRO   4           2HG      PRO   4  -4.534  -0.623  10.944
   24    HG3  PRO   4           1HG      PRO   4  -5.792  -1.815  10.563
   25    HD2  PRO   4           2HD      PRO   4  -6.385   0.622  11.566
   26    HD3  PRO   4           1HD      PRO   4  -7.339  -0.820  11.971
   27    H    GLU   5           H        GLU   5  -2.643  -2.411  14.275
   28    HA   GLU   5           HA       GLU   5  -1.097  -0.146  15.134
   29    HB2  GLU   5           2HB      GLU   5  -0.313  -3.024  14.620
   30    HB3  GLU   5           1HB      GLU   5   0.699  -1.833  15.419
   31    HG2  GLU   5           2HG      GLU   5  -2.010  -2.524  16.504
   32    HG3  GLU   5           1HG      GLU   5  -0.608  -3.535  16.846
   33    H    GLY   6           H        GLY   6  -1.928  -0.589  12.123
   34    HA2  GLY   6           2HA      GLY   6   0.689  -0.896  10.857
   35    HA3  GLY   6           1HA      GLY   6  -0.864  -0.888  10.043
   36    H    PHE   7           H        PHE   7   0.455   0.465   8.555
   37    HA   PHE   7           HA       PHE   7   0.380   3.309   9.368
   38    HB2  PHE   7           2HB      PHE   7   2.203   1.982   7.344
   39    HB3  PHE   7           1HB      PHE   7   2.172   3.701   7.709
   40    HD1  PHE   7           HD1      PHE   7   2.548   4.296  10.251
   41    HD2  PHE   7           HD2      PHE   7   3.770   0.654   8.406
   42    HE1  PHE   7           HE1      PHE   7   4.229   3.966  12.018
   43    HE2  PHE   7           HE2      PHE   7   5.444   0.320  10.176
   44    HZ   PHE   7           HZ       PHE   7   5.675   1.976  11.984
   45    H    GLN   8           H        GLN   8  -0.467   4.806   7.910
   46    HA   GLN   8           HA       GLN   8  -2.177   3.726   5.801
   47    HB2  GLN   8           2HB      GLN   8  -1.933   6.545   6.884
   48    HB3  GLN   8           1HB      GLN   8  -3.117   6.011   5.699
   49    HG2  GLN   8           2HG      GLN   8  -4.042   4.452   7.375
   50    HG3  GLN   8           1HG      GLN   8  -2.904   5.090   8.561
   51   HE21  GLN   8          1HE2      GLN   8  -3.200   7.214   9.326
   52   HE22  GLN   8          2HE2      GLN   8  -4.705   8.039   9.143
   53    H    TYR   9           H        TYR   9  -1.774   3.923   3.672
   54    HA   TYR   9           HA       TYR   9   0.403   5.714   2.777
   55    HB2  TYR   9           2HB      TYR   9  -0.481   3.043   1.648
   56    HB3  TYR   9           1HB      TYR   9   0.680   4.110   0.864
   57    HD1  TYR   9           HD1      TYR   9   0.109   1.930   3.799
   58    HD2  TYR   9           HD2      TYR   9   2.950   4.241   1.622
   59    HE1  TYR   9           HE1      TYR   9   1.932   0.897   5.088
   60    HE2  TYR   9           HE2      TYR   9   4.775   3.206   2.901
   61    HH   TYR   9           HH       TYR   9   5.186   2.056   4.933
   62    H    ARG  10           H        ARG  10  -0.005   7.081   1.046
   63    HA   ARG  10           HA       ARG  10  -2.808   7.143   0.114
   64    HB2  ARG  10           2HB      ARG  10  -2.110   9.144   1.340
   65    HB3  ARG  10           1HB      ARG  10  -0.771   9.379   0.222
   66    HG2  ARG  10           2HG      ARG  10  -2.391   9.690  -1.618
   67    HG3  ARG  10           1HG      ARG  10  -3.708   9.528  -0.455
   68    HD2  ARG  10           2HD      ARG  10  -1.558  11.651  -0.386
   69    HD3  ARG  10           1HD      ARG  10  -3.200  11.880  -0.990
   70    HE   ARG  10           HE       ARG  10  -3.238  10.916   1.676
   71   HH11  ARG  10          1HH1      ARG  10  -2.695  13.760  -0.189
   72   HH12  ARG  10          2HH1      ARG  10  -3.093  14.820   1.119
   73   HH21  ARG  10          1HH2      ARG  10  -3.751  12.297   3.342
   74   HH22  ARG  10          2HH2      ARG  10  -3.665  14.007   3.090
   75    H    ALA  11           H        ALA  11  -3.244   6.711  -1.954
   76    HA   ALA  11           HA       ALA  11  -1.131   6.397  -3.919
   77    HB1  ALA  11           3HB      ALA  11  -3.008   4.829  -3.877
   78    HB2  ALA  11           1HB      ALA  11  -2.932   5.679  -5.421
   79    HB3  ALA  11           2HB      ALA  11  -4.132   6.147  -4.214
   80    H    LEU  12           H        LEU  12  -0.509   7.893  -5.392
   81    HA   LEU  12           HA       LEU  12  -1.409  10.580  -5.153
   82    HB2  LEU  12           2HB      LEU  12   0.284   9.368  -7.344
   83    HB3  LEU  12           1HB      LEU  12   0.172  11.071  -6.940
   84    HG   LEU  12           HG       LEU  12   1.381   8.901  -5.208
   85   HD11  LEU  12          1HD1      LEU  12   3.483  10.081  -5.593
   86   HD12  LEU  12          2HD1      LEU  12   2.658  11.219  -6.661
   87   HD13  LEU  12          3HD1      LEU  12   2.779   9.515  -7.108
   88   HD21  LEU  12          3HD2      LEU  12   0.280  10.566  -3.823
   89   HD22  LEU  12          1HD2      LEU  12   1.104  11.864  -4.688
   90   HD23  LEU  12          2HD2      LEU  12   2.031  10.731  -3.704
   91    H    TYR  13           H        TYR  13  -1.513   8.440  -8.001
   92    HA   TYR  13           HA       TYR  13  -3.901   9.895  -8.980
   93    HB2  TYR  13           2HB      TYR  13  -1.712   8.542 -10.595
   94    HB3  TYR  13           1HB      TYR  13  -3.129   9.339 -11.268
   95    HD1  TYR  13           HD1      TYR  13  -3.317  11.791 -11.225
   96    HD2  TYR  13           HD2      TYR  13   0.166   9.819  -9.771
   97    HE1  TYR  13           HE1      TYR  13  -2.080  13.911 -11.323
   98    HE2  TYR  13           HE2      TYR  13   1.409  11.937  -9.864
   99    HH   TYR  13           HH       TYR  13  -0.134  14.955 -10.340
  100    HA   PRO  14           HA       PRO  14  -5.815   5.811  -9.400
  101    HB2  PRO  14           2HB      PRO  14  -6.999   5.868 -11.860
  102    HB3  PRO  14           1HB      PRO  14  -7.668   6.689 -10.443
  103    HG2  PRO  14           2HG      PRO  14  -6.068   7.816 -12.713
  104    HG3  PRO  14           1HG      PRO  14  -7.475   8.506 -11.882
  105    HD2  PRO  14           2HD      PRO  14  -4.918   9.292 -11.373
  106    HD3  PRO  14           1HD      PRO  14  -6.202   9.336 -10.150
  107    H    PHE  15           H        PHE  15  -4.531   4.063  -9.660
  108    HA   PHE  15           HA       PHE  15  -2.905   3.870 -12.113
  109    HB2  PHE  15           2HB      PHE  15  -2.313   2.854  -9.328
  110    HB3  PHE  15           1HB      PHE  15  -1.365   2.415 -10.748
  111    HD1  PHE  15           HD2      PHE  15  -0.294   4.312 -12.090
  112    HD2  PHE  15           HD1      PHE  15  -1.833   4.826  -8.150
  113    HE1  PHE  15           HE2      PHE  15   1.062   6.348 -11.828
  114    HE2  PHE  15           HE1      PHE  15  -0.485   6.867  -7.887
  115    HZ   PHE  15           HZ       PHE  15   0.968   7.631  -9.725
  116    H    ARG  16           H        ARG  16  -3.350   2.341 -13.467
  117    HA   ARG  16           HA       ARG  16  -5.341   0.327 -12.875
  118    HB2  ARG  16           2HB      ARG  16  -5.124  -0.186 -15.306
  119    HB3  ARG  16           1HB      ARG  16  -5.476   1.507 -14.978
  120    HG2  ARG  16           2HG      ARG  16  -3.020   1.972 -15.219
  121    HG3  ARG  16           1HG      ARG  16  -2.826   0.307 -15.772
  122    HD2  ARG  16           2HD      ARG  16  -2.980   1.833 -17.663
  123    HD3  ARG  16           1HD      ARG  16  -4.372   0.748 -17.627
  124    HE   ARG  16           HE       ARG  16  -5.573   2.692 -16.555
  125   HH11  ARG  16          1HH1      ARG  16  -2.875   3.198 -18.629
  126   HH12  ARG  16          2HH1      ARG  16  -3.452   4.724 -19.195
  127   HH21  ARG  16          1HH2      ARG  16  -6.292   4.662 -17.247
  128   HH22  ARG  16          2HH2      ARG  16  -5.364   5.558 -18.400
  129    H    ARG  17           H        ARG  17  -5.072  -1.948 -13.230
  130    HA   ARG  17           HA       ARG  17  -2.283  -2.905 -12.955
  131    HB2  ARG  17           2HB      ARG  17  -4.838  -4.006 -11.769
  132    HB3  ARG  17           1HB      ARG  17  -3.322  -4.896 -11.772
  133    HG2  ARG  17           2HG      ARG  17  -3.780  -2.218 -10.451
  134    HG3  ARG  17           1HG      ARG  17  -3.731  -3.781  -9.629
  135    HD2  ARG  17           2HD      ARG  17  -1.457  -2.526 -11.182
  136    HD3  ARG  17           1HD      ARG  17  -1.598  -2.575  -9.425
  137    HE   ARG  17           HE       ARG  17  -1.660  -5.151  -9.932
  138   HH11  ARG  17          1HH1      ARG  17   0.355  -2.768 -11.376
  139   HH12  ARG  17          2HH1      ARG  17   1.642  -3.882 -11.679
  140   HH21  ARG  17          1HH2      ARG  17  -0.014  -6.581 -10.324
  141   HH22  ARG  17          2HH2      ARG  17   1.423  -6.028 -11.120
  142    H    GLU  18           H        GLU  18  -1.749  -4.945 -13.924
  143    HA   GLU  18           HA       GLU  18  -2.790  -5.293 -16.537
  144    HB2  GLU  18           2HB      GLU  18  -1.004  -7.105 -14.895
  145    HB3  GLU  18           1HB      GLU  18  -1.318  -7.298 -16.614
  146    HG2  GLU  18           2HG      GLU  18  -0.307  -5.090 -17.024
  147    HG3  GLU  18           1HG      GLU  18   0.051  -4.956 -15.303
  148    H    ARG  19           H        ARG  19  -3.255  -7.116 -13.523
  149    HA   ARG  19           HA       ARG  19  -5.400  -8.659 -14.845
  150    HB2  ARG  19           2HB      ARG  19  -3.579  -9.616 -12.617
  151    HB3  ARG  19           1HB      ARG  19  -4.843 -10.555 -13.402
  152    HG2  ARG  19           2HG      ARG  19  -3.600 -10.381 -15.538
  153    HG3  ARG  19           1HG      ARG  19  -2.312  -9.529 -14.686
  154    HD2  ARG  19           2HD      ARG  19  -1.736 -11.874 -14.942
  155    HD3  ARG  19           1HD      ARG  19  -1.989 -11.492 -13.239
  156    HE   ARG  19           HE       ARG  19  -4.014 -12.705 -13.288
  157   HH11  ARG  19          1HH1      ARG  19  -2.316 -12.875 -16.286
  158   HH12  ARG  19          2HH1      ARG  19  -3.200 -14.265 -16.820
  159   HH21  ARG  19          1HH2      ARG  19  -5.121 -14.485 -13.989
  160   HH22  ARG  19          2HH2      ARG  19  -4.750 -15.169 -15.539
  161    HA   PRO  20           HA       PRO  20  -8.129  -7.067 -11.704
  162    HB2  PRO  20           2HB      PRO  20  -9.687  -9.561 -11.902
  163    HB3  PRO  20           1HB      PRO  20 -10.150  -7.916 -12.346
  164    HG2  PRO  20           2HG      PRO  20  -9.687  -9.806 -14.205
  165    HG3  PRO  20           1HG      PRO  20  -9.276  -8.102 -14.479
  166    HD2  PRO  20           2HD      PRO  20  -7.482 -10.382 -13.688
  167    HD3  PRO  20           1HD      PRO  20  -7.207  -9.097 -14.889
  168    H    GLU  21           H        GLU  21  -6.185  -9.738 -11.245
  169    HA   GLU  21           HA       GLU  21  -7.191 -10.637  -8.693
  170    HB2  GLU  21           2HB      GLU  21  -4.599 -11.193 -10.156
  171    HB3  GLU  21           1HB      GLU  21  -5.096 -11.994  -8.670
  172    HG2  GLU  21           2HG      GLU  21  -6.885 -13.095  -9.728
  173    HG3  GLU  21           1HG      GLU  21  -6.797 -12.051 -11.145
  174    H    ASP  22           H        ASP  22  -5.191  -8.107  -9.777
  175    HA   ASP  22           HA       ASP  22  -3.739  -7.754  -7.289
  176    HB2  ASP  22           2HB      ASP  22  -3.927  -6.010  -9.757
  177    HB3  ASP  22           1HB      ASP  22  -2.796  -5.779  -8.426
  178    H    LEU  23           H        LEU  23  -3.752  -5.010  -6.955
  179    HA   LEU  23           HA       LEU  23  -6.586  -4.288  -6.506
  180    HB2  LEU  23           2HB      LEU  23  -5.403  -4.861  -4.398
  181    HB3  LEU  23           1HB      LEU  23  -4.237  -3.594  -4.729
  182    HG   LEU  23           HG       LEU  23  -6.091  -1.920  -4.605
  183   HD11  LEU  23          1HD1      LEU  23  -7.725  -4.270  -3.636
  184   HD12  LEU  23          2HD1      LEU  23  -7.959  -3.396  -5.152
  185   HD13  LEU  23          3HD1      LEU  23  -8.225  -2.576  -3.612
  186   HD21  LEU  23          3HD2      LEU  23  -6.291  -1.962  -2.171
  187   HD22  LEU  23          1HD2      LEU  23  -4.646  -2.347  -2.678
  188   HD23  LEU  23          2HD2      LEU  23  -5.729  -3.635  -2.144
  189    H    GLU  24           H        GLU  24  -7.195  -2.500  -7.554
  190    HA   GLU  24           HA       GLU  24  -5.309  -0.829  -8.930
  191    HB2  GLU  24           2HB      GLU  24  -8.310  -0.622  -8.589
  192    HB3  GLU  24           1HB      GLU  24  -7.365   0.484  -9.573
  193    HG2  GLU  24           2HG      GLU  24  -8.352  -1.096 -11.031
  194    HG3  GLU  24           1HG      GLU  24  -6.634  -1.470 -10.945
  195    H    LEU  25           H        LEU  25  -5.114   1.483  -8.688
  196    HA   LEU  25           HA       LEU  25  -5.515   2.400  -5.902
  197    HB2  LEU  25           2HB      LEU  25  -3.445   3.253  -7.938
  198    HB3  LEU  25           1HB      LEU  25  -3.623   3.951  -6.338
  199    HG   LEU  25           HG       LEU  25  -2.888   1.072  -6.916
  200   HD11  LEU  25          1HD1      LEU  25  -1.186   3.358  -5.914
  201   HD12  LEU  25          2HD1      LEU  25  -1.086   2.602  -7.505
  202   HD13  LEU  25          3HD1      LEU  25  -0.677   1.673  -6.063
  203   HD21  LEU  25          3HD2      LEU  25  -3.059   2.572  -4.300
  204   HD22  LEU  25          1HD2      LEU  25  -2.445   0.932  -4.506
  205   HD23  LEU  25          2HD2      LEU  25  -4.140   1.286  -4.838
  206    H    LEU  26           H        LEU  26  -6.413   4.414  -5.509
  207    HA   LEU  26           HA       LEU  26  -7.567   5.828  -7.837
  208    HB2  LEU  26           2HB      LEU  26  -8.652   5.309  -5.076
  209    HB3  LEU  26           1HB      LEU  26  -9.237   6.670  -6.011
  210    HG   LEU  26           HG       LEU  26 -10.758   4.784  -6.214
  211   HD11  LEU  26          1HD1      LEU  26 -10.893   4.631  -8.638
  212   HD12  LEU  26          2HD1      LEU  26  -9.245   5.241  -8.784
  213   HD13  LEU  26          3HD1      LEU  26 -10.514   6.278  -8.134
  214   HD21  LEU  26          3HD2      LEU  26 -10.121   2.690  -7.245
  215   HD22  LEU  26          1HD2      LEU  26  -9.127   2.979  -5.819
  216   HD23  LEU  26          2HD2      LEU  26  -8.460   3.250  -7.430
  217    HA   PRO  27           HA       PRO  27  -5.320   9.473  -6.886
  218    HB2  PRO  27           2HB      PRO  27  -7.166  11.474  -7.254
  219    HB3  PRO  27           1HB      PRO  27  -6.379  10.601  -8.573
  220    HG2  PRO  27           2HG      PRO  27  -9.086  10.155  -7.359
  221    HG3  PRO  27           1HG      PRO  27  -8.616  10.172  -9.071
  222    HD2  PRO  27           2HD      PRO  27  -8.991   7.867  -7.740
  223    HD3  PRO  27           1HD      PRO  27  -7.725   8.026  -8.977
  224    H    GLY  28           H        GLY  28  -4.634   9.998  -4.911
  225    HA2  GLY  28           2HA      GLY  28  -4.580  10.883  -2.791
  226    HA3  GLY  28           1HA      GLY  28  -6.136  11.621  -3.130
  227    H    ASP  29           H        ASP  29  -5.894   8.166  -3.409
  228    HA   ASP  29           HA       ASP  29  -7.811   7.910  -1.236
  229    HB2  ASP  29           2HB      ASP  29  -7.853   6.737  -3.591
  230    HB3  ASP  29           1HB      ASP  29  -6.801   5.560  -2.808
  231    H    VAL  30           H        VAL  30  -7.595   6.263   0.442
  232    HA   VAL  30           HA       VAL  30  -4.801   6.101   1.382
  233    HB   VAL  30           HB       VAL  30  -7.344   6.063   3.024
  234   HG11  VAL  30          1HG1      VAL  30  -5.545   4.799   4.087
  235   HG12  VAL  30          2HG1      VAL  30  -5.843   6.301   4.960
  236   HG13  VAL  30          3HG1      VAL  30  -4.445   6.165   3.891
  237   HG21  VAL  30          3HG2      VAL  30  -6.691   8.309   3.751
  238   HG22  VAL  30          1HG2      VAL  30  -6.944   8.253   2.007
  239   HG23  VAL  30          2HG2      VAL  30  -5.305   8.269   2.661
  240    H    LEU  31           H        LEU  31  -3.887   4.171   1.663
  241    HA   LEU  31           HA       LEU  31  -5.587   1.785   2.011
  242    HB2  LEU  31           2HB      LEU  31  -2.944   1.926   0.539
  243    HB3  LEU  31           1HB      LEU  31  -3.871   0.468   0.833
  244    HG   LEU  31           HG       LEU  31  -5.759   1.689  -0.495
  245   HD11  LEU  31          1HD1      LEU  31  -4.955   3.221  -2.212
  246   HD12  LEU  31          2HD1      LEU  31  -3.343   3.194  -1.497
  247   HD13  LEU  31          3HD1      LEU  31  -4.696   3.882  -0.598
  248   HD21  LEU  31          3HD2      LEU  31  -4.894   0.790  -2.600
  249   HD22  LEU  31          1HD2      LEU  31  -4.632  -0.328  -1.262
  250   HD23  LEU  31          2HD2      LEU  31  -3.290   0.638  -1.879
  251    H    VAL  32           H        VAL  32  -5.270   0.784   3.904
  252    HA   VAL  32           HA       VAL  32  -3.000   1.602   5.568
  253    HB   VAL  32           HB       VAL  32  -5.454   0.004   6.332
  254   HG11  VAL  32          1HG1      VAL  32  -3.544  -0.382   7.823
  255   HG12  VAL  32          2HG1      VAL  32  -4.824   0.513   8.640
  256   HG13  VAL  32          3HG1      VAL  32  -3.384   1.359   8.072
  257   HG21  VAL  32          3HG2      VAL  32  -6.066   2.247   5.596
  258   HG22  VAL  32          1HG2      VAL  32  -4.864   2.953   6.677
  259   HG23  VAL  32          2HG2      VAL  32  -6.259   2.105   7.342
  260    H    VAL  33           H        VAL  33  -1.258   0.341   5.854
  261    HA   VAL  33           HA       VAL  33  -1.505  -2.577   5.410
  262    HB   VAL  33           HB       VAL  33   0.980  -0.865   5.123
  263   HG11  VAL  33          1HG1      VAL  33   0.548  -3.802   4.543
  264   HG12  VAL  33          2HG1      VAL  33   1.517  -3.129   5.853
  265   HG13  VAL  33          3HG1      VAL  33   2.012  -2.890   4.177
  266   HG21  VAL  33          3HG2      VAL  33  -0.638  -0.440   3.332
  267   HG22  VAL  33          1HG2      VAL  33  -0.722  -2.169   2.990
  268   HG23  VAL  33          2HG2      VAL  33   0.780  -1.287   2.718
  269    H    SER  34           H        SER  34  -1.412  -3.745   7.221
  270    HA   SER  34           HA       SER  34  -0.650  -2.707   9.752
  271    HB2  SER  34           2HB      SER  34  -1.080  -5.587   8.904
  272    HB3  SER  34           1HB      SER  34  -0.996  -5.012  10.568
  273    HG   SER  34           HG       SER  34  -3.159  -5.235   9.797
  274    H    ARG  35           H        ARG  35   1.196  -3.039  11.028
  275    HA   ARG  35           HA       ARG  35   3.662  -3.330   9.702
  276    HB2  ARG  35           2HB      ARG  35   3.083  -3.576  12.667
  277    HB3  ARG  35           1HB      ARG  35   4.692  -3.446  11.966
  278    HG2  ARG  35           2HG      ARG  35   3.823  -1.249  10.920
  279    HG3  ARG  35           1HG      ARG  35   2.531  -1.373  12.113
  280    HD2  ARG  35           2HD      ARG  35   5.496  -1.276  12.694
  281    HD3  ARG  35           1HD      ARG  35   4.351   0.042  12.926
  282    HE   ARG  35           HE       ARG  35   3.424  -2.099  14.425
  283   HH11  ARG  35          1HH1      ARG  35   6.188  -0.039  14.330
  284   HH12  ARG  35          2HH1      ARG  35   6.487  -0.179  16.029
  285   HH21  ARG  35          1HH2      ARG  35   3.844  -2.290  16.596
  286   HH22  ARG  35          2HH2      ARG  35   5.172  -1.429  17.293
  287    H    ALA  36           H        ALA  36   1.657  -5.692  11.353
  288    HA   ALA  36           HA       ALA  36   3.372  -7.882  11.419
  289    HB1  ALA  36           3HB      ALA  36   0.416  -7.892  10.786
  290    HB2  ALA  36           1HB      ALA  36   1.120  -7.863  12.403
  291    HB3  ALA  36           2HB      ALA  36   1.363  -9.265  11.362
  292    H    ALA  37           H        ALA  37   1.320  -6.739   8.745
  293    HA   ALA  37           HA       ALA  37   2.016  -8.718   6.869
  294    HB1  ALA  37           3HB      ALA  37   1.124  -7.191   5.183
  295    HB2  ALA  37           1HB      ALA  37   1.142  -5.874   6.356
  296    HB3  ALA  37           2HB      ALA  37   0.073  -7.255   6.598
  297    H    LEU  38           H        LEU  38   3.440  -5.529   7.547
  298    HA   LEU  38           HA       LEU  38   5.399  -5.478   5.562
  299    HB2  LEU  38           2HB      LEU  38   5.551  -4.430   8.393
  300    HB3  LEU  38           1HB      LEU  38   6.680  -4.014   7.118
  301    HG   LEU  38           HG       LEU  38   3.723  -3.369   7.108
  302   HD11  LEU  38          1HD1      LEU  38   4.951  -2.064   8.767
  303   HD12  LEU  38          2HD1      LEU  38   4.426  -1.054   7.419
  304   HD13  LEU  38          3HD1      LEU  38   6.110  -1.569   7.532
  305   HD21  LEU  38          3HD2      LEU  38   5.910  -2.582   5.176
  306   HD22  LEU  38          1HD2      LEU  38   4.237  -2.023   5.128
  307   HD23  LEU  38          2HD2      LEU  38   4.606  -3.726   4.855
  308    H    GLN  39           H        GLN  39   5.596  -6.854   8.850
  309    HA   GLN  39           HA       GLN  39   8.211  -7.874   8.657
  310    HB2  GLN  39           2HB      GLN  39   5.851  -8.799  10.309
  311    HB3  GLN  39           1HB      GLN  39   7.477  -9.450  10.484
  312    HG2  GLN  39           2HG      GLN  39   8.295  -7.186  11.032
  313    HG3  GLN  39           1HG      GLN  39   6.639  -6.590  10.934
  314   HE21  GLN  39          1HE2      GLN  39   5.183  -7.147  12.557
  315   HE22  GLN  39          2HE2      GLN  39   5.694  -7.813  14.064
  316    H    ALA  40           H        ALA  40   5.083  -9.348   7.808
  317    HA   ALA  40           HA       ALA  40   6.002 -11.882   7.036
  318    HB1  ALA  40           3HB      ALA  40   3.629 -11.367   7.257
  319    HB2  ALA  40           1HB      ALA  40   3.969 -12.008   5.651
  320    HB3  ALA  40           2HB      ALA  40   3.715 -10.278   5.873
  321    H    LEU  41           H        LEU  41   5.711  -8.892   5.124
  322    HA   LEU  41           HA       LEU  41   6.808  -9.907   2.713
  323    HB2  LEU  41           2HB      LEU  41   6.808  -7.080   3.792
  324    HB3  LEU  41           1HB      LEU  41   7.193  -7.527   2.141
  325    HG   LEU  41           HG       LEU  41   4.500  -7.948   3.457
  326   HD11  LEU  41          1HD1      LEU  41   3.736  -6.116   2.025
  327   HD12  LEU  41          2HD1      LEU  41   5.388  -5.865   1.458
  328   HD13  LEU  41          3HD1      LEU  41   4.982  -5.577   3.150
  329   HD21  LEU  41          3HD2      LEU  41   4.969  -9.593   1.713
  330   HD22  LEU  41          1HD2      LEU  41   5.387  -8.300   0.588
  331   HD23  LEU  41          2HD2      LEU  41   3.733  -8.452   1.181
  332    H    GLY  42           H        GLY  42   8.260  -8.765   5.670
  333    HA2  GLY  42           2HA      GLY  42  10.496  -9.257   6.309
  334    HA3  GLY  42           1HA      GLY  42  10.933  -9.395   4.614
  335    H    VAL  43           H        VAL  43   9.073  -6.692   5.787
  336    HA   VAL  43           HA       VAL  43  11.227  -4.867   5.045
  337    HB   VAL  43           HB       VAL  43   8.392  -4.223   5.899
  338   HG11  VAL  43          1HG1      VAL  43  10.500  -2.519   4.563
  339   HG12  VAL  43          2HG1      VAL  43   9.885  -2.337   6.205
  340   HG13  VAL  43          3HG1      VAL  43   8.825  -2.039   4.830
  341   HG21  VAL  43          3HG2      VAL  43   9.547  -4.508   3.119
  342   HG22  VAL  43          1HG2      VAL  43   7.933  -3.903   3.496
  343   HG23  VAL  43          2HG2      VAL  43   8.360  -5.571   3.877
  344    H    ALA  44           H        ALA  44  12.612  -4.157   6.533
  345    HA   ALA  44           HA       ALA  44  12.102  -4.436   9.362
  346    HB1  ALA  44           3HB      ALA  44  14.449  -3.225   7.897
  347    HB2  ALA  44           1HB      ALA  44  14.316  -4.893   8.456
  348    HB3  ALA  44           2HB      ALA  44  14.384  -3.574   9.626
  349    H    GLU  45           H        GLU  45  12.036  -2.761  10.910
  350    HA   GLU  45           HA       GLU  45  10.546  -0.483  10.273
  351    HB2  GLU  45           2HB      GLU  45  10.639  -1.442  12.537
  352    HB3  GLU  45           1HB      GLU  45  12.315  -0.933  12.691
  353    HG2  GLU  45           2HG      GLU  45  11.643   1.404  12.563
  354    HG3  GLU  45           1HG      GLU  45   9.962   0.924  12.333
  355    H    GLY  46           H        GLY  46  11.080   1.364   9.321
  356    HA2  GLY  46           2HA      GLY  46  12.609   3.283   9.157
  357    HA3  GLY  46           1HA      GLY  46  13.940   2.137   9.206
  358    H    GLY  47           H        GLY  47  11.752   0.578   7.407
  359    HA2  GLY  47           2HA      GLY  47  12.775   1.705   4.860
  360    HA3  GLY  47           1HA      GLY  47  12.336   0.023   5.106
  361    H    GLU  48           H        GLU  48   9.871   0.631   6.522
  362    HA   GLU  48           HA       GLU  48   8.030   0.617   4.426
  363    HB2  GLU  48           2HB      GLU  48   6.311   0.803   6.109
  364    HB3  GLU  48           1HB      GLU  48   7.601  -0.217   6.727
  365    HG2  GLU  48           2HG      GLU  48   7.069   2.663   7.453
  366    HG3  GLU  48           1HG      GLU  48   6.816   1.247   8.472
  367    H    ARG  49           H        ARG  49   9.528   3.313   5.989
  368    HA   ARG  49           HA       ARG  49   7.736   5.379   5.459
  369    HB2  ARG  49           2HB      ARG  49   9.632   6.886   5.608
  370    HB3  ARG  49           1HB      ARG  49   9.785   5.621   6.820
  371    HG2  ARG  49           2HG      ARG  49  11.401   4.452   5.376
  372    HG3  ARG  49           1HG      ARG  49  11.265   5.753   4.190
  373    HD2  ARG  49           2HD      ARG  49  12.039   7.351   5.940
  374    HD3  ARG  49           1HD      ARG  49  12.292   5.983   7.023
  375    HE   ARG  49           HE       ARG  49  13.683   5.937   4.460
  376   HH11  ARG  49          1HH1      ARG  49  13.825   6.436   7.870
  377   HH12  ARG  49          2HH1      ARG  49  15.552   6.371   7.911
  378   HH21  ARG  49          1HH2      ARG  49  15.899   5.860   4.527
  379   HH22  ARG  49          2HH2      ARG  49  16.715   6.046   6.041
  380    H    CYS  50           H        CYS  50   9.654   3.547   3.244
  381    HA   CYS  50           HA       CYS  50   8.595   5.176   1.031
  382    HB2  CYS  50           2HB      CYS  50  11.412   4.066   1.178
  383    HB3  CYS  50           1HB      CYS  50  10.702   4.849  -0.230
  384    HG   CYS  50           HG       CYS  50  10.779   7.359   0.664
  385    HA   PRO  51           HA       PRO  51   7.186   0.792   0.587
  386    HB2  PRO  51           2HB      PRO  51   5.153   1.499  -1.169
  387    HB3  PRO  51           1HB      PRO  51   4.991   1.411   0.587
  388    HG2  PRO  51           2HG      PRO  51   5.488   3.794  -1.155
  389    HG3  PRO  51           1HG      PRO  51   4.421   3.639   0.254
  390    HD2  PRO  51           2HD      PRO  51   6.795   4.850   0.453
  391    HD3  PRO  51           1HD      PRO  51   6.187   3.818   1.765
  392    H    GLN  52           H        GLN  52   8.239   3.140  -1.759
  393    HA   GLN  52           HA       GLN  52   8.256   1.624  -4.099
  394    HB2  GLN  52           2HB      GLN  52  10.104   3.097  -4.843
  395    HB3  GLN  52           1HB      GLN  52   8.775   3.989  -4.123
  396    HG2  GLN  52           2HG      GLN  52  10.677   5.029  -3.277
  397    HG3  GLN  52           1HG      GLN  52  10.154   3.973  -1.967
  398   HE21  GLN  52          1HE2      GLN  52  12.209   3.886  -1.046
  399   HE22  GLN  52          2HE2      GLN  52  13.514   3.024  -1.771
  400    H    SER  53           H        SER  53  10.179   1.231  -1.257
  401    HA   SER  53           HA       SER  53  12.334  -0.220  -2.505
  402    HB2  SER  53           2HB      SER  53  12.633   1.037  -0.381
  403    HB3  SER  53           1HB      SER  53  11.552  -0.097   0.424
  404    HG   SER  53           HG       SER  53  13.157  -1.744  -0.413
  405    H    VAL  54           H        VAL  54   9.155  -1.049  -1.747
  406    HA   VAL  54           HA       VAL  54   9.802  -3.915  -1.465
  407    HB   VAL  54           HB       VAL  54   7.131  -2.573  -0.979
  408   HG11  VAL  54          1HG1      VAL  54   8.138  -5.339  -0.295
  409   HG12  VAL  54          2HG1      VAL  54   6.922  -4.930  -1.507
  410   HG13  VAL  54          3HG1      VAL  54   6.583  -4.670   0.205
  411   HG21  VAL  54          3HG2      VAL  54   9.246  -3.369   1.033
  412   HG22  VAL  54          1HG2      VAL  54   7.625  -2.792   1.423
  413   HG23  VAL  54          2HG2      VAL  54   8.771  -1.722   0.614
  414    H    GLY  55           H        GLY  55   7.937  -1.615  -3.405
  415    HA2  GLY  55           2HA      GLY  55   7.500  -1.876  -5.719
  416    HA3  GLY  55           1HA      GLY  55   7.752  -3.610  -5.555
  417    H    TRP  56           H        TRP  56   6.056  -4.847  -4.444
  418    HA   TRP  56           HA       TRP  56   3.392  -3.580  -4.610
  419    HB2  TRP  56           2HB      TRP  56   2.692  -6.127  -5.015
  420    HB3  TRP  56           1HB      TRP  56   3.154  -5.063  -6.334
  421    HD1  TRP  56           HD1      TRP  56   5.024  -7.558  -3.988
  422    HE1  TRP  56           HE1      TRP  56   6.737  -8.837  -5.424
  423    HE3  TRP  56           HE3      TRP  56   4.173  -5.285  -8.487
  424    HZ2  TRP  56           HZ2      TRP  56   7.598  -8.888  -8.106
  425    HZ3  TRP  56           HZ3      TRP  56   5.485  -6.010 -10.441
  426    HH2  TRP  56           HH2      TRP  56   7.163  -7.775 -10.252
  427    H    MET  57           H        MET  57   1.941  -3.960  -2.977
  428    HA   MET  57           HA       MET  57   2.839  -5.484  -0.628
  429    HB2  MET  57           2HB      MET  57   2.055  -2.554  -0.591
  430    HB3  MET  57           1HB      MET  57   2.381  -3.533   0.833
  431    HG2  MET  57           2HG      MET  57   4.673  -3.704   0.313
  432    HG3  MET  57           1HG      MET  57   4.426  -3.101  -1.325
  433    HE1  MET  57           3HE      MET  57   4.313  -2.176   2.496
  434    HE2  MET  57           1HE      MET  57   2.747  -1.601   1.921
  435    HE3  MET  57           2HE      MET  57   3.979  -0.445   2.430
  436    HA   PRO  58           HA       PRO  58  -1.629  -6.147  -0.387
  437    HB2  PRO  58           2HB      PRO  58  -1.696  -7.728   1.781
  438    HB3  PRO  58           1HB      PRO  58  -1.039  -8.300   0.241
  439    HG2  PRO  58           2HG      PRO  58   0.413  -7.337   2.678
  440    HG3  PRO  58           1HG      PRO  58   0.792  -8.704   1.616
  441    HD2  PRO  58           2HD      PRO  58   2.009  -6.223   1.473
  442    HD3  PRO  58           1HD      PRO  58   1.925  -7.379   0.129
  443    H    GLY  59           H        GLY  59  -2.915  -4.485   0.271
  444    HA2  GLY  59           2HA      GLY  59  -2.835  -3.687   3.106
  445    HA3  GLY  59           1HA      GLY  59  -2.618  -2.443   1.886
  446    H    LEU  60           H        LEU  60  -4.596  -2.044   3.598
  447    HA   LEU  60           HA       LEU  60  -7.108  -3.069   2.483
  448    HB2  LEU  60           2HB      LEU  60  -6.710  -3.120   4.937
  449    HB3  LEU  60           1HB      LEU  60  -6.603  -1.371   4.936
  450    HG   LEU  60           HG       LEU  60  -8.976  -1.297   4.102
  451   HD11  LEU  60          1HD1      LEU  60 -10.351  -3.288   4.338
  452   HD12  LEU  60          2HD1      LEU  60  -8.931  -4.238   4.776
  453   HD13  LEU  60          3HD1      LEU  60  -9.068  -3.551   3.157
  454   HD21  LEU  60          3HD2      LEU  60  -8.445  -0.920   6.452
  455   HD22  LEU  60          1HD2      LEU  60  -8.511  -2.655   6.760
  456   HD23  LEU  60          2HD2      LEU  60  -9.971  -1.786   6.287
  457    H    ASN  61           H        ASN  61  -7.853  -1.926   0.791
  458    HA   ASN  61           HA       ASN  61  -7.313   0.887   0.451
  459    HB2  ASN  61           2HB      ASN  61  -7.314  -0.380  -1.550
  460    HB3  ASN  61           1HB      ASN  61  -8.842  -1.163  -1.154
  461   HD21  ASN  61          1HD2      ASN  61  -7.371   1.862  -2.132
  462   HD22  ASN  61          2HD2      ASN  61  -8.801   2.549  -2.807
  463    H    GLU  62           H        GLU  62  -8.463   2.457   1.399
  464    HA   GLU  62           HA       GLU  62 -10.892   1.938   2.784
  465    HB2  GLU  62           2HB      GLU  62  -9.406   4.497   2.194
  466    HB3  GLU  62           1HB      GLU  62 -10.894   4.459   3.132
  467    HG2  GLU  62           2HG      GLU  62  -8.375   2.952   3.837
  468    HG3  GLU  62           1HG      GLU  62  -8.852   4.504   4.524
  469    H    ARG  63           H        ARG  63 -10.274   3.013  -0.473
  470    HA   ARG  63           HA       ARG  63 -12.702   4.305  -1.019
  471    HB2  ARG  63           2HB      ARG  63 -10.711   4.194  -2.551
  472    HB3  ARG  63           1HB      ARG  63 -11.162   2.543  -2.938
  473    HG2  ARG  63           2HG      ARG  63 -11.955   3.898  -4.707
  474    HG3  ARG  63           1HG      ARG  63 -13.368   3.437  -3.760
  475    HD2  ARG  63           2HD      ARG  63 -11.915   6.066  -3.424
  476    HD3  ARG  63           1HD      ARG  63 -13.291   5.847  -4.500
  477    HE   ARG  63           HE       ARG  63 -14.612   5.299  -2.500
  478   HH11  ARG  63          1HH1      ARG  63 -11.603   6.913  -2.009
  479   HH12  ARG  63          2HH1      ARG  63 -12.135   7.677  -0.548
  480   HH21  ARG  63          1HH2      ARG  63 -15.257   6.268  -0.613
  481   HH22  ARG  63          2HH2      ARG  63 -14.161   7.298   0.242
  482    H    THR  64           H        THR  64 -11.917   0.881  -0.881
  483    HA   THR  64           HA       THR  64 -14.763   0.204  -1.377
  484    HB   THR  64           HB       THR  64 -13.992  -1.999  -2.179
  485    HG1  THR  64           HG1      THR  64 -11.331  -1.033  -2.244
  486   HG21  THR  64          3HG2      THR  64 -12.617   0.294  -3.604
  487   HG22  THR  64          1HG2      THR  64 -14.301  -0.188  -3.820
  488   HG23  THR  64          2HG2      THR  64 -13.002  -1.279  -4.302
  489    H    ARG  65           H        ARG  65 -12.396   0.321   0.967
  490    HA   ARG  65           HA       ARG  65 -12.014  -0.593   3.003
  491    HB2  ARG  65           2HB      ARG  65 -14.803  -1.758   2.837
  492    HB3  ARG  65           1HB      ARG  65 -13.850  -1.515   4.290
  493    HG2  ARG  65           2HG      ARG  65 -15.230   0.527   2.585
  494    HG3  ARG  65           1HG      ARG  65 -15.437   0.195   4.301
  495    HD2  ARG  65           2HD      ARG  65 -13.158   1.598   2.929
  496    HD3  ARG  65           1HD      ARG  65 -14.258   2.243   4.139
  497    HE   ARG  65           HE       ARG  65 -11.817   0.894   4.607
  498   HH11  ARG  65          1HH1      ARG  65 -14.998   1.139   5.951
  499   HH12  ARG  65          2HH1      ARG  65 -14.430   0.921   7.569
  500   HH21  ARG  65          1HH2      ARG  65 -11.119   0.702   6.660
  501   HH22  ARG  65          2HH2      ARG  65 -12.258   0.671   7.966
  502    H    GLN  66           H        GLN  66 -11.708  -2.233   0.415
  503    HA   GLN  66           HA       GLN  66 -11.617  -4.922   1.629
  504    HB2  GLN  66           2HB      GLN  66 -11.767  -4.029  -1.248
  505    HB3  GLN  66           1HB      GLN  66 -11.302  -5.666  -0.807
  506    HG2  GLN  66           2HG      GLN  66 -13.914  -4.333  -0.096
  507    HG3  GLN  66           1HG      GLN  66 -13.675  -5.515  -1.382
  508   HE21  GLN  66          1HE2      GLN  66 -15.437  -5.703   0.914
  509   HE22  GLN  66          2HE2      GLN  66 -14.947  -7.114   1.783
  510    H    ARG  67           H        ARG  67  -9.786  -6.275   1.236
  511    HA   ARG  67           HA       ARG  67  -7.278  -4.734   1.203
  512    HB2  ARG  67           2HB      ARG  67  -7.862  -6.184   3.190
  513    HB3  ARG  67           1HB      ARG  67  -7.704  -7.584   2.137
  514    HG2  ARG  67           2HG      ARG  67  -5.333  -6.716   1.657
  515    HG3  ARG  67           1HG      ARG  67  -5.571  -5.684   3.069
  516    HD2  ARG  67           2HD      ARG  67  -4.456  -7.663   3.810
  517    HD3  ARG  67           1HD      ARG  67  -6.125  -7.761   4.376
  518    HE   ARG  67           HE       ARG  67  -5.746  -9.039   1.847
  519   HH11  ARG  67          1HH1      ARG  67  -5.461  -9.490   5.253
  520   HH12  ARG  67          2HH1      ARG  67  -5.520 -11.214   5.126
  521   HH21  ARG  67          1HH2      ARG  67  -5.819 -11.222   1.701
  522   HH22  ARG  67          2HH2      ARG  67  -5.717 -12.190   3.130
  523    H    GLY  68           H        GLY  68  -5.727  -5.062  -0.328
  524    HA2  GLY  68           2HA      GLY  68  -5.673  -7.502  -1.916
  525    HA3  GLY  68           1HA      GLY  68  -6.101  -6.050  -2.809
  526    H    ASP  69           H        ASP  69  -3.931  -7.354  -3.659
  527    HA   ASP  69           HA       ASP  69  -1.545  -6.161  -2.474
  528    HB2  ASP  69           2HB      ASP  69  -1.620  -8.561  -3.250
  529    HB3  ASP  69           1HB      ASP  69  -1.748  -7.964  -4.901
  530    H    PHE  70           H        PHE  70  -0.994  -4.156  -3.062
  531    HA   PHE  70           HA       PHE  70  -1.556  -3.244  -5.819
  532    HB2  PHE  70           2HB      PHE  70  -1.984  -1.014  -4.954
  533    HB3  PHE  70           1HB      PHE  70  -3.026  -2.167  -4.129
  534    HD1  PHE  70           HD1      PHE  70  -2.547  -2.813  -1.782
  535    HD2  PHE  70           HD2      PHE  70  -0.349   0.253  -3.764
  536    HE1  PHE  70           HE1      PHE  70  -1.733  -1.991   0.387
  537    HE2  PHE  70           HE2      PHE  70   0.466   1.074  -1.596
  538    HZ   PHE  70           HZ       PHE  70  -0.224  -0.048   0.485
  539    HA   PRO  71           HA       PRO  71   2.782  -2.295  -6.161
  540    HB2  PRO  71           2HB      PRO  71   2.073   0.023  -7.847
  541    HB3  PRO  71           1HB      PRO  71   2.990  -1.429  -8.260
  542    HG2  PRO  71           2HG      PRO  71   0.501  -1.022  -9.194
  543    HG3  PRO  71           1HG      PRO  71   1.091  -2.644  -8.784
  544    HD2  PRO  71           2HD      PRO  71  -0.696  -0.819  -7.198
  545    HD3  PRO  71           1HD      PRO  71  -0.826  -2.573  -7.461
  546    H    GLY  72           H        GLY  72   3.255  -1.584  -4.068
  547    HA2  GLY  72           2HA      GLY  72   2.529   0.844  -2.886
  548    HA3  GLY  72           1HA      GLY  72   3.930  -0.112  -2.438
  549    H    THR  73           H        THR  73   4.900   0.264  -5.330
  550    HA   THR  73           HA       THR  73   6.643   2.428  -4.894
  551    HB   THR  73           HB       THR  73   7.246   0.696  -6.474
  552    HG1  THR  73           HG1      THR  73   7.373   3.324  -7.015
  553   HG21  THR  73          3HG2      THR  73   4.983   1.724  -8.201
  554   HG22  THR  73          1HG2      THR  73   5.010   0.180  -7.348
  555   HG23  THR  73          2HG2      THR  73   6.150   0.482  -8.657
  556    H    TYR  74           H        TYR  74   3.357   2.497  -5.854
  557    HA   TYR  74           HA       TYR  74   3.628   5.148  -7.106
  558    HB2  TYR  74           2HB      TYR  74   1.282   3.240  -7.007
  559    HB3  TYR  74           1HB      TYR  74   1.240   4.827  -7.760
  560    HD1  TYR  74           HD2      TYR  74   3.574   5.067  -9.343
  561    HD2  TYR  74           HD1      TYR  74   1.278   1.560  -8.590
  562    HE1  TYR  74           HE2      TYR  74   4.360   4.102 -11.464
  563    HE2  TYR  74           HE1      TYR  74   2.055   0.590 -10.710
  564    HH   TYR  74           HH       TYR  74   2.925   1.362 -12.872
  565    H    VAL  75           H        VAL  75   3.162   4.006  -4.030
  566    HA   VAL  75           HA       VAL  75   1.274   6.175  -3.337
  567    HB   VAL  75           HB       VAL  75   0.613   4.927  -1.361
  568   HG11  VAL  75          1HG1      VAL  75  -0.579   3.080  -2.431
  569   HG12  VAL  75          2HG1      VAL  75   0.479   3.202  -3.838
  570   HG13  VAL  75          3HG1      VAL  75  -0.615   4.528  -3.439
  571   HG21  VAL  75          3HG2      VAL  75   2.709   3.781  -0.869
  572   HG22  VAL  75          1HG2      VAL  75   2.514   2.773  -2.303
  573   HG23  VAL  75          2HG2      VAL  75   1.381   2.627  -0.961
  574    H    GLU  76           H        GLU  76   1.546   7.117  -1.152
  575    HA   GLU  76           HA       GLU  76   4.401   7.322  -0.412
  576    HB2  GLU  76           2HB      GLU  76   3.943   9.623   0.317
  577    HB3  GLU  76           1HB      GLU  76   3.588   9.400  -1.390
  578    HG2  GLU  76           2HG      GLU  76   1.215   9.296  -0.926
  579    HG3  GLU  76           1HG      GLU  76   1.521   9.389   0.807
  580    H    PHE  77           H        PHE  77   4.956   7.467   1.767
  581    HA   PHE  77           HA       PHE  77   3.181   6.134   3.605
  582    HB2  PHE  77           2HB      PHE  77   5.492   5.545   3.721
  583    HB3  PHE  77           1HB      PHE  77   5.987   7.228   3.846
  584    HD1  PHE  77           HD2      PHE  77   3.852   4.762   5.682
  585    HD2  PHE  77           HD1      PHE  77   6.606   8.005   5.924
  586    HE1  PHE  77           HE2      PHE  77   3.858   4.583   8.132
  587    HE2  PHE  77           HE1      PHE  77   6.609   7.825   8.376
  588    HZ   PHE  77           HZ       PHE  77   5.235   6.109   9.484
  589    H    LEU  78           H        LEU  78   1.665   7.140   4.764
  590    HA   LEU  78           HA       LEU  78   1.839  10.002   5.303
  591    HB2  LEU  78           2HB      LEU  78  -0.343   8.039   6.030
  592    HB3  LEU  78           1HB      LEU  78  -0.448   9.788   6.119
  593    HG   LEU  78           HG       LEU  78  -0.153   8.176   3.575
  594   HD11  LEU  78          1HD1      LEU  78  -2.459   8.897   3.121
  595   HD12  LEU  78          2HD1      LEU  78  -2.536   9.629   4.725
  596   HD13  LEU  78          3HD1      LEU  78  -2.348   7.883   4.561
  597   HD21  LEU  78          3HD2      LEU  78  -0.546  10.294   2.419
  598   HD22  LEU  78          1HD2      LEU  78   0.915  10.370   3.402
  599   HD23  LEU  78          2HD2      LEU  78  -0.566  11.146   3.963
  600    H    GLY  79           H        GLY  79   0.952   7.194   7.345
  601    HA2  GLY  79           2HA      GLY  79   2.879   7.373   9.297
  602    HA3  GLY  79           1HA      GLY  79   1.671   8.560   9.765
  603    HA   PRO  80           HA       PRO  80   0.444   4.265  11.323
  604    HB2  PRO  80           2HB      PRO  80   0.759   4.654  13.976
  605    HB3  PRO  80           1HB      PRO  80   2.102   4.170  12.934
  606    HG2  PRO  80           2HG      PRO  80   1.400   6.897  13.971
  607    HG3  PRO  80           1HG      PRO  80   2.986   6.104  13.889
  608    HD2  PRO  80           2HD      PRO  80   2.137   7.936  12.049
  609    HD3  PRO  80           1HD      PRO  80   3.274   6.628  11.662
  610    H    LEU  81           H        LEU  81  -1.565   3.730  12.289
  611    HA   LEU  81           HA       LEU  81  -3.480   5.900  12.319
  612    HB2  LEU  81           2HB      LEU  81  -3.881   2.947  12.830
  613    HB3  LEU  81           1HB      LEU  81  -5.167   4.129  12.686
  614    HG   LEU  81           HG       LEU  81  -4.216   4.589  10.326
  615   HD11  LEU  81          1HD1      LEU  81  -2.111   3.402  10.580
  616   HD12  LEU  81          2HD1      LEU  81  -3.075   2.689   9.290
  617   HD13  LEU  81          3HD1      LEU  81  -2.976   1.890  10.860
  618   HD21  LEU  81          3HD2      LEU  81  -6.366   3.509  10.736
  619   HD22  LEU  81          1HD2      LEU  81  -5.558   1.952  10.924
  620   HD23  LEU  81          2HD2      LEU  81  -5.534   2.777   9.364
  621    H    GLU  82           H        GLU  82  -3.742   7.118  14.062
  622    HA   GLU  82           HA       GLU  82  -4.018   5.839  16.693
  623    HB2  GLU  82           2HB      GLU  82  -1.641   6.847  16.206
  624    HB3  GLU  82           1HB      GLU  82  -2.433   8.391  16.474
  625    HG2  GLU  82           2HG      GLU  82  -2.362   6.125  18.465
  626    HG3  GLU  82           1HG      GLU  82  -1.260   7.497  18.462
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1   4.016   4.593  26.408
    2    H2   MET   1           2H       MET   1   4.849   3.431  25.500
    3    H3   MET   1           3H       MET   1   3.827   2.948  26.754
    4    HA   MET   1           HA       MET   1   1.914   3.825  25.573
    5    HB2  MET   1           2HB      MET   1   3.977   4.418  23.440
    6    HB3  MET   1           1HB      MET   1   2.243   4.433  23.151
    7    HG2  MET   1           2HG      MET   1   3.746   6.215  25.058
    8    HG3  MET   1           1HG      MET   1   3.065   6.679  23.498
    9    HE1  MET   1           3HE      MET   1   2.456   8.222  26.258
   10    HE2  MET   1           1HE      MET   1   0.726   8.513  26.069
   11    HE3  MET   1           2HE      MET   1   1.809   8.708  24.690
   12    H    ALA   2           H        ALA   2   0.789   2.570  23.856
   13    HA   ALA   2           HA       ALA   2   1.288  -0.177  24.177
   14    HB1  ALA   2           3HB      ALA   2  -0.932   0.769  23.724
   15    HB2  ALA   2           1HB      ALA   2  -0.526  -0.532  22.602
   16    HB3  ALA   2           2HB      ALA   2  -0.427   1.150  22.077
   17    H    GLY   3           H        GLY   3   1.250   1.432  20.969
   18    HA2  GLY   3           2HA      GLY   3   3.788   0.992  20.090
   19    HA3  GLY   3           1HA      GLY   3   3.033  -0.581  19.901
   20    HA   PRO   4           HA       PRO   4   1.831   1.848  16.136
   21    HB2  PRO   4           2HB      PRO   4   3.772   1.249  14.383
   22    HB3  PRO   4           1HB      PRO   4   3.978   2.526  15.587
   23    HG2  PRO   4           2HG      PRO   4   5.169  -0.190  15.497
   24    HG3  PRO   4           1HG      PRO   4   5.796   1.288  16.243
   25    HD2  PRO   4           2HD      PRO   4   4.399  -0.875  17.516
   26    HD3  PRO   4           1HD      PRO   4   4.979   0.631  18.258
   27    H    GLU   5           H        GLU   5   0.094   0.277  16.118
   28    HA   GLU   5           HA       GLU   5   0.293  -2.396  15.357
   29    HB2  GLU   5           2HB      GLU   5  -1.937  -0.401  15.330
   30    HB3  GLU   5           1HB      GLU   5  -2.181  -1.947  14.535
   31    HG2  GLU   5           2HG      GLU   5  -3.007  -1.849  16.876
   32    HG3  GLU   5           1HG      GLU   5  -1.856  -3.144  16.562
   33    H    GLY   6           H        GLY   6   0.222   0.462  13.340
   34    HA2  GLY   6           2HA      GLY   6   1.335  -0.874  11.133
   35    HA3  GLY   6           1HA      GLY   6  -0.398  -0.749  10.875
   36    H    PHE   7           H        PHE   7   0.563   0.459   8.972
   37    HA   PHE   7           HA       PHE   7   0.822   3.319   9.644
   38    HB2  PHE   7           2HB      PHE   7   2.403   1.828   7.525
   39    HB3  PHE   7           1HB      PHE   7   2.459   3.565   7.808
   40    HD1  PHE   7           HD1      PHE   7   3.363   4.421   9.993
   41    HD2  PHE   7           HD2      PHE   7   3.721   0.340   8.814
   42    HE1  PHE   7           HE1      PHE   7   5.158   4.102  11.643
   43    HE2  PHE   7           HE2      PHE   7   5.516   0.019  10.467
   44    HZ   PHE   7           HZ       PHE   7   6.237   1.900  11.885
   45    H    GLN   8           H        GLN   8   0.519   4.689   7.579
   46    HA   GLN   8           HA       GLN   8  -1.660   3.578   5.927
   47    HB2  GLN   8           2HB      GLN   8  -1.606   6.263   7.328
   48    HB3  GLN   8           1HB      GLN   8  -2.790   5.819   6.105
   49    HG2  GLN   8           2HG      GLN   8  -3.561   3.981   7.535
   50    HG3  GLN   8           1HG      GLN   8  -2.382   4.448   8.759
   51   HE21  GLN   8          1HE2      GLN   8  -5.269   4.303   8.952
   52   HE22  GLN   8          2HE2      GLN   8  -5.807   5.874   9.412
   53    H    TYR   9           H        TYR   9  -1.606   4.051   3.818
   54    HA   TYR   9           HA       TYR   9   0.356   6.034   2.841
   55    HB2  TYR   9           2HB      TYR   9  -0.667   3.524   1.481
   56    HB3  TYR   9           1HB      TYR   9   0.425   4.694   0.748
   57    HD1  TYR   9           HD1      TYR   9   0.123   2.016   3.257
   58    HD2  TYR   9           HD2      TYR   9   2.766   4.774   1.371
   59    HE1  TYR   9           HE1      TYR   9   2.049   0.773   4.149
   60    HE2  TYR   9           HE2      TYR   9   4.698   3.540   2.261
   61    HH   TYR   9           HH       TYR   9   5.243   1.993   4.067
   62    H    ARG  10           H        ARG  10  -0.286   6.929   0.609
   63    HA   ARG  10           HA       ARG  10  -3.212   7.096   0.253
   64    HB2  ARG  10           2HB      ARG  10  -2.544   9.134   1.426
   65    HB3  ARG  10           1HB      ARG  10  -1.309   9.454   0.214
   66    HG2  ARG  10           2HG      ARG  10  -3.128   9.636  -1.491
   67    HG3  ARG  10           1HG      ARG  10  -4.302   9.492  -0.181
   68    HD2  ARG  10           2HD      ARG  10  -2.194  11.645  -0.409
   69    HD3  ARG  10           1HD      ARG  10  -3.894  11.836  -0.833
   70    HE   ARG  10           HE       ARG  10  -4.317  11.284   1.596
   71   HH11  ARG  10          1HH1      ARG  10  -1.368  12.752   0.573
   72   HH12  ARG  10          2HH1      ARG  10  -1.160  13.593   2.070
   73   HH21  ARG  10          1HH2      ARG  10  -4.013  12.351   3.503
   74   HH22  ARG  10          2HH2      ARG  10  -2.621  13.356   3.708
   75    H    ALA  11           H        ALA  11  -3.840   6.726  -1.794
   76    HA   ALA  11           HA       ALA  11  -1.997   6.153  -3.871
   77    HB1  ALA  11           3HB      ALA  11  -3.951   5.886  -5.292
   78    HB2  ALA  11           1HB      ALA  11  -4.960   6.692  -4.090
   79    HB3  ALA  11           2HB      ALA  11  -4.224   5.132  -3.720
   80    H    LEU  12           H        LEU  12  -0.825   7.566  -4.983
   81    HA   LEU  12           HA       LEU  12  -1.524  10.371  -5.104
   82    HB2  LEU  12           2HB      LEU  12   0.806   8.878  -6.332
   83    HB3  LEU  12           1HB      LEU  12   0.634  10.624  -6.273
   84    HG   LEU  12           HG       LEU  12   0.944   8.799  -3.880
   85   HD11  LEU  12          1HD1      LEU  12   3.118   9.858  -3.619
   86   HD12  LEU  12          2HD1      LEU  12   2.850  10.805  -5.082
   87   HD13  LEU  12          3HD1      LEU  12   2.997   9.051  -5.182
   88   HD21  LEU  12          3HD2      LEU  12   1.087  10.857  -2.571
   89   HD22  LEU  12          1HD2      LEU  12  -0.478  10.715  -3.369
   90   HD23  LEU  12          2HD2      LEU  12   0.745  11.809  -4.016
   91    H    TYR  13           H        TYR  13  -0.775   7.927  -7.610
   92    HA   TYR  13           HA       TYR  13  -2.504   9.431  -9.480
   93    HB2  TYR  13           2HB      TYR  13   0.022   7.851  -9.981
   94    HB3  TYR  13           1HB      TYR  13  -1.100   8.246 -11.280
   95    HD1  TYR  13           HD1      TYR  13  -1.367  10.544 -12.040
   96    HD2  TYR  13           HD2      TYR  13   1.383   9.582  -8.934
   97    HE1  TYR  13           HE1      TYR  13  -0.313  12.747 -12.301
   98    HE2  TYR  13           HE2      TYR  13   2.444  11.785  -9.190
   99    HH   TYR  13           HH       TYR  13   2.672  13.532 -10.970
  100    HA   PRO  14           HA       PRO  14  -5.085   5.849  -9.760
  101    HB2  PRO  14           2HB      PRO  14  -6.112   6.111 -12.267
  102    HB3  PRO  14           1HB      PRO  14  -6.592   7.149 -10.919
  103    HG2  PRO  14           2HG      PRO  14  -4.637   7.690 -13.129
  104    HG3  PRO  14           1HG      PRO  14  -5.868   8.763 -12.436
  105    HD2  PRO  14           2HD      PRO  14  -3.235   8.913 -11.766
  106    HD3  PRO  14           1HD      PRO  14  -4.537   9.330 -10.633
  107    H    PHE  15           H        PHE  15  -4.294   3.852  -9.887
  108    HA   PHE  15           HA       PHE  15  -2.871   3.022 -12.342
  109    HB2  PHE  15           2HB      PHE  15  -1.339   3.203 -10.415
  110    HB3  PHE  15           1HB      PHE  15  -2.354   2.086  -9.506
  111    HD1  PHE  15           HD1      PHE  15  -0.248   2.369 -12.547
  112    HD2  PHE  15           HD2      PHE  15  -2.046  -0.239  -9.697
  113    HE1  PHE  15           HE1      PHE  15   1.029   0.483 -13.472
  114    HE2  PHE  15           HE2      PHE  15  -0.769  -2.127 -10.619
  115    HZ   PHE  15           HZ       PHE  15   0.770  -1.765 -12.505
  116    H    ARG  16           H        ARG  16  -3.567   1.209 -13.338
  117    HA   ARG  16           HA       ARG  16  -5.595  -0.444 -11.963
  118    HB2  ARG  16           2HB      ARG  16  -5.627   0.415 -14.867
  119    HB3  ARG  16           1HB      ARG  16  -6.777  -0.686 -14.117
  120    HG2  ARG  16           2HG      ARG  16  -7.517   1.127 -12.624
  121    HG3  ARG  16           1HG      ARG  16  -6.390   2.226 -13.422
  122    HD2  ARG  16           2HD      ARG  16  -8.712   0.792 -14.719
  123    HD3  ARG  16           1HD      ARG  16  -8.645   2.505 -14.313
  124    HE   ARG  16           HE       ARG  16  -6.770   2.639 -15.953
  125   HH11  ARG  16          1HH1      ARG  16  -9.125   0.132 -16.222
  126   HH12  ARG  16          2HH1      ARG  16  -8.863  -0.067 -17.920
  127   HH21  ARG  16          1HH2      ARG  16  -6.479   2.401 -18.123
  128   HH22  ARG  16          2HH2      ARG  16  -7.409   1.231 -18.994
  129    H    ARG  17           H        ARG  17  -5.813  -2.623 -12.770
  130    HA   ARG  17           HA       ARG  17  -3.394  -3.678 -14.108
  131    HB2  ARG  17           2HB      ARG  17  -3.541  -4.223 -11.659
  132    HB3  ARG  17           1HB      ARG  17  -5.057  -5.050 -11.971
  133    HG2  ARG  17           2HG      ARG  17  -3.766  -6.880 -12.114
  134    HG3  ARG  17           1HG      ARG  17  -3.434  -6.308 -13.747
  135    HD2  ARG  17           2HD      ARG  17  -1.753  -5.736 -11.302
  136    HD3  ARG  17           1HD      ARG  17  -1.387  -6.940 -12.535
  137    HE   ARG  17           HE       ARG  17  -1.540  -4.683 -13.978
  138   HH11  ARG  17          1HH1      ARG  17   0.089  -5.375 -11.020
  139   HH12  ARG  17          2HH1      ARG  17   1.429  -4.346 -11.395
  140   HH21  ARG  17          1HH2      ARG  17   0.181  -3.347 -14.436
  141   HH22  ARG  17          2HH2      ARG  17   1.464  -3.193 -13.286
  142    H    GLU  18           H        GLU  18  -3.736  -5.288 -15.677
  143    HA   GLU  18           HA       GLU  18  -6.150  -5.339 -17.090
  144    HB2  GLU  18           2HB      GLU  18  -5.204  -7.318 -18.269
  145    HB3  GLU  18           1HB      GLU  18  -4.076  -5.972 -18.165
  146    HG2  GLU  18           2HG      GLU  18  -2.871  -7.053 -16.380
  147    HG3  GLU  18           1HG      GLU  18  -4.059  -8.351 -16.312
  148    H    ARG  19           H        ARG  19  -5.231  -7.073 -14.266
  149    HA   ARG  19           HA       ARG  19  -7.690  -8.701 -14.397
  150    HB2  ARG  19           2HB      ARG  19  -5.097  -9.604 -13.114
  151    HB3  ARG  19           1HB      ARG  19  -6.545 -10.565 -13.386
  152    HG2  ARG  19           2HG      ARG  19  -6.179 -10.555 -15.762
  153    HG3  ARG  19           1HG      ARG  19  -4.831  -9.429 -15.590
  154    HD2  ARG  19           2HD      ARG  19  -3.728 -11.205 -14.143
  155    HD3  ARG  19           1HD      ARG  19  -4.981 -12.307 -14.719
  156    HE   ARG  19           HE       ARG  19  -3.732 -11.040 -16.909
  157   HH11  ARG  19          1HH1      ARG  19  -3.174 -13.467 -14.522
  158   HH12  ARG  19          2HH1      ARG  19  -1.996 -14.288 -15.483
  159   HH21  ARG  19          1HH2      ARG  19  -2.219 -12.099 -18.120
  160   HH22  ARG  19          2HH2      ARG  19  -1.435 -13.507 -17.487
  161    HA   PRO  20           HA       PRO  20  -8.514  -6.983 -10.328
  162    HB2  PRO  20           2HB      PRO  20 -10.022  -8.956  -9.222
  163    HB3  PRO  20           1HB      PRO  20 -10.630  -7.883 -10.488
  164    HG2  PRO  20           2HG      PRO  20  -9.541 -10.671 -10.729
  165    HG3  PRO  20           1HG      PRO  20 -10.984  -9.967 -11.486
  166    HD2  PRO  20           2HD      PRO  20  -8.643 -10.251 -12.819
  167    HD3  PRO  20           1HD      PRO  20  -9.750  -8.899 -13.131
  168    H    GLU  21           H        GLU  21  -6.322  -9.349 -10.839
  169    HA   GLU  21           HA       GLU  21  -5.917 -10.677  -8.426
  170    HB2  GLU  21           2HB      GLU  21  -4.820 -11.103 -10.682
  171    HB3  GLU  21           1HB      GLU  21  -3.718  -9.789 -10.301
  172    HG2  GLU  21           2HG      GLU  21  -2.639 -11.858  -9.787
  173    HG3  GLU  21           1HG      GLU  21  -3.009 -11.034  -8.271
  174    H    ASP  22           H        ASP  22  -4.276  -7.700  -9.556
  175    HA   ASP  22           HA       ASP  22  -3.136  -7.223  -6.932
  176    HB2  ASP  22           2HB      ASP  22  -3.026  -5.589  -9.487
  177    HB3  ASP  22           1HB      ASP  22  -2.143  -5.204  -8.013
  178    H    LEU  23           H        LEU  23  -3.257  -4.687  -6.311
  179    HA   LEU  23           HA       LEU  23  -6.130  -4.125  -5.979
  180    HB2  LEU  23           2HB      LEU  23  -4.693  -4.364  -3.958
  181    HB3  LEU  23           1HB      LEU  23  -3.764  -2.973  -4.486
  182    HG   LEU  23           HG       LEU  23  -5.809  -1.568  -4.288
  183   HD11  LEU  23          1HD1      LEU  23  -7.494  -3.290  -4.618
  184   HD12  LEU  23          2HD1      LEU  23  -7.755  -2.447  -3.093
  185   HD13  LEU  23          3HD1      LEU  23  -7.035  -4.057  -3.099
  186   HD21  LEU  23          3HD2      LEU  23  -5.824  -1.470  -1.853
  187   HD22  LEU  23          1HD2      LEU  23  -4.184  -1.694  -2.458
  188   HD23  LEU  23          2HD2      LEU  23  -5.060  -3.059  -1.767
  189    H    GLU  24           H        GLU  24  -7.025  -2.601  -7.218
  190    HA   GLU  24           HA       GLU  24  -5.438  -0.754  -8.766
  191    HB2  GLU  24           2HB      GLU  24  -8.451  -0.714  -8.504
  192    HB3  GLU  24           1HB      GLU  24  -7.474  -0.114  -9.833
  193    HG2  GLU  24           2HG      GLU  24  -8.080  -2.033 -10.827
  194    HG3  GLU  24           1HG      GLU  24  -6.776  -2.729  -9.870
  195    H    LEU  25           H        LEU  25  -5.253   1.464  -8.497
  196    HA   LEU  25           HA       LEU  25  -6.262   2.540  -5.930
  197    HB2  LEU  25           2HB      LEU  25  -3.580   3.113  -7.201
  198    HB3  LEU  25           1HB      LEU  25  -4.155   3.732  -5.664
  199    HG   LEU  25           HG       LEU  25  -3.558   0.833  -6.286
  200   HD11  LEU  25          1HD1      LEU  25  -2.089   2.806  -4.538
  201   HD12  LEU  25          2HD1      LEU  25  -1.547   2.206  -6.107
  202   HD13  LEU  25          3HD1      LEU  25  -1.692   1.099  -4.741
  203   HD21  LEU  25          3HD2      LEU  25  -3.932   0.464  -3.885
  204   HD22  LEU  25          1HD2      LEU  25  -5.391   1.021  -4.704
  205   HD23  LEU  25          2HD2      LEU  25  -4.454   2.140  -3.715
  206    H    LEU  26           H        LEU  26  -7.066   4.589  -5.903
  207    HA   LEU  26           HA       LEU  26  -6.999   6.145  -8.424
  208    HB2  LEU  26           2HB      LEU  26  -9.288   5.675  -6.517
  209    HB3  LEU  26           1HB      LEU  26  -9.269   7.055  -7.592
  210    HG   LEU  26           HG       LEU  26 -10.656   5.313  -8.522
  211   HD11  LEU  26          1HD1      LEU  26  -9.627   5.058 -10.716
  212   HD12  LEU  26          2HD1      LEU  26  -8.061   5.524 -10.051
  213   HD13  LEU  26          3HD1      LEU  26  -9.386   6.689 -10.090
  214   HD21  LEU  26          3HD2      LEU  26  -9.803   3.126  -9.151
  215   HD22  LEU  26          1HD2      LEU  26  -9.639   3.379  -7.414
  216   HD23  LEU  26          2HD2      LEU  26  -8.228   3.519  -8.464
  217    HA   PRO  27           HA       PRO  27  -4.963   9.281  -6.158
  218    HB2  PRO  27           2HB      PRO  27  -6.005  11.562  -7.327
  219    HB3  PRO  27           1HB      PRO  27  -4.723  10.567  -8.025
  220    HG2  PRO  27           2HG      PRO  27  -7.659  10.563  -8.615
  221    HG3  PRO  27           1HG      PRO  27  -6.289  10.440  -9.737
  222    HD2  PRO  27           2HD      PRO  27  -7.699   8.273  -9.014
  223    HD3  PRO  27           1HD      PRO  27  -5.943   8.187  -9.260
  224    H    GLY  28           H        GLY  28  -5.629   9.272  -4.039
  225    HA2  GLY  28           2HA      GLY  28  -6.436  11.131  -2.553
  226    HA3  GLY  28           1HA      GLY  28  -7.961  10.995  -3.402
  227    H    ASP  29           H        ASP  29  -6.935   7.836  -3.027
  228    HA   ASP  29           HA       ASP  29  -8.563   7.597  -0.602
  229    HB2  ASP  29           2HB      ASP  29  -8.682   5.191  -1.075
  230    HB3  ASP  29           1HB      ASP  29  -9.237   6.158  -2.432
  231    H    VAL  30           H        VAL  30  -7.946   6.210   1.147
  232    HA   VAL  30           HA       VAL  30  -5.062   6.347   1.701
  233    HB   VAL  30           HB       VAL  30  -7.381   5.981   3.618
  234   HG11  VAL  30          1HG1      VAL  30  -5.367   4.913   4.469
  235   HG12  VAL  30          2HG1      VAL  30  -5.715   6.376   5.391
  236   HG13  VAL  30          3HG1      VAL  30  -4.436   6.383   4.174
  237   HG21  VAL  30          3HG2      VAL  30  -6.904   8.278   4.321
  238   HG22  VAL  30          1HG2      VAL  30  -7.336   8.208   2.611
  239   HG23  VAL  30          2HG2      VAL  30  -5.649   8.400   3.088
  240    H    LEU  31           H        LEU  31  -3.872   4.578   2.032
  241    HA   LEU  31           HA       LEU  31  -5.187   1.948   1.897
  242    HB2  LEU  31           2HB      LEU  31  -2.315   2.682   1.281
  243    HB3  LEU  31           1HB      LEU  31  -3.015   1.081   1.140
  244    HG   LEU  31           HG       LEU  31  -4.624   2.106  -0.578
  245   HD11  LEU  31          1HD1      LEU  31  -2.551   4.298  -0.537
  246   HD12  LEU  31          2HD1      LEU  31  -4.247   4.454  -0.077
  247   HD13  LEU  31          3HD1      LEU  31  -3.818   4.097  -1.749
  248   HD21  LEU  31          3HD2      LEU  31  -2.983   1.888  -2.385
  249   HD22  LEU  31          1HD2      LEU  31  -2.825   0.601  -1.191
  250   HD23  LEU  31          2HD2      LEU  31  -1.677   1.940  -1.200
  251    H    VAL  32           H        VAL  32  -5.442   1.058   3.840
  252    HA   VAL  32           HA       VAL  32  -3.609   1.730   6.022
  253    HB   VAL  32           HB       VAL  32  -6.208   0.174   6.082
  254   HG11  VAL  32          1HG1      VAL  32  -4.758  -0.440   7.937
  255   HG12  VAL  32          2HG1      VAL  32  -6.117   0.521   8.514
  256   HG13  VAL  32          3HG1      VAL  32  -4.525   1.260   8.346
  257   HG21  VAL  32          3HG2      VAL  32  -6.562   2.496   5.421
  258   HG22  VAL  32          1HG2      VAL  32  -5.638   3.055   6.816
  259   HG23  VAL  32          2HG2      VAL  32  -7.173   2.219   7.052
  260    H    VAL  33           H        VAL  33  -1.966   0.449   6.562
  261    HA   VAL  33           HA       VAL  33  -2.113  -2.450   5.976
  262    HB   VAL  33           HB       VAL  33   0.367  -0.720   5.747
  263   HG11  VAL  33          1HG1      VAL  33   0.886  -3.000   6.426
  264   HG12  VAL  33          2HG1      VAL  33   1.400  -2.728   4.760
  265   HG13  VAL  33          3HG1      VAL  33  -0.075  -3.639   5.091
  266   HG21  VAL  33          3HG2      VAL  33   0.205  -1.085   3.331
  267   HG22  VAL  33          1HG2      VAL  33  -1.218  -0.242   3.940
  268   HG23  VAL  33          2HG2      VAL  33  -1.309  -1.960   3.555
  269    H    SER  34           H        SER  34  -1.524  -3.811   7.616
  270    HA   SER  34           HA       SER  34  -0.767  -2.617  10.185
  271    HB2  SER  34           2HB      SER  34  -1.284  -4.805  11.152
  272    HB3  SER  34           1HB      SER  34  -2.614  -4.272  10.126
  273    HG   SER  34           HG       SER  34  -1.977  -5.697   8.552
  274    H    ARG  35           H        ARG  35   1.082  -3.261  11.398
  275    HA   ARG  35           HA       ARG  35   3.437  -3.641   9.930
  276    HB2  ARG  35           2HB      ARG  35   4.537  -4.115  12.137
  277    HB3  ARG  35           1HB      ARG  35   3.622  -2.617  12.074
  278    HG2  ARG  35           2HG      ARG  35   1.821  -3.604  13.341
  279    HG3  ARG  35           1HG      ARG  35   2.597  -5.188  13.283
  280    HD2  ARG  35           2HD      ARG  35   4.300  -4.544  14.751
  281    HD3  ARG  35           1HD      ARG  35   4.024  -2.827  14.469
  282    HE   ARG  35           HE       ARG  35   1.718  -3.770  15.650
  283   HH11  ARG  35          1HH1      ARG  35   5.058  -3.700  16.497
  284   HH12  ARG  35          2HH1      ARG  35   4.742  -3.459  18.180
  285   HH21  ARG  35          1HH2      ARG  35   1.324  -3.406  17.826
  286   HH22  ARG  35          2HH2      ARG  35   2.658  -3.308  18.925
  287    H    ALA  36           H        ALA  36   1.264  -6.004  11.308
  288    HA   ALA  36           HA       ALA  36   2.867  -8.277  11.377
  289    HB1  ALA  36           3HB      ALA  36   0.825  -9.569  11.194
  290    HB2  ALA  36           1HB      ALA  36  -0.041  -8.168  10.561
  291    HB3  ALA  36           2HB      ALA  36   0.548  -8.164  12.223
  292    H    ALA  37           H        ALA  37   1.178  -6.815   8.628
  293    HA   ALA  37           HA       ALA  37   1.813  -8.810   6.711
  294    HB1  ALA  37           3HB      ALA  37   1.137  -7.169   5.049
  295    HB2  ALA  37           1HB      ALA  37   1.224  -5.881   6.253
  296    HB3  ALA  37           2HB      ALA  37   0.016  -7.156   6.410
  297    H    LEU  38           H        LEU  38   3.384  -5.730   7.557
  298    HA   LEU  38           HA       LEU  38   5.458  -5.796   5.665
  299    HB2  LEU  38           2HB      LEU  38   5.483  -4.618   8.451
  300    HB3  LEU  38           1HB      LEU  38   6.639  -4.246   7.184
  301    HG   LEU  38           HG       LEU  38   3.678  -3.630   7.090
  302   HD11  LEU  38          1HD1      LEU  38   4.858  -2.237   8.710
  303   HD12  LEU  38          2HD1      LEU  38   4.368  -1.292   7.304
  304   HD13  LEU  38          3HD1      LEU  38   6.048  -1.798   7.483
  305   HD21  LEU  38          3HD2      LEU  38   5.889  -2.903   5.158
  306   HD22  LEU  38          1HD2      LEU  38   4.213  -2.363   5.065
  307   HD23  LEU  38          2HD2      LEU  38   4.599  -4.070   4.867
  308    H    GLN  39           H        GLN  39   5.322  -7.100   8.972
  309    HA   GLN  39           HA       GLN  39   7.940  -8.126   9.094
  310    HB2  GLN  39           2HB      GLN  39   5.425  -9.159  10.436
  311    HB3  GLN  39           1HB      GLN  39   7.064  -9.628  10.868
  312    HG2  GLN  39           2HG      GLN  39   5.906  -6.852  11.079
  313    HG3  GLN  39           1HG      GLN  39   6.168  -7.971  12.414
  314   HE21  GLN  39          1HE2      GLN  39   8.288  -8.399  13.074
  315   HE22  GLN  39          2HE2      GLN  39   9.593  -7.342  12.682
  316    H    ALA  40           H        ALA  40   4.939  -9.547   7.852
  317    HA   ALA  40           HA       ALA  40   5.938 -12.127   7.269
  318    HB1  ALA  40           3HB      ALA  40   3.991 -12.347   5.803
  319    HB2  ALA  40           1HB      ALA  40   3.705 -10.610   5.910
  320    HB3  ALA  40           2HB      ALA  40   3.547 -11.620   7.348
  321    H    LEU  41           H        LEU  41   5.728  -9.188   5.276
  322    HA   LEU  41           HA       LEU  41   6.926 -10.262   2.944
  323    HB2  LEU  41           2HB      LEU  41   6.907  -7.404   3.938
  324    HB3  LEU  41           1HB      LEU  41   7.291  -7.910   2.302
  325    HG   LEU  41           HG       LEU  41   4.600  -8.252   3.643
  326   HD11  LEU  41          1HD1      LEU  41   5.507  -6.288   1.537
  327   HD12  LEU  41          2HD1      LEU  41   5.082  -5.910   3.207
  328   HD13  LEU  41          3HD1      LEU  41   3.849  -6.502   2.097
  329   HD21  LEU  41          3HD2      LEU  41   5.028  -9.996   1.992
  330   HD22  LEU  41          1HD2      LEU  41   5.467  -8.776   0.794
  331   HD23  LEU  41          2HD2      LEU  41   3.811  -8.864   1.400
  332    H    GLY  42           H        GLY  42   8.223  -9.150   5.952
  333    HA2  GLY  42           2HA      GLY  42  10.370  -9.547   6.778
  334    HA3  GLY  42           1HA      GLY  42  10.905  -9.954   5.156
  335    H    VAL  43           H        VAL  43   9.174  -6.977   5.580
  336    HA   VAL  43           HA       VAL  43  11.314  -5.418   4.554
  337    HB   VAL  43           HB       VAL  43   8.829  -4.455   6.003
  338   HG11  VAL  43          1HG1      VAL  43  10.571  -2.732   5.865
  339   HG12  VAL  43          2HG1      VAL  43   9.203  -2.333   4.828
  340   HG13  VAL  43          3HG1      VAL  43  10.688  -2.976   4.125
  341   HG21  VAL  43          3HG2      VAL  43   7.886  -4.149   3.735
  342   HG22  VAL  43          1HG2      VAL  43   8.231  -5.841   4.096
  343   HG23  VAL  43          2HG2      VAL  43   9.319  -4.922   3.054
  344    H    ALA  44           H        ALA  44  13.015  -4.543   5.569
  345    HA   ALA  44           HA       ALA  44  13.484  -4.926   8.341
  346    HB1  ALA  44           3HB      ALA  44  15.303  -4.850   6.714
  347    HB2  ALA  44           1HB      ALA  44  15.540  -3.641   7.975
  348    HB3  ALA  44           2HB      ALA  44  14.954  -3.155   6.385
  349    H    GLU  45           H        GLU  45  13.064  -3.663  10.065
  350    HA   GLU  45           HA       GLU  45  11.334  -1.481   9.972
  351    HB2  GLU  45           2HB      GLU  45  12.102  -1.031  12.333
  352    HB3  GLU  45           1HB      GLU  45  11.534  -2.664  12.025
  353    HG2  GLU  45           2HG      GLU  45  13.851  -3.445  11.877
  354    HG3  GLU  45           1HG      GLU  45  14.421  -1.804  12.180
  355    H    GLY  46           H        GLY  46  11.562   0.642   9.616
  356    HA2  GLY  46           2HA      GLY  46  12.767   2.709   9.532
  357    HA3  GLY  46           1HA      GLY  46  14.273   1.802   9.460
  358    H    GLY  47           H        GLY  47  12.340   0.160   7.444
  359    HA2  GLY  47           2HA      GLY  47  13.048   1.807   5.085
  360    HA3  GLY  47           1HA      GLY  47  12.985   0.054   5.084
  361    H    GLU  48           H        GLU  48  10.418   0.767   6.882
  362    HA   GLU  48           HA       GLU  48   8.541   0.180   4.818
  363    HB2  GLU  48           2HB      GLU  48   6.853   0.270   6.543
  364    HB3  GLU  48           1HB      GLU  48   8.268  -0.563   7.165
  365    HG2  GLU  48           2HG      GLU  48   7.582   2.322   7.730
  366    HG3  GLU  48           1HG      GLU  48   7.213   0.971   8.797
  367    H    ARG  49           H        ARG  49   9.772   3.136   6.103
  368    HA   ARG  49           HA       ARG  49   7.644   4.859   5.298
  369    HB2  ARG  49           2HB      ARG  49  10.575   5.465   5.739
  370    HB3  ARG  49           1HB      ARG  49   9.314   6.676   5.546
  371    HG2  ARG  49           2HG      ARG  49   8.213   5.816   7.581
  372    HG3  ARG  49           1HG      ARG  49   9.536   4.665   7.783
  373    HD2  ARG  49           2HD      ARG  49   9.848   6.628   9.207
  374    HD3  ARG  49           1HD      ARG  49  11.122   6.512   7.995
  375    HE   ARG  49           HE       ARG  49   9.185   8.151   6.911
  376   HH11  ARG  49          1HH1      ARG  49  11.249   8.218   9.671
  377   HH12  ARG  49          2HH1      ARG  49  11.308   9.943   9.706
  378   HH21  ARG  49          1HH2      ARG  49   9.268  10.356   6.984
  379   HH22  ARG  49          2HH2      ARG  49  10.193  11.135   8.222
  380    H    CYS  50           H        CYS  50   9.940   3.129   3.495
  381    HA   CYS  50           HA       CYS  50   9.580   4.912   1.162
  382    HB2  CYS  50           2HB      CYS  50  11.940   3.099   1.733
  383    HB3  CYS  50           1HB      CYS  50  11.757   4.148   0.332
  384    HG   CYS  50           HG       CYS  50  13.553   4.950   2.619
  385    HA   PRO  51           HA       PRO  51   7.428   0.922   0.156
  386    HB2  PRO  51           2HB      PRO  51   5.644   2.094  -1.573
  387    HB3  PRO  51           1HB      PRO  51   5.382   1.944   0.169
  388    HG2  PRO  51           2HG      PRO  51   6.384   4.297  -1.400
  389    HG3  PRO  51           1HG      PRO  51   5.205   4.257  -0.074
  390    HD2  PRO  51           2HD      PRO  51   7.759   5.005   0.334
  391    HD3  PRO  51           1HD      PRO  51   6.854   4.085   1.555
  392    H    GLN  52           H        GLN  52   8.775   3.438  -1.898
  393    HA   GLN  52           HA       GLN  52   8.751   1.996  -4.348
  394    HB2  GLN  52           2HB      GLN  52  10.637   4.216  -3.502
  395    HB3  GLN  52           1HB      GLN  52  10.379   3.653  -5.146
  396    HG2  GLN  52           2HG      GLN  52   9.046   5.486  -5.178
  397    HG3  GLN  52           1HG      GLN  52   7.872   4.309  -4.598
  398   HE21  GLN  52          1HE2      GLN  52   7.920   7.188  -4.243
  399   HE22  GLN  52          2HE2      GLN  52   7.912   7.466  -2.539
  400    H    SER  53           H        SER  53  10.693   1.731  -1.538
  401    HA   SER  53           HA       SER  53  12.915   0.411  -2.876
  402    HB2  SER  53           2HB      SER  53  12.335   0.765   0.082
  403    HB3  SER  53           1HB      SER  53  13.830   0.123  -0.598
  404    HG   SER  53           HG       SER  53  14.438   2.129  -0.637
  405    H    VAL  54           H        VAL  54   9.949  -0.471  -1.320
  406    HA   VAL  54           HA       VAL  54  10.731  -3.244  -0.895
  407    HB   VAL  54           HB       VAL  54   8.032  -1.928  -0.495
  408   HG11  VAL  54          1HG1      VAL  54   9.097  -4.595   0.446
  409   HG12  VAL  54          2HG1      VAL  54   7.831  -4.333  -0.756
  410   HG13  VAL  54          3HG1      VAL  54   7.554  -3.889   0.929
  411   HG21  VAL  54          3HG2      VAL  54   9.722  -0.903   0.932
  412   HG22  VAL  54          1HG2      VAL  54  10.228  -2.493   1.505
  413   HG23  VAL  54          2HG2      VAL  54   8.618  -1.884   1.894
  414    H    GLY  55           H        GLY  55   8.193  -1.549  -2.768
  415    HA2  GLY  55           2HA      GLY  55   7.976  -2.214  -5.155
  416    HA3  GLY  55           1HA      GLY  55   8.125  -3.879  -4.609
  417    H    TRP  56           H        TRP  56   6.343  -4.898  -3.633
  418    HA   TRP  56           HA       TRP  56   3.813  -3.381  -3.725
  419    HB2  TRP  56           2HB      TRP  56   2.737  -5.668  -4.232
  420    HB3  TRP  56           1HB      TRP  56   3.591  -4.855  -5.533
  421    HD1  TRP  56           HD1      TRP  56   5.249  -7.067  -2.806
  422    HE1  TRP  56           HE1      TRP  56   6.408  -9.038  -3.979
  423    HE3  TRP  56           HE3      TRP  56   3.707  -6.183  -7.600
  424    HZ2  TRP  56           HZ2      TRP  56   6.632 -10.090  -6.579
  425    HZ3  TRP  56           HZ3      TRP  56   4.436  -7.727  -9.373
  426    HH2  TRP  56           HH2      TRP  56   5.870  -9.640  -8.871
  427    H    MET  57           H        MET  57   2.372  -3.608  -2.057
  428    HA   MET  57           HA       MET  57   2.955  -5.577   0.049
  429    HB2  MET  57           2HB      MET  57   2.390  -2.651   0.607
  430    HB3  MET  57           1HB      MET  57   2.590  -3.910   1.817
  431    HG2  MET  57           2HG      MET  57   4.623  -2.770   1.802
  432    HG3  MET  57           1HG      MET  57   4.931  -4.231   0.865
  433    HE1  MET  57           3HE      MET  57   4.292  -0.383   0.775
  434    HE2  MET  57           1HE      MET  57   2.999  -0.964  -0.277
  435    HE3  MET  57           2HE      MET  57   4.332  -0.030  -0.954
  436    HA   PRO  58           HA       PRO  58  -1.522  -5.939  -0.013
  437    HB2  PRO  58           2HB      PRO  58  -1.899  -7.431   2.194
  438    HB3  PRO  58           1HB      PRO  58  -1.135  -8.089   0.739
  439    HG2  PRO  58           2HG      PRO  58   0.141  -7.103   3.268
  440    HG3  PRO  58           1HG      PRO  58   0.519  -8.552   2.317
  441    HD2  PRO  58           2HD      PRO  58   1.940  -6.206   2.164
  442    HD3  PRO  58           1HD      PRO  58   1.827  -7.381   0.836
  443    H    GLY  59           H        GLY  59  -2.992  -4.417   0.542
  444    HA2  GLY  59           2HA      GLY  59  -3.180  -3.491   3.311
  445    HA3  GLY  59           1HA      GLY  59  -2.787  -2.271   2.111
  446    H    LEU  60           H        LEU  60  -4.962  -1.783   3.518
  447    HA   LEU  60           HA       LEU  60  -7.312  -2.816   2.095
  448    HB2  LEU  60           2HB      LEU  60  -7.311  -2.849   4.559
  449    HB3  LEU  60           1HB      LEU  60  -7.105  -1.108   4.583
  450    HG   LEU  60           HG       LEU  60  -9.326  -0.882   3.442
  451   HD11  LEU  60          1HD1      LEU  60  -9.538  -3.844   3.989
  452   HD12  LEU  60          2HD1      LEU  60  -9.436  -3.082   2.401
  453   HD13  LEU  60          3HD1      LEU  60 -10.842  -2.798   3.425
  454   HD21  LEU  60          3HD2      LEU  60  -9.339  -2.340   6.087
  455   HD22  LEU  60          1HD2      LEU  60 -10.660  -1.369   5.437
  456   HD23  LEU  60          2HD2      LEU  60  -9.127  -0.604   5.857
  457    H    ASN  61           H        ASN  61  -8.084  -1.690   0.413
  458    HA   ASN  61           HA       ASN  61  -7.538   1.173   0.134
  459    HB2  ASN  61           2HB      ASN  61  -7.231  -0.209  -1.847
  460    HB3  ASN  61           1HB      ASN  61  -8.883  -0.813  -1.724
  461   HD21  ASN  61          1HD2      ASN  61  -6.882   1.897  -2.577
  462   HD22  ASN  61          2HD2      ASN  61  -8.107   2.793  -3.394
  463    H    GLU  62           H        GLU  62  -8.968   2.700   0.779
  464    HA   GLU  62           HA       GLU  62 -11.401   1.871   2.029
  465    HB2  GLU  62           2HB      GLU  62 -10.334   4.654   1.549
  466    HB3  GLU  62           1HB      GLU  62 -11.720   4.267   2.561
  467    HG2  GLU  62           2HG      GLU  62 -10.114   2.765   3.874
  468    HG3  GLU  62           1HG      GLU  62  -8.825   3.609   3.018
  469    H    ARG  63           H        ARG  63 -10.837   2.621  -1.240
  470    HA   ARG  63           HA       ARG  63 -13.463   3.763  -1.725
  471    HB2  ARG  63           2HB      ARG  63 -11.471   2.673  -3.729
  472    HB3  ARG  63           1HB      ARG  63 -12.929   3.573  -4.118
  473    HG2  ARG  63           2HG      ARG  63 -11.938   5.462  -2.720
  474    HG3  ARG  63           1HG      ARG  63 -10.423   4.558  -2.793
  475    HD2  ARG  63           2HD      ARG  63 -10.720   4.537  -5.313
  476    HD3  ARG  63           1HD      ARG  63 -12.011   5.714  -5.079
  477    HE   ARG  63           HE       ARG  63  -9.160   6.131  -4.517
  478   HH11  ARG  63          1HH1      ARG  63 -12.339   7.441  -4.866
  479   HH12  ARG  63          2HH1      ARG  63 -11.752   9.058  -5.055
  480   HH21  ARG  63          1HH2      ARG  63  -8.447   8.197  -4.790
  481   HH22  ARG  63          2HH2      ARG  63  -9.587   9.482  -5.010
  482    H    THR  64           H        THR  64 -11.893   0.672  -2.611
  483    HA   THR  64           HA       THR  64 -14.482  -0.539  -3.191
  484    HB   THR  64           HB       THR  64 -13.158  -2.583  -3.717
  485    HG1  THR  64           HG1      THR  64 -10.763  -2.061  -3.855
  486   HG21  THR  64          3HG2      THR  64 -12.167  -0.050  -5.046
  487   HG22  THR  64          1HG2      THR  64 -13.613  -0.960  -5.488
  488   HG23  THR  64          2HG2      THR  64 -12.017  -1.680  -5.705
  489    H    ARG  65           H        ARG  65 -12.541  -0.097  -0.472
  490    HA   ARG  65           HA       ARG  65 -12.575  -0.839   1.664
  491    HB2  ARG  65           2HB      ARG  65 -15.225  -2.079   0.878
  492    HB3  ARG  65           1HB      ARG  65 -14.619  -1.964   2.521
  493    HG2  ARG  65           2HG      ARG  65 -16.019  -0.157   2.471
  494    HG3  ARG  65           1HG      ARG  65 -14.509   0.609   1.978
  495    HD2  ARG  65           2HD      ARG  65 -16.395   1.317   0.571
  496    HD3  ARG  65           1HD      ARG  65 -15.175   0.452  -0.366
  497    HE   ARG  65           HE       ARG  65 -17.240  -1.276   0.587
  498   HH11  ARG  65          1HH1      ARG  65 -16.473   0.977  -1.907
  499   HH12  ARG  65          2HH1      ARG  65 -17.584   0.271  -3.028
  500   HH21  ARG  65          1HH2      ARG  65 -18.640  -2.167  -0.846
  501   HH22  ARG  65          2HH2      ARG  65 -18.783  -1.513  -2.443
  502    H    GLN  66           H        GLN  66 -11.610  -2.588  -0.659
  503    HA   GLN  66           HA       GLN  66 -11.647  -5.210   0.697
  504    HB2  GLN  66           2HB      GLN  66 -10.821  -4.641  -2.160
  505    HB3  GLN  66           1HB      GLN  66 -11.112  -6.213  -1.431
  506    HG2  GLN  66           2HG      GLN  66 -13.190  -4.088  -1.930
  507    HG3  GLN  66           1HG      GLN  66 -12.938  -5.536  -2.899
  508   HE21  GLN  66          1HE2      GLN  66 -15.299  -4.621  -1.425
  509   HE22  GLN  66          2HE2      GLN  66 -15.705  -5.913  -0.352
  510    H    ARG  67           H        ARG  67  -9.695  -6.403   0.919
  511    HA   ARG  67           HA       ARG  67  -7.271  -4.743   1.022
  512    HB2  ARG  67           2HB      ARG  67  -6.420  -6.942   2.246
  513    HB3  ARG  67           1HB      ARG  67  -7.363  -5.725   3.093
  514    HG2  ARG  67           2HG      ARG  67  -9.247  -7.040   3.189
  515    HG3  ARG  67           1HG      ARG  67  -8.801  -7.975   1.763
  516    HD2  ARG  67           2HD      ARG  67  -7.257  -8.159   4.343
  517    HD3  ARG  67           1HD      ARG  67  -8.673  -9.159   4.025
  518    HE   ARG  67           HE       ARG  67  -6.054  -9.437   2.867
  519   HH11  ARG  67          1HH1      ARG  67  -9.407 -10.158   2.503
  520   HH12  ARG  67          2HH1      ARG  67  -9.117 -11.470   1.413
  521   HH21  ARG  67          1HH2      ARG  67  -5.707 -11.164   1.504
  522   HH22  ARG  67          2HH2      ARG  67  -7.060 -12.033   0.863
  523    H    GLY  68           H        GLY  68  -5.605  -5.021  -0.331
  524    HA2  GLY  68           2HA      GLY  68  -5.152  -7.556  -1.687
  525    HA3  GLY  68           1HA      GLY  68  -5.664  -6.242  -2.733
  526    H    ASP  69           H        ASP  69  -3.316  -7.300  -3.361
  527    HA   ASP  69           HA       ASP  69  -1.140  -5.910  -2.012
  528    HB2  ASP  69           2HB      ASP  69  -1.024  -7.716  -4.447
  529    HB3  ASP  69           1HB      ASP  69   0.328  -7.232  -3.422
  530    H    PHE  70           H        PHE  70  -0.495  -3.933  -2.598
  531    HA   PHE  70           HA       PHE  70  -1.126  -2.975  -5.325
  532    HB2  PHE  70           2HB      PHE  70  -1.366  -0.719  -4.371
  533    HB3  PHE  70           1HB      PHE  70  -2.489  -1.850  -3.629
  534    HD1  PHE  70           HD2      PHE  70   0.548   0.160  -3.101
  535    HD2  PHE  70           HD1      PHE  70  -2.309  -2.439  -1.293
  536    HE1  PHE  70           HE2      PHE  70   1.369   0.807  -0.875
  537    HE2  PHE  70           HE1      PHE  70  -1.488  -1.790   0.933
  538    HZ   PHE  70           HZ       PHE  70   0.351  -0.166   1.145
  539    HA   PRO  71           HA       PRO  71   3.232  -1.946  -5.758
  540    HB2  PRO  71           2HB      PRO  71   3.063  -0.126  -7.764
  541    HB3  PRO  71           1HB      PRO  71   2.841  -1.859  -8.032
  542    HG2  PRO  71           2HG      PRO  71   0.775   0.289  -7.728
  543    HG3  PRO  71           1HG      PRO  71   0.824  -1.058  -8.878
  544    HD2  PRO  71           2HD      PRO  71  -0.691  -1.090  -6.611
  545    HD3  PRO  71           1HD      PRO  71  -0.017  -2.560  -7.347
  546    H    GLY  72           H        GLY  72   4.082  -0.826  -4.089
  547    HA2  GLY  72           2HA      GLY  72   2.899   1.428  -2.889
  548    HA3  GLY  72           1HA      GLY  72   4.508   0.824  -2.562
  549    H    THR  73           H        THR  73   5.022   1.341  -5.613
  550    HA   THR  73           HA       THR  73   6.361   3.807  -5.210
  551    HB   THR  73           HB       THR  73   7.148   2.135  -6.835
  552    HG1  THR  73           HG1      THR  73   7.907   3.641  -8.224
  553   HG21  THR  73          3HG2      THR  73   4.772   3.006  -8.494
  554   HG22  THR  73          1HG2      THR  73   5.017   1.413  -7.777
  555   HG23  THR  73          2HG2      THR  73   6.090   1.979  -9.056
  556    H    TYR  74           H        TYR  74   3.099   3.197  -6.012
  557    HA   TYR  74           HA       TYR  74   2.739   5.840  -7.257
  558    HB2  TYR  74           2HB      TYR  74   0.794   3.536  -6.968
  559    HB3  TYR  74           1HB      TYR  74   0.444   5.058  -7.779
  560    HD1  TYR  74           HD2      TYR  74   1.641   5.629  -9.906
  561    HD2  TYR  74           HD1      TYR  74   2.018   1.804  -8.072
  562    HE1  TYR  74           HE2      TYR  74   2.528   4.713 -12.009
  563    HE2  TYR  74           HE1      TYR  74   2.900   0.881 -10.172
  564    HH   TYR  74           HH       TYR  74   2.925   1.330 -12.514
  565    H    VAL  75           H        VAL  75   2.874   4.772  -4.180
  566    HA   VAL  75           HA       VAL  75   0.715   6.588  -3.286
  567    HB   VAL  75           HB       VAL  75   0.358   5.212  -1.302
  568   HG11  VAL  75          1HG1      VAL  75   0.176   3.609  -3.855
  569   HG12  VAL  75          2HG1      VAL  75  -1.017   4.760  -3.259
  570   HG13  VAL  75          3HG1      VAL  75  -0.707   3.272  -2.367
  571   HG21  VAL  75          3HG2      VAL  75   2.612   4.272  -1.073
  572   HG22  VAL  75          1HG2      VAL  75   2.349   3.284  -2.511
  573   HG23  VAL  75          2HG2      VAL  75   1.386   3.004  -1.060
  574    H    GLU  76           H        GLU  76   1.082   7.792  -1.365
  575    HA   GLU  76           HA       GLU  76   3.926   8.179  -0.707
  576    HB2  GLU  76           2HB      GLU  76   3.294  10.323   0.210
  577    HB3  GLU  76           1HB      GLU  76   2.596  10.161  -1.396
  578    HG2  GLU  76           2HG      GLU  76   0.424   9.693  -0.464
  579    HG3  GLU  76           1HG      GLU  76   1.088   9.668   1.168
  580    H    PHE  77           H        PHE  77   4.610   8.373   1.515
  581    HA   PHE  77           HA       PHE  77   3.132   6.610   3.312
  582    HB2  PHE  77           2HB      PHE  77   5.540   6.241   3.058
  583    HB3  PHE  77           1HB      PHE  77   5.870   7.884   3.596
  584    HD1  PHE  77           HD2      PHE  77   4.474   4.622   4.684
  585    HD2  PHE  77           HD1      PHE  77   6.071   8.385   5.891
  586    HE1  PHE  77           HE2      PHE  77   4.578   3.831   7.010
  587    HE2  PHE  77           HE1      PHE  77   6.177   7.595   8.216
  588    HZ   PHE  77           HZ       PHE  77   5.428   5.317   8.780
  589    H    LEU  78           H        LEU  78   1.632   7.464   4.608
  590    HA   LEU  78           HA       LEU  78   1.667  10.282   5.314
  591    HB2  LEU  78           2HB      LEU  78  -0.292   8.109   6.088
  592    HB3  LEU  78           1HB      LEU  78  -0.521   9.832   6.333
  593    HG   LEU  78           HG       LEU  78  -0.349   8.431   3.657
  594   HD11  LEU  78          1HD1      LEU  78  -2.702   9.697   5.066
  595   HD12  LEU  78          2HD1      LEU  78  -2.438   7.967   4.836
  596   HD13  LEU  78          3HD1      LEU  78  -2.712   9.010   3.440
  597   HD21  LEU  78          3HD2      LEU  78   0.592  10.684   3.558
  598   HD22  LEU  78          1HD2      LEU  78  -0.871  11.336   4.299
  599   HD23  LEU  78          2HD2      LEU  78  -0.946  10.598   2.699
  600    H    GLY  79           H        GLY  79   1.326   7.275   7.233
  601    HA2  GLY  79           2HA      GLY  79   3.274   7.566   9.102
  602    HA3  GLY  79           1HA      GLY  79   2.027   8.663   9.677
  603    HA   PRO  80           HA       PRO  80   1.038   4.521  11.496
  604    HB2  PRO  80           2HB      PRO  80   0.411   5.391  13.976
  605    HB3  PRO  80           1HB      PRO  80   2.084   5.139  13.462
  606    HG2  PRO  80           2HG      PRO  80   0.521   7.693  13.635
  607    HG3  PRO  80           1HG      PRO  80   2.194   7.370  14.130
  608    HD2  PRO  80           2HD      PRO  80   1.529   8.585  11.770
  609    HD3  PRO  80           1HD      PRO  80   3.005   7.624  11.989
  610    H    LEU  81           H        LEU  81  -0.988   3.588  12.020
  611    HA   LEU  81           HA       LEU  81  -3.276   5.178  11.150
  612    HB2  LEU  81           2HB      LEU  81  -4.463   2.925  11.198
  613    HB3  LEU  81           1HB      LEU  81  -3.208   3.161  10.002
  614    HG   LEU  81           HG       LEU  81  -1.638   1.888  11.497
  615   HD11  LEU  81          1HD1      LEU  81  -2.806   2.155  13.628
  616   HD12  LEU  81          2HD1      LEU  81  -2.583   0.453  13.234
  617   HD13  LEU  81          3HD1      LEU  81  -4.161   1.208  13.014
  618   HD21  LEU  81          3HD2      LEU  81  -4.105   0.441  10.543
  619   HD22  LEU  81          1HD2      LEU  81  -2.548  -0.306  10.896
  620   HD23  LEU  81          2HD2      LEU  81  -2.692   0.849   9.572
  621    H    GLU  82           H        GLU  82  -5.366   4.978  12.217
  622    HA   GLU  82           HA       GLU  82  -5.069   5.145  15.122
  623    HB2  GLU  82           2HB      GLU  82  -7.228   6.293  15.151
  624    HB3  GLU  82           1HB      GLU  82  -6.103   7.079  14.061
  625    HG2  GLU  82           2HG      GLU  82  -8.321   5.228  13.196
  626    HG3  GLU  82           1HG      GLU  82  -8.431   6.984  13.222
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1  -9.487   3.961  18.808
    2    H2   MET   1           2H       MET   1  -9.702   4.803  20.255
    3    H3   MET   1           3H       MET   1  -9.917   3.128  20.216
    4    HA   MET   1           HA       MET   1  -7.381   4.597  19.810
    5    HB2  MET   1           2HB      MET   1  -8.386   2.852  22.064
    6    HB3  MET   1           1HB      MET   1  -6.698   3.314  21.884
    7    HG2  MET   1           2HG      MET   1  -9.015   5.203  22.260
    8    HG3  MET   1           1HG      MET   1  -7.839   4.736  23.489
    9    HE1  MET   1           3HE      MET   1  -6.889   8.476  22.742
   10    HE2  MET   1           1HE      MET   1  -7.317   7.309  23.993
   11    HE3  MET   1           2HE      MET   1  -8.508   7.775  22.779
   12    H    ALA   2           H        ALA   2  -6.512   3.639  18.065
   13    HA   ALA   2           HA       ALA   2  -6.187   0.697  18.095
   14    HB1  ALA   2           3HB      ALA   2  -6.289   2.536  15.692
   15    HB2  ALA   2           1HB      ALA   2  -7.573   1.444  16.214
   16    HB3  ALA   2           2HB      ALA   2  -6.036   0.790  15.647
   17    H    GLY   3           H        GLY   3  -4.635   3.542  16.567
   18    HA2  GLY   3           2HA      GLY   3  -2.469   4.311  16.709
   19    HA3  GLY   3           1HA      GLY   3  -2.176   3.141  17.976
   20    HA   PRO   4           HA       PRO   4   0.688   1.696  14.853
   21    HB2  PRO   4           2HB      PRO   4   1.471  -0.345  16.820
   22    HB3  PRO   4           1HB      PRO   4   2.410   0.997  16.160
   23    HG2  PRO   4           2HG      PRO   4   1.557   0.980  18.712
   24    HG3  PRO   4           1HG      PRO   4   1.670   2.480  17.769
   25    HD2  PRO   4           2HD      PRO   4  -0.751   0.798  18.365
   26    HD3  PRO   4           1HD      PRO   4  -0.559   2.564  18.443
   27    H    GLU   5           H        GLU   5  -2.123   0.364  15.116
   28    HA   GLU   5           HA       GLU   5  -1.896  -2.397  14.707
   29    HB2  GLU   5           2HB      GLU   5  -3.902  -0.438  13.559
   30    HB3  GLU   5           1HB      GLU   5  -4.076  -2.186  13.487
   31    HG2  GLU   5           2HG      GLU   5  -3.912  -0.569  16.027
   32    HG3  GLU   5           1HG      GLU   5  -5.404  -1.147  15.288
   33    H    GLY   6           H        GLY   6  -1.329   0.279  12.534
   34    HA2  GLY   6           2HA      GLY   6   0.195  -1.294  10.726
   35    HA3  GLY   6           1HA      GLY   6  -1.393  -0.963  10.045
   36    H    PHE   7           H        PHE   7   0.076   0.087   8.412
   37    HA   PHE   7           HA       PHE   7   0.489   2.916   9.129
   38    HB2  PHE   7           2HB      PHE   7   2.246   1.219   7.334
   39    HB3  PHE   7           1HB      PHE   7   2.420   2.954   7.569
   40    HD1  PHE   7           HD2      PHE   7   2.867  -0.350   9.088
   41    HD2  PHE   7           HD1      PHE   7   3.337   3.852   9.635
   42    HE1  PHE   7           HE2      PHE   7   4.316  -0.768  11.030
   43    HE2  PHE   7           HE1      PHE   7   4.790   3.437  11.578
   44    HZ   PHE   7           HZ       PHE   7   5.280   1.124  12.277
   45    H    GLN   8           H        GLN   8  -0.345   4.391   7.743
   46    HA   GLN   8           HA       GLN   8  -1.893   3.383   5.466
   47    HB2  GLN   8           2HB      GLN   8  -2.006   5.989   6.991
   48    HB3  GLN   8           1HB      GLN   8  -2.946   5.680   5.538
   49    HG2  GLN   8           2HG      GLN   8  -4.097   3.852   6.625
   50    HG3  GLN   8           1HG      GLN   8  -3.104   4.048   8.068
   51   HE21  GLN   8          1HE2      GLN   8  -6.013   4.209   7.728
   52   HE22  GLN   8          2HE2      GLN   8  -6.464   5.769   8.310
   53    H    TYR   9           H        TYR   9  -1.493   3.878   3.411
   54    HA   TYR   9           HA       TYR   9   0.575   5.889   2.763
   55    HB2  TYR   9           2HB      TYR   9  -0.336   3.481   1.158
   56    HB3  TYR   9           1HB      TYR   9   0.881   4.642   0.640
   57    HD1  TYR   9           HD1      TYR   9   0.165   1.842   2.910
   58    HD2  TYR   9           HD2      TYR   9   3.118   4.618   1.599
   59    HE1  TYR   9           HE1      TYR   9   1.908   0.492   3.996
   60    HE2  TYR   9           HE2      TYR   9   4.869   3.274   2.685
   61    HH   TYR   9           HH       TYR   9   4.353   0.116   3.774
   62    H    ARG  10           H        ARG  10   0.185   6.935   0.513
   63    HA   ARG  10           HA       ARG  10  -2.718   7.436   0.159
   64    HB2  ARG  10           2HB      ARG  10  -1.294   9.365   1.057
   65    HB3  ARG  10           1HB      ARG  10  -0.549   9.422  -0.535
   66    HG2  ARG  10           2HG      ARG  10  -3.002   9.594  -1.394
   67    HG3  ARG  10           1HG      ARG  10  -3.360  10.070   0.265
   68    HD2  ARG  10           2HD      ARG  10  -1.561  11.445  -1.723
   69    HD3  ARG  10           1HD      ARG  10  -3.030  12.066  -0.974
   70    HE   ARG  10           HE       ARG  10  -0.413  11.770   0.323
   71   HH11  ARG  10          1HH1      ARG  10  -3.626  13.012   0.356
   72   HH12  ARG  10          2HH1      ARG  10  -3.313  14.081   1.680
   73   HH21  ARG  10          1HH2      ARG  10  -0.011  13.167   2.000
   74   HH22  ARG  10          2HH2      ARG  10  -1.282  14.177   2.593
   75    H    ALA  11           H        ALA  11  -3.546   6.909  -1.778
   76    HA   ALA  11           HA       ALA  11  -1.857   6.235  -4.030
   77    HB1  ALA  11           3HB      ALA  11  -3.876   4.941  -3.615
   78    HB2  ALA  11           1HB      ALA  11  -3.976   5.744  -5.182
   79    HB3  ALA  11           2HB      ALA  11  -4.868   6.386  -3.801
   80    H    LEU  12           H        LEU  12  -1.067   7.728  -5.385
   81    HA   LEU  12           HA       LEU  12  -1.967  10.445  -5.304
   82    HB2  LEU  12           2HB      LEU  12   0.008   9.138  -7.179
   83    HB3  LEU  12           1HB      LEU  12  -0.202  10.864  -6.947
   84    HG   LEU  12           HG       LEU  12   0.813   8.902  -4.877
   85   HD11  LEU  12          1HD1      LEU  12   2.933  10.088  -5.105
   86   HD12  LEU  12          2HD1      LEU  12   2.239  11.115  -6.361
   87   HD13  LEU  12          3HD1      LEU  12   2.437   9.385  -6.642
   88   HD21  LEU  12          3HD2      LEU  12  -0.501  10.680  -3.828
   89   HD22  LEU  12          1HD2      LEU  12   0.446  11.899  -4.682
   90   HD23  LEU  12          2HD2      LEU  12   1.215  10.871  -3.472
   91    H    TYR  13           H        TYR  13  -2.038   7.941  -7.855
   92    HA   TYR  13           HA       TYR  13  -4.049   9.562  -9.288
   93    HB2  TYR  13           2HB      TYR  13  -1.730   7.993 -10.442
   94    HB3  TYR  13           1HB      TYR  13  -3.066   8.601 -11.418
   95    HD1  TYR  13           HD1      TYR  13  -3.317  10.981 -11.847
   96    HD2  TYR  13           HD2      TYR  13  -0.083   9.531  -9.489
   97    HE1  TYR  13           HE1      TYR  13  -2.203  13.161 -12.048
   98    HE2  TYR  13           HE2      TYR  13   1.040  11.708  -9.681
   99    HH   TYR  13           HH       TYR  13  -0.546  14.489 -10.930
  100    HA   PRO  14           HA       PRO  14  -6.638   5.985  -9.355
  101    HB2  PRO  14           2HB      PRO  14  -7.987   6.273 -11.696
  102    HB3  PRO  14           1HB      PRO  14  -8.282   7.285 -10.278
  103    HG2  PRO  14           2HG      PRO  14  -6.677   7.873 -12.733
  104    HG3  PRO  14           1HG      PRO  14  -7.770   8.935 -11.826
  105    HD2  PRO  14           2HD      PRO  14  -5.051   9.027 -11.587
  106    HD3  PRO  14           1HD      PRO  14  -6.163   9.478 -10.279
  107    H    PHE  15           H        PHE  15  -6.195   3.918  -9.711
  108    HA   PHE  15           HA       PHE  15  -5.069   3.094 -12.313
  109    HB2  PHE  15           2HB      PHE  15  -4.369   1.977  -9.581
  110    HB3  PHE  15           1HB      PHE  15  -3.779   1.347 -11.118
  111    HD1  PHE  15           HD2      PHE  15  -2.581   3.133 -12.650
  112    HD2  PHE  15           HD1      PHE  15  -3.043   3.480  -8.429
  113    HE1  PHE  15           HE2      PHE  15  -0.692   4.706 -12.575
  114    HE2  PHE  15           HE1      PHE  15  -1.158   5.059  -8.350
  115    HZ   PHE  15           HZ       PHE  15   0.022   5.673 -10.423
  116    H    ARG  16           H        ARG  16  -6.356   1.759 -13.374
  117    HA   ARG  16           HA       ARG  16  -8.184  -0.013 -11.872
  118    HB2  ARG  16           2HB      ARG  16  -9.562  -0.104 -13.873
  119    HB3  ARG  16           1HB      ARG  16  -9.275   1.577 -13.441
  120    HG2  ARG  16           2HG      ARG  16  -7.558   1.739 -15.168
  121    HG3  ARG  16           1HG      ARG  16  -7.812   0.047 -15.590
  122    HD2  ARG  16           2HD      ARG  16 -10.199   0.634 -16.118
  123    HD3  ARG  16           1HD      ARG  16  -9.760   2.331 -15.904
  124    HE   ARG  16           HE       ARG  16  -8.443   0.599 -17.894
  125   HH11  ARG  16          1HH1      ARG  16  -9.927   3.580 -17.021
  126   HH12  ARG  16          2HH1      ARG  16  -9.683   4.276 -18.583
  127   HH21  ARG  16          1HH2      ARG  16  -8.129   1.492 -19.873
  128   HH22  ARG  16          2HH2      ARG  16  -8.662   3.108 -20.186
  129    H    ARG  17           H        ARG  17  -7.997  -2.204 -12.099
  130    HA   ARG  17           HA       ARG  17  -6.068  -3.212 -14.085
  131    HB2  ARG  17           2HB      ARG  17  -5.909  -3.377 -11.128
  132    HB3  ARG  17           1HB      ARG  17  -5.471  -4.831 -12.015
  133    HG2  ARG  17           2HG      ARG  17  -4.279  -2.169 -12.729
  134    HG3  ARG  17           1HG      ARG  17  -3.617  -3.146 -11.420
  135    HD2  ARG  17           2HD      ARG  17  -3.504  -5.053 -13.115
  136    HD3  ARG  17           1HD      ARG  17  -3.817  -3.827 -14.344
  137    HE   ARG  17           HE       ARG  17  -1.730  -2.780 -13.733
  138   HH11  ARG  17          1HH1      ARG  17  -2.228  -5.930 -12.421
  139   HH12  ARG  17          2HH1      ARG  17  -0.539  -6.234 -12.232
  140   HH21  ARG  17          1HH2      ARG  17   0.429  -3.188 -13.472
  141   HH22  ARG  17          2HH2      ARG  17   0.943  -4.700 -12.800
  142    H    GLU  18           H        GLU  18  -7.065  -4.611 -15.336
  143    HA   GLU  18           HA       GLU  18  -9.303  -6.196 -14.663
  144    HB2  GLU  18           2HB      GLU  18  -7.194  -6.608 -16.798
  145    HB3  GLU  18           1HB      GLU  18  -8.715  -7.487 -16.714
  146    HG2  GLU  18           2HG      GLU  18  -9.968  -5.463 -17.072
  147    HG3  GLU  18           1HG      GLU  18  -8.496  -4.495 -16.995
  148    H    ARG  19           H        ARG  19  -5.889  -6.648 -14.197
  149    HA   ARG  19           HA       ARG  19  -6.159  -9.401 -13.294
  150    HB2  ARG  19           2HB      ARG  19  -3.871  -7.505 -13.696
  151    HB3  ARG  19           1HB      ARG  19  -3.648  -8.892 -12.638
  152    HG2  ARG  19           2HG      ARG  19  -4.521  -9.049 -15.527
  153    HG3  ARG  19           1HG      ARG  19  -2.874  -9.307 -14.941
  154    HD2  ARG  19           2HD      ARG  19  -3.815 -11.115 -13.448
  155    HD3  ARG  19           1HD      ARG  19  -5.327 -10.952 -14.338
  156    HE   ARG  19           HE       ARG  19  -3.843 -11.480 -16.362
  157   HH11  ARG  19          1HH1      ARG  19  -3.326 -12.736 -13.191
  158   HH12  ARG  19          2HH1      ARG  19  -2.595 -14.193 -13.774
  159   HH21  ARG  19          1HH2      ARG  19  -2.874 -13.352 -17.084
  160   HH22  ARG  19          2HH2      ARG  19  -2.346 -14.531 -15.932
  161    HA   PRO  20           HA       PRO  20  -7.246  -7.836  -9.171
  162    HB2  PRO  20           2HB      PRO  20  -7.513 -10.320  -8.027
  163    HB3  PRO  20           1HB      PRO  20  -8.775  -9.529  -8.978
  164    HG2  PRO  20           2HG      PRO  20  -6.791 -11.613  -9.825
  165    HG3  PRO  20           1HG      PRO  20  -8.526 -11.505 -10.189
  166    HD2  PRO  20           2HD      PRO  20  -6.658 -10.765 -11.982
  167    HD3  PRO  20           1HD      PRO  20  -8.204  -9.900 -11.841
  168    H    GLU  21           H        GLU  21  -4.445  -9.461 -10.174
  169    HA   GLU  21           HA       GLU  21  -3.039  -9.888  -7.801
  170    HB2  GLU  21           2HB      GLU  21  -2.141 -10.588  -9.939
  171    HB3  GLU  21           1HB      GLU  21  -2.072  -8.924 -10.504
  172    HG2  GLU  21           2HG      GLU  21  -0.350  -8.419  -8.857
  173    HG3  GLU  21           1HG      GLU  21  -0.437 -10.068  -8.241
  174    H    ASP  22           H        ASP  22  -3.583  -6.922  -9.630
  175    HA   ASP  22           HA       ASP  22  -2.147  -5.294  -7.666
  176    HB2  ASP  22           2HB      ASP  22  -2.008  -5.026 -10.221
  177    HB3  ASP  22           1HB      ASP  22  -3.625  -4.345 -10.126
  178    H    LEU  23           H        LEU  23  -4.006  -2.954  -8.051
  179    HA   LEU  23           HA       LEU  23  -6.532  -3.846  -6.937
  180    HB2  LEU  23           2HB      LEU  23  -4.978  -3.924  -5.018
  181    HB3  LEU  23           1HB      LEU  23  -4.608  -2.229  -5.256
  182    HG   LEU  23           HG       LEU  23  -6.940  -1.639  -4.710
  183   HD11  LEU  23          1HD1      LEU  23  -7.280  -4.595  -4.194
  184   HD12  LEU  23          2HD1      LEU  23  -8.058  -3.658  -5.471
  185   HD13  LEU  23          3HD1      LEU  23  -8.448  -3.339  -3.781
  186   HD21  LEU  23          3HD2      LEU  23  -5.583  -3.374  -2.643
  187   HD22  LEU  23          1HD2      LEU  23  -6.841  -2.182  -2.318
  188   HD23  LEU  23          2HD2      LEU  23  -5.274  -1.663  -2.935
  189    H    GLU  24           H        GLU  24  -8.161  -2.415  -7.323
  190    HA   GLU  24           HA       GLU  24  -7.883  -0.103  -8.862
  191    HB2  GLU  24           2HB      GLU  24 -10.064  -1.216  -7.150
  192    HB3  GLU  24           1HB      GLU  24 -10.211   0.456  -7.664
  193    HG2  GLU  24           2HG      GLU  24 -11.423  -0.938  -9.177
  194    HG3  GLU  24           1HG      GLU  24 -10.021  -0.274 -10.010
  195    H    LEU  25           H        LEU  25  -6.605   1.567  -8.252
  196    HA   LEU  25           HA       LEU  25  -6.923   2.681  -5.536
  197    HB2  LEU  25           2HB      LEU  25  -4.720   3.173  -7.550
  198    HB3  LEU  25           1HB      LEU  25  -4.787   3.823  -5.921
  199    HG   LEU  25           HG       LEU  25  -4.450   0.919  -6.697
  200   HD11  LEU  25          1HD1      LEU  25  -2.421   2.243  -6.941
  201   HD12  LEU  25          2HD1      LEU  25  -2.280   1.125  -5.586
  202   HD13  LEU  25          3HD1      LEU  25  -2.590   2.836  -5.287
  203   HD21  LEU  25          3HD2      LEU  25  -5.871   1.054  -4.727
  204   HD22  LEU  25          1HD2      LEU  25  -4.715   2.133  -3.943
  205   HD23  LEU  25          2HD2      LEU  25  -4.271   0.462  -4.287
  206    H    LEU  26           H        LEU  26  -7.441   4.828  -5.208
  207    HA   LEU  26           HA       LEU  26  -8.377   6.326  -7.581
  208    HB2  LEU  26           2HB      LEU  26  -9.552   5.988  -4.841
  209    HB3  LEU  26           1HB      LEU  26  -9.893   7.454  -5.734
  210    HG   LEU  26           HG       LEU  26 -11.698   5.833  -5.994
  211   HD11  LEU  26          1HD1      LEU  26 -11.841   5.797  -8.433
  212   HD12  LEU  26          2HD1      LEU  26 -10.124   6.189  -8.544
  213   HD13  LEU  26          3HD1      LEU  26 -11.252   7.354  -7.847
  214   HD21  LEU  26          3HD2      LEU  26 -11.388   3.715  -7.140
  215   HD22  LEU  26          1HD2      LEU  26 -10.385   3.778  -5.691
  216   HD23  LEU  26          2HD2      LEU  26  -9.655   4.021  -7.280
  217    HA   PRO  27           HA       PRO  27  -5.581   9.592  -6.592
  218    HB2  PRO  27           2HB      PRO  27  -6.967  11.805  -7.395
  219    HB3  PRO  27           1HB      PRO  27  -6.233  10.659  -8.522
  220    HG2  PRO  27           2HG      PRO  27  -9.083  10.853  -7.608
  221    HG3  PRO  27           1HG      PRO  27  -8.447  10.582  -9.242
  222    HD2  PRO  27           2HD      PRO  27  -9.388   8.564  -7.714
  223    HD3  PRO  27           1HD      PRO  27  -8.043   8.339  -8.849
  224    H    GLY  28           H        GLY  28  -5.125  10.120  -4.542
  225    HA2  GLY  28           2HA      GLY  28  -5.278  11.348  -2.562
  226    HA3  GLY  28           1HA      GLY  28  -6.882  11.883  -3.038
  227    H    ASP  29           H        ASP  29  -6.219   8.500  -3.176
  228    HA   ASP  29           HA       ASP  29  -8.036   8.008  -0.942
  229    HB2  ASP  29           2HB      ASP  29  -8.441   6.794  -3.013
  230    HB3  ASP  29           1HB      ASP  29  -6.801   6.153  -2.997
  231    H    VAL  30           H        VAL  30  -7.496   6.261   0.622
  232    HA   VAL  30           HA       VAL  30  -4.647   6.368   1.398
  233    HB   VAL  30           HB       VAL  30  -7.068   6.101   3.203
  234   HG11  VAL  30          1HG1      VAL  30  -5.180   4.891   4.117
  235   HG12  VAL  30          2HG1      VAL  30  -5.433   6.369   5.044
  236   HG13  VAL  30          3HG1      VAL  30  -4.123   6.281   3.865
  237   HG21  VAL  30          3HG2      VAL  30  -5.171   8.426   2.789
  238   HG22  VAL  30          1HG2      VAL  30  -6.452   8.350   3.999
  239   HG23  VAL  30          2HG2      VAL  30  -6.858   8.354   2.285
  240    H    LEU  31           H        LEU  31  -3.580   4.490   1.647
  241    HA   LEU  31           HA       LEU  31  -5.102   1.973   1.452
  242    HB2  LEU  31           2HB      LEU  31  -2.236   2.604   0.731
  243    HB3  LEU  31           1HB      LEU  31  -2.906   0.982   0.726
  244    HG   LEU  31           HG       LEU  31  -4.573   1.769  -1.000
  245   HD11  LEU  31          1HD1      LEU  31  -4.067   3.791  -2.254
  246   HD12  LEU  31          2HD1      LEU  31  -2.775   4.188  -1.123
  247   HD13  LEU  31          3HD1      LEU  31  -4.451   4.166  -0.576
  248   HD21  LEU  31          3HD2      LEU  31  -1.645   1.931  -1.714
  249   HD22  LEU  31          1HD2      LEU  31  -2.969   1.683  -2.853
  250   HD23  LEU  31          2HD2      LEU  31  -2.625   0.467  -1.625
  251    H    VAL  32           H        VAL  32  -5.306   0.863   3.281
  252    HA   VAL  32           HA       VAL  32  -3.499   1.413   5.520
  253    HB   VAL  32           HB       VAL  32  -6.065  -0.201   5.471
  254   HG11  VAL  32          1HG1      VAL  32  -4.586  -0.886   7.285
  255   HG12  VAL  32          2HG1      VAL  32  -5.982  -0.012   7.919
  256   HG13  VAL  32          3HG1      VAL  32  -4.416   0.793   7.803
  257   HG21  VAL  32          3HG2      VAL  32  -6.428   2.178   4.953
  258   HG22  VAL  32          1HG2      VAL  32  -5.587   2.625   6.440
  259   HG23  VAL  32          2HG2      VAL  32  -7.110   1.737   6.518
  260    H    VAL  33           H        VAL  33  -1.689   0.210   5.519
  261    HA   VAL  33           HA       VAL  33  -1.885  -2.682   4.959
  262    HB   VAL  33           HB       VAL  33   0.593  -0.941   5.131
  263   HG11  VAL  33          1HG1      VAL  33   0.281  -3.835   4.311
  264   HG12  VAL  33          2HG1      VAL  33   1.079  -3.240   5.768
  265   HG13  VAL  33          3HG1      VAL  33   1.765  -2.891   4.181
  266   HG21  VAL  33          3HG2      VAL  33  -0.758  -0.395   3.175
  267   HG22  VAL  33          1HG2      VAL  33  -0.805  -2.099   2.715
  268   HG23  VAL  33          2HG2      VAL  33   0.725  -1.221   2.697
  269    H    SER  34           H        SER  34  -1.662  -4.125   6.600
  270    HA   SER  34           HA       SER  34  -1.575  -3.185   9.298
  271    HB2  SER  34           2HB      SER  34  -1.793  -5.513   9.949
  272    HB3  SER  34           1HB      SER  34  -2.863  -5.201   8.585
  273    HG   SER  34           HG       SER  34  -1.889  -6.917   7.815
  274    H    ARG  35           H        ARG  35   0.020  -3.449  10.893
  275    HA   ARG  35           HA       ARG  35   2.727  -3.369  10.142
  276    HB2  ARG  35           2HB      ARG  35   2.053  -2.505  12.300
  277    HB3  ARG  35           1HB      ARG  35   1.456  -4.082  12.798
  278    HG2  ARG  35           2HG      ARG  35   3.770  -4.958  12.695
  279    HG3  ARG  35           1HG      ARG  35   4.335  -3.338  12.293
  280    HD2  ARG  35           2HD      ARG  35   2.763  -3.915  14.794
  281    HD3  ARG  35           1HD      ARG  35   4.516  -4.086  14.728
  282    HE   ARG  35           HE       ARG  35   3.649  -1.523  13.815
  283   HH11  ARG  35          1HH1      ARG  35   4.208  -3.391  16.648
  284   HH12  ARG  35          2HH1      ARG  35   4.600  -2.016  17.618
  285   HH21  ARG  35          1HH2      ARG  35   4.177   0.253  15.079
  286   HH22  ARG  35          2HH2      ARG  35   4.582   0.010  16.741
  287    H    ALA  36           H        ALA  36   0.632  -6.050  11.051
  288    HA   ALA  36           HA       ALA  36   2.499  -8.122  11.255
  289    HB1  ALA  36           3HB      ALA  36  -0.334  -8.288  10.216
  290    HB2  ALA  36           1HB      ALA  36   0.140  -8.341  11.913
  291    HB3  ALA  36           2HB      ALA  36   0.633  -9.633  10.818
  292    H    ALA  37           H        ALA  37   0.787  -6.871   8.381
  293    HA   ALA  37           HA       ALA  37   1.752  -8.683   6.490
  294    HB1  ALA  37           3HB      ALA  37   1.164  -5.752   6.056
  295    HB2  ALA  37           1HB      ALA  37  -0.037  -7.045   6.051
  296    HB3  ALA  37           2HB      ALA  37   1.222  -7.004   4.814
  297    H    LEU  38           H        LEU  38   3.157  -5.555   7.489
  298    HA   LEU  38           HA       LEU  38   5.422  -5.650   5.820
  299    HB2  LEU  38           2HB      LEU  38   5.094  -4.305   8.511
  300    HB3  LEU  38           1HB      LEU  38   6.411  -4.001   7.391
  301    HG   LEU  38           HG       LEU  38   3.485  -3.401   6.897
  302   HD11  LEU  38          1HD1      LEU  38   4.545  -1.868   8.485
  303   HD12  LEU  38          2HD1      LEU  38   4.169  -1.065   6.961
  304   HD13  LEU  38          3HD1      LEU  38   5.830  -1.544   7.319
  305   HD21  LEU  38          3HD2      LEU  38   5.891  -2.891   5.137
  306   HD22  LEU  38          1HD2      LEU  38   4.243  -2.343   4.823
  307   HD23  LEU  38          2HD2      LEU  38   4.610  -4.067   4.832
  308    H    GLN  39           H        GLN  39   5.016  -6.735   9.196
  309    HA   GLN  39           HA       GLN  39   7.636  -7.678   9.604
  310    HB2  GLN  39           2HB      GLN  39   5.017  -8.631  10.795
  311    HB3  GLN  39           1HB      GLN  39   6.600  -9.140  11.368
  312    HG2  GLN  39           2HG      GLN  39   5.605  -6.293  11.340
  313    HG3  GLN  39           1HG      GLN  39   5.584  -7.359  12.743
  314   HE21  GLN  39          1HE2      GLN  39   6.949  -4.804  12.354
  315   HE22  GLN  39          2HE2      GLN  39   8.624  -5.112  12.639
  316    H    ALA  40           H        ALA  40   4.802  -9.245   8.170
  317    HA   ALA  40           HA       ALA  40   5.952 -11.816   7.816
  318    HB1  ALA  40           3HB      ALA  40   3.747 -10.486   6.237
  319    HB2  ALA  40           1HB      ALA  40   3.538 -11.423   7.716
  320    HB3  ALA  40           2HB      ALA  40   4.119 -12.210   6.249
  321    H    LEU  41           H        LEU  41   5.804  -8.956   5.705
  322    HA   LEU  41           HA       LEU  41   7.182 -10.080   3.492
  323    HB2  LEU  41           2HB      LEU  41   7.020  -7.196   4.400
  324    HB3  LEU  41           1HB      LEU  41   7.610  -7.725   2.836
  325    HG   LEU  41           HG       LEU  41   4.781  -8.139   3.828
  326   HD11  LEU  41          1HD1      LEU  41   4.161  -6.371   2.256
  327   HD12  LEU  41          2HD1      LEU  41   5.863  -6.110   1.869
  328   HD13  LEU  41          3HD1      LEU  41   5.261  -5.768   3.492
  329   HD21  LEU  41          3HD2      LEU  41   5.437  -9.832   2.220
  330   HD22  LEU  41          1HD2      LEU  41   6.047  -8.594   1.123
  331   HD23  LEU  41          2HD2      LEU  41   4.318  -8.694   1.466
  332    H    GLY  42           H        GLY  42   8.263  -9.047   6.583
  333    HA2  GLY  42           2HA      GLY  42  10.384  -9.299   7.513
  334    HA3  GLY  42           1HA      GLY  42  11.029  -9.635   5.914
  335    H    VAL  43           H        VAL  43   9.070  -6.815   6.330
  336    HA   VAL  43           HA       VAL  43  11.150  -5.064   5.488
  337    HB   VAL  43           HB       VAL  43   8.476  -4.354   6.725
  338   HG11  VAL  43          1HG1      VAL  43   8.769  -2.187   5.603
  339   HG12  VAL  43          2HG1      VAL  43  10.375  -2.681   5.069
  340   HG13  VAL  43          3HG1      VAL  43  10.040  -2.480   6.790
  341   HG21  VAL  43          3HG2      VAL  43   9.254  -4.652   3.816
  342   HG22  VAL  43          1HG2      VAL  43   7.693  -4.083   4.413
  343   HG23  VAL  43          2HG2      VAL  43   8.206  -5.741   4.729
  344    H    ALA  44           H        ALA  44  12.855  -4.752   6.785
  345    HA   ALA  44           HA       ALA  44  12.799  -4.833   9.613
  346    HB1  ALA  44           3HB      ALA  44  14.916  -3.675   7.799
  347    HB2  ALA  44           1HB      ALA  44  14.791  -5.365   8.287
  348    HB3  ALA  44           2HB      ALA  44  15.120  -4.121   9.493
  349    H    GLU  45           H        GLU  45  12.979  -3.209  11.150
  350    HA   GLU  45           HA       GLU  45  11.550  -0.848  10.770
  351    HB2  GLU  45           2HB      GLU  45  13.617  -1.495  12.888
  352    HB3  GLU  45           1HB      GLU  45  12.484  -0.149  12.969
  353    HG2  GLU  45           2HG      GLU  45  10.609  -1.746  12.925
  354    HG3  GLU  45           1HG      GLU  45  11.765  -3.077  12.899
  355    H    GLY  46           H        GLY  46  12.084   0.697   9.367
  356    HA2  GLY  46           2HA      GLY  46  13.767   2.624   9.206
  357    HA3  GLY  46           1HA      GLY  46  14.939   1.341   8.940
  358    H    GLY  47           H        GLY  47  12.660  -0.119   7.455
  359    HA2  GLY  47           2HA      GLY  47  13.179   1.168   4.855
  360    HA3  GLY  47           1HA      GLY  47  12.701  -0.503   5.098
  361    H    GLU  48           H        GLU  48  10.630   0.863   7.090
  362    HA   GLU  48           HA       GLU  48   8.407   0.597   5.364
  363    HB2  GLU  48           2HB      GLU  48   7.041   1.280   7.224
  364    HB3  GLU  48           1HB      GLU  48   8.330   0.262   7.840
  365    HG2  GLU  48           2HG      GLU  48   8.270   3.275   7.982
  366    HG3  GLU  48           1HG      GLU  48   7.857   2.180   9.298
  367    H    ARG  49           H        ARG  49  10.353   3.330   6.269
  368    HA   ARG  49           HA       ARG  49   8.601   5.322   5.136
  369    HB2  ARG  49           2HB      ARG  49  11.445   5.370   6.142
  370    HB3  ARG  49           1HB      ARG  49  10.667   6.789   5.452
  371    HG2  ARG  49           2HG      ARG  49   9.107   6.931   7.202
  372    HG3  ARG  49           1HG      ARG  49   9.440   5.286   7.747
  373    HD2  ARG  49           2HD      ARG  49  11.500   7.482   7.821
  374    HD3  ARG  49           1HD      ARG  49  10.397   7.164   9.160
  375    HE   ARG  49           HE       ARG  49  11.381   4.891   9.232
  376   HH11  ARG  49          1HH1      ARG  49  13.189   7.383   7.686
  377   HH12  ARG  49          2HH1      ARG  49  14.709   6.662   8.085
  378   HH21  ARG  49          1HH2      ARG  49  13.323   4.019   9.774
  379   HH22  ARG  49          2HH2      ARG  49  14.790   4.790   9.273
  380    H    CYS  50           H        CYS  50  10.105   2.969   3.576
  381    HA   CYS  50           HA       CYS  50  10.434   4.600   1.153
  382    HB2  CYS  50           2HB      CYS  50  12.703   4.203   1.972
  383    HB3  CYS  50           1HB      CYS  50  12.392   2.472   2.054
  384    HG   CYS  50           HG       CYS  50  14.070   3.245  -0.159
  385    HA   PRO  51           HA       PRO  51   7.559   0.953   0.699
  386    HB2  PRO  51           2HB      PRO  51   5.828   2.252  -0.999
  387    HB3  PRO  51           1HB      PRO  51   5.695   2.277   0.762
  388    HG2  PRO  51           2HG      PRO  51   6.895   4.320  -1.076
  389    HG3  PRO  51           1HG      PRO  51   5.853   4.562   0.340
  390    HD2  PRO  51           2HD      PRO  51   8.516   4.927   0.474
  391    HD3  PRO  51           1HD      PRO  51   7.601   4.253   1.839
  392    H    GLN  52           H        GLN  52   8.878   3.099  -1.807
  393    HA   GLN  52           HA       GLN  52   8.365   1.376  -3.985
  394    HB2  GLN  52           2HB      GLN  52  10.023   2.763  -5.226
  395    HB3  GLN  52           1HB      GLN  52   8.771   3.690  -4.421
  396    HG2  GLN  52           2HG      GLN  52  10.676   4.930  -4.010
  397    HG3  GLN  52           1HG      GLN  52  10.497   3.993  -2.530
  398   HE21  GLN  52          1HE2      GLN  52  12.707   4.278  -2.079
  399   HE22  GLN  52          2HE2      GLN  52  13.926   3.390  -2.924
  400    H    SER  53           H        SER  53  10.988   1.449  -1.662
  401    HA   SER  53           HA       SER  53  12.710  -0.340  -3.112
  402    HB2  SER  53           2HB      SER  53  13.574   1.187  -1.349
  403    HB3  SER  53           1HB      SER  53  12.681   0.273  -0.136
  404    HG   SER  53           HG       SER  53  14.071  -1.366  -0.314
  405    H    VAL  54           H        VAL  54  10.215  -0.713  -0.630
  406    HA   VAL  54           HA       VAL  54  10.597  -3.488  -0.172
  407    HB   VAL  54           HB       VAL  54   8.044  -1.888   0.157
  408   HG11  VAL  54          1HG1      VAL  54   8.910  -4.502   1.406
  409   HG12  VAL  54          2HG1      VAL  54   7.632  -4.286   0.210
  410   HG13  VAL  54          3HG1      VAL  54   7.450  -3.604   1.826
  411   HG21  VAL  54          3HG2      VAL  54   9.877  -0.855   1.391
  412   HG22  VAL  54          1HG2      VAL  54  10.266  -2.404   2.143
  413   HG23  VAL  54          2HG2      VAL  54   8.733  -1.608   2.501
  414    H    GLY  55           H        GLY  55   8.486  -1.698  -2.416
  415    HA2  GLY  55           2HA      GLY  55   8.027  -2.455  -4.619
  416    HA3  GLY  55           1HA      GLY  55   8.383  -4.095  -4.111
  417    H    TRP  56           H        TRP  56   6.588  -5.241  -4.528
  418    HA   TRP  56           HA       TRP  56   3.941  -4.168  -4.339
  419    HB2  TRP  56           2HB      TRP  56   5.015  -6.950  -4.809
  420    HB3  TRP  56           1HB      TRP  56   3.289  -6.626  -4.688
  421    HD1  TRP  56           HD1      TRP  56   6.285  -5.364  -6.843
  422    HE1  TRP  56           HE1      TRP  56   5.406  -4.944  -9.229
  423    HE3  TRP  56           HE3      TRP  56   1.345  -6.460  -6.093
  424    HZ2  TRP  56           HZ2      TRP  56   2.941  -5.072 -10.610
  425    HZ3  TRP  56           HZ3      TRP  56  -0.209  -6.290  -7.996
  426    HH2  TRP  56           HH2      TRP  56   0.576  -5.609 -10.206
  427    H    MET  57           H        MET  57   2.854  -3.853  -2.514
  428    HA   MET  57           HA       MET  57   3.280  -5.693  -0.239
  429    HB2  MET  57           2HB      MET  57   2.591  -2.745  -0.110
  430    HB3  MET  57           1HB      MET  57   2.802  -3.816   1.268
  431    HG2  MET  57           2HG      MET  57   5.147  -4.135   0.671
  432    HG3  MET  57           1HG      MET  57   4.942  -3.069  -0.718
  433    HE1  MET  57           3HE      MET  57   3.018  -0.827   0.446
  434    HE2  MET  57           1HE      MET  57   4.442  -0.463  -0.528
  435    HE3  MET  57           2HE      MET  57   4.189   0.370   1.006
  436    HA   PRO  58           HA       PRO  58  -1.174  -6.295  -0.476
  437    HB2  PRO  58           2HB      PRO  58  -1.513  -7.763   1.757
  438    HB3  PRO  58           1HB      PRO  58  -0.692  -8.412   0.330
  439    HG2  PRO  58           2HG      PRO  58   0.490  -7.305   2.853
  440    HG3  PRO  58           1HG      PRO  58   0.955  -8.756   1.946
  441    HD2  PRO  58           2HD      PRO  58   2.265  -6.352   1.755
  442    HD3  PRO  58           1HD      PRO  58   2.228  -7.559   0.452
  443    H    GLY  59           H        GLY  59  -2.616  -4.694  -0.034
  444    HA2  GLY  59           2HA      GLY  59  -2.881  -3.741   2.735
  445    HA3  GLY  59           1HA      GLY  59  -2.526  -2.549   1.498
  446    H    LEU  60           H        LEU  60  -4.715  -2.183   2.985
  447    HA   LEU  60           HA       LEU  60  -7.048  -3.163   1.502
  448    HB2  LEU  60           2HB      LEU  60  -7.131  -3.319   3.930
  449    HB3  LEU  60           1HB      LEU  60  -6.797  -1.604   4.080
  450    HG   LEU  60           HG       LEU  60  -8.983  -1.123   2.970
  451   HD11  LEU  60          1HD1      LEU  60 -10.631  -2.909   2.763
  452   HD12  LEU  60          2HD1      LEU  60  -9.417  -4.097   3.243
  453   HD13  LEU  60          3HD1      LEU  60  -9.231  -3.206   1.731
  454   HD21  LEU  60          3HD2      LEU  60  -8.778  -1.101   5.407
  455   HD22  LEU  60          1HD2      LEU  60  -9.154  -2.823   5.463
  456   HD23  LEU  60          2HD2      LEU  60 -10.368  -1.671   4.905
  457    H    ASN  61           H        ASN  61  -8.168  -1.921   0.109
  458    HA   ASN  61           HA       ASN  61  -7.417   0.865  -0.316
  459    HB2  ASN  61           2HB      ASN  61  -7.706  -0.565  -2.267
  460    HB3  ASN  61           1HB      ASN  61  -9.346  -0.970  -1.767
  461   HD21  ASN  61          1HD2      ASN  61  -7.290   1.541  -3.035
  462   HD22  ASN  61          2HD2      ASN  61  -8.561   2.545  -3.618
  463    H    GLU  62           H        GLU  62  -8.438   2.484   0.769
  464    HA   GLU  62           HA       GLU  62 -10.653   1.967   2.470
  465    HB2  GLU  62           2HB      GLU  62  -9.305   4.536   1.646
  466    HB3  GLU  62           1HB      GLU  62 -10.642   4.496   2.786
  467    HG2  GLU  62           2HG      GLU  62  -8.066   2.979   3.172
  468    HG3  GLU  62           1HG      GLU  62  -8.367   4.590   3.818
  469    H    ARG  63           H        ARG  63 -10.583   2.943  -0.868
  470    HA   ARG  63           HA       ARG  63 -13.177   4.171  -0.883
  471    HB2  ARG  63           2HB      ARG  63 -11.658   2.921  -3.185
  472    HB3  ARG  63           1HB      ARG  63 -13.082   3.937  -3.339
  473    HG2  ARG  63           2HG      ARG  63 -10.336   4.745  -2.404
  474    HG3  ARG  63           1HG      ARG  63 -11.168   5.243  -3.874
  475    HD2  ARG  63           2HD      ARG  63 -11.420   7.088  -2.490
  476    HD3  ARG  63           1HD      ARG  63 -12.941   6.230  -2.260
  477    HE   ARG  63           HE       ARG  63 -10.719   5.825  -0.383
  478   HH11  ARG  63          1HH1      ARG  63 -13.964   6.858  -0.962
  479   HH12  ARG  63          2HH1      ARG  63 -14.288   7.089   0.723
  480   HH21  ARG  63          1HH2      ARG  63 -11.169   6.119   1.747
  481   HH22  ARG  63          2HH2      ARG  63 -12.729   6.678   2.233
  482    H    THR  64           H        THR  64 -12.112   1.047  -2.236
  483    HA   THR  64           HA       THR  64 -14.880   0.161  -2.465
  484    HB   THR  64           HB       THR  64 -13.956  -1.763  -3.692
  485    HG1  THR  64           HG1      THR  64 -11.372  -0.747  -3.755
  486   HG21  THR  64          3HG2      THR  64 -12.777   0.881  -4.584
  487   HG22  THR  64          1HG2      THR  64 -14.409   0.306  -4.934
  488   HG23  THR  64          2HG2      THR  64 -13.013  -0.538  -5.605
  489    H    ARG  65           H        ARG  65 -12.231  -0.283  -0.324
  490    HA   ARG  65           HA       ARG  65 -11.853  -1.561   1.495
  491    HB2  ARG  65           2HB      ARG  65 -14.785  -2.060   1.156
  492    HB3  ARG  65           1HB      ARG  65 -13.881  -3.057   2.288
  493    HG2  ARG  65           2HG      ARG  65 -14.888  -1.206   3.457
  494    HG3  ARG  65           1HG      ARG  65 -13.134  -1.028   3.462
  495    HD2  ARG  65           2HD      ARG  65 -13.413   0.505   1.463
  496    HD3  ARG  65           1HD      ARG  65 -15.147   0.473   1.794
  497    HE   ARG  65           HE       ARG  65 -13.162   1.414   3.761
  498   HH11  ARG  65          1HH1      ARG  65 -16.200   1.712   2.182
  499   HH12  ARG  65          2HH1      ARG  65 -16.605   3.179   2.998
  500   HH21  ARG  65          1HH2      ARG  65 -13.687   3.291   4.805
  501   HH22  ARG  65          2HH2      ARG  65 -15.183   4.078   4.453
  502    H    GLN  66           H        GLN  66 -11.705  -2.585  -1.390
  503    HA   GLN  66           HA       GLN  66 -11.579  -5.457  -0.953
  504    HB2  GLN  66           2HB      GLN  66 -10.717  -3.758  -3.309
  505    HB3  GLN  66           1HB      GLN  66 -10.673  -5.514  -3.275
  506    HG2  GLN  66           2HG      GLN  66 -13.155  -3.816  -3.045
  507    HG3  GLN  66           1HG      GLN  66 -12.614  -4.666  -4.491
  508   HE21  GLN  66          1HE2      GLN  66 -12.746  -6.932  -4.545
  509   HE22  GLN  66          2HE2      GLN  66 -13.757  -7.804  -3.451
  510    H    ARG  67           H        ARG  67  -9.788  -6.607  -0.438
  511    HA   ARG  67           HA       ARG  67  -7.320  -5.137   0.141
  512    HB2  ARG  67           2HB      ARG  67  -8.074  -8.000   0.790
  513    HB3  ARG  67           1HB      ARG  67  -6.648  -7.151   1.372
  514    HG2  ARG  67           2HG      ARG  67  -8.055  -5.600   2.615
  515    HG3  ARG  67           1HG      ARG  67  -9.501  -6.399   1.998
  516    HD2  ARG  67           2HD      ARG  67  -7.398  -7.586   3.809
  517    HD3  ARG  67           1HD      ARG  67  -9.060  -7.181   4.239
  518    HE   ARG  67           HE       ARG  67  -8.204  -9.413   2.530
  519   HH11  ARG  67          1HH1      ARG  67 -10.704  -7.774   4.244
  520   HH12  ARG  67          2HH1      ARG  67 -11.782  -9.121   4.180
  521   HH21  ARG  67          1HH2      ARG  67  -9.597 -11.120   2.428
  522   HH22  ARG  67          2HH2      ARG  67 -11.167 -11.000   3.143
  523    H    GLY  68           H        GLY  68  -5.569  -5.251  -1.146
  524    HA2  GLY  68           2HA      GLY  68  -5.089  -7.618  -2.792
  525    HA3  GLY  68           1HA      GLY  68  -5.368  -6.118  -3.663
  526    H    ASP  69           H        ASP  69  -3.177  -6.623  -4.486
  527    HA   ASP  69           HA       ASP  69  -1.062  -5.692  -2.649
  528    HB2  ASP  69           2HB      ASP  69  -1.115  -7.698  -4.819
  529    HB3  ASP  69           1HB      ASP  69   0.288  -6.636  -4.842
  530    H    PHE  70           H        PHE  70   0.452  -4.135  -3.406
  531    HA   PHE  70           HA       PHE  70   0.003  -2.824  -5.954
  532    HB2  PHE  70           2HB      PHE  70  -0.363  -0.594  -4.994
  533    HB3  PHE  70           1HB      PHE  70  -1.646  -1.702  -4.525
  534    HD1  PHE  70           HD1      PHE  70  -1.762  -2.557  -2.206
  535    HD2  PHE  70           HD2      PHE  70   1.096   0.386  -3.363
  536    HE1  PHE  70           HE1      PHE  70  -1.385  -1.996   0.159
  537    HE2  PHE  70           HE2      PHE  70   1.478   0.946  -0.998
  538    HZ   PHE  70           HZ       PHE  70   0.239  -0.243   0.766
  539    HA   PRO  71           HA       PRO  71   4.421  -2.177  -5.406
  540    HB2  PRO  71           2HB      PRO  71   4.220  -0.265  -7.634
  541    HB3  PRO  71           1HB      PRO  71   5.097  -1.795  -7.548
  542    HG2  PRO  71           2HG      PRO  71   2.885  -1.490  -9.065
  543    HG3  PRO  71           1HG      PRO  71   3.290  -3.027  -8.279
  544    HD2  PRO  71           2HD      PRO  71   1.310  -0.930  -7.440
  545    HD3  PRO  71           1HD      PRO  71   1.151  -2.702  -7.424
  546    H    GLY  72           H        GLY  72   5.154  -0.911  -3.800
  547    HA2  GLY  72           2HA      GLY  72   3.953   1.358  -2.777
  548    HA3  GLY  72           1HA      GLY  72   5.633   0.930  -2.514
  549    H    THR  73           H        THR  73   6.032   1.217  -5.545
  550    HA   THR  73           HA       THR  73   7.067   3.821  -5.558
  551    HB   THR  73           HB       THR  73   7.907   2.125  -7.085
  552    HG1  THR  73           HG1      THR  73   7.764   4.540  -7.655
  553   HG21  THR  73          3HG2      THR  73   5.232   2.360  -8.478
  554   HG22  THR  73          1HG2      THR  73   5.843   0.950  -7.611
  555   HG23  THR  73          2HG2      THR  73   6.631   1.481  -9.098
  556    H    TYR  74           H        TYR  74   3.802   2.842  -6.015
  557    HA   TYR  74           HA       TYR  74   3.121   5.286  -7.502
  558    HB2  TYR  74           2HB      TYR  74   1.426   2.883  -6.785
  559    HB3  TYR  74           1HB      TYR  74   0.859   4.271  -7.707
  560    HD1  TYR  74           HD2      TYR  74   2.291   4.828  -9.861
  561    HD2  TYR  74           HD1      TYR  74   2.202   1.027  -7.946
  562    HE1  TYR  74           HE2      TYR  74   3.042   3.764 -11.948
  563    HE2  TYR  74           HE1      TYR  74   2.955  -0.045 -10.024
  564    HH   TYR  74           HH       TYR  74   2.915   0.414 -12.447
  565    H    VAL  75           H        VAL  75   3.426   4.463  -4.300
  566    HA   VAL  75           HA       VAL  75   1.330   6.383  -3.484
  567    HB   VAL  75           HB       VAL  75   0.882   5.061  -1.461
  568   HG11  VAL  75          1HG1      VAL  75  -0.362   3.223  -2.516
  569   HG12  VAL  75          2HG1      VAL  75   0.532   3.481  -4.015
  570   HG13  VAL  75          3HG1      VAL  75  -0.552   4.734  -3.408
  571   HG21  VAL  75          3HG2      VAL  75   3.046   3.934  -1.249
  572   HG22  VAL  75          1HG2      VAL  75   2.705   2.984  -2.695
  573   HG23  VAL  75          2HG2      VAL  75   1.726   2.764  -1.244
  574    H    GLU  76           H        GLU  76   1.691   7.444  -1.417
  575    HA   GLU  76           HA       GLU  76   4.547   7.592  -0.659
  576    HB2  GLU  76           2HB      GLU  76   4.132   9.823   0.168
  577    HB3  GLU  76           1HB      GLU  76   3.509   9.715  -1.473
  578    HG2  GLU  76           2HG      GLU  76   1.256   9.564  -0.686
  579    HG3  GLU  76           1HG      GLU  76   1.794   9.412   0.984
  580    H    PHE  77           H        PHE  77   5.103   7.647   1.577
  581    HA   PHE  77           HA       PHE  77   3.323   6.134   3.292
  582    HB2  PHE  77           2HB      PHE  77   5.667   5.567   3.348
  583    HB3  PHE  77           1HB      PHE  77   6.113   7.229   3.713
  584    HD1  PHE  77           HD2      PHE  77   3.789   4.652   5.153
  585    HD2  PHE  77           HD1      PHE  77   6.810   7.576   5.872
  586    HE1  PHE  77           HE2      PHE  77   3.712   4.148   7.558
  587    HE2  PHE  77           HE1      PHE  77   6.725   7.072   8.279
  588    HZ   PHE  77           HZ       PHE  77   5.174   5.356   9.125
  589    H    LEU  78           H        LEU  78   1.821   7.047   4.554
  590    HA   LEU  78           HA       LEU  78   1.972   9.893   5.197
  591    HB2  LEU  78           2HB      LEU  78  -0.208   7.867   5.725
  592    HB3  LEU  78           1HB      LEU  78  -0.327   9.584   6.059
  593    HG   LEU  78           HG       LEU  78  -0.030   8.335   3.316
  594   HD11  LEU  78          1HD1      LEU  78  -2.395   9.671   4.629
  595   HD12  LEU  78          2HD1      LEU  78  -2.231   7.951   4.274
  596   HD13  LEU  78          3HD1      LEU  78  -2.317   9.116   2.954
  597   HD21  LEU  78          3HD2      LEU  78  -0.374  11.228   4.119
  598   HD22  LEU  78          1HD2      LEU  78  -0.418  10.610   2.468
  599   HD23  LEU  78          2HD2      LEU  78   1.069  10.504   3.409
  600    H    GLY  79           H        GLY  79   1.225   6.932   7.072
  601    HA2  GLY  79           2HA      GLY  79   3.057   6.996   9.050
  602    HA3  GLY  79           1HA      GLY  79   1.954   8.268   9.551
  603    HA   PRO  80           HA       PRO  80   0.357   4.206  11.225
  604    HB2  PRO  80           2HB      PRO  80   0.239   4.913  13.834
  605    HB3  PRO  80           1HB      PRO  80   1.723   4.308  13.084
  606    HG2  PRO  80           2HG      PRO  80   0.912   7.144  13.648
  607    HG3  PRO  80           1HG      PRO  80   2.475   6.353  13.929
  608    HD2  PRO  80           2HD      PRO  80   1.993   7.934  11.767
  609    HD3  PRO  80           1HD      PRO  80   3.123   6.565  11.723
  610    H    LEU  81           H        LEU  81  -1.670   3.893  12.620
  611    HA   LEU  81           HA       LEU  81  -3.670   5.861  11.769
  612    HB2  LEU  81           2HB      LEU  81  -3.970   3.020  12.762
  613    HB3  LEU  81           1HB      LEU  81  -5.321   4.071  12.382
  614    HG   LEU  81           HG       LEU  81  -4.396   4.241  10.029
  615   HD11  LEU  81          1HD1      LEU  81  -2.913   2.419   9.288
  616   HD12  LEU  81          2HD1      LEU  81  -2.668   1.960  10.974
  617   HD13  LEU  81          3HD1      LEU  81  -2.126   3.538  10.400
  618   HD21  LEU  81          3HD2      LEU  81  -6.323   2.865  10.537
  619   HD22  LEU  81          1HD2      LEU  81  -5.272   1.526  11.009
  620   HD23  LEU  81          2HD2      LEU  81  -5.302   2.077   9.332
  621    H    GLU  82           H        GLU  82  -5.462   6.391  13.248
  622    HA   GLU  82           HA       GLU  82  -4.482   6.767  15.993
  623    HB2  GLU  82           2HB      GLU  82  -6.786   8.111  14.565
  624    HB3  GLU  82           1HB      GLU  82  -6.218   8.496  16.185
  625    HG2  GLU  82           2HG      GLU  82  -4.001   9.088  15.166
  626    HG3  GLU  82           1HG      GLU  82  -4.756   8.906  13.582
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1 -11.899   3.338  23.172
    2    H2   MET   1           2H       MET   1 -11.831   1.727  22.663
    3    H3   MET   1           3H       MET   1 -11.701   2.974  21.534
    4    HA   MET   1           HA       MET   1  -9.621   3.693  22.496
    5    HB2  MET   1           2HB      MET   1 -10.031   1.301  24.311
    6    HB3  MET   1           1HB      MET   1  -8.529   2.207  24.189
    7    HG2  MET   1           2HG      MET   1  -9.646   4.210  25.011
    8    HG3  MET   1           1HG      MET   1 -11.177   3.342  25.084
    9    HE1  MET   1           3HE      MET   1 -10.230   0.489  26.184
   10    HE2  MET   1           1HE      MET   1 -11.663   1.339  26.764
   11    HE3  MET   1           2HE      MET   1 -10.479   0.719  27.915
   12    H    ALA   2           H        ALA   2  -8.598   3.298  20.623
   13    HA   ALA   2           HA       ALA   2  -8.577   0.587  19.509
   14    HB1  ALA   2           3HB      ALA   2  -9.299   2.419  18.064
   15    HB2  ALA   2           1HB      ALA   2  -7.837   1.655  17.437
   16    HB3  ALA   2           2HB      ALA   2  -7.736   3.210  18.268
   17    H    GLY   3           H        GLY   3  -6.559  -0.092  18.342
   18    HA2  GLY   3           2HA      GLY   3  -4.055   0.870  19.564
   19    HA3  GLY   3           1HA      GLY   3  -4.444  -0.841  19.671
   20    HA   PRO   4           HA       PRO   4  -3.840   1.022  14.956
   21    HB2  PRO   4           2HB      PRO   4  -1.075   1.783  15.263
   22    HB3  PRO   4           1HB      PRO   4  -2.445   2.787  14.790
   23    HG2  PRO   4           2HG      PRO   4  -1.192   2.434  17.448
   24    HG3  PRO   4           1HG      PRO   4  -2.103   3.813  16.804
   25    HD2  PRO   4           2HD      PRO   4  -3.161   2.206  18.665
   26    HD3  PRO   4           1HD      PRO   4  -4.163   2.868  17.353
   27    H    GLU   5           H        GLU   5  -3.890  -1.068  14.255
   28    HA   GLU   5           HA       GLU   5  -1.498  -2.737  14.523
   29    HB2  GLU   5           2HB      GLU   5  -4.006  -3.484  13.014
   30    HB3  GLU   5           1HB      GLU   5  -2.797  -4.549  13.714
   31    HG2  GLU   5           2HG      GLU   5  -4.350  -4.818  15.322
   32    HG3  GLU   5           1HG      GLU   5  -3.664  -3.321  15.951
   33    H    GLY   6           H        GLY   6  -3.282  -0.890  12.129
   34    HA2  GLY   6           2HA      GLY   6  -1.455  -1.813  10.000
   35    HA3  GLY   6           1HA      GLY   6  -3.043  -1.114   9.739
   36    H    PHE   7           H        PHE   7  -0.575  -0.355   8.495
   37    HA   PHE   7           HA       PHE   7  -0.216   2.404   9.476
   38    HB2  PHE   7           2HB      PHE   7   1.500   0.673   7.681
   39    HB3  PHE   7           1HB      PHE   7   1.782   2.396   7.907
   40    HD1  PHE   7           HD2      PHE   7   1.314  -0.714   9.935
   41    HD2  PHE   7           HD1      PHE   7   3.257   3.057   9.551
   42    HE1  PHE   7           HE2      PHE   7   2.633  -1.190  11.953
   43    HE2  PHE   7           HE1      PHE   7   4.580   2.587  11.570
   44    HZ   PHE   7           HZ       PHE   7   4.270   0.458  12.775
   45    H    GLN   8           H        GLN   8  -0.130   4.131   7.853
   46    HA   GLN   8           HA       GLN   8  -2.221   3.695   5.828
   47    HB2  GLN   8           2HB      GLN   8  -1.296   6.234   7.185
   48    HB3  GLN   8           1HB      GLN   8  -2.542   6.163   5.948
   49    HG2  GLN   8           2HG      GLN   8  -3.911   4.757   7.426
   50    HG3  GLN   8           1HG      GLN   8  -2.658   4.858   8.662
   51   HE21  GLN   8          1HE2      GLN   8  -5.467   5.772   8.696
   52   HE22  GLN   8          2HE2      GLN   8  -5.386   7.447   9.106
   53    H    TYR   9           H        TYR   9  -1.644   3.622   3.773
   54    HA   TYR   9           HA       TYR   9   0.589   5.304   2.803
   55    HB2  TYR   9           2HB      TYR   9  -0.731   2.877   1.547
   56    HB3  TYR   9           1HB      TYR   9   0.504   3.853   0.758
   57    HD1  TYR   9           HD1      TYR   9  -0.111   1.676   3.717
   58    HD2  TYR   9           HD2      TYR   9   2.796   3.427   1.142
   59    HE1  TYR   9           HE1      TYR   9   1.632   0.286   4.752
   60    HE2  TYR   9           HE2      TYR   9   4.547   2.042   2.174
   61    HH   TYR   9           HH       TYR   9   3.843  -0.586   4.245
   62    H    ARG  10           H        ARG  10   0.158   6.135   0.452
   63    HA   ARG  10           HA       ARG  10  -2.644   6.724  -0.089
   64    HB2  ARG  10           2HB      ARG  10  -2.185   8.509   1.424
   65    HB3  ARG  10           1HB      ARG  10  -0.645   8.861   0.655
   66    HG2  ARG  10           2HG      ARG  10  -1.685   9.831  -1.226
   67    HG3  ARG  10           1HG      ARG  10  -3.262   9.167  -0.793
   68    HD2  ARG  10           2HD      ARG  10  -1.783  11.182   0.899
   69    HD3  ARG  10           1HD      ARG  10  -2.964  11.627  -0.335
   70    HE   ARG  10           HE       ARG  10  -4.217   9.789   1.302
   71   HH11  ARG  10          1HH1      ARG  10  -2.808  12.923   1.692
   72   HH12  ARG  10          2HH1      ARG  10  -3.885  13.354   2.974
   73   HH21  ARG  10          1HH2      ARG  10  -5.608  10.407   2.937
   74   HH22  ARG  10          2HH2      ARG  10  -5.431  11.967   3.663
   75    H    ALA  11           H        ALA  11  -2.979   6.504  -2.189
   76    HA   ALA  11           HA       ALA  11  -0.807   6.457  -4.089
   77    HB1  ALA  11           3HB      ALA  11  -2.629   4.834  -4.225
   78    HB2  ALA  11           1HB      ALA  11  -2.523   5.793  -5.702
   79    HB3  ALA  11           2HB      ALA  11  -3.782   6.137  -4.513
   80    H    LEU  12           H        LEU  12  -0.621   7.755  -5.976
   81    HA   LEU  12           HA       LEU  12  -1.649  10.487  -5.608
   82    HB2  LEU  12           2HB      LEU  12   0.601   9.480  -7.357
   83    HB3  LEU  12           1HB      LEU  12   0.147  11.163  -7.150
   84    HG   LEU  12           HG       LEU  12   1.246   9.345  -4.992
   85   HD11  LEU  12          1HD1      LEU  12   3.216  10.787  -5.084
   86   HD12  LEU  12          2HD1      LEU  12   2.506  11.680  -6.429
   87   HD13  LEU  12          3HD1      LEU  12   2.933   9.979  -6.626
   88   HD21  LEU  12          3HD2      LEU  12  -0.349  10.983  -4.094
   89   HD22  LEU  12          1HD2      LEU  12   0.562  12.286  -4.858
   90   HD23  LEU  12          2HD2      LEU  12   1.302  11.324  -3.578
   91    H    TYR  13           H        TYR  13  -1.770   7.812  -7.863
   92    HA   TYR  13           HA       TYR  13  -3.621   9.345  -9.560
   93    HB2  TYR  13           2HB      TYR  13  -1.331   7.633 -10.567
   94    HB3  TYR  13           1HB      TYR  13  -2.599   8.302 -11.590
   95    HD1  TYR  13           HD1      TYR  13  -2.805  10.816 -11.777
   96    HD2  TYR  13           HD2      TYR  13   0.564   8.940  -9.965
   97    HE1  TYR  13           HE1      TYR  13  -1.518  12.893 -12.030
   98    HE2  TYR  13           HE2      TYR  13   1.859  11.016 -10.216
   99    HH   TYR  13           HH       TYR  13   0.447  13.984 -10.914
  100    HA   PRO  14           HA       PRO  14  -6.130   5.735  -9.121
  101    HB2  PRO  14           2HB      PRO  14  -7.871   6.056 -11.168
  102    HB3  PRO  14           1HB      PRO  14  -7.888   7.084  -9.728
  103    HG2  PRO  14           2HG      PRO  14  -6.710   7.626 -12.435
  104    HG3  PRO  14           1HG      PRO  14  -7.647   8.709 -11.388
  105    HD2  PRO  14           2HD      PRO  14  -4.920   8.792 -11.571
  106    HD3  PRO  14           1HD      PRO  14  -5.808   9.258 -10.107
  107    H    PHE  15           H        PHE  15  -5.658   3.689  -9.560
  108    HA   PHE  15           HA       PHE  15  -5.435   2.776 -12.342
  109    HB2  PHE  15           2HB      PHE  15  -3.395   2.122 -10.192
  110    HB3  PHE  15           1HB      PHE  15  -3.482   1.330 -11.758
  111    HD1  PHE  15           HD2      PHE  15  -3.201   2.803 -13.847
  112    HD2  PHE  15           HD1      PHE  15  -2.114   4.054  -9.919
  113    HE1  PHE  15           HE2      PHE  15  -1.707   4.511 -14.803
  114    HE2  PHE  15           HE1      PHE  15  -0.622   5.760 -10.873
  115    HZ   PHE  15           HZ       PHE  15  -0.416   5.990 -13.317
  116    H    ARG  16           H        ARG  16  -7.086   1.313 -12.482
  117    HA   ARG  16           HA       ARG  16  -7.361  -0.622 -10.259
  118    HB2  ARG  16           2HB      ARG  16  -9.698  -0.805 -10.665
  119    HB3  ARG  16           1HB      ARG  16  -9.328   0.911 -10.596
  120    HG2  ARG  16           2HG      ARG  16  -9.436   1.060 -13.018
  121    HG3  ARG  16           1HG      ARG  16  -9.720  -0.679 -13.132
  122    HD2  ARG  16           2HD      ARG  16 -11.532   1.438 -11.989
  123    HD3  ARG  16           1HD      ARG  16 -11.848   0.342 -13.336
  124    HE   ARG  16           HE       ARG  16 -11.615  -0.560 -10.530
  125   HH11  ARG  16          1HH1      ARG  16 -13.147  -0.723 -13.624
  126   HH12  ARG  16          2HH1      ARG  16 -14.258  -1.944 -13.108
  127   HH21  ARG  16          1HH2      ARG  16 -12.997  -2.123  -9.914
  128   HH22  ARG  16          2HH2      ARG  16 -14.168  -2.739 -11.032
  129    H    ARG  17           H        ARG  17  -7.562  -2.825 -10.749
  130    HA   ARG  17           HA       ARG  17  -7.109  -3.573 -13.562
  131    HB2  ARG  17           2HB      ARG  17  -5.416  -4.393 -11.197
  132    HB3  ARG  17           1HB      ARG  17  -5.357  -5.208 -12.753
  133    HG2  ARG  17           2HG      ARG  17  -4.919  -2.249 -12.608
  134    HG3  ARG  17           1HG      ARG  17  -3.619  -3.355 -12.168
  135    HD2  ARG  17           2HD      ARG  17  -3.441  -2.673 -14.502
  136    HD3  ARG  17           1HD      ARG  17  -3.745  -4.403 -14.371
  137    HE   ARG  17           HE       ARG  17  -6.213  -3.448 -14.742
  138   HH11  ARG  17          1HH1      ARG  17  -3.269  -2.758 -16.394
  139   HH12  ARG  17          2HH1      ARG  17  -4.063  -2.487 -17.907
  140   HH21  ARG  17          1HH2      ARG  17  -7.209  -3.135 -16.697
  141   HH22  ARG  17          2HH2      ARG  17  -6.253  -2.687 -18.070
  142    H    GLU  18           H        GLU  18  -7.814  -5.558 -14.192
  143    HA   GLU  18           HA       GLU  18  -9.818  -6.901 -12.626
  144    HB2  GLU  18           2HB      GLU  18 -10.159  -6.743 -14.986
  145    HB3  GLU  18           1HB      GLU  18  -8.560  -7.382 -15.330
  146    HG2  GLU  18           2HG      GLU  18  -9.350  -9.559 -14.301
  147    HG3  GLU  18           1HG      GLU  18 -10.976  -8.870 -14.330
  148    H    ARG  19           H        ARG  19  -6.464  -7.469 -13.504
  149    HA   ARG  19           HA       ARG  19  -6.446 -10.221 -12.620
  150    HB2  ARG  19           2HB      ARG  19  -4.083  -8.473 -13.338
  151    HB3  ARG  19           1HB      ARG  19  -4.122 -10.231 -13.277
  152    HG2  ARG  19           2HG      ARG  19  -5.575  -8.461 -15.239
  153    HG3  ARG  19           1HG      ARG  19  -4.181  -9.486 -15.572
  154    HD2  ARG  19           2HD      ARG  19  -6.914 -10.450 -14.717
  155    HD3  ARG  19           1HD      ARG  19  -6.280 -10.487 -16.360
  156    HE   ARG  19           HE       ARG  19  -4.444 -11.863 -14.873
  157   HH11  ARG  19          1HH1      ARG  19  -7.836 -12.140 -15.368
  158   HH12  ARG  19          2HH1      ARG  19  -7.826 -13.861 -15.249
  159   HH21  ARG  19          1HH2      ARG  19  -4.440 -14.061 -14.696
  160   HH22  ARG  19          2HH2      ARG  19  -5.918 -14.939 -14.901
  161    HA   PRO  20           HA       PRO  20  -5.585  -9.475  -8.367
  162    HB2  PRO  20           2HB      PRO  20  -4.402 -11.823  -7.673
  163    HB3  PRO  20           1HB      PRO  20  -6.129 -11.674  -8.020
  164    HG2  PRO  20           2HG      PRO  20  -3.917 -12.638  -9.804
  165    HG3  PRO  20           1HG      PRO  20  -5.535 -13.325  -9.558
  166    HD2  PRO  20           2HD      PRO  20  -4.921 -11.778 -11.698
  167    HD3  PRO  20           1HD      PRO  20  -6.540 -11.786 -10.965
  168    H    GLU  21           H        GLU  21  -3.132  -9.345 -10.589
  169    HA   GLU  21           HA       GLU  21  -0.873  -9.414  -8.804
  170    HB2  GLU  21           2HB      GLU  21  -1.158  -8.408 -11.642
  171    HB3  GLU  21           1HB      GLU  21   0.357  -8.381 -10.754
  172    HG2  GLU  21           2HG      GLU  21   0.497 -10.291 -12.065
  173    HG3  GLU  21           1HG      GLU  21   0.048 -10.902 -10.475
  174    H    ASP  22           H        ASP  22  -3.301  -7.137  -9.246
  175    HA   ASP  22           HA       ASP  22  -1.614  -4.997  -8.126
  176    HB2  ASP  22           2HB      ASP  22  -3.582  -4.664 -10.402
  177    HB3  ASP  22           1HB      ASP  22  -2.773  -3.341  -9.570
  178    H    LEU  23           H        LEU  23  -3.030  -3.095  -7.404
  179    HA   LEU  23           HA       LEU  23  -5.657  -3.956  -6.381
  180    HB2  LEU  23           2HB      LEU  23  -4.055  -4.005  -4.530
  181    HB3  LEU  23           1HB      LEU  23  -3.565  -2.358  -4.884
  182    HG   LEU  23           HG       LEU  23  -5.813  -1.549  -4.264
  183   HD11  LEU  23          1HD1      LEU  23  -6.362  -4.439  -3.569
  184   HD12  LEU  23          2HD1      LEU  23  -7.144  -3.498  -4.841
  185   HD13  LEU  23          3HD1      LEU  23  -7.397  -3.075  -3.148
  186   HD21  LEU  23          3HD2      LEU  23  -4.528  -3.277  -2.142
  187   HD22  LEU  23          1HD2      LEU  23  -5.642  -1.938  -1.857
  188   HD23  LEU  23          2HD2      LEU  23  -4.057  -1.630  -2.564
  189    H    GLU  24           H        GLU  24  -7.240  -2.321  -6.246
  190    HA   GLU  24           HA       GLU  24  -7.055  -0.295  -8.240
  191    HB2  GLU  24           2HB      GLU  24  -9.187  -0.667  -6.122
  192    HB3  GLU  24           1HB      GLU  24  -9.340   0.265  -7.606
  193    HG2  GLU  24           2HG      GLU  24  -9.048  -1.798  -8.917
  194    HG3  GLU  24           1HG      GLU  24  -8.946  -2.720  -7.419
  195    H    LEU  25           H        LEU  25  -5.804   1.445  -7.922
  196    HA   LEU  25           HA       LEU  25  -5.733   2.774  -5.303
  197    HB2  LEU  25           2HB      LEU  25  -4.011   3.162  -7.759
  198    HB3  LEU  25           1HB      LEU  25  -3.797   4.004  -6.234
  199    HG   LEU  25           HG       LEU  25  -3.488   1.024  -6.662
  200   HD11  LEU  25          1HD1      LEU  25  -1.666   2.284  -7.666
  201   HD12  LEU  25          2HD1      LEU  25  -1.112   1.431  -6.226
  202   HD13  LEU  25          3HD1      LEU  25  -1.420   3.166  -6.158
  203   HD21  LEU  25          3HD2      LEU  25  -3.040   2.692  -4.185
  204   HD22  LEU  25          1HD2      LEU  25  -2.675   0.974  -4.358
  205   HD23  LEU  25          2HD2      LEU  25  -4.346   1.532  -4.436
  206    H    LEU  26           H        LEU  26  -6.252   4.935  -5.012
  207    HA   LEU  26           HA       LEU  26  -7.531   6.345  -7.281
  208    HB2  LEU  26           2HB      LEU  26  -8.453   6.065  -4.427
  209    HB3  LEU  26           1HB      LEU  26  -8.950   7.440  -5.390
  210    HG   LEU  26           HG       LEU  26 -10.708   5.804  -5.414
  211   HD11  LEU  26          1HD1      LEU  26 -10.966   5.412  -7.810
  212   HD12  LEU  26          2HD1      LEU  26  -9.264   5.800  -8.062
  213   HD13  LEU  26          3HD1      LEU  26 -10.374   7.039  -7.479
  214   HD21  LEU  26          3HD2      LEU  26 -10.438   3.542  -6.243
  215   HD22  LEU  26          1HD2      LEU  26  -9.358   3.820  -4.876
  216   HD23  LEU  26          2HD2      LEU  26  -8.720   3.821  -6.521
  217    HA   PRO  27           HA       PRO  27  -4.849   9.759  -6.373
  218    HB2  PRO  27           2HB      PRO  27  -6.359  11.910  -7.051
  219    HB3  PRO  27           1HB      PRO  27  -5.708  10.783  -8.249
  220    HG2  PRO  27           2HG      PRO  27  -8.462  10.892  -7.056
  221    HG3  PRO  27           1HG      PRO  27  -7.986  10.682  -8.753
  222    HD2  PRO  27           2HD      PRO  27  -8.705   8.595  -7.182
  223    HD3  PRO  27           1HD      PRO  27  -7.493   8.441  -8.471
  224    H    GLY  28           H        GLY  28  -4.405   9.955  -4.213
  225    HA2  GLY  28           2HA      GLY  28  -4.392  11.146  -2.213
  226    HA3  GLY  28           1HA      GLY  28  -5.848  11.978  -2.727
  227    H    ASP  29           H        ASP  29  -5.336   8.482  -2.424
  228    HA   ASP  29           HA       ASP  29  -7.571   8.365  -0.526
  229    HB2  ASP  29           2HB      ASP  29  -7.661   5.962  -1.080
  230    HB3  ASP  29           1HB      ASP  29  -7.805   6.976  -2.508
  231    H    VAL  30           H        VAL  30  -7.353   6.472   1.116
  232    HA   VAL  30           HA       VAL  30  -4.599   6.359   2.183
  233    HB   VAL  30           HB       VAL  30  -7.200   6.295   3.741
  234   HG11  VAL  30          1HG1      VAL  30  -4.351   6.070   4.732
  235   HG12  VAL  30          2HG1      VAL  30  -5.563   4.790   4.744
  236   HG13  VAL  30          3HG1      VAL  30  -5.784   6.221   5.750
  237   HG21  VAL  30          3HG2      VAL  30  -4.974   8.345   3.683
  238   HG22  VAL  30          1HG2      VAL  30  -6.394   8.394   4.731
  239   HG23  VAL  30          2HG2      VAL  30  -6.582   8.537   2.983
  240    H    LEU  31           H        LEU  31  -3.729   4.371   2.517
  241    HA   LEU  31           HA       LEU  31  -5.513   2.031   2.243
  242    HB2  LEU  31           2HB      LEU  31  -2.615   2.285   1.419
  243    HB3  LEU  31           1HB      LEU  31  -3.528   0.790   1.393
  244    HG   LEU  31           HG       LEU  31  -5.137   2.034  -0.214
  245   HD11  LEU  31          1HD1      LEU  31  -4.085   3.788  -1.562
  246   HD12  LEU  31          2HD1      LEU  31  -2.694   3.789  -0.478
  247   HD13  LEU  31          3HD1      LEU  31  -4.278   4.285   0.120
  248   HD21  LEU  31          3HD2      LEU  31  -3.782   1.403  -2.138
  249   HD22  LEU  31          1HD2      LEU  31  -3.694   0.182  -0.870
  250   HD23  LEU  31          2HD2      LEU  31  -2.349   1.299  -1.112
  251    H    VAL  32           H        VAL  32  -5.697   0.815   3.999
  252    HA   VAL  32           HA       VAL  32  -3.796   1.121   6.200
  253    HB   VAL  32           HB       VAL  32  -6.433  -0.372   6.118
  254   HG11  VAL  32          1HG1      VAL  32  -4.955  -1.261   7.837
  255   HG12  VAL  32          2HG1      VAL  32  -6.274  -0.354   8.579
  256   HG13  VAL  32          3HG1      VAL  32  -4.667   0.364   8.461
  257   HG21  VAL  32          3HG2      VAL  32  -6.742   2.033   5.791
  258   HG22  VAL  32          1HG2      VAL  32  -5.786   2.365   7.236
  259   HG23  VAL  32          2HG2      VAL  32  -7.337   1.537   7.374
  260    H    VAL  33           H        VAL  33  -2.074  -0.191   6.169
  261    HA   VAL  33           HA       VAL  33  -2.403  -2.983   5.246
  262    HB   VAL  33           HB       VAL  33   0.154  -1.365   5.410
  263   HG11  VAL  33          1HG1      VAL  33  -0.382  -4.092   4.217
  264   HG12  VAL  33          2HG1      VAL  33   0.552  -3.755   5.675
  265   HG13  VAL  33          3HG1      VAL  33   1.138  -3.206   4.106
  266   HG21  VAL  33          3HG2      VAL  33  -1.317  -0.478   3.683
  267   HG22  VAL  33          1HG2      VAL  33  -1.524  -2.092   3.004
  268   HG23  VAL  33          2HG2      VAL  33   0.055  -1.310   2.951
  269    H    SER  34           H        SER  34  -2.421  -4.481   6.821
  270    HA   SER  34           HA       SER  34  -1.872  -4.002   9.530
  271    HB2  SER  34           2HB      SER  34  -1.837  -6.660   8.064
  272    HB3  SER  34           1HB      SER  34  -1.947  -6.456   9.812
  273    HG   SER  34           HG       SER  34  -3.917  -6.482   8.037
  274    H    ARG  35           H        ARG  35  -0.010  -3.888  10.668
  275    HA   ARG  35           HA       ARG  35   2.503  -3.803   9.522
  276    HB2  ARG  35           2HB      ARG  35   1.999  -2.869  11.729
  277    HB3  ARG  35           1HB      ARG  35   1.836  -4.489  12.394
  278    HG2  ARG  35           2HG      ARG  35   4.170  -4.934  12.060
  279    HG3  ARG  35           1HG      ARG  35   4.378  -3.422  11.171
  280    HD2  ARG  35           2HD      ARG  35   5.202  -3.274  13.491
  281    HD3  ARG  35           1HD      ARG  35   3.898  -2.136  13.163
  282    HE   ARG  35           HE       ARG  35   3.331  -4.698  14.487
  283   HH11  ARG  35          1HH1      ARG  35   3.370  -1.257  14.547
  284   HH12  ARG  35          2HH1      ARG  35   2.415  -1.161  15.984
  285   HH21  ARG  35          1HH2      ARG  35   2.118  -4.557  16.354
  286   HH22  ARG  35          2HH2      ARG  35   1.713  -2.996  16.984
  287    H    ALA  36           H        ALA  36   0.862  -6.594  10.916
  288    HA   ALA  36           HA       ALA  36   2.896  -8.463  10.973
  289    HB1  ALA  36           3HB      ALA  36   0.037  -8.947  10.136
  290    HB2  ALA  36           1HB      ALA  36   0.627  -8.878  11.797
  291    HB3  ALA  36           2HB      ALA  36   1.173 -10.163  10.719
  292    H    ALA  37           H        ALA  37   0.901  -7.516   8.176
  293    HA   ALA  37           HA       ALA  37   1.949  -9.296   6.281
  294    HB1  ALA  37           3HB      ALA  37   1.097  -7.747   4.593
  295    HB2  ALA  37           1HB      ALA  37   0.925  -6.488   5.818
  296    HB3  ALA  37           2HB      ALA  37  -0.066  -7.944   5.905
  297    H    LEU  38           H        LEU  38   3.023  -6.026   7.188
  298    HA   LEU  38           HA       LEU  38   5.159  -5.820   5.353
  299    HB2  LEU  38           2HB      LEU  38   4.870  -4.548   8.083
  300    HB3  LEU  38           1HB      LEU  38   6.014  -4.052   6.848
  301    HG   LEU  38           HG       LEU  38   2.999  -3.902   6.603
  302   HD11  LEU  38          1HD1      LEU  38   3.881  -2.290   8.210
  303   HD12  LEU  38          2HD1      LEU  38   3.297  -1.487   6.753
  304   HD13  LEU  38          3HD1      LEU  38   5.030  -1.703   7.006
  305   HD21  LEU  38          3HD2      LEU  38   3.433  -2.643   4.548
  306   HD22  LEU  38          1HD2      LEU  38   4.077  -4.282   4.444
  307   HD23  LEU  38          2HD2      LEU  38   5.165  -2.925   4.735
  308    H    GLN  39           H        GLN  39   5.068  -6.960   8.718
  309    HA   GLN  39           HA       GLN  39   7.819  -7.579   8.938
  310    HB2  GLN  39           2HB      GLN  39   5.449  -8.727  10.433
  311    HB3  GLN  39           1HB      GLN  39   7.132  -8.929  10.903
  312    HG2  GLN  39           2HG      GLN  39   5.693  -6.281  10.705
  313    HG3  GLN  39           1HG      GLN  39   5.979  -7.176  12.197
  314   HE21  GLN  39          1HE2      GLN  39   8.037  -7.222  13.068
  315   HE22  GLN  39          2HE2      GLN  39   9.299  -6.172  12.532
  316    H    ALA  40           H        ALA  40   5.146  -9.311   7.514
  317    HA   ALA  40           HA       ALA  40   6.503 -11.831   7.258
  318    HB1  ALA  40           3HB      ALA  40   4.056 -11.681   7.193
  319    HB2  ALA  40           1HB      ALA  40   4.689 -12.420   5.724
  320    HB3  ALA  40           2HB      ALA  40   4.148 -10.742   5.703
  321    H    LEU  41           H        LEU  41   6.003  -9.034   5.136
  322    HA   LEU  41           HA       LEU  41   7.449 -10.035   2.902
  323    HB2  LEU  41           2HB      LEU  41   6.953  -7.165   3.729
  324    HB3  LEU  41           1HB      LEU  41   7.476  -7.694   2.141
  325    HG   LEU  41           HG       LEU  41   4.822  -8.437   3.385
  326   HD11  LEU  41          1HD1      LEU  41   4.904  -6.046   3.003
  327   HD12  LEU  41          2HD1      LEU  41   3.845  -6.816   1.822
  328   HD13  LEU  41          3HD1      LEU  41   5.467  -6.304   1.352
  329   HD21  LEU  41          3HD2      LEU  41   5.606 -10.046   1.722
  330   HD22  LEU  41          1HD2      LEU  41   5.862  -8.739   0.562
  331   HD23  LEU  41          2HD2      LEU  41   4.232  -9.127   1.111
  332    H    GLY  42           H        GLY  42   8.421  -8.483   5.867
  333    HA2  GLY  42           2HA      GLY  42  10.648  -8.640   6.717
  334    HA3  GLY  42           1HA      GLY  42  11.249  -8.725   5.069
  335    H    VAL  43           H        VAL  43   8.865  -6.332   5.897
  336    HA   VAL  43           HA       VAL  43  10.643  -4.196   5.146
  337    HB   VAL  43           HB       VAL  43   7.832  -4.012   6.265
  338   HG11  VAL  43          1HG1      VAL  43   9.045  -1.907   6.440
  339   HG12  VAL  43          2HG1      VAL  43   7.798  -1.792   5.199
  340   HG13  VAL  43          3HG1      VAL  43   9.488  -1.995   4.735
  341   HG21  VAL  43          3HG2      VAL  43   8.767  -4.117   3.386
  342   HG22  VAL  43          1HG2      VAL  43   7.114  -3.800   3.915
  343   HG23  VAL  43          2HG2      VAL  43   7.857  -5.366   4.239
  344    H    ALA  44           H        ALA  44  12.226  -3.802   6.612
  345    HA   ALA  44           HA       ALA  44  11.806  -3.874   9.448
  346    HB1  ALA  44           3HB      ALA  44  14.171  -2.825   7.889
  347    HB2  ALA  44           1HB      ALA  44  13.959  -4.483   8.450
  348    HB3  ALA  44           2HB      ALA  44  14.134  -3.174   9.617
  349    H    GLU  45           H        GLU  45  11.891  -2.162  10.933
  350    HA   GLU  45           HA       GLU  45  10.452   0.120  10.513
  351    HB2  GLU  45           2HB      GLU  45  11.140  -0.732  12.726
  352    HB3  GLU  45           1HB      GLU  45  12.779  -0.173  12.428
  353    HG2  GLU  45           2HG      GLU  45  11.941   2.144  12.307
  354    HG3  GLU  45           1HG      GLU  45  10.321   1.554  12.678
  355    H    GLY  46           H        GLY  46  10.759   2.097   9.644
  356    HA2  GLY  46           2HA      GLY  46  12.085   3.949   8.892
  357    HA3  GLY  46           1HA      GLY  46  13.470   2.877   8.766
  358    H    GLY  47           H        GLY  47  12.593   0.809   7.261
  359    HA2  GLY  47           2HA      GLY  47  12.520   1.803   4.611
  360    HA3  GLY  47           1HA      GLY  47  12.207   0.142   5.091
  361    H    GLU  48           H        GLU  48  10.024   1.090   6.884
  362    HA   GLU  48           HA       GLU  48   7.727   0.825   5.386
  363    HB2  GLU  48           2HB      GLU  48   6.567   1.831   7.308
  364    HB3  GLU  48           1HB      GLU  48   7.821   0.717   7.843
  365    HG2  GLU  48           2HG      GLU  48   9.323   2.774   8.061
  366    HG3  GLU  48           1HG      GLU  48   7.850   3.724   7.896
  367    H    ARG  49           H        ARG  49   9.680   3.694   5.882
  368    HA   ARG  49           HA       ARG  49   7.685   5.510   4.801
  369    HB2  ARG  49           2HB      ARG  49  10.566   6.038   5.573
  370    HB3  ARG  49           1HB      ARG  49   9.346   7.257   5.218
  371    HG2  ARG  49           2HG      ARG  49   8.052   6.543   7.171
  372    HG3  ARG  49           1HG      ARG  49   9.263   5.310   7.527
  373    HD2  ARG  49           2HD      ARG  49   9.681   8.302   7.527
  374    HD3  ARG  49           1HD      ARG  49   9.594   7.255   8.943
  375    HE   ARG  49           HE       ARG  49  11.691   6.708   6.988
  376   HH11  ARG  49          1HH1      ARG  49  10.812   7.992  10.059
  377   HH12  ARG  49          2HH1      ARG  49  12.444   8.060  10.622
  378   HH21  ARG  49          1HH2      ARG  49  13.773   6.796   7.715
  379   HH22  ARG  49          2HH2      ARG  49  14.107   7.357   9.315
  380    H    CYS  50           H        CYS  50   9.447   3.298   3.320
  381    HA   CYS  50           HA       CYS  50   9.645   4.835   0.843
  382    HB2  CYS  50           2HB      CYS  50  11.891   4.983   1.905
  383    HB3  CYS  50           1HB      CYS  50  11.983   3.226   1.911
  384    HG   CYS  50           HG       CYS  50  13.269   5.040  -0.260
  385    HA   PRO  51           HA       PRO  51   7.820   0.489   0.617
  386    HB2  PRO  51           2HB      PRO  51   5.696   1.187  -0.972
  387    HB3  PRO  51           1HB      PRO  51   5.663   1.249   0.793
  388    HG2  PRO  51           2HG      PRO  51   6.148   3.469  -1.166
  389    HG3  PRO  51           1HG      PRO  51   5.133   3.463   0.290
  390    HD2  PRO  51           2HD      PRO  51   7.582   4.570   0.300
  391    HD3  PRO  51           1HD      PRO  51   6.953   3.702   1.716
  392    H    GLN  52           H        GLN  52   8.912   2.790  -1.695
  393    HA   GLN  52           HA       GLN  52   8.553   1.405  -4.110
  394    HB2  GLN  52           2HB      GLN  52  10.313   2.850  -5.001
  395    HB3  GLN  52           1HB      GLN  52   9.209   3.772  -3.987
  396    HG2  GLN  52           2HG      GLN  52  10.812   3.702  -2.154
  397    HG3  GLN  52           1HG      GLN  52  11.913   2.740  -3.136
  398   HE21  GLN  52          1HE2      GLN  52  12.995   3.733  -4.864
  399   HE22  GLN  52          2HE2      GLN  52  13.140   5.450  -4.972
  400    H    SER  53           H        SER  53  10.685   0.763  -1.485
  401    HA   SER  53           HA       SER  53  12.672  -0.669  -3.030
  402    HB2  SER  53           2HB      SER  53  13.326   0.490  -0.965
  403    HB3  SER  53           1HB      SER  53  12.245  -0.544  -0.032
  404    HG   SER  53           HG       SER  53  13.628  -2.298  -1.160
  405    H    VAL  54           H        VAL  54   9.596  -1.474  -1.853
  406    HA   VAL  54           HA       VAL  54  10.243  -4.340  -1.624
  407    HB   VAL  54           HB       VAL  54   7.664  -2.915  -0.928
  408   HG11  VAL  54          1HG1      VAL  54   7.070  -5.006   0.225
  409   HG12  VAL  54          2HG1      VAL  54   8.546  -5.755  -0.382
  410   HG13  VAL  54          3HG1      VAL  54   7.285  -5.251  -1.508
  411   HG21  VAL  54          3HG2      VAL  54   9.479  -2.223   0.549
  412   HG22  VAL  54          1HG2      VAL  54   9.875  -3.913   0.875
  413   HG23  VAL  54          2HG2      VAL  54   8.334  -3.248   1.412
  414    H    GLY  55           H        GLY  55   7.633  -2.349  -3.080
  415    HA2  GLY  55           2HA      GLY  55   7.276  -2.594  -5.517
  416    HA3  GLY  55           1HA      GLY  55   7.525  -4.317  -5.297
  417    H    TRP  56           H        TRP  56   5.886  -5.513  -4.054
  418    HA   TRP  56           HA       TRP  56   3.219  -4.238  -4.254
  419    HB2  TRP  56           2HB      TRP  56   3.858  -7.177  -4.645
  420    HB3  TRP  56           1HB      TRP  56   2.279  -6.417  -4.817
  421    HD1  TRP  56           HD1      TRP  56   2.820  -4.044  -6.715
  422    HE1  TRP  56           HE1      TRP  56   3.614  -4.416  -9.137
  423    HE3  TRP  56           HE3      TRP  56   4.752  -8.750  -6.222
  424    HZ2  TRP  56           HZ2      TRP  56   4.878  -6.439 -10.639
  425    HZ3  TRP  56           HZ3      TRP  56   5.731  -9.840  -8.202
  426    HH2  TRP  56           HH2      TRP  56   5.791  -8.706 -10.366
  427    H    MET  57           H        MET  57   2.327  -3.925  -2.304
  428    HA   MET  57           HA       MET  57   2.741  -5.981  -0.218
  429    HB2  MET  57           2HB      MET  57   2.239  -3.025   0.237
  430    HB3  MET  57           1HB      MET  57   2.499  -4.244   1.479
  431    HG2  MET  57           2HG      MET  57   4.518  -3.031   1.249
  432    HG3  MET  57           1HG      MET  57   4.780  -4.616   0.528
  433    HE1  MET  57           3HE      MET  57   4.102  -0.812  -0.170
  434    HE2  MET  57           1HE      MET  57   2.787  -1.608  -1.033
  435    HE3  MET  57           2HE      MET  57   4.059  -0.781  -1.930
  436    HA   PRO  58           HA       PRO  58  -1.723  -6.376  -0.357
  437    HB2  PRO  58           2HB      PRO  58  -2.085  -7.975   1.781
  438    HB3  PRO  58           1HB      PRO  58  -1.305  -8.553   0.303
  439    HG2  PRO  58           2HG      PRO  58  -0.050  -7.646   2.872
  440    HG3  PRO  58           1HG      PRO  58   0.344  -9.061   1.877
  441    HD2  PRO  58           2HD      PRO  58   1.761  -6.719   1.789
  442    HD3  PRO  58           1HD      PRO  58   1.620  -7.825   0.409
  443    H    GLY  59           H        GLY  59  -3.014  -4.683   0.161
  444    HA2  GLY  59           2HA      GLY  59  -3.269  -3.920   2.997
  445    HA3  GLY  59           1HA      GLY  59  -2.854  -2.676   1.833
  446    H    LEU  60           H        LEU  60  -5.015  -2.261   3.328
  447    HA   LEU  60           HA       LEU  60  -7.368  -2.966   1.702
  448    HB2  LEU  60           2HB      LEU  60  -7.521  -3.481   4.087
  449    HB3  LEU  60           1HB      LEU  60  -7.142  -1.818   4.494
  450    HG   LEU  60           HG       LEU  60  -9.271  -1.107   3.405
  451   HD11  LEU  60          1HD1      LEU  60 -10.965  -2.775   2.872
  452   HD12  LEU  60          2HD1      LEU  60  -9.820  -4.070   3.223
  453   HD13  LEU  60          3HD1      LEU  60  -9.534  -2.983   1.862
  454   HD21  LEU  60          3HD2      LEU  60  -9.536  -3.137   5.628
  455   HD22  LEU  60          1HD2      LEU  60 -10.748  -1.931   5.190
  456   HD23  LEU  60          2HD2      LEU  60  -9.180  -1.419   5.812
  457    H    ASN  61           H        ASN  61  -8.173  -1.469   0.344
  458    HA   ASN  61           HA       ASN  61  -7.164   1.254   0.400
  459    HB2  ASN  61           2HB      ASN  61  -7.393  -0.029  -1.715
  460    HB3  ASN  61           1HB      ASN  61  -9.139  -0.056  -1.493
  461   HD21  ASN  61          1HD2      ASN  61  -6.391   1.861  -2.319
  462   HD22  ASN  61          2HD2      ASN  61  -7.261   3.226  -2.912
  463    H    GLU  62           H        GLU  62  -8.233   3.015   1.214
  464    HA   GLU  62           HA       GLU  62 -10.739   2.595   2.588
  465    HB2  GLU  62           2HB      GLU  62  -8.889   4.959   2.375
  466    HB3  GLU  62           1HB      GLU  62 -10.435   5.063   3.202
  467    HG2  GLU  62           2HG      GLU  62  -8.242   3.124   3.912
  468    HG3  GLU  62           1HG      GLU  62  -8.523   4.666   4.715
  469    H    ARG  63           H        ARG  63 -10.194   3.317  -0.606
  470    HA   ARG  63           HA       ARG  63 -12.634   4.957  -0.828
  471    HB2  ARG  63           2HB      ARG  63 -10.659   4.158  -2.978
  472    HB3  ARG  63           1HB      ARG  63 -12.047   5.208  -3.211
  473    HG2  ARG  63           2HG      ARG  63  -9.709   5.808  -1.406
  474    HG3  ARG  63           1HG      ARG  63  -9.913   6.427  -3.043
  475    HD2  ARG  63           2HD      ARG  63 -10.629   8.160  -1.617
  476    HD3  ARG  63           1HD      ARG  63 -12.106   7.429  -2.240
  477    HE   ARG  63           HE       ARG  63 -11.640   6.135   0.113
  478   HH11  ARG  63          1HH1      ARG  63 -12.024   9.441  -0.789
  479   HH12  ARG  63          2HH1      ARG  63 -12.663   9.884   0.756
  480   HH21  ARG  63          1HH2      ARG  63 -12.479   6.716   2.059
  481   HH22  ARG  63          2HH2      ARG  63 -12.940   8.361   2.338
  482    H    THR  64           H        THR  64 -11.262   1.926  -2.112
  483    HA   THR  64           HA       THR  64 -13.909   1.092  -3.066
  484    HB   THR  64           HB       THR  64 -12.758  -0.746  -4.187
  485    HG1  THR  64           HG1      THR  64 -10.349  -0.659  -4.044
  486   HG21  THR  64          3HG2      THR  64 -12.825   1.415  -5.345
  487   HG22  THR  64          1HG2      THR  64 -11.345   0.535  -5.729
  488   HG23  THR  64          2HG2      THR  64 -11.302   1.876  -4.585
  489    H    ARG  65           H        ARG  65 -11.686   0.451  -0.491
  490    HA   ARG  65           HA       ARG  65 -11.630  -0.983   1.247
  491    HB2  ARG  65           2HB      ARG  65 -14.558  -1.027   0.587
  492    HB3  ARG  65           1HB      ARG  65 -13.927  -2.111   1.823
  493    HG2  ARG  65           2HG      ARG  65 -13.525   0.882   1.844
  494    HG3  ARG  65           1HG      ARG  65 -14.827   0.049   2.701
  495    HD2  ARG  65           2HD      ARG  65 -13.293  -1.098   4.108
  496    HD3  ARG  65           1HD      ARG  65 -11.916  -0.631   3.114
  497    HE   ARG  65           HE       ARG  65 -11.892   1.436   4.136
  498   HH11  ARG  65          1HH1      ARG  65 -14.688  -0.310   5.141
  499   HH12  ARG  65          2HH1      ARG  65 -15.015   0.755   6.459
  500   HH21  ARG  65          1HH2      ARG  65 -12.297   2.779   5.839
  501   HH22  ARG  65          2HH2      ARG  65 -13.676   2.495   6.849
  502    H    GLN  66           H        GLN  66 -11.212  -1.919  -1.575
  503    HA   GLN  66           HA       GLN  66 -11.554  -4.806  -1.222
  504    HB2  GLN  66           2HB      GLN  66 -10.321  -3.247  -3.513
  505    HB3  GLN  66           1HB      GLN  66 -10.587  -4.985  -3.488
  506    HG2  GLN  66           2HG      GLN  66 -12.714  -2.849  -3.421
  507    HG3  GLN  66           1HG      GLN  66 -12.292  -3.869  -4.796
  508   HE21  GLN  66          1HE2      GLN  66 -14.842  -3.574  -3.466
  509   HE22  GLN  66          2HE2      GLN  66 -15.283  -5.147  -2.901
  510    H    ARG  67           H        ARG  67  -9.862  -6.228  -0.916
  511    HA   ARG  67           HA       ARG  67  -7.335  -5.043   0.005
  512    HB2  ARG  67           2HB      ARG  67  -8.519  -7.795   0.447
  513    HB3  ARG  67           1HB      ARG  67  -6.966  -7.261   1.079
  514    HG2  ARG  67           2HG      ARG  67  -8.033  -5.597   2.450
  515    HG3  ARG  67           1HG      ARG  67  -9.603  -5.949   1.728
  516    HD2  ARG  67           2HD      ARG  67  -9.567  -8.190   2.675
  517    HD3  ARG  67           1HD      ARG  67  -7.954  -7.910   3.328
  518    HE   ARG  67           HE       ARG  67  -8.869  -6.613   5.007
  519   HH11  ARG  67          1HH1      ARG  67 -11.317  -7.454   2.725
  520   HH12  ARG  67          2HH1      ARG  67 -12.602  -6.966   3.770
  521   HH21  ARG  67          1HH2      ARG  67 -10.518  -6.009   6.335
  522   HH22  ARG  67          2HH2      ARG  67 -12.156  -6.160   5.794
  523    H    GLY  68           H        GLY  68  -5.484  -5.281  -1.107
  524    HA2  GLY  68           2HA      GLY  68  -4.885  -7.587  -2.704
  525    HA3  GLY  68           1HA      GLY  68  -5.315  -6.207  -3.704
  526    H    ASP  69           H        ASP  69  -2.968  -6.928  -4.317
  527    HA   ASP  69           HA       ASP  69  -0.941  -5.735  -2.573
  528    HB2  ASP  69           2HB      ASP  69  -0.542  -7.260  -5.161
  529    HB3  ASP  69           1HB      ASP  69   0.674  -6.895  -3.937
  530    H    PHE  70           H        PHE  70  -0.618  -3.600  -2.852
  531    HA   PHE  70           HA       PHE  70  -1.023  -2.437  -5.521
  532    HB2  PHE  70           2HB      PHE  70  -1.135  -0.259  -4.361
  533    HB3  PHE  70           1HB      PHE  70  -2.323  -1.404  -3.751
  534    HD1  PHE  70           HD1      PHE  70  -2.002  -2.454  -1.524
  535    HD2  PHE  70           HD2      PHE  70   0.584   0.622  -2.949
  536    HE1  PHE  70           HE1      PHE  70  -1.193  -2.068   0.766
  537    HE2  PHE  70           HE2      PHE  70   1.390   1.006  -0.658
  538    HZ   PHE  70           HZ       PHE  70   0.503  -0.339   1.200
  539    HA   PRO  71           HA       PRO  71   3.343  -1.788  -6.126
  540    HB2  PRO  71           2HB      PRO  71   3.225   0.250  -7.940
  541    HB3  PRO  71           1HB      PRO  71   2.880  -1.435  -8.348
  542    HG2  PRO  71           2HG      PRO  71   0.972   0.795  -7.734
  543    HG3  PRO  71           1HG      PRO  71   0.886  -0.429  -9.017
  544    HD2  PRO  71           2HD      PRO  71  -0.550  -0.631  -6.733
  545    HD3  PRO  71           1HD      PRO  71   0.085  -2.058  -7.579
  546    H    GLY  72           H        GLY  72   4.433  -0.934  -4.448
  547    HA2  GLY  72           2HA      GLY  72   3.732   1.400  -3.033
  548    HA3  GLY  72           1HA      GLY  72   5.252   0.543  -2.897
  549    H    THR  73           H        THR  73   5.263   1.220  -6.040
  550    HA   THR  73           HA       THR  73   7.007   3.498  -5.741
  551    HB   THR  73           HB       THR  73   7.223   3.362  -8.235
  552    HG1  THR  73           HG1      THR  73   6.188   1.661  -9.306
  553   HG21  THR  73          3HG2      THR  73   8.419   1.226  -8.265
  554   HG22  THR  73          1HG2      THR  73   7.612   0.739  -6.774
  555   HG23  THR  73          2HG2      THR  73   8.739   2.097  -6.765
  556    H    TYR  74           H        TYR  74   3.653   3.141  -6.220
  557    HA   TYR  74           HA       TYR  74   3.438   5.845  -7.398
  558    HB2  TYR  74           2HB      TYR  74   1.445   3.565  -7.407
  559    HB3  TYR  74           1HB      TYR  74   1.127   5.171  -8.055
  560    HD1  TYR  74           HD2      TYR  74   2.305   5.943 -10.090
  561    HD2  TYR  74           HD1      TYR  74   2.778   1.970  -8.631
  562    HE1  TYR  74           HE2      TYR  74   3.245   5.264 -12.256
  563    HE2  TYR  74           HE1      TYR  74   3.723   1.285 -10.793
  564    HH   TYR  74           HH       TYR  74   4.724   3.504 -13.152
  565    H    VAL  75           H        VAL  75   3.473   4.606  -4.425
  566    HA   VAL  75           HA       VAL  75   1.297   6.353  -3.455
  567    HB   VAL  75           HB       VAL  75   0.763   4.806  -1.664
  568   HG11  VAL  75          1HG1      VAL  75  -0.239   2.974  -2.956
  569   HG12  VAL  75          2HG1      VAL  75   0.762   3.407  -4.342
  570   HG13  VAL  75          3HG1      VAL  75  -0.462   4.532  -3.753
  571   HG21  VAL  75          3HG2      VAL  75   2.867   2.991  -2.856
  572   HG22  VAL  75          1HG2      VAL  75   1.746   2.544  -1.567
  573   HG23  VAL  75          2HG2      VAL  75   2.946   3.806  -1.293
  574    H    GLU  76           H        GLU  76   1.737   7.630  -1.713
  575    HA   GLU  76           HA       GLU  76   4.456   7.667  -0.645
  576    HB2  GLU  76           2HB      GLU  76   3.852   9.811   0.335
  577    HB3  GLU  76           1HB      GLU  76   3.384   9.789  -1.362
  578    HG2  GLU  76           2HG      GLU  76   1.065   9.265  -0.681
  579    HG3  GLU  76           1HG      GLU  76   1.557   9.402   1.005
  580    H    PHE  77           H        PHE  77   4.787   7.835   1.722
  581    HA   PHE  77           HA       PHE  77   2.892   6.099   3.162
  582    HB2  PHE  77           2HB      PHE  77   5.177   5.230   3.002
  583    HB3  PHE  77           1HB      PHE  77   5.802   6.693   3.755
  584    HD1  PHE  77           HD2      PHE  77   3.364   3.935   4.408
  585    HD2  PHE  77           HD1      PHE  77   6.182   6.685   6.036
  586    HE1  PHE  77           HE2      PHE  77   3.099   2.894   6.619
  587    HE2  PHE  77           HE1      PHE  77   5.917   5.652   8.248
  588    HZ   PHE  77           HZ       PHE  77   4.376   3.753   8.545
  589    H    LEU  78           H        LEU  78   1.666   6.933   4.716
  590    HA   LEU  78           HA       LEU  78   2.153   9.651   5.666
  591    HB2  LEU  78           2HB      LEU  78  -0.163   7.797   6.266
  592    HB3  LEU  78           1HB      LEU  78  -0.091   9.518   6.602
  593    HG   LEU  78           HG       LEU  78  -0.140   8.255   3.849
  594   HD11  LEU  78          1HD1      LEU  78  -2.258   9.804   5.345
  595   HD12  LEU  78          2HD1      LEU  78  -2.283   8.076   4.986
  596   HD13  LEU  78          3HD1      LEU  78  -2.371   9.250   3.673
  597   HD21  LEU  78          3HD2      LEU  78  -0.370  10.544   3.010
  598   HD22  LEU  78          1HD2      LEU  78   1.161  10.321   3.856
  599   HD23  LEU  78          2HD2      LEU  78  -0.168  11.170   4.648
  600    H    GLY  79           H        GLY  79   1.328   6.529   7.215
  601    HA2  GLY  79           2HA      GLY  79   3.206   6.055   9.005
  602    HA3  GLY  79           1HA      GLY  79   2.484   7.476   9.745
  603    HA   PRO  80           HA       PRO  80   0.184   3.656  11.259
  604    HB2  PRO  80           2HB      PRO  80   0.423   4.242  13.917
  605    HB3  PRO  80           1HB      PRO  80   1.594   3.261  13.031
  606    HG2  PRO  80           2HG      PRO  80   1.721   6.169  13.753
  607    HG3  PRO  80           1HG      PRO  80   2.996   4.937  13.844
  608    HD2  PRO  80           2HD      PRO  80   2.862   6.718  11.812
  609    HD3  PRO  80           1HD      PRO  80   3.452   5.061  11.573
  610    H    LEU  81           H        LEU  81  -1.992   3.789  11.533
  611    HA   LEU  81           HA       LEU  81  -3.265   6.310  11.376
  612    HB2  LEU  81           2HB      LEU  81  -5.388   4.913  11.695
  613    HB3  LEU  81           1HB      LEU  81  -4.398   4.626  10.280
  614    HG   LEU  81           HG       LEU  81  -3.381   2.661  11.547
  615   HD11  LEU  81          1HD1      LEU  81  -5.760   3.135  13.338
  616   HD12  LEU  81          2HD1      LEU  81  -4.060   3.259  13.795
  617   HD13  LEU  81          3HD1      LEU  81  -4.740   1.695  13.342
  618   HD21  LEU  81          3HD2      LEU  81  -5.240   1.177  10.982
  619   HD22  LEU  81          1HD2      LEU  81  -4.978   2.387   9.724
  620   HD23  LEU  81          2HD2      LEU  81  -6.319   2.567  10.857
  621    H    GLU  82           H        GLU  82  -5.038   7.062  12.772
  622    HA   GLU  82           HA       GLU  82  -4.119   7.754  15.307
  623    HB2  GLU  82           2HB      GLU  82  -6.907   7.824  14.141
  624    HB3  GLU  82           1HB      GLU  82  -6.508   8.516  15.706
  625    HG2  GLU  82           2HG      GLU  82  -6.561  10.253  14.048
  626    HG3  GLU  82           1HG      GLU  82  -4.906  10.030  14.608
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1  -5.087   4.105  19.435
    2    H2   MET   1           2H       MET   1  -5.242   3.657  21.060
    3    H3   MET   1           3H       MET   1  -6.575   4.278  20.227
    4    HA   MET   1           HA       MET   1  -5.195   1.723  19.598
    5    HB2  MET   1           2HB      MET   1  -7.141   0.603  20.547
    6    HB3  MET   1           1HB      MET   1  -6.422   1.663  21.751
    7    HG2  MET   1           2HG      MET   1  -8.145   3.333  21.333
    8    HG3  MET   1           1HG      MET   1  -8.857   2.302  20.094
    9    HE1  MET   1           3HE      MET   1 -10.550   3.523  22.473
   10    HE2  MET   1           1HE      MET   1 -11.521   2.125  22.936
   11    HE3  MET   1           2HE      MET   1 -11.220   2.465  21.233
   12    H    ALA   2           H        ALA   2  -6.111   4.060  17.835
   13    HA   ALA   2           HA       ALA   2  -8.553   3.148  16.596
   14    HB1  ALA   2           3HB      ALA   2  -6.673   5.345  15.736
   15    HB2  ALA   2           1HB      ALA   2  -8.064   5.537  16.801
   16    HB3  ALA   2           2HB      ALA   2  -8.301   5.067  15.119
   17    H    GLY   3           H        GLY   3  -7.999   1.045  15.825
   18    HA2  GLY   3           2HA      GLY   3  -7.923  -0.072  13.738
   19    HA3  GLY   3           1HA      GLY   3  -6.894   1.203  13.110
   20    HA   PRO   4           HA       PRO   4  -4.125  -2.410  13.995
   21    HB2  PRO   4           2HB      PRO   4  -2.954  -2.564  11.579
   22    HB3  PRO   4           1HB      PRO   4  -4.545  -3.272  11.883
   23    HG2  PRO   4           2HG      PRO   4  -3.856  -0.664  10.579
   24    HG3  PRO   4           1HG      PRO   4  -5.045  -1.881  10.081
   25    HD2  PRO   4           2HD      PRO   4  -5.698   0.397  11.458
   26    HD3  PRO   4           1HD      PRO   4  -6.634  -1.109  11.556
   27    H    GLU   5           H        GLU   5  -1.937  -2.358  14.481
   28    HA   GLU   5           HA       GLU   5  -0.746   0.248  14.763
   29    HB2  GLU   5           2HB      GLU   5   0.151  -2.524  15.548
   30    HB3  GLU   5           1HB      GLU   5   1.145  -1.097  15.818
   31    HG2  GLU   5           2HG      GLU   5  -0.575  -0.127  17.226
   32    HG3  GLU   5           1HG      GLU   5  -1.639  -1.494  16.904
   33    H    GLY   6           H        GLY   6  -0.958  -1.265  12.024
   34    HA2  GLY   6           2HA      GLY   6   1.775  -1.448  11.140
   35    HA3  GLY   6           1HA      GLY   6   0.343  -1.505  10.124
   36    H    PHE   7           H        PHE   7   0.717  -0.024   8.558
   37    HA   PHE   7           HA       PHE   7   1.138   2.763   9.387
   38    HB2  PHE   7           2HB      PHE   7   2.790   1.350   7.274
   39    HB3  PHE   7           1HB      PHE   7   2.787   3.090   7.531
   40    HD1  PHE   7           HD2      PHE   7   3.833  -0.148   8.898
   41    HD2  PHE   7           HD1      PHE   7   3.922   4.077   9.427
   42    HE1  PHE   7           HE2      PHE   7   5.614  -0.402  10.570
   43    HE2  PHE   7           HE1      PHE   7   5.703   3.830  11.107
   44    HZ   PHE   7           HZ       PHE   7   6.556   1.588  11.682
   45    H    GLN   8           H        GLN   8   0.467   4.336   7.808
   46    HA   GLN   8           HA       GLN   8  -1.436   3.246   5.827
   47    HB2  GLN   8           2HB      GLN   8  -1.505   5.877   7.319
   48    HB3  GLN   8           1HB      GLN   8  -2.604   5.458   6.012
   49    HG2  GLN   8           2HG      GLN   8  -3.420   3.546   7.331
   50    HG3  GLN   8           1HG      GLN   8  -2.348   4.018   8.650
   51   HE21  GLN   8          1HE2      GLN   8  -2.809   5.922   9.806
   52   HE22  GLN   8          2HE2      GLN   8  -4.381   6.633   9.776
   53    H    TYR   9           H        TYR   9  -1.304   3.810   3.750
   54    HA   TYR   9           HA       TYR   9   0.749   5.780   2.942
   55    HB2  TYR   9           2HB      TYR   9  -0.323   3.416   1.375
   56    HB3  TYR   9           1HB      TYR   9   0.921   4.537   0.829
   57    HD1  TYR   9           HD2      TYR   9   3.126   4.607   2.080
   58    HD2  TYR   9           HD1      TYR   9   0.237   1.546   2.721
   59    HE1  TYR   9           HE2      TYR   9   4.858   3.193   3.100
   60    HE2  TYR   9           HE1      TYR   9   1.961   0.127   3.747
   61    HH   TYR   9           HH       TYR   9   4.470  -0.087   3.640
   62    H    ARG  10           H        ARG  10   0.211   6.681   0.636
   63    HA   ARG  10           HA       ARG  10  -2.678   7.219   0.386
   64    HB2  ARG  10           2HB      ARG  10  -1.681   9.056   1.663
   65    HB3  ARG  10           1HB      ARG  10  -0.487   9.305   0.398
   66    HG2  ARG  10           2HG      ARG  10  -2.296   9.920  -1.160
   67    HG3  ARG  10           1HG      ARG  10  -3.464   9.723   0.151
   68    HD2  ARG  10           2HD      ARG  10  -2.375  11.483   1.422
   69    HD3  ARG  10           1HD      ARG  10  -1.129  11.640   0.188
   70    HE   ARG  10           HE       ARG  10  -3.969  12.257  -0.324
   71   HH11  ARG  10          1HH1      ARG  10  -0.616  13.024  -0.559
   72   HH12  ARG  10          2HH1      ARG  10  -0.906  14.427  -1.533
   73   HH21  ARG  10          1HH2      ARG  10  -4.318  14.049  -1.567
   74   HH22  ARG  10          2HH2      ARG  10  -2.975  14.998  -2.105
   75    H    ALA  11           H        ALA  11  -3.345   6.822  -1.629
   76    HA   ALA  11           HA       ALA  11  -1.521   6.255  -3.748
   77    HB1  ALA  11           3HB      ALA  11  -3.656   5.085  -3.511
   78    HB2  ALA  11           1HB      ALA  11  -3.511   5.845  -5.096
   79    HB3  ALA  11           2HB      ALA  11  -4.520   6.585  -3.851
   80    H    LEU  12           H        LEU  12  -0.670   7.574  -5.232
   81    HA   LEU  12           HA       LEU  12  -1.287  10.394  -5.166
   82    HB2  LEU  12           2HB      LEU  12   0.646   8.893  -6.940
   83    HB3  LEU  12           1HB      LEU  12   0.594  10.630  -6.694
   84    HG   LEU  12           HG       LEU  12   1.327   8.549  -4.623
   85   HD11  LEU  12          1HD1      LEU  12   3.538   9.578  -4.695
   86   HD12  LEU  12          2HD1      LEU  12   2.994  10.687  -5.954
   87   HD13  LEU  12          3HD1      LEU  12   3.080   8.956  -6.282
   88   HD21  LEU  12          3HD2      LEU  12   1.795  10.446  -3.141
   89   HD22  LEU  12          1HD2      LEU  12   0.090  10.374  -3.586
   90   HD23  LEU  12          2HD2      LEU  12   1.154  11.553  -4.357
   91    H    TYR  13           H        TYR  13  -1.527   7.805  -7.591
   92    HA   TYR  13           HA       TYR  13  -3.461   9.423  -9.096
   93    HB2  TYR  13           2HB      TYR  13  -0.988   8.101 -10.236
   94    HB3  TYR  13           1HB      TYR  13  -2.354   8.579 -11.238
   95    HD1  TYR  13           HD1      TYR  13  -2.938  10.983 -11.472
   96    HD2  TYR  13           HD2      TYR  13   0.584   9.735  -9.427
   97    HE1  TYR  13           HE1      TYR  13  -2.037  13.261 -11.640
   98    HE2  TYR  13           HE2      TYR  13   1.492  12.015  -9.592
   99    HH   TYR  13           HH       TYR  13   1.222  14.019 -10.918
  100    HA   PRO  14           HA       PRO  14  -5.848   5.739  -9.336
  101    HB2  PRO  14           2HB      PRO  14  -6.917   5.812 -11.850
  102    HB3  PRO  14           1HB      PRO  14  -7.466   6.836 -10.518
  103    HG2  PRO  14           2HG      PRO  14  -5.608   7.488 -12.774
  104    HG3  PRO  14           1HG      PRO  14  -6.898   8.474 -12.059
  105    HD2  PRO  14           2HD      PRO  14  -4.277   8.854 -11.473
  106    HD3  PRO  14           1HD      PRO  14  -5.571   9.160 -10.297
  107    H    PHE  15           H        PHE  15  -5.164   3.720  -9.444
  108    HA   PHE  15           HA       PHE  15  -3.759   2.763 -11.856
  109    HB2  PHE  15           2HB      PHE  15  -2.132   2.980 -10.069
  110    HB3  PHE  15           1HB      PHE  15  -3.178   2.108  -8.954
  111    HD1  PHE  15           HD1      PHE  15  -1.356   1.685 -12.183
  112    HD2  PHE  15           HD2      PHE  15  -2.901  -0.189  -8.680
  113    HE1  PHE  15           HE1      PHE  15  -0.280  -0.426 -12.837
  114    HE2  PHE  15           HE2      PHE  15  -1.822  -2.298  -9.335
  115    HZ   PHE  15           HZ       PHE  15  -0.511  -2.421 -11.413
  116    H    ARG  16           H        ARG  16  -4.848   1.174 -12.850
  117    HA   ARG  16           HA       ARG  16  -6.330  -0.772 -11.217
  118    HB2  ARG  16           2HB      ARG  16  -8.169  -0.772 -12.897
  119    HB3  ARG  16           1HB      ARG  16  -8.022   0.741 -12.020
  120    HG2  ARG  16           2HG      ARG  16  -8.416   1.424 -14.202
  121    HG3  ARG  16           1HG      ARG  16  -6.664   1.557 -14.058
  122    HD2  ARG  16           2HD      ARG  16  -6.471  -0.690 -15.128
  123    HD3  ARG  16           1HD      ARG  16  -8.216  -0.676 -15.374
  124    HE   ARG  16           HE       ARG  16  -7.581   1.555 -16.606
  125   HH11  ARG  16          1HH1      ARG  16  -5.911  -1.451 -16.673
  126   HH12  ARG  16          2HH1      ARG  16  -5.327  -1.219 -18.283
  127   HH21  ARG  16          1HH2      ARG  16  -6.814   1.843 -18.674
  128   HH22  ARG  16          2HH2      ARG  16  -5.832   0.615 -19.397
  129    H    ARG  17           H        ARG  17  -6.675  -2.861 -12.280
  130    HA   ARG  17           HA       ARG  17  -4.873  -3.315 -14.570
  131    HB2  ARG  17           2HB      ARG  17  -4.884  -4.774 -11.952
  132    HB3  ARG  17           1HB      ARG  17  -4.352  -5.589 -13.417
  133    HG2  ARG  17           2HG      ARG  17  -2.719  -3.683 -13.741
  134    HG3  ARG  17           1HG      ARG  17  -3.143  -3.158 -12.109
  135    HD2  ARG  17           2HD      ARG  17  -1.106  -4.552 -12.166
  136    HD3  ARG  17           1HD      ARG  17  -2.394  -5.267 -11.196
  137    HE   ARG  17           HE       ARG  17  -2.094  -6.133 -13.974
  138   HH11  ARG  17          1HH1      ARG  17  -1.759  -6.846 -10.613
  139   HH12  ARG  17          2HH1      ARG  17  -1.622  -8.548 -10.896
  140   HH21  ARG  17          1HH2      ARG  17  -1.903  -8.306 -14.292
  141   HH22  ARG  17          2HH2      ARG  17  -1.687  -9.359 -12.933
  142    H    GLU  18           H        GLU  18  -5.303  -5.091 -15.889
  143    HA   GLU  18           HA       GLU  18  -8.043  -5.694 -16.338
  144    HB2  GLU  18           2HB      GLU  18  -5.580  -7.077 -17.439
  145    HB3  GLU  18           1HB      GLU  18  -7.202  -7.147 -18.119
  146    HG2  GLU  18           2HG      GLU  18  -7.113  -4.956 -18.896
  147    HG3  GLU  18           1HG      GLU  18  -5.805  -4.513 -17.799
  148    H    ARG  19           H        ARG  19  -5.368  -7.471 -14.880
  149    HA   ARG  19           HA       ARG  19  -6.956  -9.857 -14.435
  150    HB2  ARG  19           2HB      ARG  19  -4.127  -9.148 -13.604
  151    HB3  ARG  19           1HB      ARG  19  -4.867 -10.737 -13.423
  152    HG2  ARG  19           2HG      ARG  19  -4.924 -11.112 -15.739
  153    HG3  ARG  19           1HG      ARG  19  -4.697  -9.404 -16.111
  154    HD2  ARG  19           2HD      ARG  19  -2.660 -10.529 -16.613
  155    HD3  ARG  19           1HD      ARG  19  -2.397  -9.575 -15.157
  156    HE   ARG  19           HE       ARG  19  -3.093 -12.124 -14.321
  157   HH11  ARG  19          1HH1      ARG  19  -0.561 -10.655 -16.160
  158   HH12  ARG  19          2HH1      ARG  19   0.591 -11.865 -15.727
  159   HH21  ARG  19          1HH2      ARG  19  -1.563 -13.676 -13.794
  160   HH22  ARG  19          2HH2      ARG  19   0.042 -13.529 -14.423
  161    HA   PRO  20           HA       PRO  20  -8.747  -8.109 -10.794
  162    HB2  PRO  20           2HB      PRO  20 -10.068 -10.280  -9.860
  163    HB3  PRO  20           1HB      PRO  20 -10.561  -9.417 -11.323
  164    HG2  PRO  20           2HG      PRO  20  -8.919 -11.921 -11.069
  165    HG3  PRO  20           1HG      PRO  20 -10.290 -11.595 -12.149
  166    HD2  PRO  20           2HD      PRO  20  -7.735 -11.426 -13.005
  167    HD3  PRO  20           1HD      PRO  20  -8.998 -10.337 -13.615
  168    H    GLU  21           H        GLU  21  -6.086 -10.033 -10.546
  169    HA   GLU  21           HA       GLU  21  -6.244 -10.802  -7.780
  170    HB2  GLU  21           2HB      GLU  21  -4.885 -12.086  -9.334
  171    HB3  GLU  21           1HB      GLU  21  -3.906 -10.671  -9.694
  172    HG2  GLU  21           2HG      GLU  21  -3.129 -10.645  -7.349
  173    HG3  GLU  21           1HG      GLU  21  -4.057 -12.114  -7.049
  174    H    ASP  22           H        ASP  22  -5.364  -7.894  -9.423
  175    HA   ASP  22           HA       ASP  22  -3.585  -6.954  -7.322
  176    HB2  ASP  22           2HB      ASP  22  -3.654  -6.525 -10.013
  177    HB3  ASP  22           1HB      ASP  22  -4.450  -5.063  -9.434
  178    H    LEU  23           H        LEU  23  -4.211  -4.194  -7.320
  179    HA   LEU  23           HA       LEU  23  -6.927  -4.073  -6.177
  180    HB2  LEU  23           2HB      LEU  23  -5.371  -4.438  -4.329
  181    HB3  LEU  23           1HB      LEU  23  -4.397  -3.079  -4.856
  182    HG   LEU  23           HG       LEU  23  -6.253  -1.540  -4.334
  183   HD11  LEU  23          1HD1      LEU  23  -8.139  -3.011  -4.694
  184   HD12  LEU  23          2HD1      LEU  23  -8.189  -2.369  -3.053
  185   HD13  LEU  23          3HD1      LEU  23  -7.649  -4.025  -3.337
  186   HD21  LEU  23          3HD2      LEU  23  -5.463  -3.358  -2.051
  187   HD22  LEU  23          1HD2      LEU  23  -6.123  -1.729  -1.889
  188   HD23  LEU  23          2HD2      LEU  23  -4.550  -1.971  -2.646
  189    H    GLU  24           H        GLU  24  -8.021  -2.510  -7.187
  190    HA   GLU  24           HA       GLU  24  -6.883  -0.431  -8.715
  191    HB2  GLU  24           2HB      GLU  24  -9.655  -0.923  -7.649
  192    HB3  GLU  24           1HB      GLU  24  -9.274   0.558  -8.511
  193    HG2  GLU  24           2HG      GLU  24 -10.305  -1.099  -9.965
  194    HG3  GLU  24           1HG      GLU  24  -8.672  -0.703 -10.487
  195    H    LEU  25           H        LEU  25  -5.827   1.292  -8.015
  196    HA   LEU  25           HA       LEU  25  -6.453   2.449  -5.380
  197    HB2  LEU  25           2HB      LEU  25  -4.070   2.994  -7.159
  198    HB3  LEU  25           1HB      LEU  25  -4.282   3.523  -5.501
  199    HG   LEU  25           HG       LEU  25  -3.894   0.677  -6.441
  200   HD11  LEU  25          1HD1      LEU  25  -1.861   2.045  -6.480
  201   HD12  LEU  25          2HD1      LEU  25  -1.784   0.797  -5.238
  202   HD13  LEU  25          3HD1      LEU  25  -2.113   2.470  -4.786
  203   HD21  LEU  25          3HD2      LEU  25  -4.313   1.736  -3.644
  204   HD22  LEU  25          1HD2      LEU  25  -3.871   0.079  -4.058
  205   HD23  LEU  25          2HD2      LEU  25  -5.435   0.727  -4.557
  206    H    LEU  26           H        LEU  26  -7.282   4.479  -5.180
  207    HA   LEU  26           HA       LEU  26  -7.642   6.070  -7.641
  208    HB2  LEU  26           2HB      LEU  26  -9.353   5.758  -5.187
  209    HB3  LEU  26           1HB      LEU  26  -9.494   7.191  -6.184
  210    HG   LEU  26           HG       LEU  26 -11.221   5.596  -6.768
  211   HD11  LEU  26          1HD1      LEU  26 -10.297   6.999  -8.549
  212   HD12  LEU  26          2HD1      LEU  26 -10.858   5.445  -9.161
  213   HD13  LEU  26          3HD1      LEU  26  -9.132   5.734  -8.940
  214   HD21  LEU  26          3HD2      LEU  26 -10.047   3.544  -6.061
  215   HD22  LEU  26          1HD2      LEU  26  -9.017   3.665  -7.489
  216   HD23  LEU  26          2HD2      LEU  26 -10.753   3.404  -7.672
  217    HA   PRO  27           HA       PRO  27  -4.949   9.170  -6.074
  218    HB2  PRO  27           2HB      PRO  27  -6.070  11.453  -7.092
  219    HB3  PRO  27           1HB      PRO  27  -5.147  10.298  -8.061
  220    HG2  PRO  27           2HG      PRO  27  -8.120  10.571  -7.761
  221    HG3  PRO  27           1HG      PRO  27  -7.164  10.307  -9.233
  222    HD2  PRO  27           2HD      PRO  27  -8.459   8.291  -8.003
  223    HD3  PRO  27           1HD      PRO  27  -6.890   8.042  -8.798
  224    H    GLY  28           H        GLY  28  -4.781   9.887  -4.047
  225    HA2  GLY  28           2HA      GLY  28  -5.216  11.351  -2.271
  226    HA3  GLY  28           1HA      GLY  28  -6.811  11.658  -2.932
  227    H    ASP  29           H        ASP  29  -6.358   8.347  -2.863
  228    HA   ASP  29           HA       ASP  29  -7.993   8.117  -0.448
  229    HB2  ASP  29           2HB      ASP  29  -8.614   6.993  -2.624
  230    HB3  ASP  29           1HB      ASP  29  -7.233   5.927  -2.393
  231    H    VAL  30           H        VAL  30  -7.481   6.654   1.273
  232    HA   VAL  30           HA       VAL  30  -4.582   6.468   1.713
  233    HB   VAL  30           HB       VAL  30  -6.855   6.319   3.710
  234   HG11  VAL  30          1HG1      VAL  30  -4.908   5.033   4.450
  235   HG12  VAL  30          2HG1      VAL  30  -5.118   6.486   5.426
  236   HG13  VAL  30          3HG1      VAL  30  -3.871   6.437   4.180
  237   HG21  VAL  30          3HG2      VAL  30  -6.100   8.548   4.419
  238   HG22  VAL  30          1HG2      VAL  30  -6.617   8.548   2.732
  239   HG23  VAL  30          2HG2      VAL  30  -4.898   8.553   3.127
  240    H    LEU  31           H        LEU  31  -3.546   4.586   1.950
  241    HA   LEU  31           HA       LEU  31  -5.093   2.087   1.816
  242    HB2  LEU  31           2HB      LEU  31  -2.187   2.623   1.163
  243    HB3  LEU  31           1HB      LEU  31  -2.956   1.051   1.078
  244    HG   LEU  31           HG       LEU  31  -4.517   2.016  -0.670
  245   HD11  LEU  31          1HD1      LEU  31  -4.216   4.383  -0.189
  246   HD12  LEU  31          2HD1      LEU  31  -3.781   4.025  -1.858
  247   HD13  LEU  31          3HD1      LEU  31  -2.518   4.278  -0.654
  248   HD21  LEU  31          3HD2      LEU  31  -1.560   1.930  -1.270
  249   HD22  LEU  31          1HD2      LEU  31  -2.847   1.851  -2.475
  250   HD23  LEU  31          2HD2      LEU  31  -2.678   0.565  -1.281
  251    H    VAL  32           H        VAL  32  -5.325   1.004   3.672
  252    HA   VAL  32           HA       VAL  32  -3.498   1.513   5.902
  253    HB   VAL  32           HB       VAL  32  -6.079  -0.073   5.877
  254   HG11  VAL  32          1HG1      VAL  32  -4.616  -0.715   7.713
  255   HG12  VAL  32          2HG1      VAL  32  -6.000   0.190   8.324
  256   HG13  VAL  32          3HG1      VAL  32  -4.426   0.974   8.183
  257   HG21  VAL  32          3HG2      VAL  32  -7.102   1.906   6.914
  258   HG22  VAL  32          1HG2      VAL  32  -6.486   2.270   5.302
  259   HG23  VAL  32          2HG2      VAL  32  -5.587   2.788   6.727
  260    H    VAL  33           H        VAL  33  -1.811   0.196   6.236
  261    HA   VAL  33           HA       VAL  33  -2.031  -2.644   5.433
  262    HB   VAL  33           HB       VAL  33   0.465  -0.938   5.619
  263   HG11  VAL  33          1HG1      VAL  33   1.626  -2.879   4.650
  264   HG12  VAL  33          2HG1      VAL  33   0.137  -3.819   4.765
  265   HG13  VAL  33          3HG1      VAL  33   0.935  -3.248   6.231
  266   HG21  VAL  33          3HG2      VAL  33  -0.915  -0.373   3.683
  267   HG22  VAL  33          1HG2      VAL  33  -0.960  -2.071   3.202
  268   HG23  VAL  33          2HG2      VAL  33   0.566  -1.185   3.182
  269    H    SER  34           H        SER  34  -2.124  -4.037   7.067
  270    HA   SER  34           HA       SER  34  -1.728  -3.328   9.785
  271    HB2  SER  34           2HB      SER  34  -1.945  -6.090   8.544
  272    HB3  SER  34           1HB      SER  34  -2.116  -5.719  10.260
  273    HG   SER  34           HG       SER  34  -4.153  -5.851   9.293
  274    H    ARG  35           H        ARG  35  -0.148  -4.025  11.278
  275    HA   ARG  35           HA       ARG  35   2.514  -3.783  10.486
  276    HB2  ARG  35           2HB      ARG  35   1.691  -3.387  12.781
  277    HB3  ARG  35           1HB      ARG  35   1.421  -5.112  12.982
  278    HG2  ARG  35           2HG      ARG  35   3.451  -4.508  14.100
  279    HG3  ARG  35           1HG      ARG  35   3.858  -5.482  12.688
  280    HD2  ARG  35           2HD      ARG  35   5.391  -3.609  12.900
  281    HD3  ARG  35           1HD      ARG  35   4.411  -3.437  11.445
  282    HE   ARG  35           HE       ARG  35   2.998  -1.942  13.069
  283   HH11  ARG  35          1HH1      ARG  35   6.435  -2.150  12.892
  284   HH12  ARG  35          2HH1      ARG  35   6.660  -0.500  13.364
  285   HH21  ARG  35          1HH2      ARG  35   3.297   0.159  13.671
  286   HH22  ARG  35          2HH2      ARG  35   4.902   0.792  13.811
  287    H    ALA  36           H        ALA  36   0.697  -6.748  11.281
  288    HA   ALA  36           HA       ALA  36   2.713  -8.630  11.088
  289    HB1  ALA  36           3HB      ALA  36   0.981 -10.278  10.714
  290    HB2  ALA  36           1HB      ALA  36  -0.158  -9.015  10.241
  291    HB3  ALA  36           2HB      ALA  36   0.434  -9.092  11.900
  292    H    ALA  37           H        ALA  37   0.960  -7.062   8.462
  293    HA   ALA  37           HA       ALA  37   1.739  -8.788   6.368
  294    HB1  ALA  37           3HB      ALA  37   1.160  -6.943   4.869
  295    HB2  ALA  37           1HB      ALA  37   1.104  -5.837   6.244
  296    HB3  ALA  37           2HB      ALA  37  -0.062  -7.155   6.123
  297    H    LEU  38           H        LEU  38   3.182  -5.733   7.521
  298    HA   LEU  38           HA       LEU  38   5.412  -5.775   5.779
  299    HB2  LEU  38           2HB      LEU  38   5.100  -4.452   8.479
  300    HB3  LEU  38           1HB      LEU  38   6.396  -4.121   7.343
  301    HG   LEU  38           HG       LEU  38   3.454  -3.569   6.894
  302   HD11  LEU  38          1HD1      LEU  38   4.505  -2.026   8.472
  303   HD12  LEU  38          2HD1      LEU  38   4.109  -1.220   6.956
  304   HD13  LEU  38          3HD1      LEU  38   5.776  -1.682   7.299
  305   HD21  LEU  38          3HD2      LEU  38   5.819  -3.005   5.095
  306   HD22  LEU  38          1HD2      LEU  38   4.157  -2.486   4.811
  307   HD23  LEU  38          2HD2      LEU  38   4.558  -4.203   4.802
  308    H    GLN  39           H        GLN  39   4.888  -7.117   9.009
  309    HA   GLN  39           HA       GLN  39   7.502  -7.992   9.546
  310    HB2  GLN  39           2HB      GLN  39   4.904  -9.348  10.329
  311    HB3  GLN  39           1HB      GLN  39   6.473  -9.618  11.077
  312    HG2  GLN  39           2HG      GLN  39   4.900  -7.044  11.119
  313    HG3  GLN  39           1HG      GLN  39   5.060  -8.184  12.449
  314   HE21  GLN  39          1HE2      GLN  39   7.043  -8.324  13.534
  315   HE22  GLN  39          2HE2      GLN  39   8.223  -7.067  13.428
  316    H    ALA  40           H        ALA  40   4.843  -9.610   7.821
  317    HA   ALA  40           HA       ALA  40   6.213 -12.000   7.212
  318    HB1  ALA  40           3HB      ALA  40   4.469 -12.363   5.539
  319    HB2  ALA  40           1HB      ALA  40   3.964 -10.679   5.683
  320    HB3  ALA  40           2HB      ALA  40   3.778 -11.776   7.052
  321    H    LEU  41           H        LEU  41   5.907  -8.941   5.421
  322    HA   LEU  41           HA       LEU  41   7.399  -9.670   3.141
  323    HB2  LEU  41           2HB      LEU  41   7.108  -6.961   4.460
  324    HB3  LEU  41           1HB      LEU  41   7.763  -7.224   2.854
  325    HG   LEU  41           HG       LEU  41   4.925  -7.857   3.701
  326   HD11  LEU  41          1HD1      LEU  41   4.287  -5.939   2.339
  327   HD12  LEU  41          2HD1      LEU  41   5.987  -5.586   2.022
  328   HD13  LEU  41          3HD1      LEU  41   5.349  -5.457   3.663
  329   HD21  LEU  41          3HD2      LEU  41   6.226  -7.921   0.973
  330   HD22  LEU  41          1HD2      LEU  41   4.510  -8.171   1.305
  331   HD23  LEU  41          2HD2      LEU  41   5.703  -9.322   1.910
  332    H    GLY  42           H        GLY  42   8.396  -9.126   6.371
  333    HA2  GLY  42           2HA      GLY  42  10.492  -9.419   7.320
  334    HA3  GLY  42           1HA      GLY  42  11.159  -9.623   5.707
  335    H    VAL  43           H        VAL  43   9.299  -6.863   6.930
  336    HA   VAL  43           HA       VAL  43  11.584  -5.116   6.264
  337    HB   VAL  43           HB       VAL  43   8.657  -4.389   6.596
  338   HG11  VAL  43          1HG1      VAL  43  10.988  -2.723   5.619
  339   HG12  VAL  43          2HG1      VAL  43  10.131  -2.520   7.147
  340   HG13  VAL  43          3HG1      VAL  43   9.297  -2.223   5.624
  341   HG21  VAL  43          3HG2      VAL  43   8.672  -4.105   4.142
  342   HG22  VAL  43          1HG2      VAL  43   8.992  -5.772   4.624
  343   HG23  VAL  43          2HG2      VAL  43  10.317  -4.738   4.092
  344    H    ALA  44           H        ALA  44  12.733  -4.300   7.895
  345    HA   ALA  44           HA       ALA  44  11.697  -4.152  10.603
  346    HB1  ALA  44           3HB      ALA  44  14.332  -3.183   9.478
  347    HB2  ALA  44           1HB      ALA  44  14.044  -4.766  10.199
  348    HB3  ALA  44           2HB      ALA  44  13.916  -3.310  11.187
  349    H    GLU  45           H        GLU  45  11.131  -2.270  11.710
  350    HA   GLU  45           HA       GLU  45   9.813  -0.316  10.245
  351    HB2  GLU  45           2HB      GLU  45   9.382  -0.849  12.643
  352    HB3  GLU  45           1HB      GLU  45  10.850   0.022  13.069
  353    HG2  GLU  45           2HG      GLU  45   9.916   2.085  12.194
  354    HG3  GLU  45           1HG      GLU  45   8.467   1.231  11.665
  355    H    GLY  46           H        GLY  46  10.489   1.318   9.062
  356    HA2  GLY  46           2HA      GLY  46  11.947   3.394   9.099
  357    HA3  GLY  46           1HA      GLY  46  13.273   2.281   9.411
  358    H    GLY  47           H        GLY  47  11.611   0.407   7.517
  359    HA2  GLY  47           2HA      GLY  47  12.917   1.347   5.047
  360    HA3  GLY  47           1HA      GLY  47  12.371  -0.290   5.368
  361    H    GLU  48           H        GLU  48   9.764   0.305   6.258
  362    HA   GLU  48           HA       GLU  48   8.287   0.430   3.895
  363    HB2  GLU  48           2HB      GLU  48   6.314   0.579   5.290
  364    HB3  GLU  48           1HB      GLU  48   7.460  -0.532   6.022
  365    HG2  GLU  48           2HG      GLU  48   6.889   2.302   6.878
  366    HG3  GLU  48           1HG      GLU  48   6.426   0.828   7.723
  367    H    ARG  49           H        ARG  49   9.501   3.005   5.893
  368    HA   ARG  49           HA       ARG  49   7.905   5.148   5.148
  369    HB2  ARG  49           2HB      ARG  49  10.896   5.121   5.608
  370    HB3  ARG  49           1HB      ARG  49   9.908   6.575   5.531
  371    HG2  ARG  49           2HG      ARG  49   8.608   5.732   7.478
  372    HG3  ARG  49           1HG      ARG  49   9.738   4.380   7.589
  373    HD2  ARG  49           2HD      ARG  49  10.350   6.131   9.162
  374    HD3  ARG  49           1HD      ARG  49  11.588   5.964   7.917
  375    HE   ARG  49           HE       ARG  49   9.524   8.045   7.692
  376   HH11  ARG  49          1HH1      ARG  49  12.845   7.149   7.919
  377   HH12  ARG  49          2HH1      ARG  49  13.402   8.762   7.647
  378   HH21  ARG  49          1HH2      ARG  49  10.254  10.084   7.324
  379   HH22  ARG  49          2HH2      ARG  49  11.956  10.402   7.288
  380    H    CYS  50           H        CYS  50  10.159   3.369   3.201
  381    HA   CYS  50           HA       CYS  50   9.673   5.253   0.973
  382    HB2  CYS  50           2HB      CYS  50  11.717   4.290  -0.088
  383    HB3  CYS  50           1HB      CYS  50  12.041   5.128   1.424
  384    HG   CYS  50           HG       CYS  50  11.530   1.849   1.821
  385    HA   PRO  51           HA       PRO  51   7.044   1.494   0.169
  386    HB2  PRO  51           2HB      PRO  51   5.793   3.535  -1.613
  387    HB3  PRO  51           1HB      PRO  51   5.031   2.387  -0.506
  388    HG2  PRO  51           2HG      PRO  51   5.207   4.974   0.121
  389    HG3  PRO  51           1HG      PRO  51   5.427   3.720   1.356
  390    HD2  PRO  51           2HD      PRO  51   7.476   5.401  -0.028
  391    HD3  PRO  51           1HD      PRO  51   7.424   4.843   1.656
  392    H    GLN  52           H        GLN  52   8.212   3.858  -2.239
  393    HA   GLN  52           HA       GLN  52   8.046   2.193  -4.493
  394    HB2  GLN  52           2HB      GLN  52   8.367   4.674  -4.518
  395    HB3  GLN  52           1HB      GLN  52  10.037   4.426  -4.027
  396    HG2  GLN  52           2HG      GLN  52  10.483   3.204  -6.087
  397    HG3  GLN  52           1HG      GLN  52   8.799   3.396  -6.578
  398   HE21  GLN  52          1HE2      GLN  52  11.202   4.286  -7.940
  399   HE22  GLN  52          2HE2      GLN  52  11.057   5.996  -8.110
  400    H    SER  53           H        SER  53  10.516   2.467  -2.014
  401    HA   SER  53           HA       SER  53  12.512   0.920  -3.381
  402    HB2  SER  53           2HB      SER  53  13.127   2.500  -1.590
  403    HB3  SER  53           1HB      SER  53  12.233   1.533  -0.420
  404    HG   SER  53           HG       SER  53  14.171   0.683  -0.175
  405    H    VAL  54           H        VAL  54   9.991   0.195  -1.005
  406    HA   VAL  54           HA       VAL  54  10.674  -2.534  -0.615
  407    HB   VAL  54           HB       VAL  54   7.935  -1.269  -0.334
  408   HG11  VAL  54          1HG1      VAL  54   9.102  -3.766   0.913
  409   HG12  VAL  54          2HG1      VAL  54   7.848  -3.703  -0.326
  410   HG13  VAL  54          3HG1      VAL  54   7.525  -3.075   1.289
  411   HG21  VAL  54          3HG2      VAL  54   9.592  -0.027   0.964
  412   HG22  VAL  54          1HG2      VAL  54  10.140  -1.526   1.719
  413   HG23  VAL  54          2HG2      VAL  54   8.510  -0.928   2.027
  414    H    GLY  55           H        GLY  55   8.446  -0.914  -2.864
  415    HA2  GLY  55           2HA      GLY  55   8.118  -1.613  -5.094
  416    HA3  GLY  55           1HA      GLY  55   8.696  -3.211  -4.664
  417    H    TRP  56           H        TRP  56   7.208  -4.513  -3.247
  418    HA   TRP  56           HA       TRP  56   4.400  -4.014  -4.031
  419    HB2  TRP  56           2HB      TRP  56   4.116  -6.448  -4.236
  420    HB3  TRP  56           1HB      TRP  56   5.387  -5.867  -5.307
  421    HD1  TRP  56           HD1      TRP  56   7.998  -6.274  -4.316
  422    HE1  TRP  56           HE1      TRP  56   8.909  -8.313  -3.036
  423    HE3  TRP  56           HE3      TRP  56   3.574  -8.278  -2.719
  424    HZ2  TRP  56           HZ2      TRP  56   7.891 -10.490  -1.560
  425    HZ3  TRP  56           HZ3      TRP  56   3.628 -10.342  -1.378
  426    HH2  TRP  56           HH2      TRP  56   5.742 -11.425  -0.811
  427    H    MET  57           H        MET  57   2.873  -4.075  -2.450
  428    HA   MET  57           HA       MET  57   3.466  -5.376   0.106
  429    HB2  MET  57           2HB      MET  57   2.704  -2.456  -0.121
  430    HB3  MET  57           1HB      MET  57   2.722  -3.370   1.381
  431    HG2  MET  57           2HG      MET  57   5.122  -3.717   1.161
  432    HG3  MET  57           1HG      MET  57   5.119  -2.840  -0.368
  433    HE1  MET  57           3HE      MET  57   3.092  -0.472   0.212
  434    HE2  MET  57           1HE      MET  57   4.649  -0.245  -0.587
  435    HE3  MET  57           2HE      MET  57   4.196   0.787   0.770
  436    HA   PRO  58           HA       PRO  58  -0.947  -6.190  -0.340
  437    HB2  PRO  58           2HB      PRO  58  -1.234  -7.836   1.768
  438    HB3  PRO  58           1HB      PRO  58  -0.385  -8.350   0.305
  439    HG2  PRO  58           2HG      PRO  58   0.749  -7.408   2.917
  440    HG3  PRO  58           1HG      PRO  58   1.277  -8.752   1.886
  441    HD2  PRO  58           2HD      PRO  58   2.471  -6.267   1.915
  442    HD3  PRO  58           1HD      PRO  58   2.521  -7.377   0.530
  443    H    GLY  59           H        GLY  59  -2.585  -4.871   0.314
  444    HA2  GLY  59           2HA      GLY  59  -2.846  -4.088   3.102
  445    HA3  GLY  59           1HA      GLY  59  -2.446  -2.773   2.008
  446    H    LEU  60           H        LEU  60  -4.648  -2.342   3.300
  447    HA   LEU  60           HA       LEU  60  -6.917  -3.239   1.636
  448    HB2  LEU  60           2HB      LEU  60  -7.078  -3.788   4.024
  449    HB3  LEU  60           1HB      LEU  60  -6.872  -2.097   4.438
  450    HG   LEU  60           HG       LEU  60  -9.021  -1.578   3.315
  451   HD11  LEU  60          1HD1      LEU  60 -10.529  -3.385   2.668
  452   HD12  LEU  60          2HD1      LEU  60  -9.276  -4.573   3.025
  453   HD13  LEU  60          3HD1      LEU  60  -9.051  -3.424   1.706
  454   HD21  LEU  60          3HD2      LEU  60  -8.950  -1.993   5.726
  455   HD22  LEU  60          1HD2      LEU  60  -9.208  -3.714   5.444
  456   HD23  LEU  60          2HD2      LEU  60 -10.469  -2.553   5.025
  457    H    ASN  61           H        ASN  61  -8.003  -1.787   0.428
  458    HA   ASN  61           HA       ASN  61  -7.193   1.035   0.539
  459    HB2  ASN  61           2HB      ASN  61  -7.055  -0.111  -1.631
  460    HB3  ASN  61           1HB      ASN  61  -8.770  -0.500  -1.550
  461   HD21  ASN  61          1HD2      ASN  61  -6.441   2.078  -1.894
  462   HD22  ASN  61          2HD2      ASN  61  -7.539   3.234  -2.549
  463    H    GLU  62           H        GLU  62  -8.765   2.766   0.645
  464    HA   GLU  62           HA       GLU  62 -11.155   1.982   2.144
  465    HB2  GLU  62           2HB      GLU  62  -9.907   4.699   1.698
  466    HB3  GLU  62           1HB      GLU  62 -11.378   4.428   2.625
  467    HG2  GLU  62           2HG      GLU  62  -9.940   2.808   4.029
  468    HG3  GLU  62           1HG      GLU  62  -8.564   3.617   3.283
  469    H    ARG  63           H        ARG  63 -10.342   3.568  -0.910
  470    HA   ARG  63           HA       ARG  63 -12.962   4.465  -1.549
  471    HB2  ARG  63           2HB      ARG  63 -10.552   4.911  -2.642
  472    HB3  ARG  63           1HB      ARG  63 -11.087   3.651  -3.736
  473    HG2  ARG  63           2HG      ARG  63 -12.635   6.183  -3.199
  474    HG3  ARG  63           1HG      ARG  63 -11.482   5.997  -4.514
  475    HD2  ARG  63           2HD      ARG  63 -13.593   5.632  -5.485
  476    HD3  ARG  63           1HD      ARG  63 -12.902   4.024  -5.280
  477    HE   ARG  63           HE       ARG  63 -14.554   3.542  -3.761
  478   HH11  ARG  63          1HH1      ARG  63 -14.645   6.894  -4.520
  479   HH12  ARG  63          2HH1      ARG  63 -16.048   7.188  -3.557
  480   HH21  ARG  63          1HH2      ARG  63 -16.390   3.915  -2.570
  481   HH22  ARG  63          2HH2      ARG  63 -17.042   5.514  -2.478
  482    H    THR  64           H        THR  64 -11.182   1.714  -2.991
  483    HA   THR  64           HA       THR  64 -13.573   0.511  -4.043
  484    HB   THR  64           HB       THR  64 -12.115  -1.336  -4.754
  485    HG1  THR  64           HG1      THR  64  -9.701  -0.522  -4.147
  486   HG21  THR  64          3HG2      THR  64 -10.884   1.392  -5.214
  487   HG22  THR  64          1HG2      THR  64 -12.171   0.651  -6.166
  488   HG23  THR  64          2HG2      THR  64 -10.552  -0.050  -6.175
  489    H    ARG  65           H        ARG  65 -11.897   0.341  -1.064
  490    HA   ARG  65           HA       ARG  65 -12.036  -0.911   0.807
  491    HB2  ARG  65           2HB      ARG  65 -14.780  -1.526  -0.293
  492    HB3  ARG  65           1HB      ARG  65 -14.258  -1.873   1.352
  493    HG2  ARG  65           2HG      ARG  65 -13.818   0.572   1.643
  494    HG3  ARG  65           1HG      ARG  65 -14.556   0.831   0.061
  495    HD2  ARG  65           2HD      ARG  65 -16.177   1.220   1.818
  496    HD3  ARG  65           1HD      ARG  65 -16.628  -0.194   0.867
  497    HE   ARG  65           HE       ARG  65 -15.454  -1.450   2.803
  498   HH11  ARG  65          1HH1      ARG  65 -17.369   1.389   3.096
  499   HH12  ARG  65          2HH1      ARG  65 -17.815   1.058   4.732
  500   HH21  ARG  65          1HH2      ARG  65 -16.043  -1.880   4.912
  501   HH22  ARG  65          2HH2      ARG  65 -17.061  -0.763   5.752
  502    H    GLN  66           H        GLN  66 -11.128  -2.231  -1.777
  503    HA   GLN  66           HA       GLN  66 -11.751  -5.032  -1.169
  504    HB2  GLN  66           2HB      GLN  66 -10.299  -3.850  -3.545
  505    HB3  GLN  66           1HB      GLN  66 -10.736  -5.542  -3.349
  506    HG2  GLN  66           2HG      GLN  66 -12.619  -3.206  -3.654
  507    HG3  GLN  66           1HG      GLN  66 -12.301  -4.479  -4.832
  508   HE21  GLN  66          1HE2      GLN  66 -14.799  -3.620  -3.526
  509   HE22  GLN  66          2HE2      GLN  66 -15.444  -5.036  -2.779
  510    H    ARG  67           H        ARG  67  -9.961  -6.608  -1.351
  511    HA   ARG  67           HA       ARG  67  -7.578  -5.622   0.082
  512    HB2  ARG  67           2HB      ARG  67  -8.751  -8.418  -0.011
  513    HB3  ARG  67           1HB      ARG  67  -7.379  -7.903   0.965
  514    HG2  ARG  67           2HG      ARG  67  -8.760  -6.530   2.337
  515    HG3  ARG  67           1HG      ARG  67 -10.137  -6.719   1.251
  516    HD2  ARG  67           2HD      ARG  67 -10.365  -8.099   3.273
  517    HD3  ARG  67           1HD      ARG  67 -10.291  -9.082   1.811
  518    HE   ARG  67           HE       ARG  67  -7.840  -9.361   2.444
  519   HH11  ARG  67          1HH1      ARG  67 -10.341  -8.917   4.786
  520   HH12  ARG  67          2HH1      ARG  67  -9.496  -9.810   6.000
  521   HH21  ARG  67          1HH2      ARG  67  -6.785 -10.486   4.001
  522   HH22  ARG  67          2HH2      ARG  67  -7.500 -10.691   5.562
  523    H    GLY  68           H        GLY  68  -5.597  -5.825  -0.873
  524    HA2  GLY  68           2HA      GLY  68  -5.020  -7.894  -2.777
  525    HA3  GLY  68           1HA      GLY  68  -5.259  -6.339  -3.556
  526    H    ASP  69           H        ASP  69  -2.996  -7.003  -4.193
  527    HA   ASP  69           HA       ASP  69  -1.014  -6.039  -2.225
  528    HB2  ASP  69           2HB      ASP  69  -0.812  -8.439  -2.944
  529    HB3  ASP  69           1HB      ASP  69  -0.553  -7.879  -4.592
  530    H    PHE  70           H        PHE  70  -0.430  -3.977  -2.703
  531    HA   PHE  70           HA       PHE  70  -0.758  -3.055  -5.485
  532    HB2  PHE  70           2HB      PHE  70  -0.987  -0.793  -4.544
  533    HB3  PHE  70           1HB      PHE  70  -2.165  -1.902  -3.855
  534    HD1  PHE  70           HD1      PHE  70  -2.038  -2.565  -1.521
  535    HD2  PHE  70           HD2      PHE  70   0.815   0.122  -3.196
  536    HE1  PHE  70           HE1      PHE  70  -1.310  -1.927   0.742
  537    HE2  PHE  70           HE2      PHE  70   1.547   0.762  -0.935
  538    HZ   PHE  70           HZ       PHE  70   0.484  -0.263   1.038
  539    HA   PRO  71           HA       PRO  71   3.617  -2.088  -5.772
  540    HB2  PRO  71           2HB      PRO  71   3.557  -0.340  -7.837
  541    HB3  PRO  71           1HB      PRO  71   3.277  -2.071  -8.060
  542    HG2  PRO  71           2HG      PRO  71   1.285   0.163  -7.877
  543    HG3  PRO  71           1HG      PRO  71   1.315  -1.219  -8.987
  544    HD2  PRO  71           2HD      PRO  71  -0.251  -1.119  -6.742
  545    HD3  PRO  71           1HD      PRO  71   0.352  -2.635  -7.444
  546    H    GLY  72           H        GLY  72   4.497  -0.911  -4.168
  547    HA2  GLY  72           2HA      GLY  72   3.426   1.357  -2.960
  548    HA3  GLY  72           1HA      GLY  72   5.093   0.841  -2.816
  549    H    THR  73           H        THR  73   5.156   1.261  -5.927
  550    HA   THR  73           HA       THR  73   6.463   3.739  -5.910
  551    HB   THR  73           HB       THR  73   6.924   2.159  -7.674
  552    HG1  THR  73           HG1      THR  73   7.210   3.684  -9.147
  553   HG21  THR  73          3HG2      THR  73   4.093   2.634  -8.635
  554   HG22  THR  73          1HG2      THR  73   4.697   1.149  -7.897
  555   HG23  THR  73          2HG2      THR  73   5.316   1.671  -9.463
  556    H    TYR  74           H        TYR  74   3.056   3.004  -6.460
  557    HA   TYR  74           HA       TYR  74   2.513   5.695  -7.459
  558    HB2  TYR  74           2HB      TYR  74   0.720   3.295  -7.052
  559    HB3  TYR  74           1HB      TYR  74   0.145   4.852  -7.636
  560    HD1  TYR  74           HD2      TYR  74   1.712   5.794  -9.669
  561    HD2  TYR  74           HD1      TYR  74   1.074   1.700  -8.686
  562    HE1  TYR  74           HE2      TYR  74   2.274   5.156 -11.976
  563    HE2  TYR  74           HE1      TYR  74   1.639   1.054 -10.987
  564    HH   TYR  74           HH       TYR  74   1.514   2.314 -13.327
  565    H    VAL  75           H        VAL  75   3.015   4.655  -4.422
  566    HA   VAL  75           HA       VAL  75   0.955   6.463  -3.319
  567    HB   VAL  75           HB       VAL  75   0.753   5.079  -1.321
  568   HG11  VAL  75          1HG1      VAL  75  -0.427   3.156  -2.291
  569   HG12  VAL  75          2HG1      VAL  75   0.326   3.484  -3.853
  570   HG13  VAL  75          3HG1      VAL  75  -0.796   4.650  -3.151
  571   HG21  VAL  75          3HG2      VAL  75   3.007   4.114  -1.292
  572   HG22  VAL  75          1HG2      VAL  75   2.611   3.133  -2.703
  573   HG23  VAL  75          2HG2      VAL  75   1.775   2.859  -1.174
  574    H    GLU  76           H        GLU  76   1.534   7.782  -1.605
  575    HA   GLU  76           HA       GLU  76   4.394   7.882  -0.920
  576    HB2  GLU  76           2HB      GLU  76   3.892  10.150  -0.013
  577    HB3  GLU  76           1HB      GLU  76   3.558  10.000  -1.732
  578    HG2  GLU  76           2HG      GLU  76   1.168   9.769  -1.252
  579    HG3  GLU  76           1HG      GLU  76   1.500   9.900   0.473
  580    H    PHE  77           H        PHE  77   5.082   7.884   1.243
  581    HA   PHE  77           HA       PHE  77   3.423   6.362   3.043
  582    HB2  PHE  77           2HB      PHE  77   5.773   5.849   2.943
  583    HB3  PHE  77           1HB      PHE  77   6.207   7.512   3.316
  584    HD1  PHE  77           HD2      PHE  77   4.334   4.621   4.777
  585    HD2  PHE  77           HD1      PHE  77   6.736   8.067   5.501
  586    HE1  PHE  77           HE2      PHE  77   4.422   4.056   7.166
  587    HE2  PHE  77           HE1      PHE  77   6.820   7.507   7.893
  588    HZ   PHE  77           HZ       PHE  77   5.661   5.500   8.728
  589    H    LEU  78           H        LEU  78   2.149   7.110   4.638
  590    HA   LEU  78           HA       LEU  78   2.217   9.968   5.288
  591    HB2  LEU  78           2HB      LEU  78   0.234   7.824   6.082
  592    HB3  LEU  78           1HB      LEU  78   0.080   9.534   6.445
  593    HG   LEU  78           HG       LEU  78   0.059   8.314   3.676
  594   HD11  LEU  78          1HD1      LEU  78  -2.184   9.503   5.313
  595   HD12  LEU  78          2HD1      LEU  78  -1.969   7.796   4.926
  596   HD13  LEU  78          3HD1      LEU  78  -2.302   8.954   3.639
  597   HD21  LEU  78          3HD2      LEU  78  -0.608  10.581   2.945
  598   HD22  LEU  78          1HD2      LEU  78   1.024  10.530   3.612
  599   HD23  LEU  78          2HD2      LEU  78  -0.305  11.174   4.578
  600    H    GLY  79           H        GLY  79   1.726   7.010   7.248
  601    HA2  GLY  79           2HA      GLY  79   3.887   7.162   8.936
  602    HA3  GLY  79           1HA      GLY  79   2.730   8.293   9.621
  603    HA   PRO  80           HA       PRO  80   1.702   4.017  11.245
  604    HB2  PRO  80           2HB      PRO  80   2.229   4.423  13.849
  605    HB3  PRO  80           1HB      PRO  80   3.507   4.002  12.703
  606    HG2  PRO  80           2HG      PRO  80   2.760   6.692  13.803
  607    HG3  PRO  80           1HG      PRO  80   4.372   5.977  13.598
  608    HD2  PRO  80           2HD      PRO  80   3.273   7.763  11.831
  609    HD3  PRO  80           1HD      PRO  80   4.466   6.534  11.366
  610    H    LEU  81           H        LEU  81   0.186   3.631  13.301
  611    HA   LEU  81           HA       LEU  81  -1.892   5.738  13.280
  612    HB2  LEU  81           2HB      LEU  81  -2.261   2.750  13.599
  613    HB3  LEU  81           1HB      LEU  81  -3.544   3.943  13.686
  614    HG   LEU  81           HG       LEU  81  -2.888   4.567  11.273
  615   HD11  LEU  81          1HD1      LEU  81  -1.861   2.765   9.958
  616   HD12  LEU  81          2HD1      LEU  81  -1.523   1.882  11.449
  617   HD13  LEU  81          3HD1      LEU  81  -0.752   3.440  11.151
  618   HD21  LEU  81          3HD2      LEU  81  -4.964   3.439  11.790
  619   HD22  LEU  81          1HD2      LEU  81  -4.135   1.881  11.865
  620   HD23  LEU  81          2HD2      LEU  81  -4.254   2.747  10.331
  621    H    GLU  82           H        GLU  82  -3.064   6.133  15.231
  622    HA   GLU  82           HA       GLU  82  -1.546   5.366  17.640
  623    HB2  GLU  82           2HB      GLU  82  -2.501   7.422  18.696
  624    HB3  GLU  82           1HB      GLU  82  -1.417   7.722  17.350
  625    HG2  GLU  82           2HG      GLU  82  -4.410   7.710  17.024
  626    HG3  GLU  82           1HG      GLU  82  -3.521   9.146  17.525
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  -2.514   3.437  25.871
    2    H2   MET   1           2H       MET   1  -1.253   2.369  26.230
    3    H3   MET   1           3H       MET   1  -2.689   1.784  25.554
    4    HA   MET   1           HA       MET   1  -2.276   2.962  23.513
    5    HB2  MET   1           2HB      MET   1   0.162   3.925  25.008
    6    HB3  MET   1           1HB      MET   1   0.075   3.959  23.253
    7    HG2  MET   1           2HG      MET   1  -1.842   5.363  25.105
    8    HG3  MET   1           1HG      MET   1  -0.480   6.120  24.281
    9    HE1  MET   1           3HE      MET   1  -0.607   4.503  21.468
   10    HE2  MET   1           1HE      MET   1  -0.276   6.232  21.598
   11    HE3  MET   1           2HE      MET   1  -1.531   5.657  20.505
   12    H    ALA   2           H        ALA   2  -2.140   1.112  22.382
   13    HA   ALA   2           HA       ALA   2  -0.086  -0.867  22.845
   14    HB1  ALA   2           3HB      ALA   2  -2.061  -0.618  20.569
   15    HB2  ALA   2           1HB      ALA   2  -2.328  -1.504  22.069
   16    HB3  ALA   2           2HB      ALA   2  -1.080  -2.035  20.942
   17    H    GLY   3           H        GLY   3  -0.543   1.874  20.749
   18    HA2  GLY   3           2HA      GLY   3   1.407   3.008  19.882
   19    HA3  GLY   3           1HA      GLY   3   2.162   1.442  19.633
   20    HA   PRO   4           HA       PRO   4   0.318   2.834  15.583
   21    HB2  PRO   4           2HB      PRO   4   2.565   2.628  14.086
   22    HB3  PRO   4           1HB      PRO   4   2.183   4.076  15.025
   23    HG2  PRO   4           2HG      PRO   4   4.042   1.820  15.694
   24    HG3  PRO   4           1HG      PRO   4   4.282   3.566  15.900
   25    HD2  PRO   4           2HD      PRO   4   3.543   1.906  17.940
   26    HD3  PRO   4           1HD      PRO   4   3.092   3.622  17.872
   27    H    GLU   5           H        GLU   5  -0.802   0.772  15.858
   28    HA   GLU   5           HA       GLU   5   0.303  -1.750  15.312
   29    HB2  GLU   5           2HB      GLU   5  -2.527  -0.760  14.884
   30    HB3  GLU   5           1HB      GLU   5  -2.043  -2.453  14.866
   31    HG2  GLU   5           2HG      GLU   5  -1.423  -2.360  17.186
   32    HG3  GLU   5           1HG      GLU   5  -1.690  -0.618  17.232
   33    H    GLY   6           H        GLY   6  -1.179   0.625  13.147
   34    HA2  GLY   6           2HA      GLY   6   0.167  -0.676  10.884
   35    HA3  GLY   6           1HA      GLY   6  -1.567  -0.398  10.773
   36    H    PHE   7           H        PHE   7   0.091   0.678   8.894
   37    HA   PHE   7           HA       PHE   7   0.069   3.554   9.567
   38    HB2  PHE   7           2HB      PHE   7   1.917   2.085   7.670
   39    HB3  PHE   7           1HB      PHE   7   1.860   3.834   7.863
   40    HD1  PHE   7           HD1      PHE   7   2.120   4.649  10.382
   41    HD2  PHE   7           HD2      PHE   7   3.515   0.920   8.866
   42    HE1  PHE   7           HE1      PHE   7   3.740   4.509  12.226
   43    HE2  PHE   7           HE2      PHE   7   5.132   0.775  10.712
   44    HZ   PHE   7           HZ       PHE   7   5.248   2.570  12.395
   45    H    GLN   8           H        GLN   8  -0.312   5.008   7.751
   46    HA   GLN   8           HA       GLN   8  -2.248   3.869   5.836
   47    HB2  GLN   8           2HB      GLN   8  -1.973   6.688   6.912
   48    HB3  GLN   8           1HB      GLN   8  -3.108   6.215   5.654
   49    HG2  GLN   8           2HG      GLN   8  -4.217   4.698   7.209
   50    HG3  GLN   8           1HG      GLN   8  -3.073   5.144   8.471
   51   HE21  GLN   8          1HE2      GLN   8  -5.970   5.409   8.441
   52   HE22  GLN   8          2HE2      GLN   8  -6.302   7.086   8.668
   53    H    TYR   9           H        TYR   9  -1.723   3.830   3.747
   54    HA   TYR   9           HA       TYR   9   0.446   5.587   2.782
   55    HB2  TYR   9           2HB      TYR   9  -0.536   2.922   1.725
   56    HB3  TYR   9           1HB      TYR   9   0.659   3.923   0.909
   57    HD1  TYR   9           HD1      TYR   9   0.030   1.785   3.850
   58    HD2  TYR   9           HD2      TYR   9   2.936   4.067   1.726
   59    HE1  TYR   9           HE1      TYR   9   1.815   0.748   5.184
   60    HE2  TYR   9           HE2      TYR   9   4.726   3.031   3.057
   61    HH   TYR   9           HH       TYR   9   5.052   1.888   5.171
   62    H    ARG  10           H        ARG  10   0.025   7.060   1.238
   63    HA   ARG  10           HA       ARG  10  -2.767   7.346   0.377
   64    HB2  ARG  10           2HB      ARG  10  -1.772   9.243   1.530
   65    HB3  ARG  10           1HB      ARG  10  -0.452   9.293   0.372
   66    HG2  ARG  10           2HG      ARG  10  -2.122   9.814  -1.412
   67    HG3  ARG  10           1HG      ARG  10  -3.353   9.929  -0.150
   68    HD2  ARG  10           2HD      ARG  10  -2.110  11.726   0.927
   69    HD3  ARG  10           1HD      ARG  10  -0.829  11.586  -0.278
   70    HE   ARG  10           HE       ARG  10  -3.582  12.447  -0.897
   71   HH11  ARG  10          1HH1      ARG  10  -0.171  12.642  -1.397
   72   HH12  ARG  10          2HH1      ARG  10  -0.317  13.891  -2.579
   73   HH21  ARG  10          1HH2      ARG  10  -3.738  14.034  -2.426
   74   HH22  ARG  10          2HH2      ARG  10  -2.307  14.657  -3.167
   75    H    ALA  11           H        ALA  11  -3.349   6.814  -1.635
   76    HA   ALA  11           HA       ALA  11  -1.415   6.295  -3.710
   77    HB1  ALA  11           3HB      ALA  11  -3.437   4.936  -3.510
   78    HB2  ALA  11           1HB      ALA  11  -3.350   5.723  -5.087
   79    HB3  ALA  11           2HB      ALA  11  -4.430   6.357  -3.843
   80    H    LEU  12           H        LEU  12  -0.805   7.595  -5.349
   81    HA   LEU  12           HA       LEU  12  -1.377  10.401  -5.129
   82    HB2  LEU  12           2HB      LEU  12   0.247   8.910  -7.200
   83    HB3  LEU  12           1HB      LEU  12   0.242  10.649  -6.966
   84    HG   LEU  12           HG       LEU  12   1.204   8.627  -4.929
   85   HD11  LEU  12          1HD1      LEU  12   3.446   9.428  -5.454
   86   HD12  LEU  12          2HD1      LEU  12   2.794  10.490  -6.700
   87   HD13  LEU  12          3HD1      LEU  12   2.677   8.740  -6.886
   88   HD21  LEU  12          3HD2      LEU  12   0.301  10.658  -3.901
   89   HD22  LEU  12          1HD2      LEU  12   1.353  11.647  -4.917
   90   HD23  LEU  12          2HD2      LEU  12   2.050  10.569  -3.708
   91    H    TYR  13           H        TYR  13  -1.745   8.126  -7.873
   92    HA   TYR  13           HA       TYR  13  -3.976   9.771  -8.878
   93    HB2  TYR  13           2HB      TYR  13  -1.587   8.796 -10.467
   94    HB3  TYR  13           1HB      TYR  13  -3.058   9.416 -11.209
   95    HD1  TYR  13           HD1      TYR  13  -3.751  11.807 -10.701
   96    HD2  TYR  13           HD2      TYR  13   0.100  10.280  -9.713
   97    HE1  TYR  13           HE1      TYR  13  -2.895  14.103 -10.505
   98    HE2  TYR  13           HE2      TYR  13   0.964  12.572  -9.513
   99    HH   TYR  13           HH       TYR  13   0.401  14.840 -10.363
  100    HA   PRO  14           HA       PRO  14  -6.084   5.958  -9.641
  101    HB2  PRO  14           2HB      PRO  14  -7.264   6.280 -12.081
  102    HB3  PRO  14           1HB      PRO  14  -7.827   7.080 -10.609
  103    HG2  PRO  14           2HG      PRO  14  -6.102   8.156 -12.814
  104    HG3  PRO  14           1HG      PRO  14  -7.450   8.938 -11.967
  105    HD2  PRO  14           2HD      PRO  14  -4.863   9.466 -11.371
  106    HD3  PRO  14           1HD      PRO  14  -6.143   9.500 -10.142
  107    H    PHE  15           H        PHE  15  -5.015   4.120  -9.950
  108    HA   PHE  15           HA       PHE  15  -3.805   3.560 -12.586
  109    HB2  PHE  15           2HB      PHE  15  -2.919   2.616  -9.846
  110    HB3  PHE  15           1HB      PHE  15  -2.297   1.952 -11.353
  111    HD1  PHE  15           HD2      PHE  15  -1.041   3.460 -12.926
  112    HD2  PHE  15           HD1      PHE  15  -2.062   4.641  -8.959
  113    HE1  PHE  15           HE2      PHE  15   0.648   5.244 -13.023
  114    HE2  PHE  15           HE1      PHE  15  -0.372   6.428  -9.059
  115    HZ   PHE  15           HZ       PHE  15   0.985   6.730 -11.090
  116    H    ARG  16           H        ARG  16  -3.957   1.362 -13.338
  117    HA   ARG  16           HA       ARG  16  -6.154  -0.207 -12.151
  118    HB2  ARG  16           2HB      ARG  16  -6.947  -0.540 -14.593
  119    HB3  ARG  16           1HB      ARG  16  -7.332   0.978 -13.791
  120    HG2  ARG  16           2HG      ARG  16  -5.319   1.984 -14.885
  121    HG3  ARG  16           1HG      ARG  16  -5.138   0.489 -15.800
  122    HD2  ARG  16           2HD      ARG  16  -7.082   0.867 -17.037
  123    HD3  ARG  16           1HD      ARG  16  -7.733   2.002 -15.852
  124    HE   ARG  16           HE       ARG  16  -5.466   3.207 -16.738
  125   HH11  ARG  16          1HH1      ARG  16  -8.242   1.953 -18.353
  126   HH12  ARG  16          2HH1      ARG  16  -8.182   3.148 -19.598
  127   HH21  ARG  16          1HH2      ARG  16  -5.417   4.726 -18.326
  128   HH22  ARG  16          2HH2      ARG  16  -6.606   4.696 -19.585
  129    H    ARG  17           H        ARG  17  -5.954  -2.416 -12.316
  130    HA   ARG  17           HA       ARG  17  -3.565  -3.426 -13.747
  131    HB2  ARG  17           2HB      ARG  17  -3.659  -3.670 -11.215
  132    HB3  ARG  17           1HB      ARG  17  -4.990  -4.796 -11.453
  133    HG2  ARG  17           2HG      ARG  17  -3.131  -6.176 -11.244
  134    HG3  ARG  17           1HG      ARG  17  -3.374  -6.080 -12.988
  135    HD2  ARG  17           2HD      ARG  17  -1.039  -5.818 -12.603
  136    HD3  ARG  17           1HD      ARG  17  -1.666  -4.220 -13.012
  137    HE   ARG  17           HE       ARG  17  -1.789  -4.287 -10.301
  138   HH11  ARG  17          1HH1      ARG  17   0.768  -4.753 -12.578
  139   HH12  ARG  17          2HH1      ARG  17   1.992  -4.320 -11.435
  140   HH21  ARG  17          1HH2      ARG  17  -0.235  -3.788  -8.864
  141   HH22  ARG  17          2HH2      ARG  17   1.429  -3.762  -9.350
  142    H    GLU  18           H        GLU  18  -3.708  -5.425 -14.869
  143    HA   GLU  18           HA       GLU  18  -6.086  -5.929 -16.296
  144    HB2  GLU  18           2HB      GLU  18  -4.885  -7.930 -17.145
  145    HB3  GLU  18           1HB      GLU  18  -3.913  -6.466 -17.222
  146    HG2  GLU  18           2HG      GLU  18  -2.755  -7.144 -15.160
  147    HG3  GLU  18           1HG      GLU  18  -3.706  -8.626 -15.127
  148    H    ARG  19           H        ARG  19  -4.726  -7.494 -13.424
  149    HA   ARG  19           HA       ARG  19  -7.064  -9.290 -13.292
  150    HB2  ARG  19           2HB      ARG  19  -4.332  -9.561 -12.028
  151    HB3  ARG  19           1HB      ARG  19  -5.673 -10.659 -11.731
  152    HG2  ARG  19           2HG      ARG  19  -5.680 -11.276 -14.111
  153    HG3  ARG  19           1HG      ARG  19  -4.318 -10.186 -14.387
  154    HD2  ARG  19           2HD      ARG  19  -3.612 -12.542 -14.135
  155    HD3  ARG  19           1HD      ARG  19  -2.918 -11.490 -12.899
  156    HE   ARG  19           HE       ARG  19  -5.364 -12.848 -12.147
  157   HH11  ARG  19          1HH1      ARG  19  -1.911 -12.974 -12.137
  158   HH12  ARG  19          2HH1      ARG  19  -1.863 -14.046 -10.776
  159   HH21  ARG  19          1HH2      ARG  19  -5.268 -14.223 -10.430
  160   HH22  ARG  19          2HH2      ARG  19  -3.732 -14.753  -9.839
  161    HA   PRO  20           HA       PRO  20  -8.411  -6.782  -9.810
  162    HB2  PRO  20           2HB      PRO  20 -10.321  -8.976  -9.308
  163    HB3  PRO  20           1HB      PRO  20 -10.632  -7.288  -9.718
  164    HG2  PRO  20           2HG      PRO  20 -11.075  -9.263 -11.481
  165    HG3  PRO  20           1HG      PRO  20 -10.479  -7.674 -11.998
  166    HD2  PRO  20           2HD      PRO  20  -8.951 -10.229 -11.585
  167    HD3  PRO  20           1HD      PRO  20  -8.838  -9.054 -12.915
  168    H    GLU  21           H        GLU  21  -6.889  -9.785  -9.614
  169    HA   GLU  21           HA       GLU  21  -7.107 -10.257  -6.798
  170    HB2  GLU  21           2HB      GLU  21  -6.447 -12.035  -8.371
  171    HB3  GLU  21           1HB      GLU  21  -4.976 -11.154  -8.766
  172    HG2  GLU  21           2HG      GLU  21  -4.193 -11.417  -6.463
  173    HG3  GLU  21           1HG      GLU  21  -5.674 -12.280  -6.053
  174    H    ASP  22           H        ASP  22  -5.261  -8.125  -8.761
  175    HA   ASP  22           HA       ASP  22  -3.241  -7.475  -6.805
  176    HB2  ASP  22           2HB      ASP  22  -3.227  -7.268  -9.436
  177    HB3  ASP  22           1HB      ASP  22  -4.014  -5.724  -9.133
  178    H    LEU  23           H        LEU  23  -3.663  -4.459  -7.383
  179    HA   LEU  23           HA       LEU  23  -6.239  -3.918  -6.184
  180    HB2  LEU  23           2HB      LEU  23  -4.668  -4.493  -4.285
  181    HB3  LEU  23           1HB      LEU  23  -3.773  -3.040  -4.685
  182    HG   LEU  23           HG       LEU  23  -5.726  -1.659  -4.168
  183   HD11  LEU  23          1HD1      LEU  23  -7.084  -4.267  -3.471
  184   HD12  LEU  23          2HD1      LEU  23  -7.491  -3.201  -4.817
  185   HD13  LEU  23          3HD1      LEU  23  -7.726  -2.655  -3.159
  186   HD21  LEU  23          3HD2      LEU  23  -5.068  -3.634  -1.977
  187   HD22  LEU  23          1HD2      LEU  23  -5.794  -2.042  -1.751
  188   HD23  LEU  23          2HD2      LEU  23  -4.152  -2.179  -2.377
  189    H    GLU  24           H        GLU  24  -7.030  -2.248  -7.279
  190    HA   GLU  24           HA       GLU  24  -5.516  -0.391  -8.768
  191    HB2  GLU  24           2HB      GLU  24  -8.382  -0.492  -7.878
  192    HB3  GLU  24           1HB      GLU  24  -7.762   0.966  -8.632
  193    HG2  GLU  24           2HG      GLU  24  -8.846  -0.343 -10.294
  194    HG3  GLU  24           1HG      GLU  24  -7.114  -0.380 -10.607
  195    H    LEU  25           H        LEU  25  -5.135   1.820  -8.449
  196    HA   LEU  25           HA       LEU  25  -5.269   2.780  -5.652
  197    HB2  LEU  25           2HB      LEU  25  -3.250   3.482  -7.796
  198    HB3  LEU  25           1HB      LEU  25  -3.288   4.161  -6.179
  199    HG   LEU  25           HG       LEU  25  -2.784   1.247  -6.833
  200   HD11  LEU  25          1HD1      LEU  25  -0.933   2.690  -7.535
  201   HD12  LEU  25          2HD1      LEU  25  -0.485   1.686  -6.156
  202   HD13  LEU  25          3HD1      LEU  25  -0.866   3.391  -5.916
  203   HD21  LEU  25          3HD2      LEU  25  -3.876   1.540  -4.674
  204   HD22  LEU  25          1HD2      LEU  25  -2.661   2.729  -4.205
  205   HD23  LEU  25          2HD2      LEU  25  -2.196   1.048  -4.466
  206    H    LEU  26           H        LEU  26  -6.279   4.734  -5.297
  207    HA   LEU  26           HA       LEU  26  -7.239   6.193  -7.689
  208    HB2  LEU  26           2HB      LEU  26  -8.576   5.581  -5.070
  209    HB3  LEU  26           1HB      LEU  26  -9.064   6.992  -5.985
  210    HG   LEU  26           HG       LEU  26 -10.567   5.143  -6.435
  211   HD11  LEU  26          1HD1      LEU  26 -10.443   5.084  -8.870
  212   HD12  LEU  26          2HD1      LEU  26  -8.792   5.703  -8.810
  213   HD13  LEU  26          3HD1      LEU  26 -10.132   6.705  -8.252
  214   HD21  LEU  26          3HD2      LEU  26  -9.836   3.087  -7.510
  215   HD22  LEU  26          1HD2      LEU  26  -9.033   3.291  -5.952
  216   HD23  LEU  26          2HD2      LEU  26  -8.159   3.631  -7.448
  217    HA   PRO  27           HA       PRO  27  -5.150   9.849  -6.489
  218    HB2  PRO  27           2HB      PRO  27  -6.981  11.828  -7.000
  219    HB3  PRO  27           1HB      PRO  27  -6.075  10.976  -8.254
  220    HG2  PRO  27           2HG      PRO  27  -8.868  10.487  -7.276
  221    HG3  PRO  27           1HG      PRO  27  -8.259  10.527  -8.944
  222    HD2  PRO  27           2HD      PRO  27  -8.707   8.201  -7.668
  223    HD3  PRO  27           1HD      PRO  27  -7.344   8.392  -8.793
  224    H    GLY  28           H        GLY  28  -4.653  10.258  -4.426
  225    HA2  GLY  28           2HA      GLY  28  -4.810  11.190  -2.315
  226    HA3  GLY  28           1HA      GLY  28  -6.399  11.797  -2.746
  227    H    ASP  29           H        ASP  29  -5.822   8.412  -3.106
  228    HA   ASP  29           HA       ASP  29  -7.858   7.815  -1.139
  229    HB2  ASP  29           2HB      ASP  29  -7.855   6.677  -3.299
  230    HB3  ASP  29           1HB      ASP  29  -6.251   6.025  -2.980
  231    H    VAL  30           H        VAL  30  -7.598   6.206   0.551
  232    HA   VAL  30           HA       VAL  30  -4.863   6.142   1.682
  233    HB   VAL  30           HB       VAL  30  -7.490   6.205   3.196
  234   HG11  VAL  30          1HG1      VAL  30  -5.805   4.872   4.360
  235   HG12  VAL  30          2HG1      VAL  30  -6.104   6.387   5.212
  236   HG13  VAL  30          3HG1      VAL  30  -4.649   6.201   4.233
  237   HG21  VAL  30          3HG2      VAL  30  -6.764   8.424   3.964
  238   HG22  VAL  30          1HG2      VAL  30  -6.962   8.374   2.212
  239   HG23  VAL  30          2HG2      VAL  30  -5.347   8.319   2.919
  240    H    LEU  31           H        LEU  31  -4.014   4.162   1.689
  241    HA   LEU  31           HA       LEU  31  -5.801   1.829   1.930
  242    HB2  LEU  31           2HB      LEU  31  -2.968   1.987   0.871
  243    HB3  LEU  31           1HB      LEU  31  -3.903   0.510   1.032
  244    HG   LEU  31           HG       LEU  31  -5.613   1.621  -0.537
  245   HD11  LEU  31          1HD1      LEU  31  -3.250   3.422  -1.059
  246   HD12  LEU  31          2HD1      LEU  31  -4.834   3.902  -0.446
  247   HD13  LEU  31          3HD1      LEU  31  -4.675   3.287  -2.091
  248   HD21  LEU  31          3HD2      LEU  31  -4.160  -0.238  -1.183
  249   HD22  LEU  31          1HD2      LEU  31  -2.892   0.907  -1.626
  250   HD23  LEU  31          2HD2      LEU  31  -4.416   0.888  -2.515
  251    H    VAL  32           H        VAL  32  -5.628   0.440   3.604
  252    HA   VAL  32           HA       VAL  32  -3.944   1.291   5.842
  253    HB   VAL  32           HB       VAL  32  -6.221  -0.709   5.766
  254   HG11  VAL  32          1HG1      VAL  32  -4.676  -1.197   7.584
  255   HG12  VAL  32          2HG1      VAL  32  -6.183  -0.536   8.222
  256   HG13  VAL  32          3HG1      VAL  32  -4.746   0.484   8.119
  257   HG21  VAL  32          3HG2      VAL  32  -6.944   1.594   5.277
  258   HG22  VAL  32          1HG2      VAL  32  -6.178   2.147   6.768
  259   HG23  VAL  32          2HG2      VAL  32  -7.551   1.041   6.838
  260    H    VAL  33           H        VAL  33  -2.012   0.345   6.129
  261    HA   VAL  33           HA       VAL  33  -1.763  -2.569   5.665
  262    HB   VAL  33           HB       VAL  33   0.387  -0.501   5.129
  263   HG11  VAL  33          1HG1      VAL  33   1.326  -2.598   5.943
  264   HG12  VAL  33          2HG1      VAL  33   1.685  -2.389   4.229
  265   HG13  VAL  33          3HG1      VAL  33   0.409  -3.500   4.734
  266   HG21  VAL  33          3HG2      VAL  33  -1.332  -0.423   3.414
  267   HG22  VAL  33          1HG2      VAL  33  -1.242  -2.173   3.204
  268   HG23  VAL  33          2HG2      VAL  33   0.132  -1.158   2.761
  269    H    SER  34           H        SER  34  -1.334  -3.618   7.513
  270    HA   SER  34           HA       SER  34  -0.544  -2.228   9.904
  271    HB2  SER  34           2HB      SER  34  -0.772  -4.351  11.027
  272    HB3  SER  34           1HB      SER  34  -2.101  -4.199   9.879
  273    HG   SER  34           HG       SER  34  -1.431  -6.044   9.130
  274    H    ARG  35           H        ARG  35   1.346  -2.663  11.220
  275    HA   ARG  35           HA       ARG  35   3.786  -2.867   9.809
  276    HB2  ARG  35           2HB      ARG  35   3.362  -3.410  12.762
  277    HB3  ARG  35           1HB      ARG  35   4.891  -3.036  11.980
  278    HG2  ARG  35           2HG      ARG  35   3.839  -0.818  11.312
  279    HG3  ARG  35           1HG      ARG  35   2.544  -1.215  12.441
  280    HD2  ARG  35           2HD      ARG  35   4.003   0.087  13.719
  281    HD3  ARG  35           1HD      ARG  35   4.432  -1.564  14.165
  282    HE   ARG  35           HE       ARG  35   6.010  -0.486  12.006
  283   HH11  ARG  35          1HH1      ARG  35   5.742  -0.770  15.439
  284   HH12  ARG  35          2HH1      ARG  35   7.412  -0.415  15.692
  285   HH21  ARG  35          1HH2      ARG  35   8.127  -0.007  12.362
  286   HH22  ARG  35          2HH2      ARG  35   8.743   0.014  13.980
  287    H    ALA  36           H        ALA  36   1.686  -5.273  11.183
  288    HA   ALA  36           HA       ALA  36   3.444  -7.483  11.213
  289    HB1  ALA  36           3HB      ALA  36   1.419  -8.853  11.222
  290    HB2  ALA  36           1HB      ALA  36   0.455  -7.448  10.762
  291    HB3  ALA  36           2HB      ALA  36   1.261  -7.490  12.330
  292    H    ALA  37           H        ALA  37   1.174  -6.335   8.700
  293    HA   ALA  37           HA       ALA  37   1.822  -8.176   6.692
  294    HB1  ALA  37           3HB      ALA  37   0.949  -6.492   5.111
  295    HB2  ALA  37           1HB      ALA  37   0.960  -5.292   6.405
  296    HB3  ALA  37           2HB      ALA  37  -0.100  -6.697   6.515
  297    H    LEU  38           H        LEU  38   3.313  -5.053   7.498
  298    HA   LEU  38           HA       LEU  38   5.233  -4.945   5.464
  299    HB2  LEU  38           2HB      LEU  38   5.380  -3.925   8.305
  300    HB3  LEU  38           1HB      LEU  38   6.514  -3.489   7.042
  301    HG   LEU  38           HG       LEU  38   3.549  -2.893   6.973
  302   HD11  LEU  38          1HD1      LEU  38   4.645  -1.604   8.717
  303   HD12  LEU  38          2HD1      LEU  38   4.202  -0.564   7.364
  304   HD13  LEU  38          3HD1      LEU  38   5.879  -1.070   7.574
  305   HD21  LEU  38          3HD2      LEU  38   4.135  -1.445   5.074
  306   HD22  LEU  38          1HD2      LEU  38   4.492  -3.141   4.746
  307   HD23  LEU  38          2HD2      LEU  38   5.799  -2.028   5.152
  308    H    GLN  39           H        GLN  39   5.553  -6.327   8.758
  309    HA   GLN  39           HA       GLN  39   8.165  -7.329   8.430
  310    HB2  GLN  39           2HB      GLN  39   5.921  -8.312  10.208
  311    HB3  GLN  39           1HB      GLN  39   7.581  -8.882  10.313
  312    HG2  GLN  39           2HG      GLN  39   6.622  -6.063  10.796
  313    HG3  GLN  39           1HG      GLN  39   7.133  -7.223  12.020
  314   HE21  GLN  39          1HE2      GLN  39   8.195  -4.585  11.479
  315   HE22  GLN  39          2HE2      GLN  39   9.868  -4.806  11.109
  316    H    ALA  40           H        ALA  40   5.027  -8.705   7.604
  317    HA   ALA  40           HA       ALA  40   5.909 -11.287   6.864
  318    HB1  ALA  40           3HB      ALA  40   3.794 -11.460   5.647
  319    HB2  ALA  40           1HB      ALA  40   3.548  -9.721   5.820
  320    HB3  ALA  40           2HB      ALA  40   3.554 -10.758   7.246
  321    H    LEU  41           H        LEU  41   6.153  -8.219   5.264
  322    HA   LEU  41           HA       LEU  41   6.819  -9.347   2.668
  323    HB2  LEU  41           2HB      LEU  41   6.991  -6.520   3.728
  324    HB3  LEU  41           1HB      LEU  41   7.328  -6.982   2.070
  325    HG   LEU  41           HG       LEU  41   4.652  -7.292   3.443
  326   HD11  LEU  41          1HD1      LEU  41   3.930  -5.453   1.981
  327   HD12  LEU  41          2HD1      LEU  41   5.590  -5.260   1.415
  328   HD13  LEU  41          3HD1      LEU  41   5.191  -4.947   3.106
  329   HD21  LEU  41          3HD2      LEU  41   3.814  -7.811   1.207
  330   HD22  LEU  41          1HD2      LEU  41   5.042  -8.973   1.705
  331   HD23  LEU  41          2HD2      LEU  41   5.448  -7.698   0.555
  332    H    GLY  42           H        GLY  42   8.471  -9.106   5.540
  333    HA2  GLY  42           2HA      GLY  42  10.701  -9.271   6.098
  334    HA3  GLY  42           1HA      GLY  42  11.024  -9.613   4.403
  335    H    VAL  43           H        VAL  43   9.627  -6.719   5.897
  336    HA   VAL  43           HA       VAL  43  11.340  -4.976   4.393
  337    HB   VAL  43           HB       VAL  43   9.361  -4.362   6.604
  338   HG11  VAL  43          1HG1      VAL  43   9.461  -2.031   5.813
  339   HG12  VAL  43          2HG1      VAL  43  10.765  -2.471   4.709
  340   HG13  VAL  43          3HG1      VAL  43  11.011  -2.578   6.452
  341   HG21  VAL  43          3HG2      VAL  43   7.885  -3.636   4.786
  342   HG22  VAL  43          1HG2      VAL  43   8.323  -5.335   4.613
  343   HG23  VAL  43          2HG2      VAL  43   9.098  -4.117   3.599
  344    H    ALA  44           H        ALA  44  13.006  -3.685   5.113
  345    HA   ALA  44           HA       ALA  44  14.632  -4.658   7.218
  346    HB1  ALA  44           3HB      ALA  44  14.859  -2.027   5.756
  347    HB2  ALA  44           1HB      ALA  44  15.505  -3.566   5.183
  348    HB3  ALA  44           2HB      ALA  44  16.130  -2.845   6.666
  349    H    GLU  45           H        GLU  45  15.270  -3.674   9.166
  350    HA   GLU  45           HA       GLU  45  13.317  -2.624  10.818
  351    HB2  GLU  45           2HB      GLU  45  15.347  -3.658  11.665
  352    HB3  GLU  45           1HB      GLU  45  16.325  -2.354  11.011
  353    HG2  GLU  45           2HG      GLU  45  16.084  -2.113  13.402
  354    HG3  GLU  45           1HG      GLU  45  15.285  -0.783  12.569
  355    H    GLY  46           H        GLY  46  12.180  -0.836  10.263
  356    HA2  GLY  46           2HA      GLY  46  11.921   1.516  10.539
  357    HA3  GLY  46           1HA      GLY  46  13.622   1.729  10.169
  358    H    GLY  47           H        GLY  47  12.771  -0.337   7.860
  359    HA2  GLY  47           2HA      GLY  47  12.721   1.665   5.816
  360    HA3  GLY  47           1HA      GLY  47  12.622  -0.068   5.579
  361    H    GLU  48           H        GLU  48  10.213   0.679   7.702
  362    HA   GLU  48           HA       GLU  48   8.085   0.183   5.945
  363    HB2  GLU  48           2HB      GLU  48   6.643   0.797   7.816
  364    HB3  GLU  48           1HB      GLU  48   7.996  -0.176   8.376
  365    HG2  GLU  48           2HG      GLU  48   9.013   2.310   8.720
  366    HG3  GLU  48           1HG      GLU  48   7.300   2.629   8.969
  367    H    ARG  49           H        ARG  49   9.795   3.072   6.581
  368    HA   ARG  49           HA       ARG  49   7.766   4.898   5.600
  369    HB2  ARG  49           2HB      ARG  49   9.698   6.560   5.761
  370    HB3  ARG  49           1HB      ARG  49   9.176   5.809   7.263
  371    HG2  ARG  49           2HG      ARG  49  11.046   4.249   7.162
  372    HG3  ARG  49           1HG      ARG  49  11.560   4.943   5.625
  373    HD2  ARG  49           2HD      ARG  49  12.297   6.911   6.613
  374    HD3  ARG  49           1HD      ARG  49  11.279   6.698   8.039
  375    HE   ARG  49           HE       ARG  49  12.822   4.853   8.663
  376   HH11  ARG  49          1HH1      ARG  49  13.973   7.232   6.438
  377   HH12  ARG  49          2HH1      ARG  49  15.606   7.101   6.990
  378   HH21  ARG  49          1HH2      ARG  49  14.911   4.685   9.331
  379   HH22  ARG  49          2HH2      ARG  49  16.135   5.668   8.600
  380    H    CYS  50           H        CYS  50   9.375   2.666   3.953
  381    HA   CYS  50           HA       CYS  50   9.725   4.375   1.571
  382    HB2  CYS  50           2HB      CYS  50  11.618   2.166   2.412
  383    HB3  CYS  50           1HB      CYS  50  11.736   3.119   0.936
  384    HG   CYS  50           HG       CYS  50  13.269   3.694   3.637
  385    HA   PRO  51           HA       PRO  51   6.938   0.743   0.601
  386    HB2  PRO  51           2HB      PRO  51   5.278   2.207  -1.029
  387    HB3  PRO  51           1HB      PRO  51   5.038   2.008   0.710
  388    HG2  PRO  51           2HG      PRO  51   6.275   4.295  -0.780
  389    HG3  PRO  51           1HG      PRO  51   5.146   4.329   0.589
  390    HD2  PRO  51           2HD      PRO  51   7.792   4.741   0.915
  391    HD3  PRO  51           1HD      PRO  51   6.816   3.903   2.140
  392    H    GLN  52           H        GLN  52   8.359   3.232  -1.494
  393    HA   GLN  52           HA       GLN  52   8.183   1.862  -3.944
  394    HB2  GLN  52           2HB      GLN  52   8.751   4.235  -3.814
  395    HB3  GLN  52           1HB      GLN  52  10.255   3.859  -2.988
  396    HG2  GLN  52           2HG      GLN  52  11.035   2.670  -5.006
  397    HG3  GLN  52           1HG      GLN  52   9.545   3.134  -5.826
  398   HE21  GLN  52          1HE2      GLN  52  12.352   3.768  -6.421
  399   HE22  GLN  52          2HE2      GLN  52  12.427   5.491  -6.492
  400    H    SER  53           H        SER  53  10.577   1.704  -1.356
  401    HA   SER  53           HA       SER  53  12.560   0.209  -2.686
  402    HB2  SER  53           2HB      SER  53  12.990   1.342  -0.556
  403    HB3  SER  53           1HB      SER  53  11.868   0.260   0.266
  404    HG   SER  53           HG       SER  53  14.474  -0.112  -0.328
  405    H    VAL  54           H        VAL  54   9.706  -0.826  -0.863
  406    HA   VAL  54           HA       VAL  54  10.330  -3.627  -1.002
  407    HB   VAL  54           HB       VAL  54   7.667  -2.319  -0.388
  408   HG11  VAL  54          1HG1      VAL  54   8.695  -5.098   0.218
  409   HG12  VAL  54          2HG1      VAL  54   7.436  -4.676  -0.943
  410   HG13  VAL  54          3HG1      VAL  54   7.163  -4.428   0.781
  411   HG21  VAL  54          3HG2      VAL  54   9.423  -1.509   1.118
  412   HG22  VAL  54          1HG2      VAL  54   9.862  -3.172   1.513
  413   HG23  VAL  54          2HG2      VAL  54   8.279  -2.543   1.973
  414    H    GLY  55           H        GLY  55   8.213  -1.434  -2.822
  415    HA2  GLY  55           2HA      GLY  55   7.623  -1.630  -5.079
  416    HA3  GLY  55           1HA      GLY  55   8.266  -3.262  -5.089
  417    H    TRP  56           H        TRP  56   6.926  -4.882  -3.812
  418    HA   TRP  56           HA       TRP  56   4.083  -4.475  -4.458
  419    HB2  TRP  56           2HB      TRP  56   3.872  -6.917  -4.306
  420    HB3  TRP  56           1HB      TRP  56   5.153  -6.470  -5.425
  421    HD1  TRP  56           HD1      TRP  56   7.751  -6.570  -4.230
  422    HE1  TRP  56           HE1      TRP  56   8.677  -8.417  -2.692
  423    HE3  TRP  56           HE3      TRP  56   3.336  -8.629  -2.685
  424    HZ2  TRP  56           HZ2      TRP  56   7.667 -10.476  -1.043
  425    HZ3  TRP  56           HZ3      TRP  56   3.398 -10.533  -1.127
  426    HH2  TRP  56           HH2      TRP  56   5.520 -11.437  -0.325
  427    H    MET  57           H        MET  57   2.546  -4.298  -2.894
  428    HA   MET  57           HA       MET  57   3.187  -5.084  -0.145
  429    HB2  MET  57           2HB      MET  57   2.325  -2.282  -0.901
  430    HB3  MET  57           1HB      MET  57   2.493  -2.886   0.741
  431    HG2  MET  57           2HG      MET  57   4.885  -3.196   0.399
  432    HG3  MET  57           1HG      MET  57   4.730  -2.635  -1.264
  433    HE1  MET  57           3HE      MET  57   2.861  -1.208   1.911
  434    HE2  MET  57           1HE      MET  57   3.985   0.053   2.418
  435    HE3  MET  57           2HE      MET  57   4.454  -1.645   2.529
  436    HA   PRO  58           HA       PRO  58  -1.215  -6.062  -0.539
  437    HB2  PRO  58           2HB      PRO  58  -1.385  -7.744   1.545
  438    HB3  PRO  58           1HB      PRO  58  -0.556  -8.212   0.053
  439    HG2  PRO  58           2HG      PRO  58   0.607  -7.256   2.646
  440    HG3  PRO  58           1HG      PRO  58   1.153  -8.577   1.596
  441    HD2  PRO  58           2HD      PRO  58   2.257  -6.047   1.613
  442    HD3  PRO  58           1HD      PRO  58   2.330  -7.157   0.231
  443    H    GLY  59           H        GLY  59  -2.983  -5.069   0.324
  444    HA2  GLY  59           2HA      GLY  59  -3.113  -4.251   3.084
  445    HA3  GLY  59           1HA      GLY  59  -2.850  -2.899   1.993
  446    H    LEU  60           H        LEU  60  -5.036  -2.649   3.394
  447    HA   LEU  60           HA       LEU  60  -7.283  -3.735   1.833
  448    HB2  LEU  60           2HB      LEU  60  -7.353  -4.029   4.274
  449    HB3  LEU  60           1HB      LEU  60  -7.265  -2.292   4.490
  450    HG   LEU  60           HG       LEU  60  -9.465  -2.021   3.443
  451   HD11  LEU  60          1HD1      LEU  60  -9.456  -5.031   3.208
  452   HD12  LEU  60          2HD1      LEU  60  -9.415  -3.875   1.875
  453   HD13  LEU  60          3HD1      LEU  60 -10.841  -3.982   2.904
  454   HD21  LEU  60          3HD2      LEU  60  -9.367  -2.353   5.854
  455   HD22  LEU  60          1HD2      LEU  60  -9.448  -4.101   5.634
  456   HD23  LEU  60          2HD2      LEU  60 -10.821  -3.090   5.184
  457    H    ASN  61           H        ASN  61  -8.135  -2.514   0.280
  458    HA   ASN  61           HA       ASN  61  -7.551   0.337   0.150
  459    HB2  ASN  61           2HB      ASN  61  -7.290  -1.025  -1.870
  460    HB3  ASN  61           1HB      ASN  61  -8.983  -1.503  -1.790
  461   HD21  ASN  61          1HD2      ASN  61  -6.784   1.112  -2.431
  462   HD22  ASN  61          2HD2      ASN  61  -7.919   2.136  -3.224
  463    H    GLU  62           H        GLU  62  -8.834   1.489   1.533
  464    HA   GLU  62           HA       GLU  62 -11.514   0.811   2.165
  465    HB2  GLU  62           2HB      GLU  62 -10.092   3.456   2.528
  466    HB3  GLU  62           1HB      GLU  62 -11.611   2.998   3.290
  467    HG2  GLU  62           2HG      GLU  62 -10.343   1.060   4.332
  468    HG3  GLU  62           1HG      GLU  62  -8.871   1.858   3.780
  469    H    ARG  63           H        ARG  63 -10.171   2.581  -0.470
  470    HA   ARG  63           HA       ARG  63 -12.281   4.268  -1.195
  471    HB2  ARG  63           2HB      ARG  63  -9.943   4.085  -2.213
  472    HB3  ARG  63           1HB      ARG  63 -10.561   2.738  -3.150
  473    HG2  ARG  63           2HG      ARG  63 -10.675   4.579  -4.578
  474    HG3  ARG  63           1HG      ARG  63 -12.331   4.344  -4.019
  475    HD2  ARG  63           2HD      ARG  63 -12.154   6.176  -2.490
  476    HD3  ARG  63           1HD      ARG  63 -10.413   6.296  -2.743
  477    HE   ARG  63           HE       ARG  63 -12.102   6.724  -5.070
  478   HH11  ARG  63          1HH1      ARG  63 -10.319   8.168  -2.494
  479   HH12  ARG  63          2HH1      ARG  63 -10.144   9.673  -3.328
  480   HH21  ARG  63          1HH2      ARG  63 -11.857   8.650  -6.116
  481   HH22  ARG  63          2HH2      ARG  63 -10.989   9.940  -5.359
  482    H    THR  64           H        THR  64 -11.657   0.899  -2.168
  483    HA   THR  64           HA       THR  64 -14.400   0.726  -3.271
  484    HB   THR  64           HB       THR  64 -13.597  -1.200  -4.590
  485    HG1  THR  64           HG1      THR  64 -10.927  -0.583  -3.911
  486   HG21  THR  64          3HG2      THR  64 -11.886   1.278  -4.916
  487   HG22  THR  64          1HG2      THR  64 -13.491   1.027  -5.603
  488   HG23  THR  64          2HG2      THR  64 -12.136   0.036  -6.144
  489    H    ARG  65           H        ARG  65 -12.734  -0.082  -0.553
  490    HA   ARG  65           HA       ARG  65 -13.011  -1.529   1.166
  491    HB2  ARG  65           2HB      ARG  65 -15.653  -2.004  -0.223
  492    HB3  ARG  65           1HB      ARG  65 -15.223  -2.817   1.272
  493    HG2  ARG  65           2HG      ARG  65 -16.571  -0.968   1.865
  494    HG3  ARG  65           1HG      ARG  65 -14.920  -0.550   2.317
  495    HD2  ARG  65           2HD      ARG  65 -14.708   0.796   0.277
  496    HD3  ARG  65           1HD      ARG  65 -16.355   0.361  -0.186
  497    HE   ARG  65           HE       ARG  65 -15.763   1.866   2.285
  498   HH11  ARG  65          1HH1      ARG  65 -17.490   1.527  -0.683
  499   HH12  ARG  65          2HH1      ARG  65 -18.587   2.815  -0.314
  500   HH21  ARG  65          1HH2      ARG  65 -17.178   3.502   2.741
  501   HH22  ARG  65          2HH2      ARG  65 -18.422   3.904   1.606
  502    H    GLN  66           H        GLN  66 -11.830  -2.408  -1.485
  503    HA   GLN  66           HA       GLN  66 -12.208  -5.319  -1.272
  504    HB2  GLN  66           2HB      GLN  66 -10.971  -3.628  -3.454
  505    HB3  GLN  66           1HB      GLN  66 -10.982  -5.385  -3.467
  506    HG2  GLN  66           2HG      GLN  66 -13.428  -3.624  -3.457
  507    HG3  GLN  66           1HG      GLN  66 -12.751  -4.433  -4.868
  508   HE21  GLN  66          1HE2      GLN  66 -12.943  -6.684  -5.035
  509   HE22  GLN  66          2HE2      GLN  66 -14.083  -7.575  -4.094
  510    H    ARG  67           H        ARG  67 -10.360  -6.723  -1.340
  511    HA   ARG  67           HA       ARG  67  -7.968  -5.587  -0.038
  512    HB2  ARG  67           2HB      ARG  67  -8.728  -8.505  -0.301
  513    HB3  ARG  67           1HB      ARG  67  -7.500  -7.812   0.749
  514    HG2  ARG  67           2HG      ARG  67  -9.140  -6.827   2.168
  515    HG3  ARG  67           1HG      ARG  67 -10.439  -7.207   1.030
  516    HD2  ARG  67           2HD      ARG  67  -8.785  -9.166   2.633
  517    HD3  ARG  67           1HD      ARG  67 -10.504  -8.811   2.830
  518    HE   ARG  67           HE       ARG  67 -10.432  -9.649   0.299
  519   HH11  ARG  67          1HH1      ARG  67  -9.064 -11.002   3.151
  520   HH12  ARG  67          2HH1      ARG  67  -9.086 -12.612   2.519
  521   HH21  ARG  67          1HH2      ARG  67 -10.463 -11.713  -0.492
  522   HH22  ARG  67          2HH2      ARG  67  -9.863 -13.012   0.482
  523    H    GLY  68           H        GLY  68  -5.855  -6.129  -0.831
  524    HA2  GLY  68           2HA      GLY  68  -5.323  -7.907  -2.923
  525    HA3  GLY  68           1HA      GLY  68  -5.612  -6.333  -3.645
  526    H    ASP  69           H        ASP  69  -3.303  -7.135  -4.269
  527    HA   ASP  69           HA       ASP  69  -1.345  -6.063  -2.336
  528    HB2  ASP  69           2HB      ASP  69  -1.032  -8.430  -3.050
  529    HB3  ASP  69           1HB      ASP  69  -0.880  -7.887  -4.716
  530    H    PHE  70           H        PHE  70  -0.878  -3.971  -2.785
  531    HA   PHE  70           HA       PHE  70  -1.180  -3.034  -5.558
  532    HB2  PHE  70           2HB      PHE  70  -1.422  -0.782  -4.623
  533    HB3  PHE  70           1HB      PHE  70  -2.571  -1.891  -3.888
  534    HD1  PHE  70           HD1      PHE  70  -2.339  -2.563  -1.550
  535    HD2  PHE  70           HD2      PHE  70   0.363   0.218  -3.325
  536    HE1  PHE  70           HE1      PHE  70  -1.567  -1.884   0.683
  537    HE2  PHE  70           HE2      PHE  70   1.136   0.888  -1.091
  538    HZ   PHE  70           HZ       PHE  70   0.172  -0.161   0.914
  539    HA   PRO  71           HA       PRO  71   3.190  -2.184  -5.958
  540    HB2  PRO  71           2HB      PRO  71   3.102  -0.184  -7.808
  541    HB3  PRO  71           1HB      PRO  71   2.822  -1.881  -8.209
  542    HG2  PRO  71           2HG      PRO  71   0.830   0.313  -7.747
  543    HG3  PRO  71           1HG      PRO  71   0.832  -0.956  -8.987
  544    HD2  PRO  71           2HD      PRO  71  -0.690  -1.096  -6.740
  545    HD3  PRO  71           1HD      PRO  71  -0.047  -2.534  -7.557
  546    H    GLY  72           H        GLY  72   3.867  -1.326  -4.014
  547    HA2  GLY  72           2HA      GLY  72   3.015   1.047  -2.809
  548    HA3  GLY  72           1HA      GLY  72   4.532   0.234  -2.466
  549    H    THR  73           H        THR  73   5.165   0.709  -5.476
  550    HA   THR  73           HA       THR  73   6.784   2.996  -5.107
  551    HB   THR  73           HB       THR  73   7.393   1.276  -6.727
  552    HG1  THR  73           HG1      THR  73   6.942   3.867  -7.852
  553   HG21  THR  73          3HG2      THR  73   5.028   2.258  -8.336
  554   HG22  THR  73          1HG2      THR  73   5.173   0.681  -7.558
  555   HG23  THR  73          2HG2      THR  73   6.242   1.108  -8.895
  556    H    TYR  74           H        TYR  74   3.462   2.806  -5.857
  557    HA   TYR  74           HA       TYR  74   3.456   5.501  -7.064
  558    HB2  TYR  74           2HB      TYR  74   1.325   3.356  -7.058
  559    HB3  TYR  74           1HB      TYR  74   1.121   4.959  -7.754
  560    HD1  TYR  74           HD2      TYR  74   3.367   5.516  -9.346
  561    HD2  TYR  74           HD1      TYR  74   1.560   1.723  -8.662
  562    HE1  TYR  74           HE2      TYR  74   4.248   4.712 -11.495
  563    HE2  TYR  74           HE1      TYR  74   2.433   0.911 -10.811
  564    HH   TYR  74           HH       TYR  74   3.177   1.823 -12.951
  565    H    VAL  75           H        VAL  75   3.340   4.382  -4.051
  566    HA   VAL  75           HA       VAL  75   1.253   6.311  -3.224
  567    HB   VAL  75           HB       VAL  75   0.708   4.939  -1.289
  568   HG11  VAL  75          1HG1      VAL  75   0.579   3.334  -3.845
  569   HG12  VAL  75          2HG1      VAL  75  -0.574   4.565  -3.333
  570   HG13  VAL  75          3HG1      VAL  75  -0.413   3.070  -2.411
  571   HG21  VAL  75          3HG2      VAL  75   2.868   3.879  -0.904
  572   HG22  VAL  75          1HG2      VAL  75   2.693   2.941  -2.390
  573   HG23  VAL  75          2HG2      VAL  75   1.603   2.656  -1.033
  574    H    GLU  76           H        GLU  76   1.593   7.383  -1.188
  575    HA   GLU  76           HA       GLU  76   4.436   7.486  -0.384
  576    HB2  GLU  76           2HB      GLU  76   4.077   9.792   0.300
  577    HB3  GLU  76           1HB      GLU  76   3.603   9.578  -1.380
  578    HG2  GLU  76           2HG      GLU  76   1.269   9.551  -0.767
  579    HG3  GLU  76           1HG      GLU  76   1.687   9.614   0.945
  580    H    PHE  77           H        PHE  77   4.976   7.599   1.795
  581    HA   PHE  77           HA       PHE  77   3.184   6.272   3.614
  582    HB2  PHE  77           2HB      PHE  77   5.547   5.738   3.646
  583    HB3  PHE  77           1HB      PHE  77   5.968   7.417   3.950
  584    HD1  PHE  77           HD2      PHE  77   4.023   4.602   5.461
  585    HD2  PHE  77           HD1      PHE  77   6.385   8.091   6.123
  586    HE1  PHE  77           HE2      PHE  77   4.017   4.150   7.876
  587    HE2  PHE  77           HE1      PHE  77   6.377   7.638   8.541
  588    HZ   PHE  77           HZ       PHE  77   5.190   5.668   9.420
  589    H    LEU  78           H        LEU  78   1.668   7.288   4.799
  590    HA   LEU  78           HA       LEU  78   1.841  10.164   5.284
  591    HB2  LEU  78           2HB      LEU  78  -0.330   8.170   5.969
  592    HB3  LEU  78           1HB      LEU  78  -0.445   9.906   6.201
  593    HG   LEU  78           HG       LEU  78  -0.167   8.515   3.529
  594   HD11  LEU  78          1HD1      LEU  78  -2.562   9.822   4.824
  595   HD12  LEU  78          2HD1      LEU  78  -2.342   8.096   4.532
  596   HD13  LEU  78          3HD1      LEU  78  -2.494   9.207   3.173
  597   HD21  LEU  78          3HD2      LEU  78   0.857  10.733   3.533
  598   HD22  LEU  78          1HD2      LEU  78  -0.626  11.429   4.188
  599   HD23  LEU  78          2HD2      LEU  78  -0.619  10.722   2.572
  600    H    GLY  79           H        GLY  79   1.164   7.295   7.314
  601    HA2  GLY  79           2HA      GLY  79   2.974   7.459   9.284
  602    HA3  GLY  79           1HA      GLY  79   1.887   8.769   9.721
  603    HA   PRO  80           HA       PRO  80   0.296   4.891  11.774
  604    HB2  PRO  80           2HB      PRO  80  -0.400   6.132  14.110
  605    HB3  PRO  80           1HB      PRO  80   1.215   5.489  13.796
  606    HG2  PRO  80           2HG      PRO  80   0.224   8.312  13.555
  607    HG3  PRO  80           1HG      PRO  80   1.735   7.714  14.270
  608    HD2  PRO  80           2HD      PRO  80   1.656   8.767  11.784
  609    HD3  PRO  80           1HD      PRO  80   2.749   7.431  12.203
  610    H    LEU  81           H        LEU  81  -1.854   4.260  12.013
  611    HA   LEU  81           HA       LEU  81  -3.819   6.165  10.998
  612    HB2  LEU  81           2HB      LEU  81  -5.295   4.082  10.890
  613    HB3  LEU  81           1HB      LEU  81  -3.938   4.196   9.790
  614    HG   LEU  81           HG       LEU  81  -2.647   2.701  11.360
  615   HD11  LEU  81          1HD1      LEU  81  -5.358   2.308  12.629
  616   HD12  LEU  81          2HD1      LEU  81  -3.922   2.986  13.397
  617   HD13  LEU  81          3HD1      LEU  81  -3.942   1.294  12.909
  618   HD21  LEU  81          3HD2      LEU  81  -3.662   1.899   9.290
  619   HD22  LEU  81          1HD2      LEU  81  -5.165   1.571  10.151
  620   HD23  LEU  81          2HD2      LEU  81  -3.704   0.666  10.552
  621    H    GLU  82           H        GLU  82  -5.797   6.590  11.950
  622    HA   GLU  82           HA       GLU  82  -6.713   5.443  14.380
  623    HB2  GLU  82           2HB      GLU  82  -4.940   6.791  15.385
  624    HB3  GLU  82           1HB      GLU  82  -5.529   8.231  14.564
  625    HG2  GLU  82           2HG      GLU  82  -7.566   8.182  15.863
  626    HG3  GLU  82           1HG      GLU  82  -7.082   6.664  16.620
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1  -5.388  -6.888  17.743
    2    H2   MET   1           2H       MET   1  -5.118  -5.883  19.078
    3    H3   MET   1           3H       MET   1  -4.003  -7.098  18.691
    4    HA   MET   1           HA       MET   1  -3.427  -6.018  16.645
    5    HB2  MET   1           2HB      MET   1  -4.324  -3.776  16.126
    6    HB3  MET   1           1HB      MET   1  -5.579  -5.006  16.140
    7    HG2  MET   1           2HG      MET   1  -6.398  -3.002  17.189
    8    HG3  MET   1           1HG      MET   1  -6.246  -4.277  18.394
    9    HE1  MET   1           3HE      MET   1  -6.592  -1.220  19.237
   10    HE2  MET   1           1HE      MET   1  -5.392  -1.118  20.524
   11    HE3  MET   1           2HE      MET   1  -6.404  -2.555  20.378
   12    H    ALA   2           H        ALA   2  -3.437  -5.404  19.952
   13    HA   ALA   2           HA       ALA   2  -1.969  -2.955  20.032
   14    HB1  ALA   2           3HB      ALA   2  -1.748  -3.372  22.415
   15    HB2  ALA   2           1HB      ALA   2  -2.317  -5.027  22.196
   16    HB3  ALA   2           2HB      ALA   2  -3.402  -3.673  21.883
   17    H    GLY   3           H        GLY   3  -0.076  -3.038  18.908
   18    HA2  GLY   3           2HA      GLY   3   2.312  -3.736  19.956
   19    HA3  GLY   3           1HA      GLY   3   1.794  -5.241  19.206
   20    HA   PRO   4           HA       PRO   4   2.973  -3.395  15.247
   21    HB2  PRO   4           2HB      PRO   4   1.277  -4.543  13.497
   22    HB3  PRO   4           1HB      PRO   4   2.527  -5.480  14.324
   23    HG2  PRO   4           2HG      PRO   4  -0.400  -5.300  14.911
   24    HG3  PRO   4           1HG      PRO   4   0.670  -6.711  14.966
   25    HD2  PRO   4           2HD      PRO   4  -0.119  -5.232  17.178
   26    HD3  PRO   4           1HD      PRO   4   1.320  -6.266  17.112
   27    H    GLU   5           H        GLU   5   2.536  -1.210  15.334
   28    HA   GLU   5           HA       GLU   5   0.062  -0.014  15.789
   29    HB2  GLU   5           2HB      GLU   5   2.384   1.223  14.296
   30    HB3  GLU   5           1HB      GLU   5   1.104   2.082  15.142
   31    HG2  GLU   5           2HG      GLU   5   3.194   0.314  16.404
   32    HG3  GLU   5           1HG      GLU   5   3.173   2.076  16.420
   33    H    GLY   6           H        GLY   6   1.431  -1.074  12.751
   34    HA2  GLY   6           2HA      GLY   6   0.418  -1.239  10.663
   35    HA3  GLY   6           1HA      GLY   6  -1.019  -0.479  11.333
   36    H    PHE   7           H        PHE   7  -0.120   0.235   8.802
   37    HA   PHE   7           HA       PHE   7   0.783   2.992   9.270
   38    HB2  PHE   7           2HB      PHE   7   1.982   1.125   7.207
   39    HB3  PHE   7           1HB      PHE   7   2.305   2.855   7.306
   40    HD1  PHE   7           HD1      PHE   7   3.245   3.730   9.549
   41    HD2  PHE   7           HD2      PHE   7   3.327  -0.368   8.389
   42    HE1  PHE   7           HE1      PHE   7   5.051   3.312  11.165
   43    HE2  PHE   7           HE2      PHE   7   5.137  -0.788  10.000
   44    HZ   PHE   7           HZ       PHE   7   5.999   1.050  11.393
   45    H    GLN   8           H        GLN   8   0.352   4.469   7.541
   46    HA   GLN   8           HA       GLN   8  -1.922   3.677   5.829
   47    HB2  GLN   8           2HB      GLN   8  -1.476   6.328   7.234
   48    HB3  GLN   8           1HB      GLN   8  -2.808   5.968   6.147
   49    HG2  GLN   8           2HG      GLN   8  -3.634   4.279   7.692
   50    HG3  GLN   8           1HG      GLN   8  -2.279   4.591   8.775
   51   HE21  GLN   8          1HE2      GLN   8  -5.155   4.830   9.233
   52   HE22  GLN   8          2HE2      GLN   8  -5.423   6.458   9.740
   53    H    TYR   9           H        TYR   9  -1.764   4.176   3.712
   54    HA   TYR   9           HA       TYR   9   0.381   6.034   2.851
   55    HB2  TYR   9           2HB      TYR   9  -0.554   3.497   1.479
   56    HB3  TYR   9           1HB      TYR   9   0.588   4.646   0.792
   57    HD1  TYR   9           HD1      TYR   9   0.112   2.011   3.310
   58    HD2  TYR   9           HD2      TYR   9   2.873   4.788   1.631
   59    HE1  TYR   9           HE1      TYR   9   1.968   0.815   4.391
   60    HE2  TYR   9           HE2      TYR   9   4.735   3.596   2.709
   61    HH   TYR   9           HH       TYR   9   5.170   2.086   4.503
   62    H    ARG  10           H        ARG  10  -0.187   7.603   1.371
   63    HA   ARG  10           HA       ARG  10  -3.018   7.702   0.581
   64    HB2  ARG  10           2HB      ARG  10  -1.786   9.648   1.749
   65    HB3  ARG  10           1HB      ARG  10  -1.023   9.926   0.194
   66    HG2  ARG  10           2HG      ARG  10  -3.370  10.079  -0.769
   67    HG3  ARG  10           1HG      ARG  10  -3.934  10.142   0.900
   68    HD2  ARG  10           2HD      ARG  10  -2.150  12.100  -0.534
   69    HD3  ARG  10           1HD      ARG  10  -3.751  12.390   0.140
   70    HE   ARG  10           HE       ARG  10  -1.322  11.930   1.762
   71   HH11  ARG  10          1HH1      ARG  10  -4.399  13.440   1.308
   72   HH12  ARG  10          2HH1      ARG  10  -4.267  14.373   2.756
   73   HH21  ARG  10          1HH2      ARG  10  -1.166  13.177   3.596
   74   HH22  ARG  10          2HH2      ARG  10  -2.458  14.247   4.015
   75    H    ALA  11           H        ALA  11  -3.604   7.193  -1.434
   76    HA   ALA  11           HA       ALA  11  -1.706   6.397  -3.407
   77    HB1  ALA  11           3HB      ALA  11  -3.659   5.913  -4.790
   78    HB2  ALA  11           1HB      ALA  11  -4.690   6.803  -3.666
   79    HB3  ALA  11           2HB      ALA  11  -3.897   5.317  -3.149
   80    H    LEU  12           H        LEU  12  -0.627   7.714  -4.780
   81    HA   LEU  12           HA       LEU  12  -1.643  10.386  -5.360
   82    HB2  LEU  12           2HB      LEU  12   0.922   9.061  -6.253
   83    HB3  LEU  12           1HB      LEU  12   0.521  10.760  -6.444
   84    HG   LEU  12           HG       LEU  12   0.980   9.309  -3.829
   85   HD11  LEU  12          1HD1      LEU  12   2.937  10.741  -3.626
   86   HD12  LEU  12          2HD1      LEU  12   2.596  11.459  -5.202
   87   HD13  LEU  12          3HD1      LEU  12   3.026   9.752  -5.083
   88   HD21  LEU  12          3HD2      LEU  12   0.735  11.497  -2.767
   89   HD22  LEU  12          1HD2      LEU  12  -0.753  11.002  -3.572
   90   HD23  LEU  12          2HD2      LEU  12   0.295  12.208  -4.320
   91    H    TYR  13           H        TYR  13  -0.752   7.454  -7.171
   92    HA   TYR  13           HA       TYR  13  -2.122   8.557  -9.542
   93    HB2  TYR  13           2HB      TYR  13   0.152   6.598  -9.268
   94    HB3  TYR  13           1HB      TYR  13  -0.783   6.712 -10.756
   95    HD1  TYR  13           HD2      TYR  13   1.469   8.597  -8.485
   96    HD2  TYR  13           HD1      TYR  13  -0.439   8.492 -12.290
   97    HE1  TYR  13           HE2      TYR  13   2.859  10.484  -9.231
   98    HE2  TYR  13           HE1      TYR  13   0.948  10.372 -13.043
   99    HH   TYR  13           HH       TYR  13   2.229  12.186 -12.160
  100    HA   PRO  14           HA       PRO  14  -5.177   5.360  -9.010
  101    HB2  PRO  14           2HB      PRO  14  -6.545   5.688 -11.309
  102    HB3  PRO  14           1HB      PRO  14  -6.596   6.881 -10.009
  103    HG2  PRO  14           2HG      PRO  14  -5.019   6.918 -12.557
  104    HG3  PRO  14           1HG      PRO  14  -5.879   8.244 -11.754
  105    HD2  PRO  14           2HD      PRO  14  -3.156   7.826 -11.576
  106    HD3  PRO  14           1HD      PRO  14  -4.112   8.702 -10.365
  107    H    PHE  15           H        PHE  15  -5.523   3.243  -9.562
  108    HA   PHE  15           HA       PHE  15  -4.424   2.171 -12.058
  109    HB2  PHE  15           2HB      PHE  15  -3.724   1.097  -9.311
  110    HB3  PHE  15           1HB      PHE  15  -3.415   0.236 -10.814
  111    HD1  PHE  15           HD2      PHE  15  -1.862   1.298 -12.512
  112    HD2  PHE  15           HD1      PHE  15  -2.193   2.692  -8.500
  113    HE1  PHE  15           HE2      PHE  15   0.309   2.432 -12.730
  114    HE2  PHE  15           HE1      PHE  15  -0.021   3.824  -8.716
  115    HZ   PHE  15           HZ       PHE  15   1.234   3.695 -10.830
  116    H    ARG  16           H        ARG  16  -5.850   0.828 -12.995
  117    HA   ARG  16           HA       ARG  16  -7.599  -0.801 -11.288
  118    HB2  ARG  16           2HB      ARG  16  -9.471  -0.417 -12.949
  119    HB3  ARG  16           1HB      ARG  16  -9.068   0.943 -11.913
  120    HG2  ARG  16           2HG      ARG  16  -7.791   1.956 -13.754
  121    HG3  ARG  16           1HG      ARG  16  -8.236   0.598 -14.791
  122    HD2  ARG  16           2HD      ARG  16 -10.581   1.170 -14.603
  123    HD3  ARG  16           1HD      ARG  16 -10.208   2.457 -13.455
  124    HE   ARG  16           HE       ARG  16  -8.819   2.837 -15.893
  125   HH11  ARG  16          1HH1      ARG  16 -11.979   3.083 -14.548
  126   HH12  ARG  16          2HH1      ARG  16 -12.426   4.400 -15.573
  127   HH21  ARG  16          1HH2      ARG  16  -9.415   4.496 -17.220
  128   HH22  ARG  16          2HH2      ARG  16 -10.994   5.186 -17.079
  129    H    ARG  17           H        ARG  17  -7.227  -2.850 -11.707
  130    HA   ARG  17           HA       ARG  17  -6.316  -3.653 -14.402
  131    HB2  ARG  17           2HB      ARG  17  -5.511  -4.642 -11.665
  132    HB3  ARG  17           1HB      ARG  17  -5.187  -5.577 -13.117
  133    HG2  ARG  17           2HG      ARG  17  -4.223  -2.753 -12.688
  134    HG3  ARG  17           1HG      ARG  17  -3.281  -4.191 -12.294
  135    HD2  ARG  17           2HD      ARG  17  -3.414  -4.905 -14.647
  136    HD3  ARG  17           1HD      ARG  17  -4.319  -3.439 -15.032
  137    HE   ARG  17           HE       ARG  17  -2.234  -2.255 -14.177
  138   HH11  ARG  17          1HH1      ARG  17  -2.101  -5.380 -15.642
  139   HH12  ARG  17          2HH1      ARG  17  -0.524  -5.112 -16.299
  140   HH21  ARG  17          1HH2      ARG  17  -0.207  -1.954 -14.997
  141   HH22  ARG  17          2HH2      ARG  17   0.536  -3.205 -15.933
  142    H    GLU  18           H        GLU  18  -7.081  -5.555 -15.303
  143    HA   GLU  18           HA       GLU  18  -9.526  -6.693 -14.196
  144    HB2  GLU  18           2HB      GLU  18  -9.352  -6.200 -16.604
  145    HB3  GLU  18           1HB      GLU  18  -8.001  -7.311 -16.747
  146    HG2  GLU  18           2HG      GLU  18 -10.176  -8.190 -17.581
  147    HG3  GLU  18           1HG      GLU  18  -9.403  -9.197 -16.360
  148    H    ARG  19           H        ARG  19  -6.929  -7.054 -12.849
  149    HA   ARG  19           HA       ARG  19  -6.969  -9.981 -12.613
  150    HB2  ARG  19           2HB      ARG  19  -4.502  -8.227 -12.764
  151    HB3  ARG  19           1HB      ARG  19  -4.476  -9.906 -12.243
  152    HG2  ARG  19           2HG      ARG  19  -5.390  -8.945 -14.952
  153    HG3  ARG  19           1HG      ARG  19  -3.805  -9.632 -14.592
  154    HD2  ARG  19           2HD      ARG  19  -4.812 -11.749 -13.981
  155    HD3  ARG  19           1HD      ARG  19  -6.429 -11.072 -14.165
  156    HE   ARG  19           HE       ARG  19  -5.208 -10.740 -16.607
  157   HH11  ARG  19          1HH1      ARG  19  -5.952 -13.419 -14.567
  158   HH12  ARG  19          2HH1      ARG  19  -6.187 -14.497 -15.898
  159   HH21  ARG  19          1HH2      ARG  19  -5.529 -12.134 -18.300
  160   HH22  ARG  19          2HH2      ARG  19  -5.956 -13.781 -17.990
  161    HA   PRO  20           HA       PRO  20  -7.842  -8.810  -8.448
  162    HB2  PRO  20           2HB      PRO  20  -7.686 -11.241  -7.250
  163    HB3  PRO  20           1HB      PRO  20  -9.009 -10.787  -8.330
  164    HG2  PRO  20           2HG      PRO  20  -6.554 -12.406  -8.923
  165    HG3  PRO  20           1HG      PRO  20  -8.236 -12.712  -9.397
  166    HD2  PRO  20           2HD      PRO  20  -6.419 -11.611 -11.085
  167    HD3  PRO  20           1HD      PRO  20  -8.148 -11.211 -11.151
  168    H    GLU  21           H        GLU  21  -4.725  -9.816  -9.365
  169    HA   GLU  21           HA       GLU  21  -3.571  -9.963  -6.721
  170    HB2  GLU  21           2HB      GLU  21  -2.193  -9.532  -9.389
  171    HB3  GLU  21           1HB      GLU  21  -1.389  -9.899  -7.870
  172    HG2  GLU  21           2HG      GLU  21  -1.469 -11.911  -9.103
  173    HG3  GLU  21           1HG      GLU  21  -2.670 -12.059  -7.820
  174    H    ASP  22           H        ASP  22  -3.909  -7.490  -9.204
  175    HA   ASP  22           HA       ASP  22  -2.418  -5.492  -7.743
  176    HB2  ASP  22           2HB      ASP  22  -2.819  -5.786 -10.340
  177    HB3  ASP  22           1HB      ASP  22  -4.275  -4.853 -10.019
  178    H    LEU  23           H        LEU  23  -3.901  -3.185  -7.808
  179    HA   LEU  23           HA       LEU  23  -6.307  -3.817  -6.218
  180    HB2  LEU  23           2HB      LEU  23  -4.392  -3.446  -4.711
  181    HB3  LEU  23           1HB      LEU  23  -4.146  -1.863  -5.423
  182    HG   LEU  23           HG       LEU  23  -6.294  -1.096  -4.544
  183   HD11  LEU  23          1HD1      LEU  23  -7.598  -2.515  -3.024
  184   HD12  LEU  23          2HD1      LEU  23  -6.537  -3.876  -3.391
  185   HD13  LEU  23          3HD1      LEU  23  -7.542  -3.172  -4.659
  186   HD21  LEU  23          3HD2      LEU  23  -4.624  -2.451  -2.422
  187   HD22  LEU  23          1HD2      LEU  23  -5.745  -1.113  -2.169
  188   HD23  LEU  23          2HD2      LEU  23  -4.292  -0.874  -3.140
  189    H    GLU  24           H        GLU  24  -8.048  -2.525  -6.561
  190    HA   GLU  24           HA       GLU  24  -8.024  -0.555  -8.633
  191    HB2  GLU  24           2HB      GLU  24 -10.182  -1.138  -6.584
  192    HB3  GLU  24           1HB      GLU  24 -10.386  -0.195  -8.054
  193    HG2  GLU  24           2HG      GLU  24  -9.749  -2.260  -9.346
  194    HG3  GLU  24           1HG      GLU  24  -9.839  -3.148  -7.825
  195    H    LEU  25           H        LEU  25  -7.463   1.535  -8.471
  196    HA   LEU  25           HA       LEU  25  -7.371   2.820  -5.815
  197    HB2  LEU  25           2HB      LEU  25  -5.093   2.664  -7.795
  198    HB3  LEU  25           1HB      LEU  25  -5.072   3.576  -6.294
  199    HG   LEU  25           HG       LEU  25  -5.566   0.613  -6.262
  200   HD11  LEU  25          1HD1      LEU  25  -2.882   1.975  -6.375
  201   HD12  LEU  25          2HD1      LEU  25  -3.546   0.812  -7.524
  202   HD13  LEU  25          3HD1      LEU  25  -3.140   0.299  -5.887
  203   HD21  LEU  25          3HD2      LEU  25  -4.385   2.540  -4.255
  204   HD22  LEU  25          1HD2      LEU  25  -4.608   0.806  -4.013
  205   HD23  LEU  25          2HD2      LEU  25  -6.009   1.854  -4.216
  206    H    LEU  26           H        LEU  26  -7.879   4.926  -5.781
  207    HA   LEU  26           HA       LEU  26  -8.024   6.444  -8.314
  208    HB2  LEU  26           2HB      LEU  26  -9.697   6.597  -5.808
  209    HB3  LEU  26           1HB      LEU  26  -9.635   7.927  -6.944
  210    HG   LEU  26           HG       LEU  26 -11.638   6.586  -7.269
  211   HD11  LEU  26          1HD1      LEU  26 -10.632   7.684  -9.213
  212   HD12  LEU  26          2HD1      LEU  26 -11.448   6.188  -9.662
  213   HD13  LEU  26          3HD1      LEU  26  -9.687   6.231  -9.552
  214   HD21  LEU  26          3HD2      LEU  26 -11.559   4.284  -8.016
  215   HD22  LEU  26          1HD2      LEU  26 -10.752   4.437  -6.455
  216   HD23  LEU  26          2HD2      LEU  26  -9.797   4.284  -7.931
  217    HA   PRO  27           HA       PRO  27  -5.057   9.374  -6.684
  218    HB2  PRO  27           2HB      PRO  27  -6.719  11.615  -7.677
  219    HB3  PRO  27           1HB      PRO  27  -5.081  11.137  -8.136
  220    HG2  PRO  27           2HG      PRO  27  -7.161  10.760  -9.790
  221    HG3  PRO  27           1HG      PRO  27  -5.820   9.601  -9.700
  222    HD2  PRO  27           2HD      PRO  27  -8.553   9.431  -8.464
  223    HD3  PRO  27           1HD      PRO  27  -7.610   8.170  -9.282
  224    H    GLY  28           H        GLY  28  -5.099   9.464  -4.485
  225    HA2  GLY  28           2HA      GLY  28  -5.352  11.031  -2.656
  226    HA3  GLY  28           1HA      GLY  28  -6.955  11.413  -3.256
  227    H    ASP  29           H        ASP  29  -6.212   8.064  -3.257
  228    HA   ASP  29           HA       ASP  29  -8.197   7.554  -1.231
  229    HB2  ASP  29           2HB      ASP  29  -6.420   5.690  -2.824
  230    HB3  ASP  29           1HB      ASP  29  -7.676   5.148  -1.714
  231    H    VAL  30           H        VAL  30  -7.923   6.453   0.730
  232    HA   VAL  30           HA       VAL  30  -5.212   6.539   1.880
  233    HB   VAL  30           HB       VAL  30  -7.873   6.220   3.300
  234   HG11  VAL  30          1HG1      VAL  30  -6.053   5.171   4.538
  235   HG12  VAL  30          2HG1      VAL  30  -6.597   6.633   5.359
  236   HG13  VAL  30          3HG1      VAL  30  -5.101   6.655   4.426
  237   HG21  VAL  30          3HG2      VAL  30  -7.542   8.530   4.062
  238   HG22  VAL  30          1HG2      VAL  30  -7.647   8.443   2.303
  239   HG23  VAL  30          2HG2      VAL  30  -6.079   8.646   3.084
  240    H    LEU  31           H        LEU  31  -4.115   4.690   1.998
  241    HA   LEU  31           HA       LEU  31  -5.569   2.136   1.878
  242    HB2  LEU  31           2HB      LEU  31  -2.684   2.800   1.274
  243    HB3  LEU  31           1HB      LEU  31  -3.322   1.168   1.301
  244    HG   LEU  31           HG       LEU  31  -4.935   1.889  -0.531
  245   HD11  LEU  31          1HD1      LEU  31  -3.059   4.246  -0.711
  246   HD12  LEU  31          2HD1      LEU  31  -4.756   4.306  -0.232
  247   HD13  LEU  31          3HD1      LEU  31  -4.320   3.827  -1.871
  248   HD21  LEU  31          3HD2      LEU  31  -2.980   0.504  -0.972
  249   HD22  LEU  31          1HD2      LEU  31  -1.975   1.946  -1.126
  250   HD23  LEU  31          2HD2      LEU  31  -3.259   1.635  -2.296
  251    H    VAL  32           H        VAL  32  -5.738   0.936   3.641
  252    HA   VAL  32           HA       VAL  32  -4.060   1.478   5.978
  253    HB   VAL  32           HB       VAL  32  -6.488  -0.317   5.696
  254   HG11  VAL  32          1HG1      VAL  32  -5.016  -1.085   7.487
  255   HG12  VAL  32          2HG1      VAL  32  -6.485  -0.376   8.158
  256   HG13  VAL  32          3HG1      VAL  32  -4.978   0.540   8.171
  257   HG21  VAL  32          3HG2      VAL  32  -7.087   2.015   5.406
  258   HG22  VAL  32          1HG2      VAL  32  -6.206   2.457   6.868
  259   HG23  VAL  32          2HG2      VAL  32  -7.651   1.452   6.979
  260    H    VAL  33           H        VAL  33  -2.244   0.334   6.244
  261    HA   VAL  33           HA       VAL  33  -2.136  -2.464   5.273
  262    HB   VAL  33           HB       VAL  33   0.171  -0.510   5.532
  263   HG11  VAL  33          1HG1      VAL  33   0.827  -2.849   5.949
  264   HG12  VAL  33          2HG1      VAL  33   1.524  -2.225   4.454
  265   HG13  VAL  33          3HG1      VAL  33   0.136  -3.314   4.394
  266   HG21  VAL  33          3HG2      VAL  33  -1.285   0.076   3.669
  267   HG22  VAL  33          1HG2      VAL  33  -1.207  -1.578   3.061
  268   HG23  VAL  33          2HG2      VAL  33   0.243  -0.574   3.074
  269    H    SER  34           H        SER  34  -1.533  -4.034   6.702
  270    HA   SER  34           HA       SER  34  -1.194  -3.282   9.500
  271    HB2  SER  34           2HB      SER  34  -1.455  -5.637  10.007
  272    HB3  SER  34           1HB      SER  34  -2.690  -5.186   8.834
  273    HG   SER  34           HG       SER  34  -1.912  -6.685   7.597
  274    H    ARG  35           H        ARG  35   0.703  -3.389  10.651
  275    HA   ARG  35           HA       ARG  35   3.149  -3.507   9.216
  276    HB2  ARG  35           2HB      ARG  35   2.784  -2.210  11.344
  277    HB3  ARG  35           1HB      ARG  35   2.851  -3.736  12.218
  278    HG2  ARG  35           2HG      ARG  35   5.130  -4.108  11.426
  279    HG3  ARG  35           1HG      ARG  35   5.065  -2.609  10.503
  280    HD2  ARG  35           2HD      ARG  35   4.646  -1.427  12.713
  281    HD3  ARG  35           1HD      ARG  35   5.070  -2.951  13.499
  282    HE   ARG  35           HE       ARG  35   7.003  -1.946  11.588
  283   HH11  ARG  35          1HH1      ARG  35   6.075  -2.080  14.915
  284   HH12  ARG  35          2HH1      ARG  35   7.664  -1.680  15.470
  285   HH21  ARG  35          1HH2      ARG  35   8.985  -1.401  12.306
  286   HH22  ARG  35          2HH2      ARG  35   9.289  -1.258  14.006
  287    H    ALA  36           H        ALA  36   1.288  -5.921  10.880
  288    HA   ALA  36           HA       ALA  36   3.215  -7.918  11.254
  289    HB1  ALA  36           3HB      ALA  36   1.350  -9.493  11.263
  290    HB2  ALA  36           1HB      ALA  36   0.299  -8.270  10.549
  291    HB3  ALA  36           2HB      ALA  36   0.945  -8.037  12.173
  292    H    ALA  37           H        ALA  37   1.259  -7.118   8.395
  293    HA   ALA  37           HA       ALA  37   2.149  -9.206   6.724
  294    HB1  ALA  37           3HB      ALA  37   1.358  -7.820   4.870
  295    HB2  ALA  37           1HB      ALA  37   1.258  -6.423   5.947
  296    HB3  ALA  37           2HB      ALA  37   0.202  -7.814   6.203
  297    H    LEU  38           H        LEU  38   3.360  -5.881   7.142
  298    HA   LEU  38           HA       LEU  38   5.454  -5.967   5.288
  299    HB2  LEU  38           2HB      LEU  38   5.360  -4.448   7.902
  300    HB3  LEU  38           1HB      LEU  38   6.419  -4.098   6.546
  301    HG   LEU  38           HG       LEU  38   3.406  -3.834   6.588
  302   HD11  LEU  38          1HD1      LEU  38   5.582  -1.754   6.402
  303   HD12  LEU  38          2HD1      LEU  38   4.534  -2.053   7.789
  304   HD13  LEU  38          3HD1      LEU  38   3.850  -1.446   6.282
  305   HD21  LEU  38          3HD2      LEU  38   5.343  -3.321   4.326
  306   HD22  LEU  38          1HD2      LEU  38   3.626  -2.910   4.321
  307   HD23  LEU  38          2HD2      LEU  38   4.128  -4.598   4.395
  308    H    GLN  39           H        GLN  39   5.454  -6.806   8.752
  309    HA   GLN  39           HA       GLN  39   8.165  -7.544   8.937
  310    HB2  GLN  39           2HB      GLN  39   5.755  -8.466  10.520
  311    HB3  GLN  39           1HB      GLN  39   7.410  -8.905  10.928
  312    HG2  GLN  39           2HG      GLN  39   7.964  -6.528  11.184
  313    HG3  GLN  39           1HG      GLN  39   6.292  -6.108  10.819
  314   HE21  GLN  39          1HE2      GLN  39   7.920  -5.636  13.216
  315   HE22  GLN  39          2HE2      GLN  39   7.036  -6.327  14.527
  316    H    ALA  40           H        ALA  40   5.295  -9.414   8.011
  317    HA   ALA  40           HA       ALA  40   6.581 -11.917   7.688
  318    HB1  ALA  40           3HB      ALA  40   4.624 -12.549   6.370
  319    HB2  ALA  40           1HB      ALA  40   4.132 -10.858   6.263
  320    HB3  ALA  40           2HB      ALA  40   4.142 -11.678   7.824
  321    H    LEU  41           H        LEU  41   6.380  -9.083   5.646
  322    HA   LEU  41           HA       LEU  41   7.478 -10.376   3.302
  323    HB2  LEU  41           2HB      LEU  41   7.124  -7.445   3.960
  324    HB3  LEU  41           1HB      LEU  41   7.610  -8.069   2.396
  325    HG   LEU  41           HG       LEU  41   4.942  -8.596   3.724
  326   HD11  LEU  41          1HD1      LEU  41   5.636  -6.782   1.413
  327   HD12  LEU  41          2HD1      LEU  41   5.180  -6.265   3.036
  328   HD13  LEU  41          3HD1      LEU  41   4.015  -7.117   2.025
  329   HD21  LEU  41          3HD2      LEU  41   5.624 -10.432   2.284
  330   HD22  LEU  41          1HD2      LEU  41   5.953  -9.303   0.969
  331   HD23  LEU  41          2HD2      LEU  41   4.302  -9.527   1.548
  332    H    GLY  42           H        GLY  42   8.836  -9.486   6.201
  333    HA2  GLY  42           2HA      GLY  42  11.070  -9.569   6.835
  334    HA3  GLY  42           1HA      GLY  42  11.525  -9.661   5.144
  335    H    VAL  43           H        VAL  43   9.411  -7.072   5.870
  336    HA   VAL  43           HA       VAL  43  11.405  -5.135   5.155
  337    HB   VAL  43           HB       VAL  43   8.595  -4.660   6.191
  338   HG11  VAL  43          1HG1      VAL  43  10.002  -2.671   6.373
  339   HG12  VAL  43          2HG1      VAL  43   8.795  -2.464   5.105
  340   HG13  VAL  43          3HG1      VAL  43  10.468  -2.826   4.678
  341   HG21  VAL  43          3HG2      VAL  43   8.534  -6.035   4.195
  342   HG22  VAL  43          1HG2      VAL  43   9.608  -4.915   3.353
  343   HG23  VAL  43          2HG2      VAL  43   7.983  -4.405   3.813
  344    H    ALA  44           H        ALA  44  12.945  -4.568   6.571
  345    HA   ALA  44           HA       ALA  44  12.617  -4.658   9.409
  346    HB1  ALA  44           3HB      ALA  44  14.782  -5.050   8.317
  347    HB2  ALA  44           1HB      ALA  44  14.874  -3.761   9.515
  348    HB3  ALA  44           2HB      ALA  44  14.821  -3.366   7.797
  349    H    GLU  45           H        GLU  45  12.546  -2.968  10.899
  350    HA   GLU  45           HA       GLU  45  10.919  -0.790  10.390
  351    HB2  GLU  45           2HB      GLU  45  11.418  -1.721  12.625
  352    HB3  GLU  45           1HB      GLU  45  13.033  -1.033  12.542
  353    HG2  GLU  45           2HG      GLU  45  12.132   1.205  12.557
  354    HG3  GLU  45           1HG      GLU  45  10.485   0.578  12.474
  355    H    GLY  46           H        GLY  46  11.222   1.056   9.294
  356    HA2  GLY  46           2HA      GLY  46  12.591   3.062   8.911
  357    HA3  GLY  46           1HA      GLY  46  13.999   2.011   8.859
  358    H    GLY  47           H        GLY  47  12.042   0.102   7.320
  359    HA2  GLY  47           2HA      GLY  47  12.713   1.173   4.665
  360    HA3  GLY  47           1HA      GLY  47  12.263  -0.484   5.031
  361    H    GLU  48           H        GLU  48   9.924   0.482   6.652
  362    HA   GLU  48           HA       GLU  48   7.955   0.307   4.634
  363    HB2  GLU  48           2HB      GLU  48   6.321   0.634   6.388
  364    HB3  GLU  48           1HB      GLU  48   7.600  -0.413   6.982
  365    HG2  GLU  48           2HG      GLU  48   7.311   2.529   7.598
  366    HG3  GLU  48           1HG      GLU  48   6.861   1.203   8.667
  367    H    ARG  49           H        ARG  49   9.496   3.058   6.134
  368    HA   ARG  49           HA       ARG  49   7.706   5.072   5.241
  369    HB2  ARG  49           2HB      ARG  49   9.566   6.630   5.645
  370    HB3  ARG  49           1HB      ARG  49   9.370   5.496   6.978
  371    HG2  ARG  49           2HG      ARG  49  11.245   4.173   6.155
  372    HG3  ARG  49           1HG      ARG  49  11.425   5.263   4.779
  373    HD2  ARG  49           2HD      ARG  49  11.951   7.104   6.292
  374    HD3  ARG  49           1HD      ARG  49  11.724   6.040   7.682
  375    HE   ARG  49           HE       ARG  49  13.620   4.793   6.161
  376   HH11  ARG  49          1HH1      ARG  49  13.354   7.939   7.557
  377   HH12  ARG  49          2HH1      ARG  49  15.057   8.067   7.832
  378   HH21  ARG  49          1HH2      ARG  49  15.789   4.995   6.494
  379   HH22  ARG  49          2HH2      ARG  49  16.415   6.431   7.236
  380    H    CYS  50           H        CYS  50   9.888   3.104   3.516
  381    HA   CYS  50           HA       CYS  50   9.554   4.762   1.099
  382    HB2  CYS  50           2HB      CYS  50  12.099   3.298   1.863
  383    HB3  CYS  50           1HB      CYS  50  11.834   4.194   0.370
  384    HG   CYS  50           HG       CYS  50  13.240   5.294   2.990
  385    HA   PRO  51           HA       PRO  51   7.997   0.323   0.856
  386    HB2  PRO  51           2HB      PRO  51   5.797   0.937  -0.687
  387    HB3  PRO  51           1HB      PRO  51   5.810   0.946   1.078
  388    HG2  PRO  51           2HG      PRO  51   6.120   3.239  -0.828
  389    HG3  PRO  51           1HG      PRO  51   5.164   3.143   0.664
  390    HD2  PRO  51           2HD      PRO  51   7.538   4.382   0.612
  391    HD3  PRO  51           1HD      PRO  51   7.029   3.432   2.025
  392    H    GLN  52           H        GLN  52   8.670   2.679  -1.654
  393    HA   GLN  52           HA       GLN  52   8.475   1.130  -3.953
  394    HB2  GLN  52           2HB      GLN  52  10.156   2.648  -4.934
  395    HB3  GLN  52           1HB      GLN  52   8.923   3.520  -4.031
  396    HG2  GLN  52           2HG      GLN  52  10.432   3.809  -2.166
  397    HG3  GLN  52           1HG      GLN  52  11.658   2.828  -2.969
  398   HE21  GLN  52          1HE2      GLN  52  13.162   4.488  -2.926
  399   HE22  GLN  52          2HE2      GLN  52  13.041   5.877  -3.938
  400    H    SER  53           H        SER  53  10.816   0.929  -1.395
  401    HA   SER  53           HA       SER  53  12.827  -0.493  -2.899
  402    HB2  SER  53           2HB      SER  53  13.465   0.859  -0.963
  403    HB3  SER  53           1HB      SER  53  12.471  -0.141   0.094
  404    HG   SER  53           HG       SER  53  14.350  -1.513  -1.418
  405    H    VAL  54           H        VAL  54   9.893  -1.401  -1.391
  406    HA   VAL  54           HA       VAL  54  10.720  -4.193  -0.986
  407    HB   VAL  54           HB       VAL  54   8.033  -2.927  -0.396
  408   HG11  VAL  54          1HG1      VAL  54   9.278  -5.499   0.596
  409   HG12  VAL  54          2HG1      VAL  54   7.962  -5.364  -0.572
  410   HG13  VAL  54          3HG1      VAL  54   7.715  -4.850   1.097
  411   HG21  VAL  54          3HG2      VAL  54   9.793  -1.781   0.862
  412   HG22  VAL  54          1HG2      VAL  54  10.368  -3.329   1.481
  413   HG23  VAL  54          2HG2      VAL  54   8.767  -2.739   1.930
  414    H    GLY  55           H        GLY  55   9.070  -2.227  -3.280
  415    HA2  GLY  55           2HA      GLY  55   8.478  -2.993  -5.460
  416    HA3  GLY  55           1HA      GLY  55   8.254  -4.610  -4.809
  417    H    TRP  56           H        TRP  56   6.186  -5.248  -4.498
  418    HA   TRP  56           HA       TRP  56   4.163  -3.165  -3.990
  419    HB2  TRP  56           2HB      TRP  56   2.483  -4.497  -5.161
  420    HB3  TRP  56           1HB      TRP  56   3.818  -4.089  -6.223
  421    HD1  TRP  56           HD1      TRP  56   5.415  -6.805  -4.665
  422    HE1  TRP  56           HE1      TRP  56   4.927  -9.058  -5.797
  423    HE3  TRP  56           HE3      TRP  56   1.260  -5.497  -7.342
  424    HZ2  TRP  56           HZ2      TRP  56   3.040 -10.146  -7.588
  425    HZ3  TRP  56           HZ3      TRP  56   0.172  -7.204  -8.740
  426    HH2  TRP  56           HH2      TRP  56   1.047  -9.484  -8.860
  427    H    MET  57           H        MET  57   2.535  -3.599  -2.462
  428    HA   MET  57           HA       MET  57   3.010  -5.940  -0.725
  429    HB2  MET  57           2HB      MET  57   2.742  -3.096   0.284
  430    HB3  MET  57           1HB      MET  57   2.982  -4.535   1.268
  431    HG2  MET  57           2HG      MET  57   5.180  -4.860   0.185
  432    HG3  MET  57           1HG      MET  57   4.937  -3.357  -0.701
  433    HE1  MET  57           3HE      MET  57   3.397  -1.676   1.633
  434    HE2  MET  57           1HE      MET  57   4.615  -0.961   0.575
  435    HE3  MET  57           2HE      MET  57   4.756  -0.786   2.325
  436    HA   PRO  58           HA       PRO  58  -1.435  -6.196  -0.556
  437    HB2  PRO  58           2HB      PRO  58  -1.789  -7.470   1.829
  438    HB3  PRO  58           1HB      PRO  58  -1.171  -8.282   0.385
  439    HG2  PRO  58           2HG      PRO  58   0.348  -7.158   2.718
  440    HG3  PRO  58           1HG      PRO  58   0.559  -8.716   1.894
  441    HD2  PRO  58           2HD      PRO  58   2.158  -6.598   1.395
  442    HD3  PRO  58           1HD      PRO  58   1.723  -7.767   0.130
  443    H    GLY  59           H        GLY  59  -2.807  -4.548  -0.184
  444    HA2  GLY  59           2HA      GLY  59  -2.989  -3.407   2.515
  445    HA3  GLY  59           1HA      GLY  59  -2.628  -2.306   1.197
  446    H    LEU  60           H        LEU  60  -4.836  -1.954   2.808
  447    HA   LEU  60           HA       LEU  60  -7.142  -2.822   1.181
  448    HB2  LEU  60           2HB      LEU  60  -7.322  -3.477   3.487
  449    HB3  LEU  60           1HB      LEU  60  -6.930  -1.859   4.035
  450    HG   LEU  60           HG       LEU  60  -9.077  -1.033   3.127
  451   HD11  LEU  60          1HD1      LEU  60  -9.604  -3.934   2.494
  452   HD12  LEU  60          2HD1      LEU  60  -9.388  -2.630   1.325
  453   HD13  LEU  60          3HD1      LEU  60 -10.785  -2.626   2.400
  454   HD21  LEU  60          3HD2      LEU  60  -8.921  -1.739   5.461
  455   HD22  LEU  60          1HD2      LEU  60  -9.360  -3.385   5.001
  456   HD23  LEU  60          2HD2      LEU  60 -10.520  -2.069   4.799
  457    H    ASN  61           H        ASN  61  -8.082  -1.362  -0.112
  458    HA   ASN  61           HA       ASN  61  -7.513   1.484   0.157
  459    HB2  ASN  61           2HB      ASN  61  -7.504   0.379  -2.065
  460    HB3  ASN  61           1HB      ASN  61  -9.211  -0.003  -1.874
  461   HD21  ASN  61          1HD2      ASN  61  -7.908   1.574  -3.930
  462   HD22  ASN  61          2HD2      ASN  61  -8.635   3.139  -3.869
  463    H    GLU  62           H        GLU  62  -8.817   2.877   1.246
  464    HA   GLU  62           HA       GLU  62 -11.159   1.910   2.564
  465    HB2  GLU  62           2HB      GLU  62  -9.872   4.633   2.446
  466    HB3  GLU  62           1HB      GLU  62 -11.341   4.323   3.366
  467    HG2  GLU  62           2HG      GLU  62  -8.709   2.902   3.773
  468    HG3  GLU  62           1HG      GLU  62  -9.302   4.245   4.748
  469    H    ARG  63           H        ARG  63 -10.786   3.443  -0.512
  470    HA   ARG  63           HA       ARG  63 -13.575   4.280  -0.616
  471    HB2  ARG  63           2HB      ARG  63 -11.499   4.163  -2.817
  472    HB3  ARG  63           1HB      ARG  63 -13.130   4.788  -3.011
  473    HG2  ARG  63           2HG      ARG  63 -12.541   6.460  -1.180
  474    HG3  ARG  63           1HG      ARG  63 -10.866   5.949  -1.408
  475    HD2  ARG  63           2HD      ARG  63 -11.200   7.887  -2.765
  476    HD3  ARG  63           1HD      ARG  63 -11.126   6.500  -3.845
  477    HE   ARG  63           HE       ARG  63 -13.784   6.812  -3.386
  478   HH11  ARG  63          1HH1      ARG  63 -11.302   8.933  -4.474
  479   HH12  ARG  63          2HH1      ARG  63 -12.379   9.880  -5.438
  480   HH21  ARG  63          1HH2      ARG  63 -15.165   8.033  -4.634
  481   HH22  ARG  63          2HH2      ARG  63 -14.543   9.379  -5.526
  482    H    THR  64           H        THR  64 -11.681   2.078  -2.699
  483    HA   THR  64           HA       THR  64 -14.014   0.765  -3.708
  484    HB   THR  64           HB       THR  64 -12.466  -0.740  -4.867
  485    HG1  THR  64           HG1      THR  64 -10.090   0.063  -4.388
  486   HG21  THR  64          3HG2      THR  64 -11.511   2.135  -4.883
  487   HG22  THR  64          1HG2      THR  64 -12.834   1.475  -5.844
  488   HG23  THR  64          2HG2      THR  64 -11.180   0.939  -6.136
  489    H    ARG  65           H        ARG  65 -11.970   0.225  -0.983
  490    HA   ARG  65           HA       ARG  65 -11.974  -1.251   0.728
  491    HB2  ARG  65           2HB      ARG  65 -14.597  -2.265  -0.373
  492    HB3  ARG  65           1HB      ARG  65 -13.970  -2.539   1.245
  493    HG2  ARG  65           2HG      ARG  65 -15.028   0.001   0.047
  494    HG3  ARG  65           1HG      ARG  65 -15.575  -0.854   1.488
  495    HD2  ARG  65           2HD      ARG  65 -13.017   0.711   1.144
  496    HD3  ARG  65           1HD      ARG  65 -14.393   1.136   2.157
  497    HE   ARG  65           HE       ARG  65 -12.388  -0.922   2.706
  498   HH11  ARG  65          1HH1      ARG  65 -15.247   0.726   3.680
  499   HH12  ARG  65          2HH1      ARG  65 -15.038   0.331   5.348
  500   HH21  ARG  65          1HH2      ARG  65 -12.120  -1.408   4.864
  501   HH22  ARG  65          2HH2      ARG  65 -13.280  -0.852   6.013
  502    H    GLN  66           H        GLN  66 -11.338  -2.078  -2.271
  503    HA   GLN  66           HA       GLN  66 -11.283  -4.954  -2.086
  504    HB2  GLN  66           2HB      GLN  66 -10.016  -3.007  -4.031
  505    HB3  GLN  66           1HB      GLN  66  -9.881  -4.753  -4.180
  506    HG2  GLN  66           2HG      GLN  66 -12.496  -3.252  -4.160
  507    HG3  GLN  66           1HG      GLN  66 -11.631  -3.730  -5.620
  508   HE21  GLN  66          1HE2      GLN  66 -11.526  -5.908  -6.167
  509   HE22  GLN  66          2HE2      GLN  66 -12.585  -7.081  -5.471
  510    H    ARG  67           H        ARG  67  -9.444  -6.275  -1.824
  511    HA   ARG  67           HA       ARG  67  -7.100  -4.948  -0.609
  512    HB2  ARG  67           2HB      ARG  67  -8.135  -7.761  -0.155
  513    HB3  ARG  67           1HB      ARG  67  -6.659  -7.112   0.537
  514    HG2  ARG  67           2HG      ARG  67  -8.259  -7.012   2.250
  515    HG3  ARG  67           1HG      ARG  67  -8.107  -5.357   1.660
  516    HD2  ARG  67           2HD      ARG  67 -10.452  -5.982   2.047
  517    HD3  ARG  67           1HD      ARG  67 -10.146  -5.613   0.349
  518    HE   ARG  67           HE       ARG  67  -9.912  -8.405   0.950
  519   HH11  ARG  67          1HH1      ARG  67 -12.140  -5.894   0.174
  520   HH12  ARG  67          2HH1      ARG  67 -13.311  -6.989  -0.467
  521   HH21  ARG  67          1HH2      ARG  67 -11.415  -9.794   0.122
  522   HH22  ARG  67          2HH2      ARG  67 -12.911  -9.176  -0.495
  523    H    GLY  68           H        GLY  68  -5.117  -5.293  -1.487
  524    HA2  GLY  68           2HA      GLY  68  -4.429  -7.563  -3.056
  525    HA3  GLY  68           1HA      GLY  68  -4.812  -6.204  -4.102
  526    H    ASP  69           H        ASP  69  -2.355  -7.057  -4.430
  527    HA   ASP  69           HA       ASP  69  -0.530  -5.708  -2.599
  528    HB2  ASP  69           2HB      ASP  69   0.051  -7.311  -5.106
  529    HB3  ASP  69           1HB      ASP  69   1.244  -6.746  -3.941
  530    H    PHE  70           H        PHE  70  -0.338  -3.560  -2.862
  531    HA   PHE  70           HA       PHE  70  -0.573  -2.400  -5.544
  532    HB2  PHE  70           2HB      PHE  70  -0.894  -0.260  -4.432
  533    HB3  PHE  70           1HB      PHE  70  -1.983  -1.455  -3.742
  534    HD1  PHE  70           HD1      PHE  70  -1.618  -2.305  -1.461
  535    HD2  PHE  70           HD2      PHE  70   0.870   0.738  -3.114
  536    HE1  PHE  70           HE1      PHE  70  -0.793  -1.752   0.788
  537    HE2  PHE  70           HE2      PHE  70   1.697   1.286  -0.863
  538    HZ   PHE  70           HZ       PHE  70   0.865   0.042   1.091
  539    HA   PRO  71           HA       PRO  71   3.836  -1.674  -5.898
  540    HB2  PRO  71           2HB      PRO  71   3.059   0.707  -7.493
  541    HB3  PRO  71           1HB      PRO  71   4.056  -0.678  -7.953
  542    HG2  PRO  71           2HG      PRO  71   1.571  -0.372  -8.905
  543    HG3  PRO  71           1HG      PRO  71   2.224  -1.976  -8.520
  544    HD2  PRO  71           2HD      PRO  71   0.308  -0.282  -6.957
  545    HD3  PRO  71           1HD      PRO  71   0.307  -2.040  -7.216
  546    H    GLY  72           H        GLY  72   4.936  -0.807  -4.195
  547    HA2  GLY  72           2HA      GLY  72   3.938   1.406  -2.690
  548    HA3  GLY  72           1HA      GLY  72   5.470   0.594  -2.444
  549    H    THR  73           H        THR  73   4.729   2.041  -5.552
  550    HA   THR  73           HA       THR  73   6.824   4.052  -5.064
  551    HB   THR  73           HB       THR  73   7.313   2.615  -6.939
  552    HG1  THR  73           HG1      THR  73   8.098   4.445  -7.663
  553   HG21  THR  73          3HG2      THR  73   4.668   3.510  -8.106
  554   HG22  THR  73          1HG2      THR  73   5.055   1.892  -7.519
  555   HG23  THR  73          2HG2      THR  73   5.882   2.537  -8.937
  556    H    TYR  74           H        TYR  74   3.450   3.740  -6.000
  557    HA   TYR  74           HA       TYR  74   3.257   6.537  -6.821
  558    HB2  TYR  74           2HB      TYR  74   1.062   6.028  -7.587
  559    HB3  TYR  74           1HB      TYR  74   2.027   4.607  -7.977
  560    HD1  TYR  74           HD2      TYR  74   1.873   2.588  -6.494
  561    HD2  TYR  74           HD1      TYR  74  -0.825   5.854  -6.136
  562    HE1  TYR  74           HE2      TYR  74   0.347   1.174  -5.196
  563    HE2  TYR  74           HE1      TYR  74  -2.357   4.448  -4.829
  564    HH   TYR  74           HH       TYR  74  -1.428   1.465  -3.527
  565    H    VAL  75           H        VAL  75   3.455   5.259  -3.865
  566    HA   VAL  75           HA       VAL  75   1.191   6.786  -2.731
  567    HB   VAL  75           HB       VAL  75   1.405   5.309  -0.718
  568   HG11  VAL  75          1HG1      VAL  75   0.813   3.909  -3.330
  569   HG12  VAL  75          2HG1      VAL  75  -0.314   4.888  -2.392
  570   HG13  VAL  75          3HG1      VAL  75   0.294   3.369  -1.733
  571   HG21  VAL  75          3HG2      VAL  75   3.706   4.570  -1.005
  572   HG22  VAL  75          1HG2      VAL  75   3.276   3.745  -2.505
  573   HG23  VAL  75          2HG2      VAL  75   2.626   3.175  -0.968
  574    H    GLU  76           H        GLU  76   1.486   8.156  -1.029
  575    HA   GLU  76           HA       GLU  76   4.247   8.717  -0.171
  576    HB2  GLU  76           2HB      GLU  76   3.316  10.825   0.755
  577    HB3  GLU  76           1HB      GLU  76   3.052  10.676  -0.977
  578    HG2  GLU  76           2HG      GLU  76   0.755  10.068  -0.639
  579    HG3  GLU  76           1HG      GLU  76   0.987   9.995   1.106
  580    H    PHE  77           H        PHE  77   4.870   8.488   1.957
  581    HA   PHE  77           HA       PHE  77   3.281   6.759   3.612
  582    HB2  PHE  77           2HB      PHE  77   5.742   6.579   3.494
  583    HB3  PHE  77           1HB      PHE  77   5.893   8.174   4.225
  584    HD1  PHE  77           HD2      PHE  77   4.446   4.798   4.867
  585    HD2  PHE  77           HD1      PHE  77   6.101   8.353   6.536
  586    HE1  PHE  77           HE2      PHE  77   4.426   3.759   7.092
  587    HE2  PHE  77           HE1      PHE  77   6.087   7.311   8.767
  588    HZ   PHE  77           HZ       PHE  77   5.250   5.014   9.046
  589    H    LEU  78           H        LEU  78   1.644   7.447   4.850
  590    HA   LEU  78           HA       LEU  78   1.487  10.203   5.754
  591    HB2  LEU  78           2HB      LEU  78  -0.382   7.882   6.270
  592    HB3  LEU  78           1HB      LEU  78  -0.715   9.567   6.628
  593    HG   LEU  78           HG       LEU  78  -0.354   8.385   3.864
  594   HD11  LEU  78          1HD1      LEU  78  -2.823   9.438   5.247
  595   HD12  LEU  78          2HD1      LEU  78  -2.472   7.744   4.899
  596   HD13  LEU  78          3HD1      LEU  78  -2.727   8.880   3.575
  597   HD21  LEU  78          3HD2      LEU  78   0.482  10.669   3.958
  598   HD22  LEU  78          1HD2      LEU  78  -1.021  11.205   4.710
  599   HD23  LEU  78          2HD2      LEU  78  -1.030  10.599   3.056
  600    H    GLY  79           H        GLY  79   1.404   7.018   7.352
  601    HA2  GLY  79           2HA      GLY  79   3.142   7.218   9.366
  602    HA3  GLY  79           1HA      GLY  79   1.847   8.253   9.958
  603    HA   PRO  80           HA       PRO  80   0.627   3.989  11.250
  604    HB2  PRO  80           2HB      PRO  80   0.257   4.448  13.858
  605    HB3  PRO  80           1HB      PRO  80   1.881   4.246  13.187
  606    HG2  PRO  80           2HG      PRO  80   0.438   6.767  13.923
  607    HG3  PRO  80           1HG      PRO  80   2.131   6.323  14.211
  608    HD2  PRO  80           2HD      PRO  80   1.261   7.925  12.127
  609    HD3  PRO  80           1HD      PRO  80   2.785   7.016  12.130
  610    H    LEU  81           H        LEU  81  -1.407   3.350  12.605
  611    HA   LEU  81           HA       LEU  81  -3.685   4.696  11.479
  612    HB2  LEU  81           2HB      LEU  81  -3.494   2.428  13.468
  613    HB3  LEU  81           1HB      LEU  81  -4.987   2.976  12.727
  614    HG   LEU  81           HG       LEU  81  -2.635   1.843  11.189
  615   HD11  LEU  81          1HD1      LEU  81  -5.237   0.532  11.996
  616   HD12  LEU  81          2HD1      LEU  81  -3.633   0.130  12.612
  617   HD13  LEU  81          3HD1      LEU  81  -4.025  -0.164  10.918
  618   HD21  LEU  81          3HD2      LEU  81  -4.036   3.402   9.902
  619   HD22  LEU  81          1HD2      LEU  81  -5.467   2.463  10.324
  620   HD23  LEU  81          2HD2      LEU  81  -4.205   1.746   9.321
  621    H    GLU  82           H        GLU  82  -5.287   5.897  12.519
  622    HA   GLU  82           HA       GLU  82  -4.608   6.832  15.226
  623    HB2  GLU  82           2HB      GLU  82  -5.876   8.844  14.791
  624    HB3  GLU  82           1HB      GLU  82  -4.699   8.600  13.513
  625    HG2  GLU  82           2HG      GLU  82  -7.625   7.907  13.279
  626    HG3  GLU  82           1HG      GLU  82  -6.922   9.435  12.762
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1  -5.532   5.540  25.158
    2    H2   MET   1           2H       MET   1  -6.348   4.073  25.372
    3    H3   MET   1           3H       MET   1  -6.491   4.912  23.914
    4    HA   MET   1           HA       MET   1  -4.136   4.592  23.467
    5    HB2  MET   1           2HB      MET   1  -4.250   2.934  25.997
    6    HB3  MET   1           1HB      MET   1  -2.901   2.940  24.869
    7    HG2  MET   1           2HG      MET   1  -2.531   5.310  25.320
    8    HG3  MET   1           1HG      MET   1  -3.886   5.307  26.448
    9    HE1  MET   1           3HE      MET   1  -0.754   5.619  28.798
   10    HE2  MET   1           1HE      MET   1  -2.308   6.323  28.346
   11    HE3  MET   1           2HE      MET   1  -0.967   6.337  27.200
   12    H    ALA   2           H        ALA   2  -4.921   3.628  21.616
   13    HA   ALA   2           HA       ALA   2  -5.990   0.897  21.806
   14    HB1  ALA   2           3HB      ALA   2  -6.676   1.178  19.482
   15    HB2  ALA   2           1HB      ALA   2  -5.871   2.747  19.420
   16    HB3  ALA   2           2HB      ALA   2  -7.265   2.510  20.476
   17    H    GLY   3           H        GLY   3  -4.030   2.300  19.178
   18    HA2  GLY   3           2HA      GLY   3  -1.559   1.586  19.296
   19    HA3  GLY   3           1HA      GLY   3  -2.226  -0.036  19.375
   20    HA   PRO   4           HA       PRO   4  -2.204   1.790  14.867
   21    HB2  PRO   4           2HB      PRO   4   0.411   1.887  14.115
   22    HB3  PRO   4           1HB      PRO   4  -0.446   3.274  14.798
   23    HG2  PRO   4           2HG      PRO   4   1.422   1.355  16.142
   24    HG3  PRO   4           1HG      PRO   4   1.319   3.117  16.305
   25    HD2  PRO   4           2HD      PRO   4   0.256   1.405  18.129
   26    HD3  PRO   4           1HD      PRO   4  -0.439   3.004  17.795
   27    H    GLU   5           H        GLU   5  -3.047  -0.224  14.326
   28    HA   GLU   5           HA       GLU   5  -1.675  -2.671  14.324
   29    HB2  GLU   5           2HB      GLU   5  -3.887  -1.768  12.460
   30    HB3  GLU   5           1HB      GLU   5  -3.403  -3.434  12.745
   31    HG2  GLU   5           2HG      GLU   5  -4.072  -3.208  15.104
   32    HG3  GLU   5           1HG      GLU   5  -4.611  -1.559  14.775
   33    H    GLY   6           H        GLY   6  -1.487   0.023  12.173
   34    HA2  GLY   6           2HA      GLY   6   0.775  -1.037  10.802
   35    HA3  GLY   6           1HA      GLY   6  -0.654  -1.063   9.777
   36    H    PHE   7           H        PHE   7   0.388   0.420   8.357
   37    HA   PHE   7           HA       PHE   7   0.419   3.202   9.353
   38    HB2  PHE   7           2HB      PHE   7   2.289   1.985   7.303
   39    HB3  PHE   7           1HB      PHE   7   2.283   3.669   7.816
   40    HD1  PHE   7           HD1      PHE   7   2.906   4.242  10.170
   41    HD2  PHE   7           HD2      PHE   7   3.403   0.322   8.576
   42    HE1  PHE   7           HE1      PHE   7   4.461   3.698  11.998
   43    HE2  PHE   7           HE2      PHE   7   4.956  -0.227  10.401
   44    HZ   PHE   7           HZ       PHE   7   5.488   1.460  12.116
   45    H    GLN   8           H        GLN   8  -0.077   4.848   7.791
   46    HA   GLN   8           HA       GLN   8  -2.025   3.949   5.796
   47    HB2  GLN   8           2HB      GLN   8  -1.459   6.634   7.052
   48    HB3  GLN   8           1HB      GLN   8  -2.551   6.447   5.687
   49    HG2  GLN   8           2HG      GLN   8  -3.983   4.991   6.995
   50    HG3  GLN   8           1HG      GLN   8  -2.871   5.090   8.359
   51   HE21  GLN   8          1HE2      GLN   8  -5.718   5.887   8.074
   52   HE22  GLN   8          2HE2      GLN   8  -5.764   7.542   8.570
   53    H    TYR   9           H        TYR   9  -1.500   3.818   3.716
   54    HA   TYR   9           HA       TYR   9   0.618   5.575   2.633
   55    HB2  TYR   9           2HB      TYR   9  -0.341   2.869   1.658
   56    HB3  TYR   9           1HB      TYR   9   0.820   3.880   0.803
   57    HD1  TYR   9           HD1      TYR   9   0.278   1.930   3.918
   58    HD2  TYR   9           HD2      TYR   9   3.118   3.890   1.417
   59    HE1  TYR   9           HE1      TYR   9   2.108   0.898   5.194
   60    HE2  TYR   9           HE2      TYR   9   4.952   2.860   2.689
   61    HH   TYR   9           HH       TYR   9   5.376   1.876   4.858
   62    H    ARG  10           H        ARG  10   0.010   7.083   1.175
   63    HA   ARG  10           HA       ARG  10  -2.793   7.094   0.293
   64    HB2  ARG  10           2HB      ARG  10  -2.082   9.077   1.462
   65    HB3  ARG  10           1HB      ARG  10  -0.690   9.259   0.409
   66    HG2  ARG  10           2HG      ARG  10  -2.198   9.714  -1.482
   67    HG3  ARG  10           1HG      ARG  10  -3.579   9.577  -0.392
   68    HD2  ARG  10           2HD      ARG  10  -2.819  11.476   0.893
   69    HD3  ARG  10           1HD      ARG  10  -1.325  11.560  -0.042
   70    HE   ARG  10           HE       ARG  10  -3.316  11.827  -1.893
   71   HH11  ARG  10          1HH1      ARG  10  -2.486  13.517   0.998
   72   HH12  ARG  10          2HH1      ARG  10  -3.062  15.032   0.393
   73   HH21  ARG  10          1HH2      ARG  10  -4.021  13.774  -2.644
   74   HH22  ARG  10          2HH2      ARG  10  -3.909  15.177  -1.636
   75    H    ALA  11           H        ALA  11  -3.285   6.469  -1.709
   76    HA   ALA  11           HA       ALA  11  -1.357   5.961  -3.734
   77    HB1  ALA  11           3HB      ALA  11  -3.434   4.695  -3.577
   78    HB2  ALA  11           1HB      ALA  11  -3.287   5.456  -5.162
   79    HB3  ALA  11           2HB      ALA  11  -4.363   6.147  -3.948
   80    H    LEU  12           H        LEU  12  -0.417   7.347  -5.075
   81    HA   LEU  12           HA       LEU  12  -1.070  10.124  -5.070
   82    HB2  LEU  12           2HB      LEU  12   0.839   8.656  -6.891
   83    HB3  LEU  12           1HB      LEU  12   0.829  10.378  -6.554
   84    HG   LEU  12           HG       LEU  12   1.509   8.178  -4.592
   85   HD11  LEU  12          1HD1      LEU  12   3.755   9.168  -4.637
   86   HD12  LEU  12          2HD1      LEU  12   3.232  10.291  -5.893
   87   HD13  LEU  12          3HD1      LEU  12   3.269   8.557  -6.217
   88   HD21  LEU  12          3HD2      LEU  12   2.078   9.986  -3.038
   89   HD22  LEU  12          1HD2      LEU  12   0.363  10.003  -3.455
   90   HD23  LEU  12          2HD2      LEU  12   1.462  11.173  -4.190
   91    H    TYR  13           H        TYR  13  -0.971   7.771  -7.762
   92    HA   TYR  13           HA       TYR  13  -2.958   9.421  -9.196
   93    HB2  TYR  13           2HB      TYR  13  -0.524   8.068 -10.409
   94    HB3  TYR  13           1HB      TYR  13  -1.755   8.954 -11.306
   95    HD1  TYR  13           HD1      TYR  13  -2.052  11.437 -10.805
   96    HD2  TYR  13           HD2      TYR  13   1.317   9.209  -9.461
   97    HE1  TYR  13           HE1      TYR  13  -0.818  13.531 -10.451
   98    HE2  TYR  13           HE2      TYR  13   2.562  11.298  -9.104
   99    HH   TYR  13           HH       TYR  13   1.056  14.359  -9.133
  100    HA   PRO  14           HA       PRO  14  -5.314   5.750  -9.820
  101    HB2  PRO  14           2HB      PRO  14  -6.203   6.007 -12.408
  102    HB3  PRO  14           1HB      PRO  14  -6.879   6.891 -11.034
  103    HG2  PRO  14           2HG      PRO  14  -4.878   7.796 -13.076
  104    HG3  PRO  14           1HG      PRO  14  -6.247   8.684 -12.380
  105    HD2  PRO  14           2HD      PRO  14  -3.702   9.088 -11.563
  106    HD3  PRO  14           1HD      PRO  14  -5.080   9.216 -10.450
  107    H    PHE  15           H        PHE  15  -4.422   3.804  -9.941
  108    HA   PHE  15           HA       PHE  15  -2.917   3.036 -12.363
  109    HB2  PHE  15           2HB      PHE  15  -1.382   3.198 -10.499
  110    HB3  PHE  15           1HB      PHE  15  -2.439   2.229  -9.480
  111    HD1  PHE  15           HD1      PHE  15  -0.301   2.099 -12.517
  112    HD2  PHE  15           HD2      PHE  15  -2.263  -0.118  -9.449
  113    HE1  PHE  15           HE1      PHE  15   0.871   0.060 -13.239
  114    HE2  PHE  15           HE2      PHE  15  -1.090  -2.156 -10.170
  115    HZ   PHE  15           HZ       PHE  15   0.478  -2.068 -12.066
  116    H    ARG  16           H        ARG  16  -4.162   1.700 -13.536
  117    HA   ARG  16           HA       ARG  16  -6.052  -0.089 -12.217
  118    HB2  ARG  16           2HB      ARG  16  -6.921  -0.562 -14.417
  119    HB3  ARG  16           1HB      ARG  16  -6.724   1.177 -14.251
  120    HG2  ARG  16           2HG      ARG  16  -4.654   1.072 -15.551
  121    HG3  ARG  16           1HG      ARG  16  -4.836  -0.673 -15.710
  122    HD2  ARG  16           2HD      ARG  16  -7.051  -0.227 -16.835
  123    HD3  ARG  16           1HD      ARG  16  -6.612   1.482 -16.852
  124    HE   ARG  16           HE       ARG  16  -4.742  -0.400 -18.056
  125   HH11  ARG  16          1HH1      ARG  16  -7.176   1.995 -18.517
  126   HH12  ARG  16          2HH1      ARG  16  -6.765   2.231 -20.184
  127   HH21  ARG  16          1HH2      ARG  16  -4.249  -0.110 -20.172
  128   HH22  ARG  16          2HH2      ARG  16  -5.120   1.053 -21.113
  129    H    ARG  17           H        ARG  17  -5.617  -2.155 -11.749
  130    HA   ARG  17           HA       ARG  17  -3.112  -3.358 -12.384
  131    HB2  ARG  17           2HB      ARG  17  -4.316  -3.881 -10.311
  132    HB3  ARG  17           1HB      ARG  17  -5.636  -4.577 -11.237
  133    HG2  ARG  17           2HG      ARG  17  -4.312  -6.358 -10.362
  134    HG3  ARG  17           1HG      ARG  17  -4.056  -6.293 -12.104
  135    HD2  ARG  17           2HD      ARG  17  -1.946  -5.098 -11.750
  136    HD3  ARG  17           1HD      ARG  17  -2.201  -5.159 -10.005
  137    HE   ARG  17           HE       ARG  17  -2.218  -7.707 -10.434
  138   HH11  ARG  17          1HH1      ARG  17  -0.279  -5.430 -12.141
  139   HH12  ARG  17          2HH1      ARG  17   0.997  -6.562 -12.421
  140   HH21  ARG  17          1HH2      ARG  17  -0.572  -9.154 -10.801
  141   HH22  ARG  17          2HH2      ARG  17   0.834  -8.640 -11.666
  142    H    GLU  18           H        GLU  18  -2.715  -5.245 -13.666
  143    HA   GLU  18           HA       GLU  18  -3.633  -5.372 -16.227
  144    HB2  GLU  18           2HB      GLU  18  -2.872  -7.829 -14.620
  145    HB3  GLU  18           1HB      GLU  18  -2.759  -7.633 -16.364
  146    HG2  GLU  18           2HG      GLU  18  -1.119  -6.214 -14.272
  147    HG3  GLU  18           1HG      GLU  18  -0.570  -7.460 -15.391
  148    H    ARG  19           H        ARG  19  -4.852  -7.356 -13.545
  149    HA   ARG  19           HA       ARG  19  -7.503  -7.422 -14.840
  150    HB2  ARG  19           2HB      ARG  19  -6.088  -9.681 -13.392
  151    HB3  ARG  19           1HB      ARG  19  -7.789  -9.711 -13.838
  152    HG2  ARG  19           2HG      ARG  19  -7.258  -9.686 -16.173
  153    HG3  ARG  19           1HG      ARG  19  -5.551  -9.391 -15.833
  154    HD2  ARG  19           2HD      ARG  19  -7.075 -11.869 -15.013
  155    HD3  ARG  19           1HD      ARG  19  -6.037 -11.747 -16.435
  156    HE   ARG  19           HE       ARG  19  -4.242 -11.153 -14.705
  157   HH11  ARG  19          1HH1      ARG  19  -6.836 -13.345 -14.121
  158   HH12  ARG  19          2HH1      ARG  19  -5.951 -14.249 -12.942
  159   HH21  ARG  19          1HH2      ARG  19  -3.118 -12.328 -13.205
  160   HH22  ARG  19          2HH2      ARG  19  -3.868 -13.678 -12.432
  161    HA   PRO  20           HA       PRO  20  -9.043  -5.663 -11.054
  162    HB2  PRO  20           2HB      PRO  20 -11.351  -7.527 -11.324
  163    HB3  PRO  20           1HB      PRO  20 -11.334  -5.764 -11.200
  164    HG2  PRO  20           2HG      PRO  20 -11.831  -6.952 -13.528
  165    HG3  PRO  20           1HG      PRO  20 -10.845  -5.481 -13.454
  166    HD2  PRO  20           2HD      PRO  20  -9.977  -8.331 -13.793
  167    HD3  PRO  20           1HD      PRO  20  -9.367  -6.862 -14.586
  168    H    GLU  21           H        GLU  21  -8.245  -8.925 -11.319
  169    HA   GLU  21           HA       GLU  21  -9.097 -10.151  -9.002
  170    HB2  GLU  21           2HB      GLU  21  -7.913 -11.285 -10.834
  171    HB3  GLU  21           1HB      GLU  21  -6.424 -10.465 -10.387
  172    HG2  GLU  21           2HG      GLU  21  -6.240 -11.683  -8.368
  173    HG3  GLU  21           1HG      GLU  21  -7.891 -12.289  -8.498
  174    H    ASP  22           H        ASP  22  -6.260  -8.024  -9.387
  175    HA   ASP  22           HA       ASP  22  -5.624  -8.273  -6.541
  176    HB2  ASP  22           2HB      ASP  22  -4.249  -6.622  -8.667
  177    HB3  ASP  22           1HB      ASP  22  -3.646  -6.946  -7.047
  178    H    LEU  23           H        LEU  23  -4.579  -5.666  -6.122
  179    HA   LEU  23           HA       LEU  23  -7.107  -4.233  -5.681
  180    HB2  LEU  23           2HB      LEU  23  -5.605  -4.856  -3.760
  181    HB3  LEU  23           1HB      LEU  23  -4.418  -3.738  -4.399
  182    HG   LEU  23           HG       LEU  23  -5.958  -1.864  -4.041
  183   HD11  LEU  23          1HD1      LEU  23  -8.057  -2.190  -2.811
  184   HD12  LEU  23          2HD1      LEU  23  -7.832  -3.938  -2.894
  185   HD13  LEU  23          3HD1      LEU  23  -8.081  -3.010  -4.373
  186   HD21  LEU  23          3HD2      LEU  23  -5.938  -1.865  -1.592
  187   HD22  LEU  23          1HD2      LEU  23  -4.423  -2.490  -2.243
  188   HD23  LEU  23          2HD2      LEU  23  -5.626  -3.603  -1.590
  189    H    GLU  24           H        GLU  24  -7.493  -2.216  -6.479
  190    HA   GLU  24           HA       GLU  24  -5.485  -1.132  -8.355
  191    HB2  GLU  24           2HB      GLU  24  -8.488  -0.755  -8.369
  192    HB3  GLU  24           1HB      GLU  24  -7.364  -0.154  -9.582
  193    HG2  GLU  24           2HG      GLU  24  -6.803  -2.419 -10.239
  194    HG3  GLU  24           1HG      GLU  24  -7.828  -3.069  -8.961
  195    H    LEU  25           H        LEU  25  -4.974   1.054  -8.363
  196    HA   LEU  25           HA       LEU  25  -5.564   2.401  -5.814
  197    HB2  LEU  25           2HB      LEU  25  -3.338   2.915  -7.794
  198    HB3  LEU  25           1HB      LEU  25  -3.518   3.683  -6.227
  199    HG   LEU  25           HG       LEU  25  -2.975   0.743  -6.705
  200   HD11  LEU  25          1HD1      LEU  25  -1.047   2.184  -7.168
  201   HD12  LEU  25          2HD1      LEU  25  -0.794   1.198  -5.730
  202   HD13  LEU  25          3HD1      LEU  25  -1.202   2.906  -5.566
  203   HD21  LEU  25          3HD2      LEU  25  -3.202   2.274  -4.109
  204   HD22  LEU  25          1HD2      LEU  25  -2.740   0.580  -4.278
  205   HD23  LEU  25          2HD2      LEU  25  -4.366   1.098  -4.720
  206    H    LEU  26           H        LEU  26  -6.692   4.252  -5.712
  207    HA   LEU  26           HA       LEU  26  -7.055   5.866  -8.163
  208    HB2  LEU  26           2HB      LEU  26  -8.899   5.308  -5.855
  209    HB3  LEU  26           1HB      LEU  26  -9.078   6.793  -6.765
  210    HG   LEU  26           HG       LEU  26 -10.649   5.117  -7.558
  211   HD11  LEU  26          1HD1      LEU  26 -10.126   5.154  -9.934
  212   HD12  LEU  26          2HD1      LEU  26  -8.451   5.579  -9.573
  213   HD13  LEU  26          3HD1      LEU  26  -9.751   6.707  -9.183
  214   HD21  LEU  26          3HD2      LEU  26  -9.954   3.040  -8.580
  215   HD22  LEU  26          1HD2      LEU  26  -9.353   3.114  -6.924
  216   HD23  LEU  26          2HD2      LEU  26  -8.257   3.420  -8.275
  217    HA   PRO  27           HA       PRO  27  -4.739   9.096  -6.326
  218    HB2  PRO  27           2HB      PRO  27  -5.934  11.343  -7.307
  219    HB3  PRO  27           1HB      PRO  27  -4.946  10.260  -8.294
  220    HG2  PRO  27           2HG      PRO  27  -7.934  10.387  -8.040
  221    HG3  PRO  27           1HG      PRO  27  -6.944  10.239  -9.506
  222    HD2  PRO  27           2HD      PRO  27  -8.152   8.106  -8.384
  223    HD3  PRO  27           1HD      PRO  27  -6.568   7.976  -9.175
  224    H    GLY  28           H        GLY  28  -4.965   9.144  -4.127
  225    HA2  GLY  28           2HA      GLY  28  -5.538  10.769  -2.376
  226    HA3  GLY  28           1HA      GLY  28  -7.157  10.824  -3.048
  227    H    ASP  29           H        ASP  29  -6.432   7.651  -3.233
  228    HA   ASP  29           HA       ASP  29  -8.015   6.915  -0.990
  229    HB2  ASP  29           2HB      ASP  29  -6.576   5.498  -3.154
  230    HB3  ASP  29           1HB      ASP  29  -6.802   4.575  -1.672
  231    H    VAL  30           H        VAL  30  -7.488   6.507   1.048
  232    HA   VAL  30           HA       VAL  30  -4.667   6.327   1.828
  233    HB   VAL  30           HB       VAL  30  -7.156   6.574   3.537
  234   HG11  VAL  30          1HG1      VAL  30  -5.403   5.407   4.750
  235   HG12  VAL  30          2HG1      VAL  30  -5.610   7.036   5.395
  236   HG13  VAL  30          3HG1      VAL  30  -4.244   6.673   4.336
  237   HG21  VAL  30          3HG2      VAL  30  -5.051   8.635   2.854
  238   HG22  VAL  30          1HG2      VAL  30  -6.427   8.872   3.932
  239   HG23  VAL  30          2HG2      VAL  30  -6.693   8.588   2.212
  240    H    LEU  31           H        LEU  31  -3.892   4.312   1.617
  241    HA   LEU  31           HA       LEU  31  -5.565   1.995   2.161
  242    HB2  LEU  31           2HB      LEU  31  -2.736   2.206   1.118
  243    HB3  LEU  31           1HB      LEU  31  -3.587   0.693   1.367
  244    HG   LEU  31           HG       LEU  31  -5.339   1.571  -0.274
  245   HD11  LEU  31          1HD1      LEU  31  -3.124   3.512  -0.938
  246   HD12  LEU  31          2HD1      LEU  31  -4.699   3.926  -0.253
  247   HD13  LEU  31          3HD1      LEU  31  -4.595   3.250  -1.878
  248   HD21  LEU  31          3HD2      LEU  31  -4.064   0.839  -2.201
  249   HD22  LEU  31          1HD2      LEU  31  -3.720  -0.185  -0.807
  250   HD23  LEU  31          2HD2      LEU  31  -2.555   1.043  -1.306
  251    H    VAL  32           H        VAL  32  -5.501   0.812   3.966
  252    HA   VAL  32           HA       VAL  32  -3.525   1.458   6.032
  253    HB   VAL  32           HB       VAL  32  -5.961  -0.340   6.216
  254   HG11  VAL  32          1HG1      VAL  32  -4.159   0.775   8.375
  255   HG12  VAL  32          2HG1      VAL  32  -4.300  -0.916   7.895
  256   HG13  VAL  32          3HG1      VAL  32  -5.664  -0.099   8.660
  257   HG21  VAL  32          3HG2      VAL  32  -6.596   1.972   5.740
  258   HG22  VAL  32          1HG2      VAL  32  -5.606   2.536   7.089
  259   HG23  VAL  32          2HG2      VAL  32  -7.027   1.535   7.393
  260    H    VAL  33           H        VAL  33  -1.640   0.381   5.765
  261    HA   VAL  33           HA       VAL  33  -1.709  -2.507   5.160
  262    HB   VAL  33           HB       VAL  33   0.640  -0.590   5.052
  263   HG11  VAL  33          1HG1      VAL  33   0.432  -3.482   4.189
  264   HG12  VAL  33          2HG1      VAL  33   1.347  -2.871   5.567
  265   HG13  VAL  33          3HG1      VAL  33   1.822  -2.430   3.927
  266   HG21  VAL  33          3HG2      VAL  33  -1.006  -0.118   3.303
  267   HG22  VAL  33          1HG2      VAL  33  -0.980  -1.810   2.803
  268   HG23  VAL  33          2HG2      VAL  33   0.461  -0.810   2.611
  269    H    SER  34           H        SER  34  -1.463  -3.876   6.843
  270    HA   SER  34           HA       SER  34  -0.910  -2.901   9.461
  271    HB2  SER  34           2HB      SER  34  -1.166  -5.191  10.216
  272    HB3  SER  34           1HB      SER  34  -2.407  -4.841   9.015
  273    HG   SER  34           HG       SER  34  -1.570  -6.789   8.453
  274    H    ARG  35           H        ARG  35   0.887  -3.077  10.752
  275    HA   ARG  35           HA       ARG  35   3.440  -3.170   9.578
  276    HB2  ARG  35           2HB      ARG  35   2.997  -2.000  11.683
  277    HB3  ARG  35           1HB      ARG  35   2.650  -3.527  12.484
  278    HG2  ARG  35           2HG      ARG  35   4.949  -4.225  12.264
  279    HG3  ARG  35           1HG      ARG  35   5.324  -2.803  11.288
  280    HD2  ARG  35           2HD      ARG  35   6.061  -2.623  13.668
  281    HD3  ARG  35           1HD      ARG  35   4.968  -1.341  13.155
  282    HE   ARG  35           HE       ARG  35   3.345  -2.165  14.581
  283   HH11  ARG  35          1HH1      ARG  35   6.079  -4.266  14.544
  284   HH12  ARG  35          2HH1      ARG  35   5.538  -5.174  15.912
  285   HH21  ARG  35          1HH2      ARG  35   2.665  -3.345  16.342
  286   HH22  ARG  35          2HH2      ARG  35   3.614  -4.676  16.899
  287    H    ALA  36           H        ALA  36   1.433  -5.676  10.952
  288    HA   ALA  36           HA       ALA  36   3.318  -7.758  11.141
  289    HB1  ALA  36           3HB      ALA  36   0.376  -7.953  10.470
  290    HB2  ALA  36           1HB      ALA  36   1.055  -7.885  12.096
  291    HB3  ALA  36           2HB      ALA  36   1.399  -9.265  11.054
  292    H    ALA  37           H        ALA  37   1.239  -6.730   8.419
  293    HA   ALA  37           HA       ALA  37   2.051  -8.654   6.547
  294    HB1  ALA  37           3HB      ALA  37   1.216  -5.795   6.023
  295    HB2  ALA  37           1HB      ALA  37   0.127  -7.171   6.199
  296    HB3  ALA  37           2HB      ALA  37   1.244  -7.101   4.838
  297    H    LEU  38           H        LEU  38   3.390  -5.418   7.230
  298    HA   LEU  38           HA       LEU  38   5.438  -5.342   5.353
  299    HB2  LEU  38           2HB      LEU  38   5.450  -4.275   8.181
  300    HB3  LEU  38           1HB      LEU  38   6.611  -3.830   6.944
  301    HG   LEU  38           HG       LEU  38   3.637  -3.269   6.856
  302   HD11  LEU  38          1HD1      LEU  38   4.810  -1.898   8.498
  303   HD12  LEU  38          2HD1      LEU  38   4.301  -0.929   7.117
  304   HD13  LEU  38          3HD1      LEU  38   5.988  -1.420   7.275
  305   HD21  LEU  38          3HD2      LEU  38   5.839  -2.521   4.924
  306   HD22  LEU  38          1HD2      LEU  38   4.180  -1.925   4.860
  307   HD23  LEU  38          2HD2      LEU  38   4.510  -3.638   4.617
  308    H    GLN  39           H        GLN  39   5.488  -6.787   8.609
  309    HA   GLN  39           HA       GLN  39   8.156  -7.657   8.625
  310    HB2  GLN  39           2HB      GLN  39   5.700  -8.792   9.980
  311    HB3  GLN  39           1HB      GLN  39   7.333  -9.372  10.294
  312    HG2  GLN  39           2HG      GLN  39   6.433  -6.519  10.703
  313    HG3  GLN  39           1HG      GLN  39   6.493  -7.744  11.972
  314   HE21  GLN  39          1HE2      GLN  39   8.406  -5.730   9.845
  315   HE22  GLN  39          2HE2      GLN  39   9.903  -5.956  10.672
  316    H    ALA  40           H        ALA  40   5.228  -9.307   7.436
  317    HA   ALA  40           HA       ALA  40   6.464 -11.709   6.622
  318    HB1  ALA  40           3HB      ALA  40   4.048 -11.490   6.788
  319    HB2  ALA  40           1HB      ALA  40   4.503 -12.006   5.164
  320    HB3  ALA  40           2HB      ALA  40   4.040 -10.328   5.460
  321    H    LEU  41           H        LEU  41   6.009  -8.629   4.938
  322    HA   LEU  41           HA       LEU  41   7.082  -9.388   2.425
  323    HB2  LEU  41           2HB      LEU  41   7.069  -6.654   3.720
  324    HB3  LEU  41           1HB      LEU  41   7.310  -6.981   2.014
  325    HG   LEU  41           HG       LEU  41   4.762  -7.525   3.552
  326   HD11  LEU  41          1HD1      LEU  41   3.836  -5.649   2.291
  327   HD12  LEU  41          2HD1      LEU  41   5.415  -5.349   1.560
  328   HD13  LEU  41          3HD1      LEU  41   5.189  -5.137   3.297
  329   HD21  LEU  41          3HD2      LEU  41   5.072  -9.089   1.708
  330   HD22  LEU  41          1HD2      LEU  41   5.367  -7.749   0.599
  331   HD23  LEU  41          2HD2      LEU  41   3.779  -7.948   1.347
  332    H    GLY  42           H        GLY  42   8.577  -8.571   5.443
  333    HA2  GLY  42           2HA      GLY  42  10.861  -8.941   5.953
  334    HA3  GLY  42           1HA      GLY  42  11.246  -8.849   4.242
  335    H    VAL  43           H        VAL  43   9.191  -6.431   5.631
  336    HA   VAL  43           HA       VAL  43  11.143  -4.362   5.072
  337    HB   VAL  43           HB       VAL  43   8.338  -4.083   6.184
  338   HG11  VAL  43          1HG1      VAL  43   9.751  -2.137   6.633
  339   HG12  VAL  43          2HG1      VAL  43   8.504  -1.754   5.445
  340   HG13  VAL  43          3HG1      VAL  43  10.166  -2.031   4.921
  341   HG21  VAL  43          3HG2      VAL  43   9.317  -3.896   3.329
  342   HG22  VAL  43          1HG2      VAL  43   7.688  -3.502   3.878
  343   HG23  VAL  43          2HG2      VAL  43   8.284  -5.158   4.001
  344    H    ALA  44           H        ALA  44  12.690  -4.080   6.550
  345    HA   ALA  44           HA       ALA  44  12.406  -4.628   9.325
  346    HB1  ALA  44           3HB      ALA  44  14.563  -3.075   7.890
  347    HB2  ALA  44           1HB      ALA  44  14.549  -4.817   8.167
  348    HB3  ALA  44           2HB      ALA  44  14.660  -3.708   9.534
  349    H    GLU  45           H        GLU  45  12.431  -3.190  11.089
  350    HA   GLU  45           HA       GLU  45  10.730  -0.951  10.885
  351    HB2  GLU  45           2HB      GLU  45  12.632  -1.627  13.145
  352    HB3  GLU  45           1HB      GLU  45  11.216  -0.588  13.244
  353    HG2  GLU  45           2HG      GLU  45   9.769  -2.497  12.767
  354    HG3  GLU  45           1HG      GLU  45  11.183  -3.543  12.644
  355    H    GLY  46           H        GLY  46  11.197   1.003  10.075
  356    HA2  GLY  46           2HA      GLY  46  12.624   3.016  10.245
  357    HA3  GLY  46           1HA      GLY  46  14.011   1.942  10.160
  358    H    GLY  47           H        GLY  47  12.149   0.442   8.080
  359    HA2  GLY  47           2HA      GLY  47  12.860   2.173   5.774
  360    HA3  GLY  47           1HA      GLY  47  12.817   0.420   5.719
  361    H    GLU  48           H        GLU  48  10.249   1.529   7.536
  362    HA   GLU  48           HA       GLU  48   8.319   0.577   5.686
  363    HB2  GLU  48           2HB      GLU  48   6.656   1.185   7.338
  364    HB3  GLU  48           1HB      GLU  48   8.032   0.446   8.142
  365    HG2  GLU  48           2HG      GLU  48   7.532   3.420   7.984
  366    HG3  GLU  48           1HG      GLU  48   7.083   2.397   9.346
  367    H    ARG  49           H        ARG  49   9.648   3.737   6.224
  368    HA   ARG  49           HA       ARG  49   7.439   5.169   5.059
  369    HB2  ARG  49           2HB      ARG  49  10.265   6.128   5.540
  370    HB3  ARG  49           1HB      ARG  49   8.872   7.138   5.174
  371    HG2  ARG  49           2HG      ARG  49   7.835   6.206   7.312
  372    HG3  ARG  49           1HG      ARG  49   9.446   5.587   7.685
  373    HD2  ARG  49           2HD      ARG  49   8.606   8.460   7.309
  374    HD3  ARG  49           1HD      ARG  49   9.221   7.695   8.775
  375    HE   ARG  49           HE       ARG  49  11.380   7.523   7.665
  376   HH11  ARG  49          1HH1      ARG  49   9.080   9.727   6.323
  377   HH12  ARG  49          2HH1      ARG  49  10.290  10.617   5.461
  378   HH21  ARG  49          1HH2      ARG  49  12.906   8.693   6.576
  379   HH22  ARG  49          2HH2      ARG  49  12.424  10.054   5.619
  380    H    CYS  50           H        CYS  50   9.689   3.187   3.648
  381    HA   CYS  50           HA       CYS  50   9.551   4.694   1.101
  382    HB2  CYS  50           2HB      CYS  50  11.864   4.489   1.869
  383    HB3  CYS  50           1HB      CYS  50  11.692   2.740   1.980
  384    HG   CYS  50           HG       CYS  50  13.219   3.681  -0.305
  385    HA   PRO  51           HA       PRO  51   7.042   0.884   0.339
  386    HB2  PRO  51           2HB      PRO  51   5.382   2.096  -1.469
  387    HB3  PRO  51           1HB      PRO  51   5.096   2.113   0.275
  388    HG2  PRO  51           2HG      PRO  51   6.334   4.223  -1.462
  389    HG3  PRO  51           1HG      PRO  51   5.140   4.402  -0.161
  390    HD2  PRO  51           2HD      PRO  51   7.762   4.924   0.221
  391    HD3  PRO  51           1HD      PRO  51   6.746   4.234   1.506
  392    H    GLN  52           H        GLN  52   8.728   3.155  -1.692
  393    HA   GLN  52           HA       GLN  52   8.753   1.770  -4.138
  394    HB2  GLN  52           2HB      GLN  52  10.845   3.578  -2.900
  395    HB3  GLN  52           1HB      GLN  52  10.868   3.039  -4.574
  396    HG2  GLN  52           2HG      GLN  52   8.816   4.217  -5.035
  397    HG3  GLN  52           1HG      GLN  52   8.646   4.656  -3.335
  398   HE21  GLN  52          1HE2      GLN  52   8.639   6.859  -3.836
  399   HE22  GLN  52          2HE2      GLN  52  10.073   7.699  -4.302
  400    H    SER  53           H        SER  53  11.041   1.661  -1.405
  401    HA   SER  53           HA       SER  53  12.779  -0.278  -2.507
  402    HB2  SER  53           2HB      SER  53  13.359   1.194  -0.573
  403    HB3  SER  53           1HB      SER  53  12.262   0.254   0.436
  404    HG   SER  53           HG       SER  53  14.801  -0.331  -0.445
  405    H    VAL  54           H        VAL  54   9.759  -0.535  -0.796
  406    HA   VAL  54           HA       VAL  54   9.844  -3.315  -0.190
  407    HB   VAL  54           HB       VAL  54   7.477  -1.457  -0.564
  408   HG11  VAL  54          1HG1      VAL  54   7.538  -4.200   0.708
  409   HG12  VAL  54          2HG1      VAL  54   6.796  -3.796  -0.839
  410   HG13  VAL  54          3HG1      VAL  54   6.150  -3.112   0.651
  411   HG21  VAL  54          3HG2      VAL  54   8.894  -2.381   1.943
  412   HG22  VAL  54          1HG2      VAL  54   7.446  -1.376   1.894
  413   HG23  VAL  54          2HG2      VAL  54   8.965  -0.766   1.243
  414    H    GLY  55           H        GLY  55   8.715  -1.469  -2.994
  415    HA2  GLY  55           2HA      GLY  55   8.433  -2.196  -5.182
  416    HA3  GLY  55           1HA      GLY  55   8.812  -3.830  -4.663
  417    H    TRP  56           H        TRP  56   7.083  -5.052  -3.575
  418    HA   TRP  56           HA       TRP  56   4.375  -4.174  -4.387
  419    HB2  TRP  56           2HB      TRP  56   5.449  -7.011  -4.328
  420    HB3  TRP  56           1HB      TRP  56   3.799  -6.555  -4.729
  421    HD1  TRP  56           HD1      TRP  56   4.367  -4.197  -6.774
  422    HE1  TRP  56           HE1      TRP  56   5.372  -4.726  -9.084
  423    HE3  TRP  56           HE3      TRP  56   6.464  -8.746  -5.724
  424    HZ2  TRP  56           HZ2      TRP  56   6.846  -6.801 -10.301
  425    HZ3  TRP  56           HZ3      TRP  56   7.647  -9.941  -7.521
  426    HH2  TRP  56           HH2      TRP  56   7.832  -8.985  -9.765
  427    H    MET  57           H        MET  57   2.970  -3.947  -2.746
  428    HA   MET  57           HA       MET  57   3.302  -5.585  -0.324
  429    HB2  MET  57           2HB      MET  57   2.730  -3.534   1.055
  430    HB3  MET  57           1HB      MET  57   4.337  -3.555   0.345
  431    HG2  MET  57           2HG      MET  57   3.782  -1.941  -1.251
  432    HG3  MET  57           1HG      MET  57   2.056  -2.167  -1.006
  433    HE1  MET  57           3HE      MET  57   5.384  -0.865   0.676
  434    HE2  MET  57           1HE      MET  57   4.687  -1.923   1.905
  435    HE3  MET  57           2HE      MET  57   4.752  -0.181   2.176
  436    HA   PRO  58           HA       PRO  58  -1.177  -5.722  -0.643
  437    HB2  PRO  58           2HB      PRO  58  -1.733  -7.140   1.551
  438    HB3  PRO  58           1HB      PRO  58  -0.843  -7.863   0.206
  439    HG2  PRO  58           2HG      PRO  58   0.178  -6.841   2.824
  440    HG3  PRO  58           1HG      PRO  58   0.689  -8.267   1.903
  441    HD2  PRO  58           2HD      PRO  58   1.977  -5.780   1.911
  442    HD3  PRO  58           1HD      PRO  58   2.208  -7.059   0.702
  443    H    GLY  59           H        GLY  59  -2.905  -4.472   0.030
  444    HA2  GLY  59           2HA      GLY  59  -2.768  -3.126   2.638
  445    HA3  GLY  59           1HA      GLY  59  -2.790  -2.107   1.209
  446    H    LEU  60           H        LEU  60  -4.702  -1.358   2.560
  447    HA   LEU  60           HA       LEU  60  -7.137  -2.713   1.594
  448    HB2  LEU  60           2HB      LEU  60  -6.880  -3.268   3.942
  449    HB3  LEU  60           1HB      LEU  60  -6.639  -1.582   4.353
  450    HG   LEU  60           HG       LEU  60  -8.986  -1.108   3.655
  451   HD11  LEU  60          1HD1      LEU  60 -10.542  -2.969   3.342
  452   HD12  LEU  60          2HD1      LEU  60  -9.198  -4.113   3.413
  453   HD13  LEU  60          3HD1      LEU  60  -9.300  -2.948   2.090
  454   HD21  LEU  60          3HD2      LEU  60  -8.471  -1.466   5.997
  455   HD22  LEU  60          1HD2      LEU  60  -8.641  -3.210   5.798
  456   HD23  LEU  60          2HD2      LEU  60 -10.046  -2.160   5.611
  457    H    ASN  61           H        ASN  61  -7.916  -1.310   0.096
  458    HA   ASN  61           HA       ASN  61  -7.710   1.558   0.397
  459    HB2  ASN  61           2HB      ASN  61  -8.957  -0.258  -1.658
  460    HB3  ASN  61           1HB      ASN  61  -9.310   1.463  -1.666
  461   HD21  ASN  61          1HD2      ASN  61  -7.724   2.906  -2.230
  462   HD22  ASN  61          2HD2      ASN  61  -6.239   2.413  -2.961
  463    H    GLU  62           H        GLU  62  -9.159   2.908   1.316
  464    HA   GLU  62           HA       GLU  62 -11.378   1.877   2.739
  465    HB2  GLU  62           2HB      GLU  62 -10.586   4.728   2.125
  466    HB3  GLU  62           1HB      GLU  62 -11.931   4.295   3.174
  467    HG2  GLU  62           2HG      GLU  62 -10.220   2.941   4.514
  468    HG3  GLU  62           1HG      GLU  62  -8.995   3.819   3.605
  469    H    ARG  63           H        ARG  63 -11.119   3.148  -0.512
  470    HA   ARG  63           HA       ARG  63 -13.947   3.471  -0.907
  471    HB2  ARG  63           2HB      ARG  63 -11.630   3.216  -2.824
  472    HB3  ARG  63           1HB      ARG  63 -13.291   3.319  -3.386
  473    HG2  ARG  63           2HG      ARG  63 -13.478   5.498  -2.153
  474    HG3  ARG  63           1HG      ARG  63 -11.739   5.398  -1.857
  475    HD2  ARG  63           2HD      ARG  63 -11.289   5.400  -4.234
  476    HD3  ARG  63           1HD      ARG  63 -13.011   5.327  -4.600
  477    HE   ARG  63           HE       ARG  63 -12.192   7.627  -3.058
  478   HH11  ARG  63          1HH1      ARG  63 -12.708   6.335  -6.216
  479   HH12  ARG  63          2HH1      ARG  63 -12.896   7.893  -6.941
  480   HH21  ARG  63          1HH2      ARG  63 -12.437   9.626  -4.011
  481   HH22  ARG  63          2HH2      ARG  63 -12.725   9.731  -5.711
  482    H    THR  64           H        THR  64 -11.645   0.917  -1.879
  483    HA   THR  64           HA       THR  64 -13.606  -0.703  -3.153
  484    HB   THR  64           HB       THR  64 -11.908  -2.434  -3.284
  485    HG1  THR  64           HG1      THR  64  -9.904  -2.139  -2.165
  486   HG21  THR  64          3HG2      THR  64 -10.664   0.303  -3.648
  487   HG22  THR  64          1HG2      THR  64 -11.669  -0.540  -4.829
  488   HG23  THR  64          2HG2      THR  64 -10.097  -1.197  -4.382
  489    H    ARG  65           H        ARG  65 -12.551  -0.450   0.153
  490    HA   ARG  65           HA       ARG  65 -13.133  -1.505   2.087
  491    HB2  ARG  65           2HB      ARG  65 -15.383  -2.700   0.441
  492    HB3  ARG  65           1HB      ARG  65 -15.286  -2.710   2.197
  493    HG2  ARG  65           2HG      ARG  65 -15.471  -0.223   0.492
  494    HG3  ARG  65           1HG      ARG  65 -16.827  -0.996   1.311
  495    HD2  ARG  65           2HD      ARG  65 -14.377   0.132   2.667
  496    HD3  ARG  65           1HD      ARG  65 -15.942   0.935   2.558
  497    HE   ARG  65           HE       ARG  65 -15.983  -1.687   3.788
  498   HH11  ARG  65          1HH1      ARG  65 -15.749   1.716   4.288
  499   HH12  ARG  65          2HH1      ARG  65 -16.192   1.608   5.956
  500   HH21  ARG  65          1HH2      ARG  65 -16.571  -1.805   5.915
  501   HH22  ARG  65          2HH2      ARG  65 -16.690  -0.357   6.856
  502    H    GLN  66           H        GLN  66 -11.609  -2.889  -0.265
  503    HA   GLN  66           HA       GLN  66 -11.618  -5.611   0.885
  504    HB2  GLN  66           2HB      GLN  66 -11.446  -4.854  -2.042
  505    HB3  GLN  66           1HB      GLN  66 -11.156  -6.474  -1.421
  506    HG2  GLN  66           2HG      GLN  66 -13.745  -4.953  -1.158
  507    HG3  GLN  66           1HG      GLN  66 -13.407  -6.186  -2.373
  508   HE21  GLN  66          1HE2      GLN  66 -15.436  -6.104  -0.258
  509   HE22  GLN  66          2HE2      GLN  66 -15.194  -7.537   0.676
  510    H    ARG  67           H        ARG  67  -9.643  -6.825   0.532
  511    HA   ARG  67           HA       ARG  67  -7.247  -5.168   0.745
  512    HB2  ARG  67           2HB      ARG  67  -7.720  -8.133   1.162
  513    HB3  ARG  67           1HB      ARG  67  -6.160  -7.351   1.367
  514    HG2  ARG  67           2HG      ARG  67  -7.009  -6.035   3.208
  515    HG3  ARG  67           1HG      ARG  67  -8.637  -6.666   2.950
  516    HD2  ARG  67           2HD      ARG  67  -7.423  -7.758   4.834
  517    HD3  ARG  67           1HD      ARG  67  -7.945  -8.882   3.579
  518    HE   ARG  67           HE       ARG  67  -5.335  -8.109   2.983
  519   HH11  ARG  67          1HH1      ARG  67  -6.981  -9.872   5.459
  520   HH12  ARG  67          2HH1      ARG  67  -5.613 -10.876   5.792
  521   HH21  ARG  67          1HH2      ARG  67  -3.617  -9.422   3.409
  522   HH22  ARG  67          2HH2      ARG  67  -3.740 -10.646   4.626
  523    H    GLY  68           H        GLY  68  -5.210  -6.288  -0.273
  524    HA2  GLY  68           2HA      GLY  68  -5.135  -7.975  -2.399
  525    HA3  GLY  68           1HA      GLY  68  -5.654  -6.464  -3.130
  526    H    ASP  69           H        ASP  69  -3.351  -7.572  -4.000
  527    HA   ASP  69           HA       ASP  69  -1.121  -6.268  -2.610
  528    HB2  ASP  69           2HB      ASP  69  -1.052  -8.145  -4.986
  529    HB3  ASP  69           1HB      ASP  69   0.317  -7.646  -3.993
  530    H    PHE  70           H        PHE  70  -0.215  -4.419  -3.331
  531    HA   PHE  70           HA       PHE  70  -0.666  -3.598  -6.125
  532    HB2  PHE  70           2HB      PHE  70  -1.174  -1.321  -5.427
  533    HB3  PHE  70           1HB      PHE  70  -2.297  -2.435  -4.657
  534    HD1  PHE  70           HD1      PHE  70  -2.059  -2.962  -2.242
  535    HD2  PHE  70           HD2      PHE  70   0.326   0.020  -4.137
  536    HE1  PHE  70           HE1      PHE  70  -1.478  -2.025  -0.044
  537    HE2  PHE  70           HE2      PHE  70   0.910   0.953  -1.938
  538    HZ   PHE  70           HZ       PHE  70   0.008  -0.069   0.112
  539    HA   PRO  71           HA       PRO  71   3.663  -2.414  -6.011
  540    HB2  PRO  71           2HB      PRO  71   3.750  -0.489  -7.916
  541    HB3  PRO  71           1HB      PRO  71   3.510  -2.198  -8.311
  542    HG2  PRO  71           2HG      PRO  71   1.477  -0.004  -8.080
  543    HG3  PRO  71           1HG      PRO  71   1.622  -1.269  -9.316
  544    HD2  PRO  71           2HD      PRO  71  -0.129  -1.427  -7.232
  545    HD3  PRO  71           1HD      PRO  71   0.597  -2.857  -7.992
  546    H    GLY  72           H        GLY  72   4.594  -1.293  -4.408
  547    HA2  GLY  72           2HA      GLY  72   3.341   0.920  -3.125
  548    HA3  GLY  72           1HA      GLY  72   4.940   0.290  -2.776
  549    H    THR  73           H        THR  73   4.908   0.990  -6.012
  550    HA   THR  73           HA       THR  73   6.582   3.294  -5.687
  551    HB   THR  73           HB       THR  73   6.664   3.318  -8.174
  552    HG1  THR  73           HG1      THR  73   5.550   1.589  -9.264
  553   HG21  THR  73          3HG2      THR  73   7.785   1.163  -8.446
  554   HG22  THR  73          1HG2      THR  73   7.030   0.564  -6.969
  555   HG23  THR  73          2HG2      THR  73   8.204   1.878  -6.890
  556    H    TYR  74           H        TYR  74   3.198   2.889  -6.060
  557    HA   TYR  74           HA       TYR  74   2.884   5.652  -7.055
  558    HB2  TYR  74           2HB      TYR  74   0.991   3.295  -7.124
  559    HB3  TYR  74           1HB      TYR  74   0.515   4.931  -7.568
  560    HD1  TYR  74           HD2      TYR  74   1.575   6.027  -9.548
  561    HD2  TYR  74           HD1      TYR  74   2.219   1.916  -8.638
  562    HE1  TYR  74           HE2      TYR  74   2.382   5.651 -11.840
  563    HE2  TYR  74           HE1      TYR  74   3.032   1.533 -10.927
  564    HH   TYR  74           HH       TYR  74   2.818   2.547 -13.154
  565    H    VAL  75           H        VAL  75   3.248   4.601  -4.139
  566    HA   VAL  75           HA       VAL  75   1.022   6.206  -3.051
  567    HB   VAL  75           HB       VAL  75   0.884   4.733  -1.078
  568   HG11  VAL  75          1HG1      VAL  75  -0.324   2.885  -2.132
  569   HG12  VAL  75          2HG1      VAL  75   0.414   3.281  -3.683
  570   HG13  VAL  75          3HG1      VAL  75  -0.693   4.420  -2.918
  571   HG21  VAL  75          3HG2      VAL  75   3.122   3.772  -1.121
  572   HG22  VAL  75          1HG2      VAL  75   2.748   2.921  -2.620
  573   HG23  VAL  75          2HG2      VAL  75   1.908   2.493  -1.131
  574    H    GLU  76           H        GLU  76   1.461   7.446  -1.223
  575    HA   GLU  76           HA       GLU  76   4.308   7.697  -0.469
  576    HB2  GLU  76           2HB      GLU  76   3.766   9.972   0.275
  577    HB3  GLU  76           1HB      GLU  76   3.321   9.744  -1.411
  578    HG2  GLU  76           2HG      GLU  76   0.996   9.531  -0.831
  579    HG3  GLU  76           1HG      GLU  76   1.378   9.552   0.889
  580    H    PHE  77           H        PHE  77   4.868   7.907   1.761
  581    HA   PHE  77           HA       PHE  77   3.128   6.436   3.551
  582    HB2  PHE  77           2HB      PHE  77   5.502   5.966   3.622
  583    HB3  PHE  77           1HB      PHE  77   5.872   7.654   3.952
  584    HD1  PHE  77           HD2      PHE  77   4.222   4.637   5.373
  585    HD2  PHE  77           HD1      PHE  77   5.921   8.466   6.164
  586    HE1  PHE  77           HE2      PHE  77   4.129   4.187   7.784
  587    HE2  PHE  77           HE1      PHE  77   5.819   8.013   8.577
  588    HZ   PHE  77           HZ       PHE  77   4.923   5.871   9.388
  589    H    LEU  78           H        LEU  78   1.541   7.409   4.623
  590    HA   LEU  78           HA       LEU  78   1.562  10.250   5.185
  591    HB2  LEU  78           2HB      LEU  78  -0.441   8.112   5.932
  592    HB3  LEU  78           1HB      LEU  78  -0.676   9.837   6.151
  593    HG   LEU  78           HG       LEU  78  -0.360   8.435   3.490
  594   HD11  LEU  78          1HD1      LEU  78  -2.796   9.615   4.827
  595   HD12  LEU  78          2HD1      LEU  78  -2.488   7.905   4.519
  596   HD13  LEU  78          3HD1      LEU  78  -2.729   9.014   3.170
  597   HD21  LEU  78          3HD2      LEU  78  -0.964  11.329   4.117
  598   HD22  LEU  78          1HD2      LEU  78  -0.978  10.597   2.512
  599   HD23  LEU  78          2HD2      LEU  78   0.530  10.708   3.417
  600    H    GLY  79           H        GLY  79   1.151   7.351   7.254
  601    HA2  GLY  79           2HA      GLY  79   3.026   7.776   9.166
  602    HA3  GLY  79           1HA      GLY  79   1.744   8.876   9.644
  603    HA   PRO  80           HA       PRO  80   0.764   4.651  11.398
  604    HB2  PRO  80           2HB      PRO  80   1.208   5.101  14.002
  605    HB3  PRO  80           1HB      PRO  80   2.537   4.721  12.899
  606    HG2  PRO  80           2HG      PRO  80   1.665   7.386  13.960
  607    HG3  PRO  80           1HG      PRO  80   3.306   6.737  13.783
  608    HD2  PRO  80           2HD      PRO  80   2.123   8.465  11.987
  609    HD3  PRO  80           1HD      PRO  80   3.430   7.337  11.572
  610    H    LEU  81           H        LEU  81  -1.115   4.071  12.611
  611    HA   LEU  81           HA       LEU  81  -3.118   6.199  12.807
  612    HB2  LEU  81           2HB      LEU  81  -3.425   3.190  12.975
  613    HB3  LEU  81           1HB      LEU  81  -4.745   4.343  13.029
  614    HG   LEU  81           HG       LEU  81  -4.032   5.092  10.703
  615   HD11  LEU  81          1HD1      LEU  81  -1.775   4.157  10.713
  616   HD12  LEU  81          2HD1      LEU  81  -2.725   3.529   9.368
  617   HD13  LEU  81          3HD1      LEU  81  -2.445   2.526  10.788
  618   HD21  LEU  81          3HD2      LEU  81  -5.178   3.242   9.593
  619   HD22  LEU  81          1HD2      LEU  81  -5.997   3.699  11.088
  620   HD23  LEU  81          2HD2      LEU  81  -4.994   2.250  11.039
  621    H    GLU  82           H        GLU  82  -4.610   6.240  14.678
  622    HA   GLU  82           HA       GLU  82  -3.153   5.836  17.172
  623    HB2  GLU  82           2HB      GLU  82  -5.150   7.025  18.209
  624    HB3  GLU  82           1HB      GLU  82  -4.148   7.961  17.114
  625    HG2  GLU  82           2HG      GLU  82  -6.646   6.621  16.134
  626    HG3  GLU  82           1HG      GLU  82  -6.719   8.167  16.976
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1 -11.345   2.435  21.495
    2    H2   MET   1           2H       MET   1 -11.366   1.701  23.017
    3    H3   MET   1           3H       MET   1 -11.281   0.749  21.621
    4    HA   MET   1           HA       MET   1  -9.202   2.634  22.574
    5    HB2  MET   1           2HB      MET   1  -9.280  -0.393  22.529
    6    HB3  MET   1           1HB      MET   1  -7.843   0.555  22.884
    7    HG2  MET   1           2HG      MET   1  -8.993   1.531  24.829
    8    HG3  MET   1           1HG      MET   1 -10.394   0.517  24.481
    9    HE1  MET   1           3HE      MET   1  -6.263  -1.183  25.661
   10    HE2  MET   1           1HE      MET   1  -6.595   0.542  25.513
   11    HE3  MET   1           2HE      MET   1  -6.601  -0.481  24.077
   12    H    ALA   2           H        ALA   2  -7.410   2.898  21.265
   13    HA   ALA   2           HA       ALA   2  -7.630   1.824  18.518
   14    HB1  ALA   2           3HB      ALA   2  -6.567   4.516  19.388
   15    HB2  ALA   2           1HB      ALA   2  -8.130   4.218  18.628
   16    HB3  ALA   2           2HB      ALA   2  -6.641   3.918  17.729
   17    H    GLY   3           H        GLY   3  -5.112   2.856  17.646
   18    HA2  GLY   3           2HA      GLY   3  -2.786   2.512  18.769
   19    HA3  GLY   3           1HA      GLY   3  -3.364   0.860  18.936
   20    HA   PRO   4           HA       PRO   4  -1.427   1.851  14.649
   21    HB2  PRO   4           2HB      PRO   4   1.021   0.495  15.557
   22    HB3  PRO   4           1HB      PRO   4   0.837   2.061  14.765
   23    HG2  PRO   4           2HG      PRO   4   1.537   1.843  17.361
   24    HG3  PRO   4           1HG      PRO   4   0.546   3.186  16.760
   25    HD2  PRO   4           2HD      PRO   4  -0.309   0.706  18.226
   26    HD3  PRO   4           1HD      PRO   4  -0.860   2.384  18.433
   27    H    GLU   5           H        GLU   5  -3.090   0.200  14.201
   28    HA   GLU   5           HA       GLU   5  -2.515  -2.580  14.316
   29    HB2  GLU   5           2HB      GLU   5  -4.313  -1.124  12.352
   30    HB3  GLU   5           1HB      GLU   5  -4.350  -2.846  12.711
   31    HG2  GLU   5           2HG      GLU   5  -4.984  -2.300  15.049
   32    HG3  GLU   5           1HG      GLU   5  -5.053  -0.598  14.595
   33    H    GLY   6           H        GLY   6  -1.327  -0.075  12.361
   34    HA2  GLY   6           2HA      GLY   6   0.641  -1.587  11.097
   35    HA3  GLY   6           1HA      GLY   6  -0.701  -1.446   9.971
   36    H    PHE   7           H        PHE   7   0.201  -0.091   8.471
   37    HA   PHE   7           HA       PHE   7   0.831   2.633   9.404
   38    HB2  PHE   7           2HB      PHE   7   2.392   1.007   7.384
   39    HB3  PHE   7           1HB      PHE   7   2.573   2.748   7.574
   40    HD1  PHE   7           HD1      PHE   7   3.646   3.685   9.544
   41    HD2  PHE   7           HD2      PHE   7   3.220  -0.527   9.075
   42    HE1  PHE   7           HE1      PHE   7   5.276   3.325  11.347
   43    HE2  PHE   7           HE2      PHE   7   4.854  -0.892  10.878
   44    HZ   PHE   7           HZ       PHE   7   5.883   1.031  12.017
   45    H    GLN   8           H        GLN   8   0.197   4.310   8.105
   46    HA   GLN   8           HA       GLN   8  -1.867   3.682   6.141
   47    HB2  GLN   8           2HB      GLN   8  -1.090   6.210   7.595
   48    HB3  GLN   8           1HB      GLN   8  -2.271   6.203   6.294
   49    HG2  GLN   8           2HG      GLN   8  -2.563   4.402   8.661
   50    HG3  GLN   8           1HG      GLN   8  -3.112   6.072   8.715
   51   HE21  GLN   8          1HE2      GLN   8  -5.255   5.471   8.953
   52   HE22  GLN   8          2HE2      GLN   8  -6.174   4.791   7.659
   53    H    TYR   9           H        TYR   9  -1.664   3.932   4.050
   54    HA   TYR   9           HA       TYR   9   0.499   5.634   2.959
   55    HB2  TYR   9           2HB      TYR   9  -0.553   3.026   1.817
   56    HB3  TYR   9           1HB      TYR   9   0.606   4.082   1.015
   57    HD1  TYR   9           HD1      TYR   9   0.110   1.721   3.797
   58    HD2  TYR   9           HD2      TYR   9   2.925   4.154   1.722
   59    HE1  TYR   9           HE1      TYR   9   1.948   0.554   4.934
   60    HE2  TYR   9           HE2      TYR   9   4.772   2.991   2.858
   61    HH   TYR   9           HH       TYR   9   4.314   0.108   4.625
   62    H    ARG  10           H        ARG  10  -0.009   6.704   0.928
   63    HA   ARG  10           HA       ARG  10  -2.911   6.906   0.404
   64    HB2  ARG  10           2HB      ARG  10  -2.253   8.836   1.713
   65    HB3  ARG  10           1HB      ARG  10  -0.928   9.181   0.614
   66    HG2  ARG  10           2HG      ARG  10  -2.444   9.801  -1.137
   67    HG3  ARG  10           1HG      ARG  10  -3.832   9.247  -0.195
   68    HD2  ARG  10           2HD      ARG  10  -1.986  11.505   0.600
   69    HD3  ARG  10           1HD      ARG  10  -3.563  11.711  -0.163
   70    HE   ARG  10           HE       ARG  10  -4.234  10.285   1.970
   71   HH11  ARG  10          1HH1      ARG  10  -2.183  13.046   1.723
   72   HH12  ARG  10          2HH1      ARG  10  -2.537  13.580   3.329
   73   HH21  ARG  10          1HH2      ARG  10  -4.651  10.974   4.037
   74   HH22  ARG  10          2HH2      ARG  10  -3.886  12.405   4.629
   75    H    ALA  11           H        ALA  11  -3.404   6.398  -1.616
   76    HA   ALA  11           HA       ALA  11  -1.441   6.117  -3.682
   77    HB1  ALA  11           3HB      ALA  11  -3.401   4.657  -3.579
   78    HB2  ALA  11           1HB      ALA  11  -3.338   5.512  -5.122
   79    HB3  ALA  11           2HB      ALA  11  -4.460   6.038  -3.866
   80    H    LEU  12           H        LEU  12  -0.717   7.627  -5.073
   81    HA   LEU  12           HA       LEU  12  -1.959  10.281  -5.004
   82    HB2  LEU  12           2HB      LEU  12   0.684   9.374  -6.157
   83    HB3  LEU  12           1HB      LEU  12   0.133  11.037  -6.072
   84    HG   LEU  12           HG       LEU  12   0.744   9.251  -3.706
   85   HD11  LEU  12          1HD1      LEU  12   2.616  10.773  -3.315
   86   HD12  LEU  12          2HD1      LEU  12   2.214  11.657  -4.787
   87   HD13  LEU  12          3HD1      LEU  12   2.753   9.980  -4.884
   88   HD21  LEU  12          3HD2      LEU  12  -0.163  12.132  -3.798
   89   HD22  LEU  12          1HD2      LEU  12   0.420  11.297  -2.357
   90   HD23  LEU  12          2HD2      LEU  12  -1.062  10.762  -3.146
   91    H    TYR  13           H        TYR  13  -1.698   7.589  -7.156
   92    HA   TYR  13           HA       TYR  13  -2.868   9.205  -9.330
   93    HB2  TYR  13           2HB      TYR  13  -0.624   7.188  -9.596
   94    HB3  TYR  13           1HB      TYR  13  -1.541   7.811 -10.964
   95    HD1  TYR  13           HD1      TYR  13  -1.331  10.169 -11.633
   96    HD2  TYR  13           HD2      TYR  13   1.047   8.542  -8.498
   97    HE1  TYR  13           HE1      TYR  13   0.176  12.099 -11.783
   98    HE2  TYR  13           HE2      TYR  13   2.564  10.474  -8.645
   99    HH   TYR  13           HH       TYR  13   3.214  12.197 -10.180
  100    HA   PRO  14           HA       PRO  14  -5.826   5.855  -9.640
  101    HB2  PRO  14           2HB      PRO  14  -6.722   6.275 -12.177
  102    HB3  PRO  14           1HB      PRO  14  -7.185   7.298 -10.811
  103    HG2  PRO  14           2HG      PRO  14  -5.108   7.777 -12.920
  104    HG3  PRO  14           1HG      PRO  14  -6.283   8.911 -12.227
  105    HD2  PRO  14           2HD      PRO  14  -3.674   8.835 -11.460
  106    HD3  PRO  14           1HD      PRO  14  -4.986   9.313 -10.365
  107    H    PHE  15           H        PHE  15  -5.251   3.779  -9.866
  108    HA   PHE  15           HA       PHE  15  -3.807   2.918 -12.281
  109    HB2  PHE  15           2HB      PHE  15  -2.133   3.329 -10.531
  110    HB3  PHE  15           1HB      PHE  15  -3.002   2.271  -9.429
  111    HD1  PHE  15           HD1      PHE  15  -1.390   2.223 -12.798
  112    HD2  PHE  15           HD2      PHE  15  -2.318   0.066  -9.241
  113    HE1  PHE  15           HE1      PHE  15  -0.059   0.318 -13.605
  114    HE2  PHE  15           HE2      PHE  15  -0.990  -1.839 -10.048
  115    HZ   PHE  15           HZ       PHE  15   0.141  -1.715 -12.231
  116    H    ARG  16           H        ARG  16  -4.892   1.299 -13.201
  117    HA   ARG  16           HA       ARG  16  -6.244  -0.691 -11.479
  118    HB2  ARG  16           2HB      ARG  16  -7.852   0.751 -12.737
  119    HB3  ARG  16           1HB      ARG  16  -7.135   0.185 -14.240
  120    HG2  ARG  16           2HG      ARG  16  -7.737  -2.174 -13.437
  121    HG3  ARG  16           1HG      ARG  16  -8.744  -1.373 -12.231
  122    HD2  ARG  16           2HD      ARG  16  -8.980  -1.139 -15.232
  123    HD3  ARG  16           1HD      ARG  16 -10.085  -1.988 -14.153
  124    HE   ARG  16           HE       ARG  16  -9.690   0.934 -14.022
  125   HH11  ARG  16          1HH1      ARG  16 -11.748  -1.830 -14.134
  126   HH12  ARG  16          2HH1      ARG  16 -13.193  -0.890 -14.027
  127   HH21  ARG  16          1HH2      ARG  16 -11.528   2.125 -13.887
  128   HH22  ARG  16          2HH2      ARG  16 -13.071   1.342 -13.886
  129    H    ARG  17           H        ARG  17  -6.203  -2.864 -12.194
  130    HA   ARG  17           HA       ARG  17  -4.470  -3.490 -14.489
  131    HB2  ARG  17           2HB      ARG  17  -4.239  -4.548 -11.676
  132    HB3  ARG  17           1HB      ARG  17  -3.602  -5.448 -13.048
  133    HG2  ARG  17           2HG      ARG  17  -2.821  -2.581 -12.660
  134    HG3  ARG  17           1HG      ARG  17  -2.053  -3.839 -11.696
  135    HD2  ARG  17           2HD      ARG  17  -2.164  -3.814 -14.716
  136    HD3  ARG  17           1HD      ARG  17  -0.791  -3.265 -13.753
  137    HE   ARG  17           HE       ARG  17  -1.270  -5.812 -12.877
  138   HH11  ARG  17          1HH1      ARG  17  -0.527  -4.361 -15.914
  139   HH12  ARG  17          2HH1      ARG  17   0.271  -5.770 -16.515
  140   HH21  ARG  17          1HH2      ARG  17  -0.258  -7.632 -13.683
  141   HH22  ARG  17          2HH2      ARG  17   0.421  -7.585 -15.273
  142    H    GLU  18           H        GLU  18  -5.034  -5.327 -15.649
  143    HA   GLU  18           HA       GLU  18  -7.796  -6.016 -15.510
  144    HB2  GLU  18           2HB      GLU  18  -6.217  -5.860 -17.575
  145    HB3  GLU  18           1HB      GLU  18  -5.787  -7.516 -17.176
  146    HG2  GLU  18           2HG      GLU  18  -7.497  -7.496 -18.875
  147    HG3  GLU  18           1HG      GLU  18  -8.152  -8.164 -17.379
  148    H    ARG  19           H        ARG  19  -5.045  -7.321 -13.987
  149    HA   ARG  19           HA       ARG  19  -6.419  -9.876 -13.426
  150    HB2  ARG  19           2HB      ARG  19  -3.473  -9.212 -13.151
  151    HB3  ARG  19           1HB      ARG  19  -4.204 -10.759 -12.766
  152    HG2  ARG  19           2HG      ARG  19  -3.156 -11.037 -14.852
  153    HG3  ARG  19           1HG      ARG  19  -4.880 -10.908 -15.203
  154    HD2  ARG  19           2HD      ARG  19  -4.656  -8.730 -16.053
  155    HD3  ARG  19           1HD      ARG  19  -3.076  -8.507 -15.305
  156    HE   ARG  19           HE       ARG  19  -2.120  -9.889 -16.982
  157   HH11  ARG  19          1HH1      ARG  19  -5.475  -9.289 -17.525
  158   HH12  ARG  19          2HH1      ARG  19  -5.363  -9.586 -19.221
  159   HH21  ARG  19          1HH2      ARG  19  -1.998 -10.252 -19.157
  160   HH22  ARG  19          2HH2      ARG  19  -3.412 -10.092 -20.138
  161    HA   PRO  20           HA       PRO  20  -6.800  -8.722  -9.116
  162    HB2  PRO  20           2HB      PRO  20  -6.533 -11.115  -7.862
  163    HB3  PRO  20           1HB      PRO  20  -7.959 -10.695  -8.819
  164    HG2  PRO  20           2HG      PRO  20  -5.562 -12.322  -9.613
  165    HG3  PRO  20           1HG      PRO  20  -7.281 -12.673  -9.874
  166    HD2  PRO  20           2HD      PRO  20  -5.721 -11.631 -11.817
  167    HD3  PRO  20           1HD      PRO  20  -7.438 -11.206 -11.662
  168    H    GLU  21           H        GLU  21  -3.889  -9.479 -10.444
  169    HA   GLU  21           HA       GLU  21  -2.102  -9.974  -8.378
  170    HB2  GLU  21           2HB      GLU  21  -1.658  -8.125 -10.734
  171    HB3  GLU  21           1HB      GLU  21  -0.408  -8.918  -9.784
  172    HG2  GLU  21           2HG      GLU  21  -1.076 -11.077 -10.606
  173    HG3  GLU  21           1HG      GLU  21  -2.463 -10.374 -11.439
  174    H    ASP  22           H        ASP  22  -3.186  -6.836  -9.626
  175    HA   ASP  22           HA       ASP  22  -2.018  -5.471  -7.300
  176    HB2  ASP  22           2HB      ASP  22  -3.089  -4.281  -9.876
  177    HB3  ASP  22           1HB      ASP  22  -2.153  -3.448  -8.637
  178    H    LEU  23           H        LEU  23  -3.435  -3.238  -7.038
  179    HA   LEU  23           HA       LEU  23  -6.275  -3.979  -6.732
  180    HB2  LEU  23           2HB      LEU  23  -5.017  -4.220  -4.587
  181    HB3  LEU  23           1HB      LEU  23  -4.599  -2.520  -4.679
  182    HG   LEU  23           HG       LEU  23  -6.970  -1.907  -4.464
  183   HD11  LEU  23          1HD1      LEU  23  -8.641  -3.631  -3.905
  184   HD12  LEU  23          2HD1      LEU  23  -7.445  -4.883  -4.248
  185   HD13  LEU  23          3HD1      LEU  23  -8.003  -3.817  -5.539
  186   HD21  LEU  23          3HD2      LEU  23  -6.000  -3.822  -2.334
  187   HD22  LEU  23          1HD2      LEU  23  -7.287  -2.632  -2.132
  188   HD23  LEU  23          2HD2      LEU  23  -5.636  -2.099  -2.441
  189    H    GLU  24           H        GLU  24  -7.760  -2.259  -6.970
  190    HA   GLU  24           HA       GLU  24  -6.971  -0.242  -8.784
  191    HB2  GLU  24           2HB      GLU  24  -9.521  -0.420  -7.163
  192    HB3  GLU  24           1HB      GLU  24  -9.266   0.622  -8.556
  193    HG2  GLU  24           2HG      GLU  24  -8.895  -1.422  -9.934
  194    HG3  GLU  24           1HG      GLU  24  -9.339  -2.390  -8.528
  195    H    LEU  25           H        LEU  25  -5.793   1.486  -8.318
  196    HA   LEU  25           HA       LEU  25  -6.072   2.801  -5.698
  197    HB2  LEU  25           2HB      LEU  25  -3.924   3.167  -7.798
  198    HB3  LEU  25           1HB      LEU  25  -3.924   3.846  -6.181
  199    HG   LEU  25           HG       LEU  25  -3.688   0.919  -6.898
  200   HD11  LEU  25          1HD1      LEU  25  -1.458   1.087  -5.936
  201   HD12  LEU  25          2HD1      LEU  25  -1.706   2.807  -5.631
  202   HD13  LEU  25          3HD1      LEU  25  -1.647   2.203  -7.288
  203   HD21  LEU  25          3HD2      LEU  25  -3.800   2.240  -4.188
  204   HD22  LEU  25          1HD2      LEU  25  -3.373   0.553  -4.481
  205   HD23  LEU  25          2HD2      LEU  25  -4.990   1.133  -4.875
  206    H    LEU  26           H        LEU  26  -6.725   4.907  -5.507
  207    HA   LEU  26           HA       LEU  26  -7.329   6.412  -7.978
  208    HB2  LEU  26           2HB      LEU  26  -8.981   6.017  -5.501
  209    HB3  LEU  26           1HB      LEU  26  -9.145   7.505  -6.409
  210    HG   LEU  26           HG       LEU  26 -10.894   5.960  -7.049
  211   HD11  LEU  26          1HD1      LEU  26 -10.561   5.901  -9.464
  212   HD12  LEU  26          2HD1      LEU  26  -8.837   6.207  -9.246
  213   HD13  LEU  26          3HD1      LEU  26 -10.020   7.435  -8.785
  214   HD21  LEU  26          3HD2      LEU  26 -10.464   3.814  -8.080
  215   HD22  LEU  26          1HD2      LEU  26  -9.737   3.859  -6.474
  216   HD23  LEU  26          2HD2      LEU  26  -8.725   4.043  -7.906
  217    HA   PRO  27           HA       PRO  27  -4.754   9.677  -6.524
  218    HB2  PRO  27           2HB      PRO  27  -6.189  11.915  -7.275
  219    HB3  PRO  27           1HB      PRO  27  -5.214  10.937  -8.378
  220    HG2  PRO  27           2HG      PRO  27  -8.168  10.855  -7.882
  221    HG3  PRO  27           1HG      PRO  27  -7.288  10.774  -9.421
  222    HD2  PRO  27           2HD      PRO  27  -8.281   8.566  -8.265
  223    HD3  PRO  27           1HD      PRO  27  -6.726   8.534  -9.122
  224    H    GLY  28           H        GLY  28  -4.477  10.097  -4.431
  225    HA2  GLY  28           2HA      GLY  28  -4.774  11.083  -2.369
  226    HA3  GLY  28           1HA      GLY  28  -6.232  11.842  -2.986
  227    H    ASP  29           H        ASP  29  -5.770   8.353  -3.080
  228    HA   ASP  29           HA       ASP  29  -8.020   8.069  -1.213
  229    HB2  ASP  29           2HB      ASP  29  -7.950   6.928  -3.519
  230    HB3  ASP  29           1HB      ASP  29  -6.774   5.826  -2.806
  231    H    VAL  30           H        VAL  30  -7.944   6.286   0.403
  232    HA   VAL  30           HA       VAL  30  -5.329   6.375   1.761
  233    HB   VAL  30           HB       VAL  30  -8.044   5.752   2.944
  234   HG11  VAL  30          1HG1      VAL  30  -6.214   4.791   4.237
  235   HG12  VAL  30          2HG1      VAL  30  -6.943   6.138   5.108
  236   HG13  VAL  30          3HG1      VAL  30  -5.401   6.357   4.283
  237   HG21  VAL  30          3HG2      VAL  30  -7.975   8.019   3.875
  238   HG22  VAL  30          1HG2      VAL  30  -7.983   8.039   2.111
  239   HG23  VAL  30          2HG2      VAL  30  -6.482   8.338   2.990
  240    H    LEU  31           H        LEU  31  -4.197   4.578   2.210
  241    HA   LEU  31           HA       LEU  31  -5.467   1.939   1.815
  242    HB2  LEU  31           2HB      LEU  31  -2.637   2.772   1.147
  243    HB3  LEU  31           1HB      LEU  31  -3.205   1.115   1.128
  244    HG   LEU  31           HG       LEU  31  -4.909   1.875  -0.628
  245   HD11  LEU  31          1HD1      LEU  31  -3.038   4.238  -0.787
  246   HD12  LEU  31          2HD1      LEU  31  -4.724   4.281  -0.272
  247   HD13  LEU  31          3HD1      LEU  31  -4.324   3.848  -1.932
  248   HD21  LEU  31          3HD2      LEU  31  -3.292   1.665  -2.439
  249   HD22  LEU  31          1HD2      LEU  31  -2.958   0.510  -1.151
  250   HD23  LEU  31          2HD2      LEU  31  -1.971   1.965  -1.310
  251    H    VAL  32           H        VAL  32  -5.694   0.990   3.745
  252    HA   VAL  32           HA       VAL  32  -3.811   1.580   5.915
  253    HB   VAL  32           HB       VAL  32  -6.341  -0.071   6.084
  254   HG11  VAL  32          1HG1      VAL  32  -4.788  -0.380   7.939
  255   HG12  VAL  32          2HG1      VAL  32  -6.230   0.481   8.474
  256   HG13  VAL  32          3HG1      VAL  32  -4.728   1.366   8.199
  257   HG21  VAL  32          3HG2      VAL  32  -6.918   2.143   5.236
  258   HG22  VAL  32          1HG2      VAL  32  -6.021   2.900   6.554
  259   HG23  VAL  32          2HG2      VAL  32  -7.470   1.955   6.900
  260    H    VAL  33           H        VAL  33  -2.025   0.307   5.862
  261    HA   VAL  33           HA       VAL  33  -2.290  -2.541   5.153
  262    HB   VAL  33           HB       VAL  33   0.219  -0.864   5.434
  263   HG11  VAL  33          1HG1      VAL  33   0.645  -3.230   5.856
  264   HG12  VAL  33          2HG1      VAL  33   1.343  -2.746   4.311
  265   HG13  VAL  33          3HG1      VAL  33  -0.163  -3.665   4.350
  266   HG21  VAL  33          3HG2      VAL  33  -1.166  -0.122   3.562
  267   HG22  VAL  33          1HG2      VAL  33  -1.248  -1.775   2.951
  268   HG23  VAL  33          2HG2      VAL  33   0.296  -0.921   2.983
  269    H    SER  34           H        SER  34  -1.992  -4.139   6.626
  270    HA   SER  34           HA       SER  34  -1.763  -3.505   9.413
  271    HB2  SER  34           2HB      SER  34  -3.141  -5.380   8.801
  272    HB3  SER  34           1HB      SER  34  -1.806  -6.155   7.950
  273    HG   SER  34           HG       SER  34  -2.487  -6.430  10.493
  274    H    ARG  35           H        ARG  35  -0.111  -3.863  10.837
  275    HA   ARG  35           HA       ARG  35   2.563  -3.798   9.887
  276    HB2  ARG  35           2HB      ARG  35   3.176  -4.047  12.300
  277    HB3  ARG  35           1HB      ARG  35   2.030  -2.749  11.988
  278    HG2  ARG  35           2HG      ARG  35   0.194  -4.254  12.706
  279    HG3  ARG  35           1HG      ARG  35   1.400  -5.476  13.115
  280    HD2  ARG  35           2HD      ARG  35   2.396  -3.974  14.753
  281    HD3  ARG  35           1HD      ARG  35   1.257  -2.703  14.310
  282    HE   ARG  35           HE       ARG  35  -0.379  -4.705  15.050
  283   HH11  ARG  35          1HH1      ARG  35   2.336  -3.232  16.581
  284   HH12  ARG  35          2HH1      ARG  35   1.776  -3.593  18.176
  285   HH21  ARG  35          1HH2      ARG  35  -1.109  -5.126  17.097
  286   HH22  ARG  35          2HH2      ARG  35  -0.175  -4.626  18.466
  287    H    ALA  36           H        ALA  36   0.484  -6.405  11.013
  288    HA   ALA  36           HA       ALA  36   2.435  -8.423  11.309
  289    HB1  ALA  36           3HB      ALA  36  -0.462  -8.720  10.515
  290    HB2  ALA  36           1HB      ALA  36   0.145  -8.619  12.168
  291    HB3  ALA  36           2HB      ALA  36   0.579  -9.993  11.151
  292    H    ALA  37           H        ALA  37   0.753  -7.183   8.489
  293    HA   ALA  37           HA       ALA  37   1.542  -9.215   6.657
  294    HB1  ALA  37           3HB      ALA  37   0.842  -7.643   4.917
  295    HB2  ALA  37           1HB      ALA  37   0.757  -6.347   6.111
  296    HB3  ALA  37           2HB      ALA  37  -0.348  -7.719   6.217
  297    H    LEU  38           H        LEU  38   2.882  -6.006   7.433
  298    HA   LEU  38           HA       LEU  38   4.992  -5.984   5.594
  299    HB2  LEU  38           2HB      LEU  38   4.876  -4.750   8.350
  300    HB3  LEU  38           1HB      LEU  38   6.066  -4.352   7.124
  301    HG   LEU  38           HG       LEU  38   3.085  -3.862   6.929
  302   HD11  LEU  38          1HD1      LEU  38   5.391  -1.948   7.285
  303   HD12  LEU  38          2HD1      LEU  38   4.160  -2.344   8.485
  304   HD13  LEU  38          3HD1      LEU  38   3.708  -1.491   7.010
  305   HD21  LEU  38          3HD2      LEU  38   5.302  -3.179   4.992
  306   HD22  LEU  38          1HD2      LEU  38   3.621  -2.657   4.858
  307   HD23  LEU  38          2HD2      LEU  38   4.022  -4.369   4.741
  308    H    GLN  39           H        GLN  39   4.871  -7.310   8.890
  309    HA   GLN  39           HA       GLN  39   7.540  -8.145   9.090
  310    HB2  GLN  39           2HB      GLN  39   5.040  -9.371  10.273
  311    HB3  GLN  39           1HB      GLN  39   6.674  -9.822  10.736
  312    HG2  GLN  39           2HG      GLN  39   5.443  -7.088  11.047
  313    HG3  GLN  39           1HG      GLN  39   5.686  -8.268  12.333
  314   HE21  GLN  39          1HE2      GLN  39   7.798  -8.698  13.035
  315   HE22  GLN  39          2HE2      GLN  39   9.091  -7.596  12.739
  316    H    ALA  40           H        ALA  40   4.703  -9.854   7.781
  317    HA   ALA  40           HA       ALA  40   5.983 -12.253   7.060
  318    HB1  ALA  40           3HB      ALA  40   4.106 -12.600   5.530
  319    HB2  ALA  40           1HB      ALA  40   3.634 -10.909   5.712
  320    HB3  ALA  40           2HB      ALA  40   3.548 -12.004   7.093
  321    H    LEU  41           H        LEU  41   5.600  -9.201   5.291
  322    HA   LEU  41           HA       LEU  41   6.833 -10.013   2.865
  323    HB2  LEU  41           2HB      LEU  41   6.687  -7.258   4.104
  324    HB3  LEU  41           1HB      LEU  41   7.099  -7.600   2.436
  325    HG   LEU  41           HG       LEU  41   4.421  -8.210   3.697
  326   HD11  LEU  41          1HD1      LEU  41   3.604  -6.312   2.366
  327   HD12  LEU  41          2HD1      LEU  41   5.261  -5.943   1.890
  328   HD13  LEU  41          3HD1      LEU  41   4.779  -5.817   3.582
  329   HD21  LEU  41          3HD2      LEU  41   4.963  -9.699   1.838
  330   HD22  LEU  41          1HD2      LEU  41   5.331  -8.306   0.815
  331   HD23  LEU  41          2HD2      LEU  41   3.685  -8.574   1.387
  332    H    GLY  42           H        GLY  42   8.117  -8.977   5.940
  333    HA2  GLY  42           2HA      GLY  42  10.327  -9.192   6.686
  334    HA3  GLY  42           1HA      GLY  42  10.846  -9.469   5.032
  335    H    VAL  43           H        VAL  43   8.861  -6.743   6.026
  336    HA   VAL  43           HA       VAL  43  10.677  -4.869   4.839
  337    HB   VAL  43           HB       VAL  43   8.252  -4.324   6.572
  338   HG11  VAL  43          1HG1      VAL  43   9.755  -2.514   4.676
  339   HG12  VAL  43          2HG1      VAL  43   9.713  -2.384   6.434
  340   HG13  VAL  43          3HG1      VAL  43   8.246  -2.108   5.495
  341   HG21  VAL  43          3HG2      VAL  43   8.487  -4.505   3.564
  342   HG22  VAL  43          1HG2      VAL  43   7.048  -3.994   4.448
  343   HG23  VAL  43          2HG2      VAL  43   7.647  -5.645   4.617
  344    H    ALA  44           H        ALA  44  12.376  -3.906   5.761
  345    HA   ALA  44           HA       ALA  44  12.860  -4.217   8.617
  346    HB1  ALA  44           3HB      ALA  44  14.622  -3.062   6.451
  347    HB2  ALA  44           1HB      ALA  44  14.669  -4.720   7.052
  348    HB3  ALA  44           2HB      ALA  44  15.110  -3.383   8.115
  349    H    GLU  45           H        GLU  45  13.259  -2.500  10.057
  350    HA   GLU  45           HA       GLU  45  11.670  -0.273  10.033
  351    HB2  GLU  45           2HB      GLU  45  12.897  -1.035  12.015
  352    HB3  GLU  45           1HB      GLU  45  14.414  -0.514  11.293
  353    HG2  GLU  45           2HG      GLU  45  13.583   1.817  11.306
  354    HG3  GLU  45           1HG      GLU  45  12.119   1.265  12.119
  355    H    GLY  46           H        GLY  46  11.627   1.638   9.012
  356    HA2  GLY  46           2HA      GLY  46  12.677   3.557   7.992
  357    HA3  GLY  46           1HA      GLY  46  14.033   2.536   7.536
  358    H    GLY  47           H        GLY  47  12.672   0.369   6.380
  359    HA2  GLY  47           2HA      GLY  47  12.106   1.241   3.769
  360    HA3  GLY  47           1HA      GLY  47  11.659  -0.327   4.427
  361    H    GLU  48           H        GLU  48  10.050   0.901   6.547
  362    HA   GLU  48           HA       GLU  48   7.485   1.064   5.546
  363    HB2  GLU  48           2HB      GLU  48   6.925   2.158   7.679
  364    HB3  GLU  48           1HB      GLU  48   8.082   0.856   7.936
  365    HG2  GLU  48           2HG      GLU  48   9.880   2.693   7.788
  366    HG3  GLU  48           1HG      GLU  48   8.550   3.820   8.014
  367    H    ARG  49           H        ARG  49   9.939   3.552   5.727
  368    HA   ARG  49           HA       ARG  49   8.110   5.705   5.010
  369    HB2  ARG  49           2HB      ARG  49  11.103   5.755   5.483
  370    HB3  ARG  49           1HB      ARG  49  10.050   7.160   5.350
  371    HG2  ARG  49           2HG      ARG  49   9.008   6.727   7.406
  372    HG3  ARG  49           1HG      ARG  49   9.597   5.067   7.453
  373    HD2  ARG  49           2HD      ARG  49  10.840   6.336   9.037
  374    HD3  ARG  49           1HD      ARG  49  11.910   5.959   7.687
  375    HE   ARG  49           HE       ARG  49  11.044   8.391   7.007
  376   HH11  ARG  49          1HH1      ARG  49  12.206   7.172  10.001
  377   HH12  ARG  49          2HH1      ARG  49  12.859   8.693  10.496
  378   HH21  ARG  49          1HH2      ARG  49  11.878  10.341   7.651
  379   HH22  ARG  49          2HH2      ARG  49  12.664  10.467   9.190
  380    H    CYS  50           H        CYS  50   9.725   3.382   3.317
  381    HA   CYS  50           HA       CYS  50   9.772   5.020   0.872
  382    HB2  CYS  50           2HB      CYS  50  11.973   3.091   1.671
  383    HB3  CYS  50           1HB      CYS  50  11.877   3.965   0.145
  384    HG   CYS  50           HG       CYS  50  12.448   5.279   3.251
  385    HA   PRO  51           HA       PRO  51   7.326   1.012   0.504
  386    HB2  PRO  51           2HB      PRO  51   5.397   2.166  -1.113
  387    HB3  PRO  51           1HB      PRO  51   5.298   2.058   0.648
  388    HG2  PRO  51           2HG      PRO  51   6.172   4.358  -1.062
  389    HG3  PRO  51           1HG      PRO  51   5.153   4.365   0.391
  390    HD2  PRO  51           2HD      PRO  51   7.736   5.080   0.495
  391    HD3  PRO  51           1HD      PRO  51   6.977   4.176   1.823
  392    H    GLN  52           H        GLN  52   8.477   3.347  -1.847
  393    HA   GLN  52           HA       GLN  52   8.162   1.828  -4.197
  394    HB2  GLN  52           2HB      GLN  52  10.284   3.896  -3.562
  395    HB3  GLN  52           1HB      GLN  52   9.863   3.320  -5.170
  396    HG2  GLN  52           2HG      GLN  52   7.592   4.240  -4.876
  397    HG3  GLN  52           1HG      GLN  52   8.075   4.868  -3.300
  398   HE21  GLN  52          1HE2      GLN  52   7.697   6.993  -3.904
  399   HE22  GLN  52          2HE2      GLN  52   8.726   7.841  -5.003
  400    H    SER  53           H        SER  53  10.496   1.623  -1.628
  401    HA   SER  53           HA       SER  53  12.398   0.038  -3.141
  402    HB2  SER  53           2HB      SER  53  12.279   0.721  -0.187
  403    HB3  SER  53           1HB      SER  53  13.598  -0.159  -0.961
  404    HG   SER  53           HG       SER  53  13.686   2.298  -0.681
  405    H    VAL  54           H        VAL  54   9.780  -0.550  -0.870
  406    HA   VAL  54           HA       VAL  54  10.376  -3.334  -0.474
  407    HB   VAL  54           HB       VAL  54   7.749  -1.896  -0.006
  408   HG11  VAL  54          1HG1      VAL  54   8.801  -4.501   1.116
  409   HG12  VAL  54          2HG1      VAL  54   7.514  -4.330  -0.077
  410   HG13  VAL  54          3HG1      VAL  54   7.280  -3.727   1.564
  411   HG21  VAL  54          3HG2      VAL  54   9.565  -0.819   1.231
  412   HG22  VAL  54          1HG2      VAL  54  10.045  -2.376   1.908
  413   HG23  VAL  54          2HG2      VAL  54   8.482  -1.674   2.329
  414    H    GLY  55           H        GLY  55   8.018  -1.547  -2.464
  415    HA2  GLY  55           2HA      GLY  55   7.539  -2.098  -4.711
  416    HA3  GLY  55           1HA      GLY  55   8.108  -3.731  -4.419
  417    H    TRP  56           H        TRP  56   6.687  -5.111  -3.026
  418    HA   TRP  56           HA       TRP  56   3.858  -4.557  -3.689
  419    HB2  TRP  56           2HB      TRP  56   5.381  -7.163  -3.551
  420    HB3  TRP  56           1HB      TRP  56   3.624  -7.092  -3.608
  421    HD1  TRP  56           HD1      TRP  56   6.713  -6.409  -5.787
  422    HE1  TRP  56           HE1      TRP  56   5.963  -6.349  -8.251
  423    HE3  TRP  56           HE3      TRP  56   1.654  -6.643  -5.102
  424    HZ2  TRP  56           HZ2      TRP  56   3.547  -6.403  -9.709
  425    HZ3  TRP  56           HZ3      TRP  56   0.192  -6.637  -7.081
  426    HH2  TRP  56           HH2      TRP  56   1.122  -6.517  -9.337
  427    H    MET  57           H        MET  57   2.708  -3.987  -1.958
  428    HA   MET  57           HA       MET  57   3.000  -5.603   0.496
  429    HB2  MET  57           2HB      MET  57   2.314  -2.654   0.358
  430    HB3  MET  57           1HB      MET  57   2.320  -3.629   1.821
  431    HG2  MET  57           2HG      MET  57   4.328  -2.385   1.807
  432    HG3  MET  57           1HG      MET  57   4.755  -4.052   1.432
  433    HE1  MET  57           3HE      MET  57   4.282  -0.414  -0.003
  434    HE2  MET  57           1HE      MET  57   3.108  -1.374  -0.907
  435    HE3  MET  57           2HE      MET  57   4.516  -0.703  -1.727
  436    HA   PRO  58           HA       PRO  58  -1.446  -6.152  -0.109
  437    HB2  PRO  58           2HB      PRO  58  -1.906  -7.813   1.952
  438    HB3  PRO  58           1HB      PRO  58  -1.038  -8.351   0.509
  439    HG2  PRO  58           2HG      PRO  58   0.042  -7.560   3.183
  440    HG3  PRO  58           1HG      PRO  58   0.548  -8.884   2.119
  441    HD2  PRO  58           2HD      PRO  58   1.827  -6.434   2.310
  442    HD3  PRO  58           1HD      PRO  58   1.946  -7.527   0.917
  443    H    GLY  59           H        GLY  59  -2.915  -4.631   0.471
  444    HA2  GLY  59           2HA      GLY  59  -3.192  -3.898   3.296
  445    HA3  GLY  59           1HA      GLY  59  -2.792  -2.612   2.172
  446    H    LEU  60           H        LEU  60  -4.949  -2.154   3.525
  447    HA   LEU  60           HA       LEU  60  -7.305  -3.080   2.042
  448    HB2  LEU  60           2HB      LEU  60  -7.386  -3.152   4.491
  449    HB3  LEU  60           1HB      LEU  60  -7.036  -1.436   4.566
  450    HG   LEU  60           HG       LEU  60  -9.198  -0.960   3.447
  451   HD11  LEU  60          1HD1      LEU  60  -9.440  -3.071   2.231
  452   HD12  LEU  60          2HD1      LEU  60 -10.865  -2.702   3.198
  453   HD13  LEU  60          3HD1      LEU  60  -9.714  -3.918   3.755
  454   HD21  LEU  60          3HD2      LEU  60  -9.035  -0.913   5.883
  455   HD22  LEU  60          1HD2      LEU  60  -9.433  -2.631   5.951
  456   HD23  LEU  60          2HD2      LEU  60 -10.623  -1.471   5.361
  457    H    ASN  61           H        ASN  61  -8.092  -1.870   0.421
  458    HA   ASN  61           HA       ASN  61  -7.275   0.932   0.155
  459    HB2  ASN  61           2HB      ASN  61  -7.022  -0.389  -1.837
  460    HB3  ASN  61           1HB      ASN  61  -8.679  -0.974  -1.727
  461   HD21  ASN  61          1HD2      ASN  61  -6.699   1.848  -2.347
  462   HD22  ASN  61          2HD2      ASN  61  -7.894   2.714  -3.236
  463    H    GLU  62           H        GLU  62  -8.556   2.569   0.766
  464    HA   GLU  62           HA       GLU  62 -11.089   2.012   1.962
  465    HB2  GLU  62           2HB      GLU  62  -9.512   4.537   1.538
  466    HB3  GLU  62           1HB      GLU  62 -11.123   4.568   2.245
  467    HG2  GLU  62           2HG      GLU  62  -8.767   3.028   3.332
  468    HG3  GLU  62           1HG      GLU  62  -9.354   4.575   3.942
  469    H    ARG  63           H        ARG  63 -10.172   3.308  -1.179
  470    HA   ARG  63           HA       ARG  63 -12.622   4.420  -1.957
  471    HB2  ARG  63           2HB      ARG  63 -10.652   4.671  -3.345
  472    HB3  ARG  63           1HB      ARG  63 -10.561   2.937  -3.609
  473    HG2  ARG  63           2HG      ARG  63 -11.417   3.955  -5.588
  474    HG3  ARG  63           1HG      ARG  63 -12.731   3.065  -4.827
  475    HD2  ARG  63           2HD      ARG  63 -12.310   6.028  -4.450
  476    HD3  ARG  63           1HD      ARG  63 -13.303   5.359  -5.741
  477    HE   ARG  63           HE       ARG  63 -14.031   4.469  -3.099
  478   HH11  ARG  63          1HH1      ARG  63 -14.575   6.798  -5.572
  479   HH12  ARG  63          2HH1      ARG  63 -16.086   7.308  -4.901
  480   HH21  ARG  63          1HH2      ARG  63 -15.962   5.118  -2.261
  481   HH22  ARG  63          2HH2      ARG  63 -16.862   6.367  -3.053
  482    H    THR  64           H        THR  64 -11.481   1.082  -2.400
  483    HA   THR  64           HA       THR  64 -14.145   0.212  -3.250
  484    HB   THR  64           HB       THR  64 -13.067  -1.968  -3.699
  485    HG1  THR  64           HG1      THR  64 -10.536  -0.837  -3.161
  486   HG21  THR  64          3HG2      THR  64 -11.551   0.388  -4.845
  487   HG22  THR  64          1HG2      THR  64 -13.057  -0.280  -5.471
  488   HG23  THR  64          2HG2      THR  64 -11.578  -1.240  -5.524
  489    H    ARG  65           H        ARG  65 -12.312   0.386  -0.403
  490    HA   ARG  65           HA       ARG  65 -12.441  -0.474   1.681
  491    HB2  ARG  65           2HB      ARG  65 -15.273  -1.048   0.786
  492    HB3  ARG  65           1HB      ARG  65 -14.712  -1.270   2.441
  493    HG2  ARG  65           2HG      ARG  65 -14.176   1.098   2.603
  494    HG3  ARG  65           1HG      ARG  65 -14.668   1.343   0.926
  495    HD2  ARG  65           2HD      ARG  65 -16.395   2.034   2.548
  496    HD3  ARG  65           1HD      ARG  65 -16.940   0.761   1.458
  497    HE   ARG  65           HE       ARG  65 -16.704  -0.807   3.277
  498   HH11  ARG  65          1HH1      ARG  65 -16.518   2.514   4.182
  499   HH12  ARG  65          2HH1      ARG  65 -16.973   2.198   5.818
  500   HH21  ARG  65          1HH2      ARG  65 -17.271  -1.191   5.369
  501   HH22  ARG  65          2HH2      ARG  65 -17.391   0.124   6.486
  502    H    GLN  66           H        GLN  66 -11.633  -2.209  -0.607
  503    HA   GLN  66           HA       GLN  66 -12.011  -4.838   0.694
  504    HB2  GLN  66           2HB      GLN  66 -11.600  -4.190  -2.233
  505    HB3  GLN  66           1HB      GLN  66 -11.528  -5.819  -1.573
  506    HG2  GLN  66           2HG      GLN  66 -13.924  -3.989  -1.519
  507    HG3  GLN  66           1HG      GLN  66 -13.690  -5.363  -2.598
  508   HE21  GLN  66          1HE2      GLN  66 -15.815  -4.886  -0.699
  509   HE22  GLN  66          2HE2      GLN  66 -15.793  -6.219   0.401
  510    H    ARG  67           H        ARG  67 -10.197  -6.346   0.464
  511    HA   ARG  67           HA       ARG  67  -7.646  -4.972   0.864
  512    HB2  ARG  67           2HB      ARG  67  -8.406  -7.875   1.261
  513    HB3  ARG  67           1HB      ARG  67  -6.875  -7.147   1.727
  514    HG2  ARG  67           2HG      ARG  67  -7.944  -5.796   3.394
  515    HG3  ARG  67           1HG      ARG  67  -9.546  -6.284   2.832
  516    HD2  ARG  67           2HD      ARG  67  -7.463  -8.092   4.072
  517    HD3  ARG  67           1HD      ARG  67  -8.925  -7.495   4.859
  518    HE   ARG  67           HE       ARG  67 -10.041  -8.731   2.847
  519   HH11  ARG  67          1HH1      ARG  67  -7.328  -9.785   4.687
  520   HH12  ARG  67          2HH1      ARG  67  -7.662 -11.460   4.426
  521   HH21  ARG  67          1HH2      ARG  67 -10.446 -10.892   2.495
  522   HH22  ARG  67          2HH2      ARG  67  -9.403 -12.080   3.195
  523    H    GLY  68           H        GLY  68  -5.725  -5.524  -0.243
  524    HA2  GLY  68           2HA      GLY  68  -5.525  -7.542  -2.224
  525    HA3  GLY  68           1HA      GLY  68  -5.885  -6.005  -2.998
  526    H    ASP  69           H        ASP  69  -3.652  -6.810  -3.912
  527    HA   ASP  69           HA       ASP  69  -1.457  -5.764  -2.237
  528    HB2  ASP  69           2HB      ASP  69  -1.343  -7.332  -4.829
  529    HB3  ASP  69           1HB      ASP  69   0.048  -6.838  -3.868
  530    H    PHE  70           H        PHE  70  -0.163  -4.035  -2.947
  531    HA   PHE  70           HA       PHE  70  -0.897  -2.762  -5.487
  532    HB2  PHE  70           2HB      PHE  70  -1.103  -0.554  -4.442
  533    HB3  PHE  70           1HB      PHE  70  -2.291  -1.678  -3.794
  534    HD1  PHE  70           HD1      PHE  70  -2.086  -2.526  -1.496
  535    HD2  PHE  70           HD2      PHE  70   0.645   0.356  -3.052
  536    HE1  PHE  70           HE1      PHE  70  -1.334  -2.003   0.787
  537    HE2  PHE  70           HE2      PHE  70   1.397   0.875  -0.771
  538    HZ   PHE  70           HZ       PHE  70   0.410  -0.303   1.150
  539    HA   PRO  71           HA       PRO  71   3.511  -2.014  -5.731
  540    HB2  PRO  71           2HB      PRO  71   2.915   0.027  -7.755
  541    HB3  PRO  71           1HB      PRO  71   3.742  -1.521  -7.942
  542    HG2  PRO  71           2HG      PRO  71   1.277  -1.066  -8.960
  543    HG3  PRO  71           1HG      PRO  71   1.793  -2.665  -8.388
  544    HD2  PRO  71           2HD      PRO  71   0.088  -0.615  -7.004
  545    HD3  PRO  71           1HD      PRO  71  -0.123  -2.378  -7.100
  546    H    GLY  72           H        GLY  72   4.548  -0.855  -4.225
  547    HA2  GLY  72           2HA      GLY  72   3.511   1.402  -2.926
  548    HA3  GLY  72           1HA      GLY  72   5.171   0.850  -2.823
  549    H    THR  73           H        THR  73   5.129   1.298  -5.946
  550    HA   THR  73           HA       THR  73   6.366   3.869  -5.843
  551    HB   THR  73           HB       THR  73   7.103   2.167  -7.444
  552    HG1  THR  73           HG1      THR  73   6.152   4.639  -8.487
  553   HG21  THR  73          3HG2      THR  73   4.484   2.668  -8.872
  554   HG22  THR  73          1HG2      THR  73   4.903   1.200  -7.983
  555   HG23  THR  73          2HG2      THR  73   5.802   1.640  -9.434
  556    H    TYR  74           H        TYR  74   3.101   3.100  -5.910
  557    HA   TYR  74           HA       TYR  74   2.405   5.627  -7.282
  558    HB2  TYR  74           2HB      TYR  74   0.677   3.199  -6.739
  559    HB3  TYR  74           1HB      TYR  74   0.118   4.680  -7.507
  560    HD1  TYR  74           HD2      TYR  74   1.232   5.369  -9.711
  561    HD2  TYR  74           HD1      TYR  74   1.635   1.480  -8.024
  562    HE1  TYR  74           HE2      TYR  74   1.907   4.493 -11.905
  563    HE2  TYR  74           HE1      TYR  74   2.315   0.598 -10.215
  564    HH   TYR  74           HH       TYR  74   2.136   1.132 -12.555
  565    H    VAL  75           H        VAL  75   2.945   4.604  -4.222
  566    HA   VAL  75           HA       VAL  75   0.804   6.307  -3.102
  567    HB   VAL  75           HB       VAL  75   0.586   4.843  -1.170
  568   HG11  VAL  75          1HG1      VAL  75  -0.501   2.917  -2.244
  569   HG12  VAL  75          2HG1      VAL  75   0.283   3.331  -3.768
  570   HG13  VAL  75          3HG1      VAL  75  -0.897   4.432  -3.056
  571   HG21  VAL  75          3HG2      VAL  75   2.570   3.034  -2.561
  572   HG22  VAL  75          1HG2      VAL  75   1.672   2.638  -1.094
  573   HG23  VAL  75          2HG2      VAL  75   2.853   3.948  -1.080
  574    H    GLU  76           H        GLU  76   1.319   7.568  -1.308
  575    HA   GLU  76           HA       GLU  76   4.168   7.788  -0.627
  576    HB2  GLU  76           2HB      GLU  76   3.662   9.940   0.312
  577    HB3  GLU  76           1HB      GLU  76   2.881   9.846  -1.261
  578    HG2  GLU  76           2HG      GLU  76   0.739   9.471  -0.250
  579    HG3  GLU  76           1HG      GLU  76   1.465   9.323   1.348
  580    H    PHE  77           H        PHE  77   4.656   8.247   1.734
  581    HA   PHE  77           HA       PHE  77   3.187   6.351   3.425
  582    HB2  PHE  77           2HB      PHE  77   5.603   6.002   3.240
  583    HB3  PHE  77           1HB      PHE  77   5.902   7.642   3.803
  584    HD1  PHE  77           HD2      PHE  77   3.902   4.687   4.957
  585    HD2  PHE  77           HD1      PHE  77   6.663   7.772   5.972
  586    HE1  PHE  77           HE2      PHE  77   3.987   3.851   7.267
  587    HE2  PHE  77           HE1      PHE  77   6.745   6.939   8.285
  588    HZ   PHE  77           HZ       PHE  77   5.407   4.976   8.934
  589    H    LEU  78           H        LEU  78   1.796   7.072   4.919
  590    HA   LEU  78           HA       LEU  78   1.762   9.922   5.614
  591    HB2  LEU  78           2HB      LEU  78  -0.225   7.748   6.298
  592    HB3  LEU  78           1HB      LEU  78  -0.449   9.470   6.549
  593    HG   LEU  78           HG       LEU  78  -0.225   8.090   3.864
  594   HD11  LEU  78          1HD1      LEU  78  -2.594   9.348   5.245
  595   HD12  LEU  78          2HD1      LEU  78  -2.341   7.625   4.967
  596   HD13  LEU  78          3HD1      LEU  78  -2.579   8.711   3.599
  597   HD21  LEU  78          3HD2      LEU  78  -0.709  10.996   4.528
  598   HD22  LEU  78          1HD2      LEU  78  -0.810  10.280   2.917
  599   HD23  LEU  78          2HD2      LEU  78   0.734  10.322   3.767
  600    H    GLY  79           H        GLY  79   1.804   6.761   7.260
  601    HA2  GLY  79           2HA      GLY  79   3.625   6.892   9.116
  602    HA3  GLY  79           1HA      GLY  79   2.537   8.097   9.784
  603    HA   PRO  80           HA       PRO  80   1.328   3.813  11.346
  604    HB2  PRO  80           2HB      PRO  80   1.797   4.237  13.988
  605    HB3  PRO  80           1HB      PRO  80   3.041   3.647  12.879
  606    HG2  PRO  80           2HG      PRO  80   2.581   6.431  13.897
  607    HG3  PRO  80           1HG      PRO  80   4.107   5.544  13.713
  608    HD2  PRO  80           2HD      PRO  80   3.249   7.398  11.908
  609    HD3  PRO  80           1HD      PRO  80   4.247   6.001  11.457
  610    H    LEU  81           H        LEU  81  -0.724   3.400  12.120
  611    HA   LEU  81           HA       LEU  81  -2.569   5.559  12.253
  612    HB2  LEU  81           2HB      LEU  81  -2.913   2.636  12.938
  613    HB3  LEU  81           1HB      LEU  81  -4.227   3.795  12.921
  614    HG   LEU  81           HG       LEU  81  -3.632   4.214  10.471
  615   HD11  LEU  81          1HD1      LEU  81  -2.501   2.382   9.306
  616   HD12  LEU  81          2HD1      LEU  81  -2.127   1.629  10.857
  617   HD13  LEU  81          3HD1      LEU  81  -1.430   3.196  10.444
  618   HD21  LEU  81          3HD2      LEU  81  -4.904   2.271   9.717
  619   HD22  LEU  81          1HD2      LEU  81  -5.617   3.005  11.152
  620   HD23  LEU  81          2HD2      LEU  81  -4.686   1.513  11.294
  621    H    GLU  82           H        GLU  82  -3.424   6.647  13.942
  622    HA   GLU  82           HA       GLU  82  -2.410   6.008  16.614
  623    HB2  GLU  82           2HB      GLU  82  -2.169   8.325  15.672
  624    HB3  GLU  82           1HB      GLU  82  -3.920   8.481  15.738
  625    HG2  GLU  82           2HG      GLU  82  -2.855   9.554  17.651
  626    HG3  GLU  82           1HG      GLU  82  -3.876   8.208  18.159
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1 -11.820   1.221  20.990
    2    H2   MET   1           2H       MET   1 -10.851   2.515  21.481
    3    H3   MET   1           3H       MET   1 -10.146   1.018  21.134
    4    HA   MET   1           HA       MET   1 -11.548   2.753  19.180
    5    HB2  MET   1           2HB      MET   1  -9.435   3.745  19.893
    6    HB3  MET   1           1HB      MET   1  -8.591   2.231  19.597
    7    HG2  MET   1           2HG      MET   1  -8.196   3.859  17.820
    8    HG3  MET   1           1HG      MET   1  -9.025   2.424  17.216
    9    HE1  MET   1           3HE      MET   1  -8.813   5.220  15.648
   10    HE2  MET   1           1HE      MET   1 -10.448   5.355  15.004
   11    HE3  MET   1           2HE      MET   1  -9.619   3.797  14.987
   12    H    ALA   2           H        ALA   2 -12.391   1.572  17.575
   13    HA   ALA   2           HA       ALA   2 -11.326  -1.125  17.062
   14    HB1  ALA   2           3HB      ALA   2 -13.705  -0.980  17.613
   15    HB2  ALA   2           1HB      ALA   2 -13.463  -1.584  15.973
   16    HB3  ALA   2           2HB      ALA   2 -13.965   0.088  16.234
   17    H    GLY   3           H        GLY   3 -10.728  -1.818  15.018
   18    HA2  GLY   3           2HA      GLY   3 -11.109  -0.874  12.543
   19    HA3  GLY   3           1HA      GLY   3  -9.948   0.291  13.159
   20    HA   PRO   4           HA       PRO   4  -7.242  -3.052  11.610
   21    HB2  PRO   4           2HB      PRO   4  -5.610  -1.549  10.124
   22    HB3  PRO   4           1HB      PRO   4  -7.238  -1.953   9.566
   23    HG2  PRO   4           2HG      PRO   4  -6.204   0.603  10.702
   24    HG3  PRO   4           1HG      PRO   4  -7.417   0.346   9.437
   25    HD2  PRO   4           2HD      PRO   4  -7.924   0.886  12.163
   26    HD3  PRO   4           1HD      PRO   4  -9.107   0.332  10.962
   27    H    GLU   5           H        GLU   5  -4.627  -2.934  11.508
   28    HA   GLU   5           HA       GLU   5  -3.744  -1.847  14.123
   29    HB2  GLU   5           2HB      GLU   5  -2.210  -3.769  14.261
   30    HB3  GLU   5           1HB      GLU   5  -3.888  -4.284  14.147
   31    HG2  GLU   5           2HG      GLU   5  -3.628  -4.890  11.851
   32    HG3  GLU   5           1HG      GLU   5  -2.025  -4.158  11.783
   33    H    GLY   6           H        GLY   6  -3.027  -2.066  10.733
   34    HA2  GLY   6           2HA      GLY   6  -0.180  -1.706  11.012
   35    HA3  GLY   6           1HA      GLY   6  -1.085  -1.796   9.517
   36    H    PHE   7           H        PHE   7  -0.003  -0.131   8.545
   37    HA   PHE   7           HA       PHE   7  -0.199   2.547   9.782
   38    HB2  PHE   7           2HB      PHE   7   1.828   1.481   7.793
   39    HB3  PHE   7           1HB      PHE   7   1.771   3.139   8.384
   40    HD1  PHE   7           HD2      PHE   7   2.137  -0.382   9.550
   41    HD2  PHE   7           HD1      PHE   7   2.918   3.734  10.321
   42    HE1  PHE   7           HE2      PHE   7   3.546  -1.011  11.463
   43    HE2  PHE   7           HE1      PHE   7   4.330   3.109  12.236
   44    HZ   PHE   7           HZ       PHE   7   4.645   0.735  12.810
   45    H    GLN   8           H        GLN   8  -0.316   4.368   8.194
   46    HA   GLN   8           HA       GLN   8  -2.223   3.670   6.056
   47    HB2  GLN   8           2HB      GLN   8  -2.089   5.888   8.021
   48    HB3  GLN   8           1HB      GLN   8  -2.629   6.329   6.404
   49    HG2  GLN   8           2HG      GLN   8  -4.364   4.571   6.548
   50    HG3  GLN   8           1HG      GLN   8  -3.850   4.240   8.201
   51   HE21  GLN   8          1HE2      GLN   8  -6.414   5.246   7.068
   52   HE22  GLN   8          2HE2      GLN   8  -6.735   6.707   7.932
   53    H    TYR   9           H        TYR   9  -1.695   3.977   4.037
   54    HA   TYR   9           HA       TYR   9   0.452   5.881   3.321
   55    HB2  TYR   9           2HB      TYR   9  -0.367   3.400   1.781
   56    HB3  TYR   9           1HB      TYR   9   1.007   4.448   1.448
   57    HD1  TYR   9           HD1      TYR   9  -0.347   1.924   3.780
   58    HD2  TYR   9           HD2      TYR   9   3.090   4.166   2.637
   59    HE1  TYR   9           HE1      TYR   9   1.054   0.485   5.188
   60    HE2  TYR   9           HE2      TYR   9   4.501   2.722   4.047
   61    HH   TYR   9           HH       TYR   9   4.171   1.222   6.098
   62    H    ARG  10           H        ARG  10   0.181   6.626   0.920
   63    HA   ARG  10           HA       ARG  10  -2.670   7.025   0.276
   64    HB2  ARG  10           2HB      ARG  10  -1.964   8.958   1.577
   65    HB3  ARG  10           1HB      ARG  10  -0.591   9.209   0.514
   66    HG2  ARG  10           2HG      ARG  10  -2.067   9.784  -1.319
   67    HG3  ARG  10           1HG      ARG  10  -3.479   9.429  -0.321
   68    HD2  ARG  10           2HD      ARG  10  -2.855  11.237   1.212
   69    HD3  ARG  10           1HD      ARG  10  -1.426  11.578   0.235
   70    HE   ARG  10           HE       ARG  10  -2.842  12.391  -1.493
   71   HH11  ARG  10          1HH1      ARG  10  -4.483  11.725   1.473
   72   HH12  ARG  10          2HH1      ARG  10  -5.877  12.645   1.029
   73   HH21  ARG  10          1HH2      ARG  10  -4.621  13.604  -2.017
   74   HH22  ARG  10          2HH2      ARG  10  -5.947  13.707  -0.912
   75    H    ALA  11           H        ALA  11  -3.092   6.602  -1.794
   76    HA   ALA  11           HA       ALA  11  -0.979   6.185  -3.711
   77    HB1  ALA  11           3HB      ALA  11  -2.933   4.705  -3.627
   78    HB2  ALA  11           1HB      ALA  11  -2.753   5.458  -5.212
   79    HB3  ALA  11           2HB      ALA  11  -3.973   6.055  -4.085
   80    H    LEU  12           H        LEU  12  -0.280   7.560  -5.246
   81    HA   LEU  12           HA       LEU  12  -1.249  10.280  -5.193
   82    HB2  LEU  12           2HB      LEU  12   0.930   9.050  -6.885
   83    HB3  LEU  12           1HB      LEU  12   0.644  10.766  -6.653
   84    HG   LEU  12           HG       LEU  12   1.565   8.797  -4.547
   85   HD11  LEU  12          1HD1      LEU  12   3.618  10.140  -4.544
   86   HD12  LEU  12          2HD1      LEU  12   2.974  11.125  -5.858
   87   HD13  LEU  12          3HD1      LEU  12   3.315   9.414  -6.122
   88   HD21  LEU  12          3HD2      LEU  12   0.082  10.427  -3.535
   89   HD22  LEU  12          1HD2      LEU  12   0.964  11.748  -4.303
   90   HD23  LEU  12          2HD2      LEU  12   1.749  10.762  -3.069
   91    H    TYR  13           H        TYR  13  -0.998   7.755  -7.716
   92    HA   TYR  13           HA       TYR  13  -2.930   9.289  -9.353
   93    HB2  TYR  13           2HB      TYR  13  -0.662   7.599 -10.444
   94    HB3  TYR  13           1HB      TYR  13  -1.761   8.613 -11.368
   95    HD1  TYR  13           HD1      TYR  13  -1.696  11.171 -10.832
   96    HD2  TYR  13           HD2      TYR  13   1.399   8.442  -9.777
   97    HE1  TYR  13           HE1      TYR  13  -0.109  13.041 -10.659
   98    HE2  TYR  13           HE2      TYR  13   2.989  10.306  -9.597
   99    HH   TYR  13           HH       TYR  13   2.074  13.503  -9.430
  100    HA   PRO  14           HA       PRO  14  -5.202   5.441  -9.765
  101    HB2  PRO  14           2HB      PRO  14  -6.219   5.582 -12.271
  102    HB3  PRO  14           1HB      PRO  14  -6.791   6.610 -10.950
  103    HG2  PRO  14           2HG      PRO  14  -4.851   7.253 -13.147
  104    HG3  PRO  14           1HG      PRO  14  -6.185   8.232 -12.510
  105    HD2  PRO  14           2HD      PRO  14  -3.588   8.623 -11.789
  106    HD3  PRO  14           1HD      PRO  14  -4.951   8.966 -10.704
  107    H    PHE  15           H        PHE  15  -4.253   3.496  -9.886
  108    HA   PHE  15           HA       PHE  15  -2.803   2.749 -12.354
  109    HB2  PHE  15           2HB      PHE  15  -2.086   1.987  -9.508
  110    HB3  PHE  15           1HB      PHE  15  -1.309   1.336 -10.948
  111    HD1  PHE  15           HD2      PHE  15   0.047   2.829 -12.402
  112    HD2  PHE  15           HD1      PHE  15  -1.500   4.128  -8.652
  113    HE1  PHE  15           HE2      PHE  15   1.617   4.719 -12.411
  114    HE2  PHE  15           HE1      PHE  15   0.072   6.021  -8.660
  115    HZ   PHE  15           HZ       PHE  15   1.632   6.318 -10.540
  116    H    ARG  16           H        ARG  16  -3.117   0.678 -13.141
  117    HA   ARG  16           HA       ARG  16  -5.148  -0.977 -11.769
  118    HB2  ARG  16           2HB      ARG  16  -4.965  -0.318 -14.708
  119    HB3  ARG  16           1HB      ARG  16  -5.914  -1.659 -14.087
  120    HG2  ARG  16           2HG      ARG  16  -6.862   0.397 -12.574
  121    HG3  ARG  16           1HG      ARG  16  -6.484   1.223 -14.089
  122    HD2  ARG  16           2HD      ARG  16  -8.767   0.434 -14.169
  123    HD3  ARG  16           1HD      ARG  16  -7.797  -0.503 -15.306
  124    HE   ARG  16           HE       ARG  16  -8.760  -1.457 -12.690
  125   HH11  ARG  16          1HH1      ARG  16  -7.549  -2.133 -15.852
  126   HH12  ARG  16          2HH1      ARG  16  -7.779  -3.836 -15.681
  127   HH21  ARG  16          1HH2      ARG  16  -9.021  -3.626 -12.481
  128   HH22  ARG  16          2HH2      ARG  16  -8.598  -4.672 -13.793
  129    H    ARG  17           H        ARG  17  -5.104  -3.249 -12.217
  130    HA   ARG  17           HA       ARG  17  -2.574  -4.246 -13.373
  131    HB2  ARG  17           2HB      ARG  17  -3.218  -5.071 -11.102
  132    HB3  ARG  17           1HB      ARG  17  -4.671  -5.773 -11.804
  133    HG2  ARG  17           2HG      ARG  17  -3.095  -7.527 -11.592
  134    HG3  ARG  17           1HG      ARG  17  -3.178  -7.127 -13.307
  135    HD2  ARG  17           2HD      ARG  17  -0.877  -7.390 -12.811
  136    HD3  ARG  17           1HD      ARG  17  -1.148  -5.651 -12.928
  137    HE   ARG  17           HE       ARG  17  -1.156  -6.985 -10.316
  138   HH11  ARG  17          1HH1      ARG  17   0.236  -4.669 -12.454
  139   HH12  ARG  17          2HH1      ARG  17   1.182  -3.938 -11.207
  140   HH21  ARG  17          1HH2      ARG  17   0.028  -6.056  -8.740
  141   HH22  ARG  17          2HH2      ARG  17   1.078  -4.729  -9.119
  142    H    GLU  18           H        GLU  18  -2.615  -5.810 -15.042
  143    HA   GLU  18           HA       GLU  18  -4.547  -5.547 -17.036
  144    HB2  GLU  18           2HB      GLU  18  -2.520  -7.738 -16.546
  145    HB3  GLU  18           1HB      GLU  18  -3.524  -7.672 -17.987
  146    HG2  GLU  18           2HG      GLU  18  -1.325  -6.771 -18.441
  147    HG3  GLU  18           1HG      GLU  18  -2.542  -5.504 -18.576
  148    H    ARG  19           H        ARG  19  -4.288  -7.953 -14.459
  149    HA   ARG  19           HA       ARG  19  -6.968  -8.971 -15.189
  150    HB2  ARG  19           2HB      ARG  19  -4.780 -10.382 -13.635
  151    HB3  ARG  19           1HB      ARG  19  -6.338 -11.068 -14.086
  152    HG2  ARG  19           2HG      ARG  19  -5.765 -10.980 -16.424
  153    HG3  ARG  19           1HG      ARG  19  -4.266 -10.121 -16.065
  154    HD2  ARG  19           2HD      ARG  19  -3.527 -12.117 -14.749
  155    HD3  ARG  19           1HD      ARG  19  -4.966 -12.964 -15.325
  156    HE   ARG  19           HE       ARG  19  -3.711 -12.035 -17.587
  157   HH11  ARG  19          1HH1      ARG  19  -2.885 -14.124 -14.981
  158   HH12  ARG  19          2HH1      ARG  19  -1.779 -15.050 -15.929
  159   HH21  ARG  19          1HH2      ARG  19  -2.259 -13.193 -18.787
  160   HH22  ARG  19          2HH2      ARG  19  -1.423 -14.528 -18.065
  161    HA   PRO  20           HA       PRO  20  -8.589  -7.184 -11.537
  162    HB2  PRO  20           2HB      PRO  20 -10.645  -8.866 -10.939
  163    HB3  PRO  20           1HB      PRO  20 -10.658  -7.775 -12.329
  164    HG2  PRO  20           2HG      PRO  20  -9.975 -10.697 -12.229
  165    HG3  PRO  20           1HG      PRO  20 -11.011  -9.831 -13.381
  166    HD2  PRO  20           2HD      PRO  20  -8.465 -10.488 -13.972
  167    HD3  PRO  20           1HD      PRO  20  -9.203  -8.984 -14.563
  168    H    GLU  21           H        GLU  21  -6.701  -9.836 -11.210
  169    HA   GLU  21           HA       GLU  21  -7.395 -10.962  -8.725
  170    HB2  GLU  21           2HB      GLU  21  -5.825 -11.987 -10.331
  171    HB3  GLU  21           1HB      GLU  21  -4.655 -10.721  -9.995
  172    HG2  GLU  21           2HG      GLU  21  -4.031 -12.705  -8.806
  173    HG3  GLU  21           1HG      GLU  21  -4.552 -11.484  -7.645
  174    H    ASP  22           H        ASP  22  -5.345  -8.185  -9.515
  175    HA   ASP  22           HA       ASP  22  -4.407  -7.858  -6.799
  176    HB2  ASP  22           2HB      ASP  22  -4.047  -6.182  -9.292
  177    HB3  ASP  22           1HB      ASP  22  -3.271  -5.836  -7.749
  178    H    LEU  23           H        LEU  23  -4.335  -5.075  -6.556
  179    HA   LEU  23           HA       LEU  23  -7.176  -4.316  -6.260
  180    HB2  LEU  23           2HB      LEU  23  -6.148  -4.920  -4.104
  181    HB3  LEU  23           1HB      LEU  23  -4.880  -3.741  -4.373
  182    HG   LEU  23           HG       LEU  23  -6.582  -1.929  -4.296
  183   HD11  LEU  23          1HD1      LEU  23  -8.828  -2.420  -3.462
  184   HD12  LEU  23          2HD1      LEU  23  -8.478  -4.148  -3.516
  185   HD13  LEU  23          3HD1      LEU  23  -8.533  -3.211  -5.010
  186   HD21  LEU  23          3HD2      LEU  23  -6.516  -3.738  -1.875
  187   HD22  LEU  23          1HD2      LEU  23  -6.960  -2.030  -1.876
  188   HD23  LEU  23          2HD2      LEU  23  -5.317  -2.514  -2.295
  189    H    GLU  24           H        GLU  24  -7.664  -2.562  -7.432
  190    HA   GLU  24           HA       GLU  24  -5.767  -0.994  -8.799
  191    HB2  GLU  24           2HB      GLU  24  -8.695  -1.029  -8.510
  192    HB3  GLU  24           1HB      GLU  24  -8.035   0.565  -8.832
  193    HG2  GLU  24           2HG      GLU  24  -8.630  -0.427 -10.906
  194    HG3  GLU  24           1HG      GLU  24  -6.873  -0.365 -10.815
  195    H    LEU  25           H        LEU  25  -5.266   1.205  -8.654
  196    HA   LEU  25           HA       LEU  25  -5.591   2.442  -5.988
  197    HB2  LEU  25           2HB      LEU  25  -3.375   2.807  -8.021
  198    HB3  LEU  25           1HB      LEU  25  -3.524   3.731  -6.538
  199    HG   LEU  25           HG       LEU  25  -3.049   0.747  -6.716
  200   HD11  LEU  25          1HD1      LEU  25  -1.100   2.069  -7.373
  201   HD12  LEU  25          2HD1      LEU  25  -0.835   1.256  -5.830
  202   HD13  LEU  25          3HD1      LEU  25  -1.203   2.982  -5.866
  203   HD21  LEU  25          3HD2      LEU  25  -3.200   2.560  -4.301
  204   HD22  LEU  25          1HD2      LEU  25  -2.753   0.853  -4.288
  205   HD23  LEU  25          2HD2      LEU  25  -4.384   1.332  -4.754
  206    H    LEU  26           H        LEU  26  -6.452   4.475  -5.877
  207    HA   LEU  26           HA       LEU  26  -6.917   5.938  -8.402
  208    HB2  LEU  26           2HB      LEU  26  -8.692   5.651  -5.981
  209    HB3  LEU  26           1HB      LEU  26  -8.878   6.995  -7.087
  210    HG   LEU  26           HG       LEU  26 -10.511   5.325  -7.627
  211   HD11  LEU  26          1HD1      LEU  26 -10.033   4.923  -9.957
  212   HD12  LEU  26          2HD1      LEU  26  -8.313   5.203  -9.688
  213   HD13  LEU  26          3HD1      LEU  26  -9.463   6.529  -9.500
  214   HD21  LEU  26          3HD2      LEU  26  -9.985   3.049  -8.235
  215   HD22  LEU  26          1HD2      LEU  26  -9.368   3.384  -6.617
  216   HD23  LEU  26          2HD2      LEU  26  -8.264   3.343  -7.992
  217    HA   PRO  27           HA       PRO  27  -4.606   9.302  -6.763
  218    HB2  PRO  27           2HB      PRO  27  -5.944  11.496  -7.687
  219    HB3  PRO  27           1HB      PRO  27  -4.969  10.447  -8.723
  220    HG2  PRO  27           2HG      PRO  27  -7.941  10.467  -8.312
  221    HG3  PRO  27           1HG      PRO  27  -7.018  10.325  -9.822
  222    HD2  PRO  27           2HD      PRO  27  -8.102   8.176  -8.590
  223    HD3  PRO  27           1HD      PRO  27  -6.572   8.077  -9.486
  224    H    GLY  28           H        GLY  28  -4.560   9.667  -4.627
  225    HA2  GLY  28           2HA      GLY  28  -5.059  10.958  -2.726
  226    HA3  GLY  28           1HA      GLY  28  -6.617  11.365  -3.427
  227    H    ASP  29           H        ASP  29  -5.707   8.032  -3.403
  228    HA   ASP  29           HA       ASP  29  -7.771   7.435  -1.439
  229    HB2  ASP  29           2HB      ASP  29  -6.142   5.765  -3.341
  230    HB3  ASP  29           1HB      ASP  29  -7.076   5.013  -2.050
  231    H    VAL  30           H        VAL  30  -7.449   6.738   0.596
  232    HA   VAL  30           HA       VAL  30  -4.703   6.450   1.591
  233    HB   VAL  30           HB       VAL  30  -7.310   6.467   3.144
  234   HG11  VAL  30          1HG1      VAL  30  -5.500   5.316   4.322
  235   HG12  VAL  30          2HG1      VAL  30  -5.892   6.844   5.107
  236   HG13  VAL  30          3HG1      VAL  30  -4.449   6.717   4.100
  237   HG21  VAL  30          3HG2      VAL  30  -5.315   8.707   2.733
  238   HG22  VAL  30          1HG2      VAL  30  -6.758   8.771   3.746
  239   HG23  VAL  30          2HG2      VAL  30  -6.916   8.607   1.998
  240    H    LEU  31           H        LEU  31  -3.808   4.487   1.932
  241    HA   LEU  31           HA       LEU  31  -5.594   2.143   2.111
  242    HB2  LEU  31           2HB      LEU  31  -2.885   2.295   0.780
  243    HB3  LEU  31           1HB      LEU  31  -3.787   0.815   1.038
  244    HG   LEU  31           HG       LEU  31  -5.655   1.995  -0.356
  245   HD11  LEU  31          1HD1      LEU  31  -3.241   3.562  -1.269
  246   HD12  LEU  31          2HD1      LEU  31  -4.636   4.212  -0.408
  247   HD13  LEU  31          3HD1      LEU  31  -4.830   3.560  -2.033
  248   HD21  LEU  31          3HD2      LEU  31  -4.467   0.001  -1.073
  249   HD22  LEU  31          1HD2      LEU  31  -3.112   0.982  -1.632
  250   HD23  LEU  31          2HD2      LEU  31  -4.682   1.111  -2.426
  251    H    VAL  32           H        VAL  32  -5.400   0.925   3.872
  252    HA   VAL  32           HA       VAL  32  -3.159   1.425   5.706
  253    HB   VAL  32           HB       VAL  32  -5.701  -0.134   6.234
  254   HG11  VAL  32          1HG1      VAL  32  -5.099   0.175   8.605
  255   HG12  VAL  32          2HG1      VAL  32  -3.596   0.955   8.112
  256   HG13  VAL  32          3HG1      VAL  32  -3.877  -0.744   7.726
  257   HG21  VAL  32          3HG2      VAL  32  -6.507   1.853   7.416
  258   HG22  VAL  32          1HG2      VAL  32  -6.213   2.204   5.712
  259   HG23  VAL  32          2HG2      VAL  32  -5.058   2.736   6.933
  260    H    VAL  33           H        VAL  33  -1.503   0.019   5.779
  261    HA   VAL  33           HA       VAL  33  -1.965  -2.780   4.929
  262    HB   VAL  33           HB       VAL  33   0.652  -1.256   5.061
  263   HG11  VAL  33          1HG1      VAL  33   0.089  -4.059   4.071
  264   HG12  VAL  33          2HG1      VAL  33   0.990  -3.627   5.526
  265   HG13  VAL  33          3HG1      VAL  33   1.630  -3.212   3.935
  266   HG21  VAL  33          3HG2      VAL  33  -0.781  -0.494   3.230
  267   HG22  VAL  33          1HG2      VAL  33  -0.960  -2.157   2.667
  268   HG23  VAL  33          2HG2      VAL  33   0.619  -1.372   2.612
  269    H    SER  34           H        SER  34  -1.901  -4.328   6.435
  270    HA   SER  34           HA       SER  34  -1.610  -3.794   9.177
  271    HB2  SER  34           2HB      SER  34  -1.483  -6.439   7.699
  272    HB3  SER  34           1HB      SER  34  -1.602  -6.282   9.453
  273    HG   SER  34           HG       SER  34  -3.578  -6.290   7.708
  274    H    ARG  35           H        ARG  35   0.097  -3.725  10.532
  275    HA   ARG  35           HA       ARG  35   2.718  -3.588   9.587
  276    HB2  ARG  35           2HB      ARG  35   3.414  -3.611  11.957
  277    HB3  ARG  35           1HB      ARG  35   2.084  -2.505  11.652
  278    HG2  ARG  35           2HG      ARG  35   0.517  -4.222  12.528
  279    HG3  ARG  35           1HG      ARG  35   1.911  -5.225  12.939
  280    HD2  ARG  35           2HD      ARG  35   1.389  -2.441  13.993
  281    HD3  ARG  35           1HD      ARG  35   1.065  -3.937  14.868
  282    HE   ARG  35           HE       ARG  35   3.742  -4.001  14.149
  283   HH11  ARG  35          1HH1      ARG  35   1.708  -1.964  16.050
  284   HH12  ARG  35          2HH1      ARG  35   2.962  -1.589  17.183
  285   HH21  ARG  35          1HH2      ARG  35   5.342  -3.509  15.606
  286   HH22  ARG  35          2HH2      ARG  35   5.001  -2.449  16.933
  287    H    ALA  36           H        ALA  36   0.912  -6.343  10.827
  288    HA   ALA  36           HA       ALA  36   2.946  -8.230  11.098
  289    HB1  ALA  36           3HB      ALA  36   0.144  -8.661  10.048
  290    HB2  ALA  36           1HB      ALA  36   0.625  -8.642  11.745
  291    HB3  ALA  36           2HB      ALA  36   1.214  -9.916  10.675
  292    H    ALA  37           H        ALA  37   1.240  -7.172   8.165
  293    HA   ALA  37           HA       ALA  37   2.397  -9.008   6.358
  294    HB1  ALA  37           3HB      ALA  37   1.388  -6.215   5.783
  295    HB2  ALA  37           1HB      ALA  37   0.398  -7.676   5.826
  296    HB3  ALA  37           2HB      ALA  37   1.650  -7.494   4.596
  297    H    LEU  38           H        LEU  38   3.349  -5.678   7.219
  298    HA   LEU  38           HA       LEU  38   5.616  -5.386   5.645
  299    HB2  LEU  38           2HB      LEU  38   5.146  -4.424   8.477
  300    HB3  LEU  38           1HB      LEU  38   6.424  -3.836   7.429
  301    HG   LEU  38           HG       LEU  38   3.478  -3.575   6.785
  302   HD11  LEU  38          1HD1      LEU  38   3.986  -2.315   8.804
  303   HD12  LEU  38          2HD1      LEU  38   3.702  -1.229   7.444
  304   HD13  LEU  38          3HD1      LEU  38   5.349  -1.539   7.996
  305   HD21  LEU  38          3HD2      LEU  38   5.918  -2.247   5.596
  306   HD22  LEU  38          1HD2      LEU  38   4.243  -1.949   5.133
  307   HD23  LEU  38          2HD2      LEU  38   4.969  -3.528   4.839
  308    H    GLN  39           H        GLN  39   5.348  -6.825   8.882
  309    HA   GLN  39           HA       GLN  39   8.028  -7.544   9.270
  310    HB2  GLN  39           2HB      GLN  39   5.534  -8.960  10.255
  311    HB3  GLN  39           1HB      GLN  39   7.156  -9.199  10.892
  312    HG2  GLN  39           2HG      GLN  39   7.227  -6.901  11.663
  313    HG3  GLN  39           1HG      GLN  39   5.640  -6.596  10.957
  314   HE21  GLN  39          1HE2      GLN  39   4.786  -6.018  12.953
  315   HE22  GLN  39          2HE2      GLN  39   4.437  -7.184  14.180
  316    H    ALA  40           H        ALA  40   5.356  -9.513   7.963
  317    HA   ALA  40           HA       ALA  40   6.842 -11.839   7.458
  318    HB1  ALA  40           3HB      ALA  40   4.391 -11.780   7.533
  319    HB2  ALA  40           1HB      ALA  40   4.981 -12.531   6.051
  320    HB3  ALA  40           2HB      ALA  40   4.368 -10.877   6.018
  321    H    LEU  41           H        LEU  41   6.087  -9.107   5.290
  322    HA   LEU  41           HA       LEU  41   7.296 -10.147   2.964
  323    HB2  LEU  41           2HB      LEU  41   6.897  -7.272   3.815
  324    HB3  LEU  41           1HB      LEU  41   7.383  -7.771   2.204
  325    HG   LEU  41           HG       LEU  41   4.756  -8.488   3.524
  326   HD11  LEU  41          1HD1      LEU  41   3.754  -6.936   1.923
  327   HD12  LEU  41          2HD1      LEU  41   5.358  -6.490   1.340
  328   HD13  LEU  41          3HD1      LEU  41   4.881  -6.110   2.996
  329   HD21  LEU  41          3HD2      LEU  41   5.506 -10.193   1.941
  330   HD22  LEU  41          1HD2      LEU  41   5.732  -8.956   0.704
  331   HD23  LEU  41          2HD2      LEU  41   4.115  -9.313   1.311
  332    H    GLY  42           H        GLY  42   8.659  -8.564   5.759
  333    HA2  GLY  42           2HA      GLY  42  10.949  -8.846   6.357
  334    HA3  GLY  42           1HA      GLY  42  11.354  -9.015   4.658
  335    H    VAL  43           H        VAL  43   9.249  -6.427   5.661
  336    HA   VAL  43           HA       VAL  43  10.986  -4.437   4.600
  337    HB   VAL  43           HB       VAL  43   8.539  -4.072   6.350
  338   HG11  VAL  43          1HG1      VAL  43   8.445  -1.807   5.379
  339   HG12  VAL  43          2HG1      VAL  43   9.974  -2.109   4.553
  340   HG13  VAL  43          3HG1      VAL  43   9.917  -2.065   6.316
  341   HG21  VAL  43          3HG2      VAL  43   7.333  -3.700   4.236
  342   HG22  VAL  43          1HG2      VAL  43   8.009  -5.328   4.331
  343   HG23  VAL  43          2HG2      VAL  43   8.798  -4.102   3.338
  344    H    ALA  44           H        ALA  44  12.822  -3.859   5.571
  345    HA   ALA  44           HA       ALA  44  13.279  -4.177   8.387
  346    HB1  ALA  44           3HB      ALA  44  14.983  -2.831   6.290
  347    HB2  ALA  44           1HB      ALA  44  15.053  -4.533   6.744
  348    HB3  ALA  44           2HB      ALA  44  15.505  -3.291   7.912
  349    H    GLU  45           H        GLU  45  13.681  -2.560   9.953
  350    HA   GLU  45           HA       GLU  45  12.096  -0.293   9.991
  351    HB2  GLU  45           2HB      GLU  45  13.117  -1.222  12.006
  352    HB3  GLU  45           1HB      GLU  45  14.713  -0.738  11.448
  353    HG2  GLU  45           2HG      GLU  45  14.183   1.582  11.694
  354    HG3  GLU  45           1HG      GLU  45  12.484   1.221  11.991
  355    H    GLY  46           H        GLY  46  12.237   1.757   9.211
  356    HA2  GLY  46           2HA      GLY  46  13.458   3.612   8.243
  357    HA3  GLY  46           1HA      GLY  46  14.667   2.468   7.674
  358    H    GLY  47           H        GLY  47  13.109   0.510   6.525
  359    HA2  GLY  47           2HA      GLY  47  12.340   1.579   4.019
  360    HA3  GLY  47           1HA      GLY  47  11.998  -0.047   4.592
  361    H    GLU  48           H        GLU  48  10.600   1.165   6.975
  362    HA   GLU  48           HA       GLU  48   7.940   1.158   6.266
  363    HB2  GLU  48           2HB      GLU  48   8.763   1.113   8.583
  364    HB3  GLU  48           1HB      GLU  48   9.284   2.784   8.444
  365    HG2  GLU  48           2HG      GLU  48   7.287   2.926   9.620
  366    HG3  GLU  48           1HG      GLU  48   6.814   3.315   7.968
  367    H    ARG  49           H        ARG  49  10.151   3.926   6.383
  368    HA   ARG  49           HA       ARG  49   8.152   5.844   5.605
  369    HB2  ARG  49           2HB      ARG  49  11.167   6.095   5.725
  370    HB3  ARG  49           1HB      ARG  49  10.040   7.430   5.515
  371    HG2  ARG  49           2HG      ARG  49  10.234   5.642   7.941
  372    HG3  ARG  49           1HG      ARG  49  10.846   7.291   7.809
  373    HD2  ARG  49           2HD      ARG  49   7.953   6.418   7.676
  374    HD3  ARG  49           1HD      ARG  49   8.730   7.305   8.985
  375    HE   ARG  49           HE       ARG  49   8.365   8.409   6.275
  376   HH11  ARG  49          1HH1      ARG  49   8.342   8.766   9.694
  377   HH12  ARG  49          2HH1      ARG  49   7.912  10.442   9.622
  378   HH21  ARG  49          1HH2      ARG  49   7.797  10.549   6.193
  379   HH22  ARG  49          2HH2      ARG  49   7.613  11.435   7.672
  380    H    CYS  50           H        CYS  50   9.736   3.503   3.858
  381    HA   CYS  50           HA       CYS  50   9.437   5.035   1.369
  382    HB2  CYS  50           2HB      CYS  50  11.851   3.379   2.119
  383    HB3  CYS  50           1HB      CYS  50  11.527   3.963   0.490
  384    HG   CYS  50           HG       CYS  50  13.466   5.406   2.298
  385    HA   PRO  51           HA       PRO  51   7.357   0.846   0.814
  386    HB2  PRO  51           2HB      PRO  51   5.187   2.049  -0.426
  387    HB3  PRO  51           1HB      PRO  51   5.229   1.581   1.276
  388    HG2  PRO  51           2HG      PRO  51   5.707   4.268   0.039
  389    HG3  PRO  51           1HG      PRO  51   4.808   3.856   1.513
  390    HD2  PRO  51           2HD      PRO  51   7.291   4.857   1.637
  391    HD3  PRO  51           1HD      PRO  51   6.748   3.607   2.778
  392    H    GLN  52           H        GLN  52   8.016   3.785  -0.927
  393    HA   GLN  52           HA       GLN  52   7.981   3.009  -3.578
  394    HB2  GLN  52           2HB      GLN  52   9.677   4.782  -3.917
  395    HB3  GLN  52           1HB      GLN  52   8.351   5.303  -2.885
  396    HG2  GLN  52           2HG      GLN  52   9.868   4.705  -0.917
  397    HG3  GLN  52           1HG      GLN  52  11.174   4.613  -2.095
  398   HE21  GLN  52          1HE2      GLN  52  10.885   6.433   0.142
  399   HE22  GLN  52          2HE2      GLN  52  10.880   8.027  -0.518
  400    H    SER  53           H        SER  53  10.233   2.082  -1.081
  401    HA   SER  53           HA       SER  53  12.174   0.982  -2.964
  402    HB2  SER  53           2HB      SER  53  13.037   2.036  -0.935
  403    HB3  SER  53           1HB      SER  53  12.099   0.932   0.069
  404    HG   SER  53           HG       SER  53  13.440  -0.701  -0.425
  405    H    VAL  54           H        VAL  54   9.609  -0.145  -0.847
  406    HA   VAL  54           HA       VAL  54  10.373  -2.880  -0.769
  407    HB   VAL  54           HB       VAL  54   7.618  -1.691  -0.357
  408   HG11  VAL  54          1HG1      VAL  54   8.757  -4.355   0.513
  409   HG12  VAL  54          2HG1      VAL  54   7.530  -4.100  -0.729
  410   HG13  VAL  54          3HG1      VAL  54   7.171  -3.723   0.956
  411   HG21  VAL  54          3HG2      VAL  54   8.175  -1.733   2.042
  412   HG22  VAL  54          1HG2      VAL  54   9.256  -0.671   1.139
  413   HG23  VAL  54          2HG2      VAL  54   9.810  -2.265   1.650
  414    H    GLY  55           H        GLY  55   7.678  -1.333  -2.590
  415    HA2  GLY  55           2HA      GLY  55   7.596  -1.902  -5.025
  416    HA3  GLY  55           1HA      GLY  55   7.878  -3.563  -4.542
  417    H    TRP  56           H        TRP  56   6.111  -4.821  -4.493
  418    HA   TRP  56           HA       TRP  56   3.457  -3.529  -4.393
  419    HB2  TRP  56           2HB      TRP  56   4.236  -6.299  -5.351
  420    HB3  TRP  56           1HB      TRP  56   2.605  -5.641  -5.372
  421    HD1  TRP  56           HD1      TRP  56   4.624  -2.823  -6.388
  422    HE1  TRP  56           HE1      TRP  56   4.780  -2.621  -8.947
  423    HE3  TRP  56           HE3      TRP  56   2.959  -7.486  -7.664
  424    HZ2  TRP  56           HZ2      TRP  56   4.262  -4.228 -11.207
  425    HZ3  TRP  56           HZ3      TRP  56   2.821  -8.072 -10.050
  426    HH2  TRP  56           HH2      TRP  56   3.458  -6.479 -11.784
  427    H    MET  57           H        MET  57   2.111  -3.830  -2.686
  428    HA   MET  57           HA       MET  57   2.687  -6.013  -0.784
  429    HB2  MET  57           2HB      MET  57   2.155  -3.136   0.005
  430    HB3  MET  57           1HB      MET  57   2.392  -4.480   1.113
  431    HG2  MET  57           2HG      MET  57   4.689  -4.748   0.188
  432    HG3  MET  57           1HG      MET  57   4.427  -3.279  -0.750
  433    HE1  MET  57           3HE      MET  57   2.650  -1.585   1.412
  434    HE2  MET  57           1HE      MET  57   3.908  -0.900   0.382
  435    HE3  MET  57           2HE      MET  57   3.943  -0.620   2.123
  436    HA   PRO  58           HA       PRO  58  -1.815  -6.277  -0.703
  437    HB2  PRO  58           2HB      PRO  58  -2.136  -8.018   1.315
  438    HB3  PRO  58           1HB      PRO  58  -1.416  -8.513  -0.221
  439    HG2  PRO  58           2HG      PRO  58  -0.073  -7.850   2.372
  440    HG3  PRO  58           1HG      PRO  58   0.280  -9.161   1.232
  441    HD2  PRO  58           2HD      PRO  58   1.680  -6.778   1.358
  442    HD3  PRO  58           1HD      PRO  58   1.599  -7.820  -0.077
  443    H    GLY  59           H        GLY  59  -3.203  -4.770   0.086
  444    HA2  GLY  59           2HA      GLY  59  -3.252  -4.154   2.939
  445    HA3  GLY  59           1HA      GLY  59  -2.805  -2.826   1.883
  446    H    LEU  60           H        LEU  60  -4.766  -2.022   3.121
  447    HA   LEU  60           HA       LEU  60  -7.321  -2.866   1.915
  448    HB2  LEU  60           2HB      LEU  60  -7.391  -3.065   4.275
  449    HB3  LEU  60           1HB      LEU  60  -6.603  -1.517   4.510
  450    HG   LEU  60           HG       LEU  60  -8.646  -0.375   3.671
  451   HD11  LEU  60          1HD1      LEU  60 -10.729  -1.619   3.452
  452   HD12  LEU  60          2HD1      LEU  60  -9.864  -3.135   3.705
  453   HD13  LEU  60          3HD1      LEU  60  -9.536  -2.160   2.272
  454   HD21  LEU  60          3HD2      LEU  60  -9.118  -2.240   6.001
  455   HD22  LEU  60          1HD2      LEU  60  -9.998  -0.747   5.667
  456   HD23  LEU  60          2HD2      LEU  60  -8.284  -0.688   6.072
  457    H    ASN  61           H        ASN  61  -7.950  -1.602   0.239
  458    HA   ASN  61           HA       ASN  61  -7.293   1.224   0.101
  459    HB2  ASN  61           2HB      ASN  61  -7.369  -0.018  -1.980
  460    HB3  ASN  61           1HB      ASN  61  -9.016  -0.548  -1.656
  461   HD21  ASN  61          1HD2      ASN  61  -7.013   2.101  -2.666
  462   HD22  ASN  61          2HD2      ASN  61  -8.298   3.104  -3.242
  463    H    GLU  62           H        GLU  62  -8.353   2.531   1.527
  464    HA   GLU  62           HA       GLU  62 -10.842   1.817   2.694
  465    HB2  GLU  62           2HB      GLU  62  -9.331   4.430   2.781
  466    HB3  GLU  62           1HB      GLU  62 -10.753   4.075   3.754
  467    HG2  GLU  62           2HG      GLU  62  -9.438   2.062   4.631
  468    HG3  GLU  62           1HG      GLU  62  -8.023   2.826   3.907
  469    H    ARG  63           H        ARG  63 -10.286   3.255  -0.333
  470    HA   ARG  63           HA       ARG  63 -12.715   4.838  -0.351
  471    HB2  ARG  63           2HB      ARG  63 -10.614   5.257  -1.796
  472    HB3  ARG  63           1HB      ARG  63 -11.226   3.971  -2.829
  473    HG2  ARG  63           2HG      ARG  63 -13.377   5.281  -3.003
  474    HG3  ARG  63           1HG      ARG  63 -12.541   6.606  -2.195
  475    HD2  ARG  63           2HD      ARG  63 -12.392   7.070  -4.502
  476    HD3  ARG  63           1HD      ARG  63 -10.807   6.456  -4.040
  477    HE   ARG  63           HE       ARG  63 -11.443   4.330  -5.053
  478   HH11  ARG  63          1HH1      ARG  63 -13.265   7.128  -5.880
  479   HH12  ARG  63          2HH1      ARG  63 -13.877   6.441  -7.344
  480   HH21  ARG  63          1HH2      ARG  63 -12.256   3.439  -6.958
  481   HH22  ARG  63          2HH2      ARG  63 -13.340   4.374  -7.923
  482    H    THR  64           H        THR  64 -11.759   1.597  -1.233
  483    HA   THR  64           HA       THR  64 -14.514   1.011  -2.150
  484    HB   THR  64           HB       THR  64 -13.567  -0.994  -3.244
  485    HG1  THR  64           HG1      THR  64 -10.953  -0.028  -2.891
  486   HG21  THR  64          3HG2      THR  64 -12.156   1.571  -4.016
  487   HG22  THR  64          1HG2      THR  64 -13.762   1.072  -4.549
  488   HG23  THR  64          2HG2      THR  64 -12.341   0.149  -5.043
  489    H    ARG  65           H        ARG  65 -12.385   0.590   0.426
  490    HA   ARG  65           HA       ARG  65 -12.369  -0.637   2.330
  491    HB2  ARG  65           2HB      ARG  65 -15.179  -1.199   1.410
  492    HB3  ARG  65           1HB      ARG  65 -14.528  -2.009   2.826
  493    HG2  ARG  65           2HG      ARG  65 -15.794  -0.089   3.518
  494    HG3  ARG  65           1HG      ARG  65 -14.088   0.191   3.858
  495    HD2  ARG  65           2HD      ARG  65 -15.099   2.199   2.957
  496    HD3  ARG  65           1HD      ARG  65 -13.923   1.554   1.813
  497    HE   ARG  65           HE       ARG  65 -16.300   0.487   1.007
  498   HH11  ARG  65          1HH1      ARG  65 -15.159   3.686   1.578
  499   HH12  ARG  65          2HH1      ARG  65 -16.228   4.389   0.415
  500   HH21  ARG  65          1HH2      ARG  65 -17.661   1.404  -0.491
  501   HH22  ARG  65          2HH2      ARG  65 -17.619   3.115  -0.740
  502    H    GLN  66           H        GLN  66 -11.727  -1.841  -0.452
  503    HA   GLN  66           HA       GLN  66 -12.009  -4.696   0.150
  504    HB2  GLN  66           2HB      GLN  66 -10.957  -3.399  -2.376
  505    HB3  GLN  66           1HB      GLN  66 -11.378  -5.095  -2.158
  506    HG2  GLN  66           2HG      GLN  66 -13.249  -2.737  -2.156
  507    HG3  GLN  66           1HG      GLN  66 -13.125  -3.998  -3.379
  508   HE21  GLN  66          1HE2      GLN  66 -15.385  -3.105  -1.750
  509   HE22  GLN  66          2HE2      GLN  66 -15.958  -4.509  -0.925
  510    H    ARG  67           H        ARG  67 -10.297  -6.106   0.310
  511    HA   ARG  67           HA       ARG  67  -7.652  -4.890   0.786
  512    HB2  ARG  67           2HB      ARG  67  -8.833  -7.509   1.750
  513    HB3  ARG  67           1HB      ARG  67  -7.150  -7.061   1.979
  514    HG2  ARG  67           2HG      ARG  67  -8.249  -6.587   4.008
  515    HG3  ARG  67           1HG      ARG  67  -7.972  -5.030   3.228
  516    HD2  ARG  67           2HD      ARG  67 -10.196  -5.081   4.174
  517    HD3  ARG  67           1HD      ARG  67 -10.306  -5.053   2.415
  518    HE   ARG  67           HE       ARG  67 -10.375  -7.718   3.345
  519   HH11  ARG  67          1HH1      ARG  67 -12.337  -4.875   3.153
  520   HH12  ARG  67          2HH1      ARG  67 -13.814  -5.768   3.237
  521   HH21  ARG  67          1HH2      ARG  67 -12.287  -8.834   3.437
  522   HH22  ARG  67          2HH2      ARG  67 -13.785  -7.974   3.401
  523    H    GLY  68           H        GLY  68  -5.962  -5.381  -0.525
  524    HA2  GLY  68           2HA      GLY  68  -5.751  -7.845  -1.962
  525    HA3  GLY  68           1HA      GLY  68  -6.288  -6.546  -3.015
  526    H    ASP  69           H        ASP  69  -4.135  -7.408  -3.970
  527    HA   ASP  69           HA       ASP  69  -1.747  -6.307  -2.717
  528    HB2  ASP  69           2HB      ASP  69  -2.055  -7.791  -5.343
  529    HB3  ASP  69           1HB      ASP  69  -0.537  -7.425  -4.526
  530    H    PHE  70           H        PHE  70  -1.189  -4.238  -3.071
  531    HA   PHE  70           HA       PHE  70  -1.778  -3.060  -5.719
  532    HB2  PHE  70           2HB      PHE  70  -2.171  -0.915  -4.684
  533    HB3  PHE  70           1HB      PHE  70  -3.186  -2.109  -3.886
  534    HD1  PHE  70           HD1      PHE  70  -2.593  -2.902  -1.597
  535    HD2  PHE  70           HD2      PHE  70  -0.505   0.292  -3.493
  536    HE1  PHE  70           HE1      PHE  70  -1.686  -2.202   0.578
  537    HE2  PHE  70           HE2      PHE  70   0.400   0.995  -1.316
  538    HZ   PHE  70           HZ       PHE  70  -0.187  -0.253   0.719
  539    HA   PRO  71           HA       PRO  71   2.581  -2.171  -6.039
  540    HB2  PRO  71           2HB      PRO  71   1.882   0.238  -7.593
  541    HB3  PRO  71           1HB      PRO  71   2.770  -1.202  -8.097
  542    HG2  PRO  71           2HG      PRO  71   0.272  -0.704  -8.973
  543    HG3  PRO  71           1HG      PRO  71   0.842  -2.356  -8.665
  544    HD2  PRO  71           2HD      PRO  71  -0.889  -0.596  -6.951
  545    HD3  PRO  71           1HD      PRO  71  -1.054  -2.330  -7.313
  546    H    GLY  72           H        GLY  72   3.008  -1.592  -3.875
  547    HA2  GLY  72           2HA      GLY  72   2.297   0.888  -2.695
  548    HA3  GLY  72           1HA      GLY  72   3.495  -0.238  -2.084
  549    H    THR  73           H        THR  73   4.721   0.205  -4.984
  550    HA   THR  73           HA       THR  73   6.729   2.023  -4.260
  551    HB   THR  73           HB       THR  73   5.874   1.282  -7.074
  552    HG1  THR  73           HG1      THR  73   7.913   0.126  -5.442
  553   HG21  THR  73          3HG2      THR  73   8.207   1.836  -7.680
  554   HG22  THR  73          1HG2      THR  73   8.493   2.391  -6.030
  555   HG23  THR  73          2HG2      THR  73   7.339   3.240  -7.061
  556    H    TYR  74           H        TYR  74   3.581   2.556  -5.661
  557    HA   TYR  74           HA       TYR  74   4.246   5.280  -6.508
  558    HB2  TYR  74           2HB      TYR  74   1.679   3.712  -6.823
  559    HB3  TYR  74           1HB      TYR  74   2.011   5.289  -7.530
  560    HD1  TYR  74           HD2      TYR  74   4.301   5.312  -8.974
  561    HD2  TYR  74           HD1      TYR  74   1.883   1.895  -8.214
  562    HE1  TYR  74           HE2      TYR  74   5.204   4.231 -10.988
  563    HE2  TYR  74           HE1      TYR  74   2.776   0.805 -10.227
  564    HH   TYR  74           HH       TYR  74   5.492   2.007 -11.917
  565    H    VAL  75           H        VAL  75   3.452   4.084  -3.584
  566    HA   VAL  75           HA       VAL  75   1.471   6.197  -2.987
  567    HB   VAL  75           HB       VAL  75   0.768   4.952  -1.047
  568   HG11  VAL  75          1HG1      VAL  75  -0.163   2.946  -2.112
  569   HG12  VAL  75          2HG1      VAL  75   0.955   3.147  -3.461
  570   HG13  VAL  75          3HG1      VAL  75  -0.286   4.363  -3.156
  571   HG21  VAL  75          3HG2      VAL  75   2.922   4.006  -0.371
  572   HG22  VAL  75          1HG2      VAL  75   2.877   2.906  -1.748
  573   HG23  VAL  75          2HG2      VAL  75   1.678   2.760  -0.464
  574    H    GLU  76           H        GLU  76   1.709   7.511  -1.165
  575    HA   GLU  76           HA       GLU  76   4.448   7.747  -0.112
  576    HB2  GLU  76           2HB      GLU  76   3.821  10.012   0.551
  577    HB3  GLU  76           1HB      GLU  76   3.474   9.760  -1.153
  578    HG2  GLU  76           2HG      GLU  76   1.120   9.516  -0.694
  579    HG3  GLU  76           1HG      GLU  76   1.412   9.587   1.043
  580    H    PHE  77           H        PHE  77   4.718   8.215   2.206
  581    HA   PHE  77           HA       PHE  77   2.922   6.549   3.798
  582    HB2  PHE  77           2HB      PHE  77   5.371   6.239   3.958
  583    HB3  PHE  77           1HB      PHE  77   5.539   7.885   4.555
  584    HD1  PHE  77           HD2      PHE  77   3.677   4.738   5.349
  585    HD2  PHE  77           HD1      PHE  77   5.674   8.193   6.846
  586    HE1  PHE  77           HE2      PHE  77   3.384   3.910   7.647
  587    HE2  PHE  77           HE1      PHE  77   5.377   7.373   9.143
  588    HZ   PHE  77           HZ       PHE  77   4.233   5.228   9.548
  589    H    LEU  78           H        LEU  78   1.338   7.361   5.030
  590    HA   LEU  78           HA       LEU  78   1.231  10.240   5.555
  591    HB2  LEU  78           2HB      LEU  78  -0.818   8.074   6.055
  592    HB3  LEU  78           1HB      LEU  78  -1.076   9.788   6.323
  593    HG   LEU  78           HG       LEU  78  -0.592   8.454   3.651
  594   HD11  LEU  78          1HD1      LEU  78  -3.064   9.767   4.790
  595   HD12  LEU  78          2HD1      LEU  78  -2.822   8.036   4.561
  596   HD13  LEU  78          3HD1      LEU  78  -2.894   9.107   3.163
  597   HD21  LEU  78          3HD2      LEU  78  -1.020  10.668   2.678
  598   HD22  LEU  78          1HD2      LEU  78   0.422  10.671   3.694
  599   HD23  LEU  78          2HD2      LEU  78  -1.083  11.367   4.296
  600    H    GLY  79           H        GLY  79   1.118   7.171   7.355
  601    HA2  GLY  79           2HA      GLY  79   2.727   7.545   9.405
  602    HA3  GLY  79           1HA      GLY  79   1.428   8.622   9.888
  603    HA   PRO  80           HA       PRO  80   0.349   4.311  11.350
  604    HB2  PRO  80           2HB      PRO  80   1.087   4.413  13.921
  605    HB3  PRO  80           1HB      PRO  80   2.266   4.057  12.653
  606    HG2  PRO  80           2HG      PRO  80   1.764   6.627  14.103
  607    HG3  PRO  80           1HG      PRO  80   3.308   5.881  13.648
  608    HD2  PRO  80           2HD      PRO  80   2.052   7.911  12.233
  609    HD3  PRO  80           1HD      PRO  80   3.254   6.798  11.551
  610    H    LEU  81           H        LEU  81  -1.194   3.787  13.187
  611    HA   LEU  81           HA       LEU  81  -2.848   6.119  13.932
  612    HB2  LEU  81           2HB      LEU  81  -4.672   4.133  13.999
  613    HB3  LEU  81           1HB      LEU  81  -4.401   5.150  12.599
  614    HG   LEU  81           HG       LEU  81  -2.845   2.598  12.833
  615   HD11  LEU  81          1HD1      LEU  81  -5.708   2.763  11.893
  616   HD12  LEU  81          2HD1      LEU  81  -5.130   1.907  13.324
  617   HD13  LEU  81          3HD1      LEU  81  -4.643   1.367  11.717
  618   HD21  LEU  81          3HD2      LEU  81  -4.034   4.079  10.485
  619   HD22  LEU  81          1HD2      LEU  81  -2.999   2.653  10.404
  620   HD23  LEU  81          2HD2      LEU  81  -2.356   4.174  11.017
  621    H    GLU  82           H        GLU  82  -3.363   6.335  16.028
  622    HA   GLU  82           HA       GLU  82  -2.893   6.204  18.258
  623    HB2  GLU  82           2HB      GLU  82  -4.014   4.196  19.345
  624    HB3  GLU  82           1HB      GLU  82  -5.017   5.214  18.329
  625    HG2  GLU  82           2HG      GLU  82  -5.360   3.589  16.786
  626    HG3  GLU  82           1HG      GLU  82  -3.764   2.880  17.013
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  -7.697  -4.890  21.989
    2    H2   MET   1           2H       MET   1  -7.447  -3.563  23.003
    3    H3   MET   1           3H       MET   1  -6.244  -4.741  22.842
    4    HA   MET   1           HA       MET   1  -5.873  -4.166  20.567
    5    HB2  MET   1           2HB      MET   1  -7.052  -2.220  19.572
    6    HB3  MET   1           1HB      MET   1  -8.134  -3.550  19.948
    7    HG2  MET   1           2HG      MET   1  -8.835  -2.386  22.001
    8    HG3  MET   1           1HG      MET   1  -7.778  -1.041  21.579
    9    HE1  MET   1           3HE      MET   1 -11.015  -3.056  20.637
   10    HE2  MET   1           1HE      MET   1 -10.014  -3.244  19.195
   11    HE3  MET   1           2HE      MET   1 -11.488  -2.278  19.125
   12    H    ALA   2           H        ALA   2  -3.963  -3.120  20.462
   13    HA   ALA   2           HA       ALA   2  -3.532  -0.532  21.640
   14    HB1  ALA   2           3HB      ALA   2  -1.865  -1.176  23.297
   15    HB2  ALA   2           1HB      ALA   2  -2.139  -2.880  22.931
   16    HB3  ALA   2           2HB      ALA   2  -3.423  -1.917  23.661
   17    H    GLY   3           H        GLY   3  -1.501   0.397  21.108
   18    HA2  GLY   3           2HA      GLY   3   0.529   0.612  20.009
   19    HA3  GLY   3           1HA      GLY   3   0.514  -1.115  19.695
   20    HA   PRO   4           HA       PRO   4  -0.263   1.111  15.676
   21    HB2  PRO   4           2HB      PRO   4   1.597  -0.204  14.205
   22    HB3  PRO   4           1HB      PRO   4   1.988   1.210  15.191
   23    HG2  PRO   4           2HG      PRO   4   2.382  -1.698  15.814
   24    HG3  PRO   4           1HG      PRO   4   3.486  -0.335  16.081
   25    HD2  PRO   4           2HD      PRO   4   1.941  -1.401  18.055
   26    HD3  PRO   4           1HD      PRO   4   2.426   0.306  18.024
   27    H    GLU   5           H        GLU   5  -2.293   0.142  15.429
   28    HA   GLU   5           HA       GLU   5  -2.714  -2.614  14.876
   29    HB2  GLU   5           2HB      GLU   5  -4.385  -0.773  15.648
   30    HB3  GLU   5           1HB      GLU   5  -4.537  -0.395  13.941
   31    HG2  GLU   5           2HG      GLU   5  -5.096  -3.108  15.133
   32    HG3  GLU   5           1HG      GLU   5  -6.320  -1.875  14.860
   33    H    GLY   6           H        GLY   6  -2.417   0.249  12.806
   34    HA2  GLY   6           2HA      GLY   6  -1.384  -1.380  10.634
   35    HA3  GLY   6           1HA      GLY   6  -2.924  -0.599  10.307
   36    H    PHE   7           H        PHE   7  -1.093   0.116   8.605
   37    HA   PHE   7           HA       PHE   7  -0.211   2.794   9.483
   38    HB2  PHE   7           2HB      PHE   7   1.251   0.929   7.588
   39    HB3  PHE   7           1HB      PHE   7   1.740   2.574   7.977
   40    HD1  PHE   7           HD1      PHE   7   2.579   3.121  10.235
   41    HD2  PHE   7           HD2      PHE   7   1.686  -0.887   9.091
   42    HE1  PHE   7           HE1      PHE   7   3.864   2.284  12.157
   43    HE2  PHE   7           HE2      PHE   7   2.972  -1.723  11.014
   44    HZ   PHE   7           HZ       PHE   7   4.061  -0.138  12.551
   45    H    GLN   8           H        GLN   8  -0.655   4.478   8.093
   46    HA   GLN   8           HA       GLN   8  -2.497   3.858   5.915
   47    HB2  GLN   8           2HB      GLN   8  -1.795   6.436   7.314
   48    HB3  GLN   8           1HB      GLN   8  -2.855   6.368   5.914
   49    HG2  GLN   8           2HG      GLN   8  -4.402   4.935   7.144
   50    HG3  GLN   8           1HG      GLN   8  -3.328   4.976   8.544
   51   HE21  GLN   8          1HE2      GLN   8  -6.116   5.892   8.252
   52   HE22  GLN   8          2HE2      GLN   8  -6.100   7.549   8.732
   53    H    TYR   9           H        TYR   9  -2.010   3.957   3.852
   54    HA   TYR   9           HA       TYR   9   0.193   5.695   2.921
   55    HB2  TYR   9           2HB      TYR   9  -0.784   3.046   1.828
   56    HB3  TYR   9           1HB      TYR   9   0.201   4.149   0.875
   57    HD1  TYR   9           HD1      TYR   9   0.187   2.042   3.939
   58    HD2  TYR   9           HD2      TYR   9   2.545   4.272   1.178
   59    HE1  TYR   9           HE1      TYR   9   2.232   1.076   4.908
   60    HE2  TYR   9           HE2      TYR   9   4.591   3.312   2.139
   61    HH   TYR   9           HH       TYR   9   5.376   2.262   4.145
   62    H    ARG  10           H        ARG  10  -0.193   6.597   0.694
   63    HA   ARG  10           HA       ARG  10  -3.035   6.803  -0.037
   64    HB2  ARG  10           2HB      ARG  10  -2.695   8.729   1.368
   65    HB3  ARG  10           1HB      ARG  10  -1.220   9.160   0.512
   66    HG2  ARG  10           2HG      ARG  10  -2.491   9.684  -1.490
   67    HG3  ARG  10           1HG      ARG  10  -3.983   9.161  -0.703
   68    HD2  ARG  10           2HD      ARG  10  -2.237  11.428   0.264
   69    HD3  ARG  10           1HD      ARG  10  -3.670  11.630  -0.743
   70    HE   ARG  10           HE       ARG  10  -4.790  10.387   1.242
   71   HH11  ARG  10          1HH1      ARG  10  -2.282  12.736   1.444
   72   HH12  ARG  10          2HH1      ARG  10  -2.813  13.331   2.978
   73   HH21  ARG  10          1HH2      ARG  10  -5.481  11.174   3.211
   74   HH22  ARG  10          2HH2      ARG  10  -4.583  12.433   3.986
   75    H    ALA  11           H        ALA  11  -3.323   6.511  -2.148
   76    HA   ALA  11           HA       ALA  11  -1.099   6.474  -3.980
   77    HB1  ALA  11           3HB      ALA  11  -2.791   5.849  -5.659
   78    HB2  ALA  11           1HB      ALA  11  -4.065   6.144  -4.473
   79    HB3  ALA  11           2HB      ALA  11  -2.892   4.849  -4.210
   80    H    LEU  12           H        LEU  12  -0.385   8.091  -5.217
   81    HA   LEU  12           HA       LEU  12  -1.665  10.675  -5.126
   82    HB2  LEU  12           2HB      LEU  12   0.796   9.733  -6.608
   83    HB3  LEU  12           1HB      LEU  12   0.279  11.405  -6.478
   84    HG   LEU  12           HG       LEU  12   1.116   9.645  -4.160
   85   HD11  LEU  12          1HD1      LEU  12   3.079  11.090  -4.029
   86   HD12  LEU  12          2HD1      LEU  12   2.548  11.957  -5.471
   87   HD13  LEU  12          3HD1      LEU  12   3.001  10.255  -5.581
   88   HD21  LEU  12          3HD2      LEU  12   0.988  11.695  -2.828
   89   HD22  LEU  12          1HD2      LEU  12  -0.583  11.275  -3.510
   90   HD23  LEU  12          2HD2      LEU  12   0.371  12.573  -4.228
   91    H    TYR  13           H        TYR  13  -1.156   8.162  -7.554
   92    HA   TYR  13           HA       TYR  13  -3.136   9.497  -9.280
   93    HB2  TYR  13           2HB      TYR  13  -0.542   8.205 -10.168
   94    HB3  TYR  13           1HB      TYR  13  -1.843   8.649 -11.270
   95    HD1  TYR  13           HD1      TYR  13  -2.380  11.026 -11.662
   96    HD2  TYR  13           HD2      TYR  13   0.935   9.881  -9.242
   97    HE1  TYR  13           HE1      TYR  13  -1.467  13.299 -11.845
   98    HE2  TYR  13           HE2      TYR  13   1.857  12.154  -9.424
   99    HH   TYR  13           HH       TYR  13   1.725  14.095 -10.777
  100    HA   PRO  14           HA       PRO  14  -5.249   5.637  -9.014
  101    HB2  PRO  14           2HB      PRO  14  -6.739   5.719 -11.305
  102    HB3  PRO  14           1HB      PRO  14  -7.110   6.673  -9.864
  103    HG2  PRO  14           2HG      PRO  14  -5.681   7.495 -12.372
  104    HG3  PRO  14           1HG      PRO  14  -6.911   8.378 -11.446
  105    HD2  PRO  14           2HD      PRO  14  -4.271   8.942 -11.240
  106    HD3  PRO  14           1HD      PRO  14  -5.378   9.097  -9.858
  107    H    PHE  15           H        PHE  15  -4.312   3.713  -9.302
  108    HA   PHE  15           HA       PHE  15  -3.498   2.915 -12.025
  109    HB2  PHE  15           2HB      PHE  15  -1.486   3.501 -10.705
  110    HB3  PHE  15           1HB      PHE  15  -1.952   2.320  -9.485
  111    HD1  PHE  15           HD1      PHE  15  -0.776   2.755 -12.955
  112    HD2  PHE  15           HD2      PHE  15  -1.526  -0.013  -9.804
  113    HE1  PHE  15           HE1      PHE  15   0.454   1.019 -14.193
  114    HE2  PHE  15           HE2      PHE  15  -0.298  -1.751 -11.035
  115    HZ   PHE  15           HZ       PHE  15   0.693  -1.239 -13.231
  116    H    ARG  16           H        ARG  16  -4.510   1.110 -12.665
  117    HA   ARG  16           HA       ARG  16  -5.683  -0.648 -10.618
  118    HB2  ARG  16           2HB      ARG  16  -6.307  -0.421 -13.563
  119    HB3  ARG  16           1HB      ARG  16  -7.080  -1.544 -12.458
  120    HG2  ARG  16           2HG      ARG  16  -7.939   0.391 -11.159
  121    HG3  ARG  16           1HG      ARG  16  -7.253   1.468 -12.378
  122    HD2  ARG  16           2HD      ARG  16  -9.638   1.071 -12.778
  123    HD3  ARG  16           1HD      ARG  16  -8.649   0.436 -14.096
  124    HE   ARG  16           HE       ARG  16  -9.424  -1.427 -11.999
  125   HH11  ARG  16          1HH1      ARG  16 -10.011  -0.232 -15.173
  126   HH12  ARG  16          2HH1      ARG  16 -10.887  -1.643 -15.655
  127   HH21  ARG  16          1HH2      ARG  16 -10.560  -3.197 -12.596
  128   HH22  ARG  16          2HH2      ARG  16 -11.212  -3.307 -14.195
  129    H    ARG  17           H        ARG  17  -3.940  -1.973 -10.106
  130    HA   ARG  17           HA       ARG  17  -3.092  -4.082 -10.121
  131    HB2  ARG  17           2HB      ARG  17  -4.906  -4.258 -12.512
  132    HB3  ARG  17           1HB      ARG  17  -3.976  -5.636 -11.947
  133    HG2  ARG  17           2HG      ARG  17  -5.172  -5.760  -9.925
  134    HG3  ARG  17           1HG      ARG  17  -5.852  -4.143 -10.133
  135    HD2  ARG  17           2HD      ARG  17  -7.308  -6.268 -10.628
  136    HD3  ARG  17           1HD      ARG  17  -7.420  -4.848 -11.669
  137    HE   ARG  17           HE       ARG  17  -5.458  -6.629 -12.658
  138   HH11  ARG  17          1HH1      ARG  17  -8.884  -6.360 -12.343
  139   HH12  ARG  17          2HH1      ARG  17  -9.185  -7.221 -13.812
  140   HH21  ARG  17          1HH2      ARG  17  -5.857  -7.712 -14.530
  141   HH22  ARG  17          2HH2      ARG  17  -7.493  -7.996 -15.027
  142    H    GLU  18           H        GLU  18  -1.146  -4.923 -10.634
  143    HA   GLU  18           HA       GLU  18  -0.138  -4.670 -13.396
  144    HB2  GLU  18           2HB      GLU  18   1.227  -5.604 -10.853
  145    HB3  GLU  18           1HB      GLU  18   1.973  -5.648 -12.443
  146    HG2  GLU  18           2HG      GLU  18   1.685  -3.165 -12.566
  147    HG3  GLU  18           1HG      GLU  18   1.130  -3.205 -10.892
  148    H    ARG  19           H        ARG  19  -0.496  -7.117 -10.808
  149    HA   ARG  19           HA       ARG  19  -1.037  -9.233 -12.754
  150    HB2  ARG  19           2HB      ARG  19  -1.226  -9.261  -9.724
  151    HB3  ARG  19           1HB      ARG  19  -1.345 -10.662 -10.772
  152    HG2  ARG  19           2HG      ARG  19   1.114  -8.943 -10.503
  153    HG3  ARG  19           1HG      ARG  19   0.829 -10.435  -9.612
  154    HD2  ARG  19           2HD      ARG  19   0.476 -11.454 -12.004
  155    HD3  ARG  19           1HD      ARG  19   1.398 -10.041 -12.525
  156    HE   ARG  19           HE       ARG  19   2.423 -11.919 -10.496
  157   HH11  ARG  19          1HH1      ARG  19   2.836 -10.175 -13.435
  158   HH12  ARG  19          2HH1      ARG  19   4.494 -10.631 -13.592
  159   HH21  ARG  19          1HH2      ARG  19   4.534 -12.516 -10.730
  160   HH22  ARG  19          2HH2      ARG  19   5.440 -11.961 -12.093
  161    HA   PRO  20           HA       PRO  20  -5.497  -8.752 -12.644
  162    HB2  PRO  20           2HB      PRO  20  -6.375 -11.350 -12.524
  163    HB3  PRO  20           1HB      PRO  20  -5.757 -10.590 -13.995
  164    HG2  PRO  20           2HG      PRO  20  -4.339 -12.383 -12.049
  165    HG3  PRO  20           1HG      PRO  20  -4.308 -12.413 -13.825
  166    HD2  PRO  20           2HD      PRO  20  -2.305 -11.319 -12.391
  167    HD3  PRO  20           1HD      PRO  20  -2.812 -10.638 -13.952
  168    H    GLU  21           H        GLU  21  -3.788 -10.051 -10.023
  169    HA   GLU  21           HA       GLU  21  -6.143 -10.407  -8.314
  170    HB2  GLU  21           2HB      GLU  21  -4.320 -12.119  -8.361
  171    HB3  GLU  21           1HB      GLU  21  -3.224 -10.918  -7.691
  172    HG2  GLU  21           2HG      GLU  21  -4.755 -10.752  -5.709
  173    HG3  GLU  21           1HG      GLU  21  -5.658 -12.114  -6.371
  174    H    ASP  22           H        ASP  22  -3.749  -8.057  -9.003
  175    HA   ASP  22           HA       ASP  22  -3.234  -6.974  -6.469
  176    HB2  ASP  22           2HB      ASP  22  -3.149  -5.617  -9.167
  177    HB3  ASP  22           1HB      ASP  22  -2.427  -4.983  -7.692
  178    H    LEU  23           H        LEU  23  -3.679  -4.536  -6.059
  179    HA   LEU  23           HA       LEU  23  -6.600  -4.261  -5.891
  180    HB2  LEU  23           2HB      LEU  23  -5.250  -4.300  -3.810
  181    HB3  LEU  23           1HB      LEU  23  -4.410  -2.858  -4.346
  182    HG   LEU  23           HG       LEU  23  -6.515  -1.583  -4.236
  183   HD11  LEU  23          1HD1      LEU  23  -8.502  -2.573  -3.194
  184   HD12  LEU  23          2HD1      LEU  23  -7.702  -4.146  -3.158
  185   HD13  LEU  23          3HD1      LEU  23  -8.090  -3.386  -4.704
  186   HD21  LEU  23          3HD2      LEU  23  -5.816  -3.088  -1.712
  187   HD22  LEU  23          1HD2      LEU  23  -6.744  -1.591  -1.782
  188   HD23  LEU  23          2HD2      LEU  23  -5.058  -1.605  -2.295
  189    H    GLU  24           H        GLU  24  -7.618  -2.222  -6.289
  190    HA   GLU  24           HA       GLU  24  -6.283  -0.681  -8.402
  191    HB2  GLU  24           2HB      GLU  24  -9.211  -0.659  -7.614
  192    HB3  GLU  24           1HB      GLU  24  -8.503   0.034  -9.069
  193    HG2  GLU  24           2HG      GLU  24  -7.844  -2.224  -9.803
  194    HG3  GLU  24           1HG      GLU  24  -8.612  -2.899  -8.371
  195    H    LEU  25           H        LEU  25  -5.668   1.392  -8.134
  196    HA   LEU  25           HA       LEU  25  -6.160   2.625  -5.504
  197    HB2  LEU  25           2HB      LEU  25  -3.988   3.222  -7.518
  198    HB3  LEU  25           1HB      LEU  25  -4.108   3.883  -5.897
  199    HG   LEU  25           HG       LEU  25  -3.596   0.987  -6.610
  200   HD11  LEU  25          1HD1      LEU  25  -1.400   1.344  -5.642
  201   HD12  LEU  25          2HD1      LEU  25  -1.803   3.025  -5.289
  202   HD13  LEU  25          3HD1      LEU  25  -1.672   2.483  -6.963
  203   HD21  LEU  25          3HD2      LEU  25  -3.844   2.302  -3.900
  204   HD22  LEU  25          1HD2      LEU  25  -3.311   0.646  -4.191
  205   HD23  LEU  25          2HD2      LEU  25  -4.956   1.125  -4.600
  206    H    LEU  26           H        LEU  26  -6.667   4.816  -5.284
  207    HA   LEU  26           HA       LEU  26  -7.677   6.196  -7.706
  208    HB2  LEU  26           2HB      LEU  26  -8.828   6.049  -4.917
  209    HB3  LEU  26           1HB      LEU  26  -9.244   7.360  -6.000
  210    HG   LEU  26           HG       LEU  26 -10.993   5.720  -6.055
  211   HD11  LEU  26          1HD1      LEU  26 -11.079   5.201  -8.434
  212   HD12  LEU  26          2HD1      LEU  26  -9.355   5.542  -8.585
  213   HD13  LEU  26          3HD1      LEU  26 -10.477   6.836  -8.163
  214   HD21  LEU  26          3HD2      LEU  26 -10.659   3.415  -6.724
  215   HD22  LEU  26          1HD2      LEU  26  -9.689   3.780  -5.297
  216   HD23  LEU  26          2HD2      LEU  26  -8.923   3.685  -6.883
  217    HA   PRO  27           HA       PRO  27  -5.021   9.579  -6.546
  218    HB2  PRO  27           2HB      PRO  27  -6.385  11.757  -7.430
  219    HB3  PRO  27           1HB      PRO  27  -5.612  10.606  -8.527
  220    HG2  PRO  27           2HG      PRO  27  -8.492  10.805  -7.716
  221    HG3  PRO  27           1HG      PRO  27  -7.798  10.525  -9.325
  222    HD2  PRO  27           2HD      PRO  27  -8.793   8.519  -7.769
  223    HD3  PRO  27           1HD      PRO  27  -7.470   8.272  -8.927
  224    H    GLY  28           H        GLY  28  -4.897   9.705  -4.332
  225    HA2  GLY  28           2HA      GLY  28  -5.099  10.975  -2.368
  226    HA3  GLY  28           1HA      GLY  28  -6.534  11.739  -3.026
  227    H    ASP  29           H        ASP  29  -5.730   8.306  -2.450
  228    HA   ASP  29           HA       ASP  29  -8.154   8.089  -0.788
  229    HB2  ASP  29           2HB      ASP  29  -7.976   5.627  -1.243
  230    HB3  ASP  29           1HB      ASP  29  -8.264   6.611  -2.671
  231    H    VAL  30           H        VAL  30  -7.916   6.189   0.894
  232    HA   VAL  30           HA       VAL  30  -5.320   6.462   2.289
  233    HB   VAL  30           HB       VAL  30  -8.044   6.255   3.607
  234   HG11  VAL  30          1HG1      VAL  30  -6.293   5.159   4.914
  235   HG12  VAL  30          2HG1      VAL  30  -6.811   6.649   5.702
  236   HG13  VAL  30          3HG1      VAL  30  -5.289   6.607   4.811
  237   HG21  VAL  30          3HG2      VAL  30  -7.621   8.564   4.358
  238   HG22  VAL  30          1HG2      VAL  30  -7.717   8.448   2.601
  239   HG23  VAL  30          2HG2      VAL  30  -6.147   8.598   3.390
  240    H    LEU  31           H        LEU  31  -4.296   4.549   2.225
  241    HA   LEU  31           HA       LEU  31  -5.868   2.059   2.372
  242    HB2  LEU  31           2HB      LEU  31  -2.989   2.462   1.531
  243    HB3  LEU  31           1HB      LEU  31  -3.847   0.933   1.533
  244    HG   LEU  31           HG       LEU  31  -5.461   2.026  -0.143
  245   HD11  LEU  31          1HD1      LEU  31  -3.167   3.975  -0.380
  246   HD12  LEU  31          2HD1      LEU  31  -4.794   4.342   0.195
  247   HD13  LEU  31          3HD1      LEU  31  -4.541   3.852  -1.481
  248   HD21  LEU  31          3HD2      LEU  31  -2.598   1.503  -0.942
  249   HD22  LEU  31          1HD2      LEU  31  -3.990   1.507  -2.027
  250   HD23  LEU  31          2HD2      LEU  31  -3.869   0.294  -0.755
  251    H    VAL  32           H        VAL  32  -5.762   0.788   4.147
  252    HA   VAL  32           HA       VAL  32  -3.762   1.436   6.216
  253    HB   VAL  32           HB       VAL  32  -6.315  -0.177   6.487
  254   HG11  VAL  32          1HG1      VAL  32  -4.596  -0.832   8.113
  255   HG12  VAL  32          2HG1      VAL  32  -5.943  -0.006   8.898
  256   HG13  VAL  32          3HG1      VAL  32  -4.426   0.852   8.615
  257   HG21  VAL  32          3HG2      VAL  32  -6.790   2.171   6.017
  258   HG22  VAL  32          1HG2      VAL  32  -5.720   2.668   7.330
  259   HG23  VAL  32          2HG2      VAL  32  -7.201   1.776   7.685
  260    H    VAL  33           H        VAL  33  -1.995   0.201   6.108
  261    HA   VAL  33           HA       VAL  33  -2.195  -2.635   5.336
  262    HB   VAL  33           HB       VAL  33   0.269  -0.890   5.610
  263   HG11  VAL  33          1HG1      VAL  33   0.820  -3.216   5.998
  264   HG12  VAL  33          2HG1      VAL  33   1.417  -2.733   4.411
  265   HG13  VAL  33          3HG1      VAL  33  -0.051  -3.701   4.543
  266   HG21  VAL  33          3HG2      VAL  33  -1.154  -0.170   3.757
  267   HG22  VAL  33          1HG2      VAL  33  -1.188  -1.816   3.127
  268   HG23  VAL  33          2HG2      VAL  33   0.328  -0.914   3.157
  269    H    SER  34           H        SER  34  -1.939  -4.221   6.821
  270    HA   SER  34           HA       SER  34  -1.663  -3.584   9.596
  271    HB2  SER  34           2HB      SER  34  -1.774  -6.049   9.944
  272    HB3  SER  34           1HB      SER  34  -3.080  -5.441   8.930
  273    HG   SER  34           HG       SER  34  -2.426  -6.733   7.428
  274    H    ARG  35           H        ARG  35   0.020  -3.923  11.006
  275    HA   ARG  35           HA       ARG  35   2.652  -3.752  10.137
  276    HB2  ARG  35           2HB      ARG  35   3.268  -4.471  12.483
  277    HB3  ARG  35           1HB      ARG  35   2.176  -3.099  12.361
  278    HG2  ARG  35           2HG      ARG  35   0.278  -4.537  12.897
  279    HG3  ARG  35           1HG      ARG  35   1.348  -5.938  12.976
  280    HD2  ARG  35           2HD      ARG  35   2.513  -5.020  14.869
  281    HD3  ARG  35           1HD      ARG  35   1.655  -3.489  14.719
  282    HE   ARG  35           HE       ARG  35  -0.355  -5.219  15.123
  283   HH11  ARG  35          1HH1      ARG  35   2.636  -4.782  16.782
  284   HH12  ARG  35          2HH1      ARG  35   1.982  -5.262  18.310
  285   HH21  ARG  35          1HH2      ARG  35  -1.192  -5.799  17.096
  286   HH22  ARG  35          2HH2      ARG  35  -0.162  -5.814  18.486
  287    H    ALA  36           H        ALA  36   0.769  -6.650  10.872
  288    HA   ALA  36           HA       ALA  36   2.812  -8.563  10.739
  289    HB1  ALA  36           3HB      ALA  36  -0.088  -8.865   9.951
  290    HB2  ALA  36           1HB      ALA  36   0.570  -9.056  11.576
  291    HB3  ALA  36           2HB      ALA  36   1.031 -10.183  10.298
  292    H    ALA  37           H        ALA  37   1.016  -6.946   8.177
  293    HA   ALA  37           HA       ALA  37   1.742  -8.668   6.046
  294    HB1  ALA  37           3HB      ALA  37   0.994  -6.870   4.573
  295    HB2  ALA  37           1HB      ALA  37   0.978  -5.746   5.934
  296    HB3  ALA  37           2HB      ALA  37  -0.145  -7.106   5.901
  297    H    LEU  38           H        LEU  38   3.094  -5.512   7.062
  298    HA   LEU  38           HA       LEU  38   5.162  -5.315   5.212
  299    HB2  LEU  38           2HB      LEU  38   5.143  -4.409   8.098
  300    HB3  LEU  38           1HB      LEU  38   6.312  -3.891   6.897
  301    HG   LEU  38           HG       LEU  38   3.336  -3.357   6.773
  302   HD11  LEU  38          1HD1      LEU  38   5.618  -1.497   7.444
  303   HD12  LEU  38          2HD1      LEU  38   4.408  -2.106   8.574
  304   HD13  LEU  38          3HD1      LEU  38   3.925  -1.037   7.257
  305   HD21  LEU  38          3HD2      LEU  38   5.588  -2.381   5.010
  306   HD22  LEU  38          1HD2      LEU  38   3.909  -1.848   4.924
  307   HD23  LEU  38          2HD2      LEU  38   4.323  -3.521   4.552
  308    H    GLN  39           H        GLN  39   5.171  -6.950   8.367
  309    HA   GLN  39           HA       GLN  39   7.886  -7.797   8.234
  310    HB2  GLN  39           2HB      GLN  39   5.587  -8.920   9.850
  311    HB3  GLN  39           1HB      GLN  39   7.287  -9.303  10.100
  312    HG2  GLN  39           2HG      GLN  39   7.704  -6.892  10.554
  313    HG3  GLN  39           1HG      GLN  39   5.966  -6.617  10.449
  314   HE21  GLN  39          1HE2      GLN  39   5.848  -5.915  12.576
  315   HE22  GLN  39          2HE2      GLN  39   5.986  -7.000  13.914
  316    H    ALA  40           H        ALA  40   4.852  -9.255   7.167
  317    HA   ALA  40           HA       ALA  40   5.906 -11.805   6.477
  318    HB1  ALA  40           3HB      ALA  40   3.506 -11.427   6.739
  319    HB2  ALA  40           1HB      ALA  40   3.866 -12.072   5.137
  320    HB3  ALA  40           2HB      ALA  40   3.509 -10.356   5.339
  321    H    LEU  41           H        LEU  41   6.001  -8.705   4.935
  322    HA   LEU  41           HA       LEU  41   6.945  -9.722   2.380
  323    HB2  LEU  41           2HB      LEU  41   6.826  -6.905   3.479
  324    HB3  LEU  41           1HB      LEU  41   7.231  -7.326   1.825
  325    HG   LEU  41           HG       LEU  41   4.562  -7.921   3.118
  326   HD11  LEU  41          1HD1      LEU  41   3.680  -6.055   1.836
  327   HD12  LEU  41          2HD1      LEU  41   5.292  -5.690   1.221
  328   HD13  LEU  41          3HD1      LEU  41   4.942  -5.503   2.940
  329   HD21  LEU  41          3HD2      LEU  41   5.455  -8.046   0.232
  330   HD22  LEU  41          1HD2      LEU  41   3.820  -8.346   0.826
  331   HD23  LEU  41          2HD2      LEU  41   5.135  -9.429   1.282
  332    H    GLY  42           H        GLY  42   8.323  -9.201   5.397
  333    HA2  GLY  42           2HA      GLY  42  10.501  -9.282   6.134
  334    HA3  GLY  42           1HA      GLY  42  10.992  -9.616   4.483
  335    H    VAL  43           H        VAL  43   9.205  -6.739   5.479
  336    HA   VAL  43           HA       VAL  43  11.093  -4.997   4.239
  337    HB   VAL  43           HB       VAL  43   8.824  -4.315   6.127
  338   HG11  VAL  43          1HG1      VAL  43   8.942  -2.061   5.132
  339   HG12  VAL  43          2HG1      VAL  43  10.381  -2.543   4.233
  340   HG13  VAL  43          3HG1      VAL  43  10.421  -2.482   5.995
  341   HG21  VAL  43          3HG2      VAL  43   7.545  -3.818   4.098
  342   HG22  VAL  43          1HG2      VAL  43   8.059  -5.506   4.126
  343   HG23  VAL  43          2HG2      VAL  43   8.905  -4.341   3.105
  344    H    ALA  44           H        ALA  44  12.754  -3.842   5.073
  345    HA   ALA  44           HA       ALA  44  13.670  -4.462   7.748
  346    HB1  ALA  44           3HB      ALA  44  14.902  -2.689   5.632
  347    HB2  ALA  44           1HB      ALA  44  15.259  -4.396   5.892
  348    HB3  ALA  44           2HB      ALA  44  15.677  -3.210   7.128
  349    H    GLU  45           H        GLU  45  13.462  -3.235   9.511
  350    HA   GLU  45           HA       GLU  45  11.756  -1.100   9.800
  351    HB2  GLU  45           2HB      GLU  45  12.786  -2.520  11.610
  352    HB3  GLU  45           1HB      GLU  45  14.248  -1.560  11.464
  353    HG2  GLU  45           2HG      GLU  45  11.560  -0.390  12.166
  354    HG3  GLU  45           1HG      GLU  45  12.704  -0.974  13.368
  355    H    GLY  46           H        GLY  46  11.791   0.892   8.978
  356    HA2  GLY  46           2HA      GLY  46  12.906   3.065   8.860
  357    HA3  GLY  46           1HA      GLY  46  14.407   2.217   8.526
  358    H    GLY  47           H        GLY  47  12.009   0.636   6.860
  359    HA2  GLY  47           2HA      GLY  47  12.633   2.138   4.380
  360    HA3  GLY  47           1HA      GLY  47  12.247   0.426   4.453
  361    H    GLU  48           H        GLU  48  10.203   2.066   6.521
  362    HA   GLU  48           HA       GLU  48   7.878   1.463   5.094
  363    HB2  GLU  48           2HB      GLU  48   8.212   3.513   7.300
  364    HB3  GLU  48           1HB      GLU  48   6.678   2.872   6.736
  365    HG2  GLU  48           2HG      GLU  48   7.089   1.673   8.679
  366    HG3  GLU  48           1HG      GLU  48   7.600   0.573   7.404
  367    H    ARG  49           H        ARG  49   9.854   4.350   5.021
  368    HA   ARG  49           HA       ARG  49   7.908   5.956   3.608
  369    HB2  ARG  49           2HB      ARG  49  10.834   6.348   4.246
  370    HB3  ARG  49           1HB      ARG  49   9.900   7.518   3.325
  371    HG2  ARG  49           2HG      ARG  49   8.445   7.922   5.193
  372    HG3  ARG  49           1HG      ARG  49   9.195   6.615   6.114
  373    HD2  ARG  49           2HD      ARG  49  10.640   9.095   5.163
  374    HD3  ARG  49           1HD      ARG  49   9.969   8.886   6.782
  375    HE   ARG  49           HE       ARG  49  11.515   6.868   6.875
  376   HH11  ARG  49          1HH1      ARG  49  12.278   9.744   5.122
  377   HH12  ARG  49          2HH1      ARG  49  13.983   9.474   5.225
  378   HH21  ARG  49          1HH2      ARG  49  13.708   6.578   7.023
  379   HH22  ARG  49          2HH2      ARG  49  14.776   7.727   6.301
  380    H    CYS  50           H        CYS  50   9.740   3.389   2.594
  381    HA   CYS  50           HA       CYS  50   9.820   4.400  -0.181
  382    HB2  CYS  50           2HB      CYS  50  11.900   2.636   1.139
  383    HB3  CYS  50           1HB      CYS  50  11.875   3.070  -0.567
  384    HG   CYS  50           HG       CYS  50  13.856   4.504   0.941
  385    HA   PRO  51           HA       PRO  51   7.360   0.377   0.225
  386    HB2  PRO  51           2HB      PRO  51   5.165   1.281  -1.145
  387    HB3  PRO  51           1HB      PRO  51   5.351   1.431   0.606
  388    HG2  PRO  51           2HG      PRO  51   5.861   3.466  -1.534
  389    HG3  PRO  51           1HG      PRO  51   5.039   3.665   0.027
  390    HD2  PRO  51           2HD      PRO  51   7.594   4.438  -0.341
  391    HD3  PRO  51           1HD      PRO  51   7.034   3.768   1.208
  392    H    GLN  52           H        GLN  52   8.194   2.567  -2.343
  393    HA   GLN  52           HA       GLN  52   7.624   0.977  -4.590
  394    HB2  GLN  52           2HB      GLN  52   9.255   2.417  -5.762
  395    HB3  GLN  52           1HB      GLN  52   8.118   3.341  -4.788
  396    HG2  GLN  52           2HG      GLN  52   9.826   3.548  -3.023
  397    HG3  GLN  52           1HG      GLN  52  10.965   2.671  -4.044
  398   HE21  GLN  52          1HE2      GLN  52  12.399   4.396  -4.131
  399   HE22  GLN  52          2HE2      GLN  52  12.066   5.828  -5.035
  400    H    SER  53           H        SER  53  10.130   0.707  -2.224
  401    HA   SER  53           HA       SER  53  11.857  -0.944  -3.893
  402    HB2  SER  53           2HB      SER  53  12.882   0.579  -2.258
  403    HB3  SER  53           1HB      SER  53  12.045  -0.250  -0.946
  404    HG   SER  53           HG       SER  53  13.791  -1.624  -2.711
  405    H    VAL  54           H        VAL  54   9.041  -1.502  -2.240
  406    HA   VAL  54           HA       VAL  54   9.757  -4.221  -1.386
  407    HB   VAL  54           HB       VAL  54   7.171  -2.695  -0.962
  408   HG11  VAL  54          1HG1      VAL  54   6.656  -4.432   0.688
  409   HG12  VAL  54          2HG1      VAL  54   8.139  -5.286   0.256
  410   HG13  VAL  54          3HG1      VAL  54   6.842  -5.112  -0.928
  411   HG21  VAL  54          3HG2      VAL  54   9.041  -1.639   0.211
  412   HG22  VAL  54          1HG2      VAL  54   9.461  -3.183   0.954
  413   HG23  VAL  54          2HG2      VAL  54   7.929  -2.399   1.352
  414    H    GLY  55           H        GLY  55   7.188  -2.607  -3.284
  415    HA2  GLY  55           2HA      GLY  55   6.740  -3.514  -5.550
  416    HA3  GLY  55           1HA      GLY  55   6.861  -5.114  -4.834
  417    H    TRP  56           H        TRP  56   4.938  -6.066  -4.584
  418    HA   TRP  56           HA       TRP  56   2.520  -4.435  -4.310
  419    HB2  TRP  56           2HB      TRP  56   2.820  -7.439  -4.608
  420    HB3  TRP  56           1HB      TRP  56   1.299  -6.552  -4.626
  421    HD1  TRP  56           HD1      TRP  56   1.710  -4.318  -6.644
  422    HE1  TRP  56           HE1      TRP  56   2.213  -4.778  -9.120
  423    HE3  TRP  56           HE3      TRP  56   3.539  -9.079  -6.234
  424    HZ2  TRP  56           HZ2      TRP  56   3.244  -6.877 -10.699
  425    HZ3  TRP  56           HZ3      TRP  56   4.261 -10.243  -8.280
  426    HH2  TRP  56           HH2      TRP  56   4.115  -9.164 -10.466
  427    H    MET  57           H        MET  57   1.968  -3.835  -2.295
  428    HA   MET  57           HA       MET  57   2.601  -5.636  -0.050
  429    HB2  MET  57           2HB      MET  57   1.832  -2.709   0.031
  430    HB3  MET  57           1HB      MET  57   2.351  -3.685   1.398
  431    HG2  MET  57           2HG      MET  57   4.534  -4.024   0.194
  432    HG3  MET  57           1HG      MET  57   3.992  -2.812  -0.967
  433    HE1  MET  57           3HE      MET  57   2.325  -0.915   1.132
  434    HE2  MET  57           1HE      MET  57   3.300  -0.305  -0.203
  435    HE3  MET  57           2HE      MET  57   3.553   0.312   1.431
  436    HA   PRO  58           HA       PRO  58  -1.783  -6.580   0.362
  437    HB2  PRO  58           2HB      PRO  58  -1.061  -7.446   3.095
  438    HB3  PRO  58           1HB      PRO  58  -1.746  -8.387   1.765
  439    HG2  PRO  58           2HG      PRO  58   0.798  -8.724   2.557
  440    HG3  PRO  58           1HG      PRO  58   0.332  -8.855   0.850
  441    HD2  PRO  58           2HD      PRO  58   1.629  -6.564   2.293
  442    HD3  PRO  58           1HD      PRO  58   2.002  -7.242   0.693
  443    H    GLY  59           H        GLY  59  -3.200  -4.943   0.729
  444    HA2  GLY  59           2HA      GLY  59  -3.338  -3.754   3.393
  445    HA3  GLY  59           1HA      GLY  59  -2.973  -2.647   2.078
  446    H    LEU  60           H        LEU  60  -5.173  -2.203   3.595
  447    HA   LEU  60           HA       LEU  60  -7.431  -3.024   1.871
  448    HB2  LEU  60           2HB      LEU  60  -7.548  -3.692   4.274
  449    HB3  LEU  60           1HB      LEU  60  -7.512  -1.997   4.718
  450    HG   LEU  60           HG       LEU  60  -9.656  -1.649   3.525
  451   HD11  LEU  60          1HD1      LEU  60  -9.453  -3.426   1.868
  452   HD12  LEU  60          2HD1      LEU  60 -10.956  -3.579   2.776
  453   HD13  LEU  60          3HD1      LEU  60  -9.597  -4.645   3.137
  454   HD21  LEU  60          3HD2      LEU  60  -9.675  -2.120   5.919
  455   HD22  LEU  60          1HD2      LEU  60  -9.723  -3.854   5.589
  456   HD23  LEU  60          2HD2      LEU  60 -11.082  -2.830   5.129
  457    H    ASN  61           H        ASN  61  -8.000  -1.479   0.460
  458    HA   ASN  61           HA       ASN  61  -7.217   1.282   0.873
  459    HB2  ASN  61           2HB      ASN  61  -7.064   0.156  -1.351
  460    HB3  ASN  61           1HB      ASN  61  -8.821   0.071  -1.396
  461   HD21  ASN  61          1HD2      ASN  61  -6.965   1.432  -3.195
  462   HD22  ASN  61          2HD2      ASN  61  -7.414   3.098  -3.181
  463    H    GLU  62           H        GLU  62  -8.426   2.423   2.287
  464    HA   GLU  62           HA       GLU  62 -11.145   1.845   2.863
  465    HB2  GLU  62           2HB      GLU  62  -9.335   4.117   3.663
  466    HB3  GLU  62           1HB      GLU  62 -10.991   3.974   4.236
  467    HG2  GLU  62           2HG      GLU  62  -8.889   1.852   4.625
  468    HG3  GLU  62           1HG      GLU  62  -9.270   3.101   5.809
  469    H    ARG  63           H        ARG  63  -9.965   3.440   0.191
  470    HA   ARG  63           HA       ARG  63 -12.154   5.316  -0.084
  471    HB2  ARG  63           2HB      ARG  63 -10.044   5.783  -1.220
  472    HB3  ARG  63           1HB      ARG  63 -10.160   4.273  -2.109
  473    HG2  ARG  63           2HG      ARG  63 -10.759   6.011  -3.604
  474    HG3  ARG  63           1HG      ARG  63 -12.241   5.155  -3.191
  475    HD2  ARG  63           2HD      ARG  63 -11.360   7.714  -1.858
  476    HD3  ARG  63           1HD      ARG  63 -12.418   7.664  -3.265
  477    HE   ARG  63           HE       ARG  63 -13.290   6.141  -0.951
  478   HH11  ARG  63          1HH1      ARG  63 -13.535   9.085  -2.726
  479   HH12  ARG  63          2HH1      ARG  63 -15.054   9.495  -2.013
  480   HH21  ARG  63          1HH2      ARG  63 -15.213   6.703  -0.042
  481   HH22  ARG  63          2HH2      ARG  63 -15.991   8.171  -0.521
  482    H    THR  64           H        THR  64 -11.328   2.114  -1.378
  483    HA   THR  64           HA       THR  64 -14.083   1.834  -2.422
  484    HB   THR  64           HB       THR  64 -13.233  -0.032  -3.776
  485    HG1  THR  64           HG1      THR  64 -10.789  -0.139  -3.795
  486   HG21  THR  64          3HG2      THR  64 -13.152   2.241  -4.715
  487   HG22  THR  64          1HG2      THR  64 -11.815   1.255  -5.310
  488   HG23  THR  64          2HG2      THR  64 -11.533   2.459  -4.052
  489    H    ARG  65           H        ARG  65 -12.228   1.015   0.192
  490    HA   ARG  65           HA       ARG  65 -12.310  -0.459   1.900
  491    HB2  ARG  65           2HB      ARG  65 -15.111  -1.110   0.956
  492    HB3  ARG  65           1HB      ARG  65 -14.461  -1.334   2.574
  493    HG2  ARG  65           2HG      ARG  65 -15.040   1.282   1.189
  494    HG3  ARG  65           1HG      ARG  65 -15.898   0.587   2.563
  495    HD2  ARG  65           2HD      ARG  65 -13.030   1.546   2.546
  496    HD3  ARG  65           1HD      ARG  65 -14.399   2.392   3.257
  497    HE   ARG  65           HE       ARG  65 -12.973   0.128   4.360
  498   HH11  ARG  65          1HH1      ARG  65 -15.795   2.101   4.518
  499   HH12  ARG  65          2HH1      ARG  65 -16.141   1.664   6.151
  500   HH21  ARG  65          1HH2      ARG  65 -13.425  -0.402   6.470
  501   HH22  ARG  65          2HH2      ARG  65 -14.812   0.282   7.245
  502    H    GLN  66           H        GLN  66 -11.590  -1.386  -0.909
  503    HA   GLN  66           HA       GLN  66 -12.206  -4.249  -0.766
  504    HB2  GLN  66           2HB      GLN  66 -10.862  -2.602  -2.921
  505    HB3  GLN  66           1HB      GLN  66 -11.142  -4.335  -3.026
  506    HG2  GLN  66           2HG      GLN  66 -13.299  -2.243  -2.755
  507    HG3  GLN  66           1HG      GLN  66 -12.806  -3.010  -4.264
  508   HE21  GLN  66          1HE2      GLN  66 -13.364  -5.160  -4.629
  509   HE22  GLN  66          2HE2      GLN  66 -14.568  -5.968  -3.696
  510    H    ARG  67           H        ARG  67 -10.649  -5.861  -0.680
  511    HA   ARG  67           HA       ARG  67  -8.106  -5.056   0.561
  512    HB2  ARG  67           2HB      ARG  67  -9.623  -6.616   1.760
  513    HB3  ARG  67           1HB      ARG  67  -9.462  -7.761   0.440
  514    HG2  ARG  67           2HG      ARG  67  -8.025  -8.521   2.130
  515    HG3  ARG  67           1HG      ARG  67  -6.977  -7.772   0.925
  516    HD2  ARG  67           2HD      ARG  67  -6.296  -7.157   3.183
  517    HD3  ARG  67           1HD      ARG  67  -6.861  -5.740   2.295
  518    HE   ARG  67           HE       ARG  67  -9.043  -6.159   3.522
  519   HH11  ARG  67          1HH1      ARG  67  -6.010  -7.086   4.862
  520   HH12  ARG  67          2HH1      ARG  67  -6.542  -6.868   6.490
  521   HH21  ARG  67          1HH2      ARG  67  -9.714  -5.884   5.604
  522   HH22  ARG  67          2HH2      ARG  67  -8.610  -6.163   6.904
  523    H    GLY  68           H        GLY  68  -6.105  -5.624  -0.287
  524    HA2  GLY  68           2HA      GLY  68  -5.519  -7.749  -1.957
  525    HA3  GLY  68           1HA      GLY  68  -5.964  -6.435  -3.035
  526    H    ASP  69           H        ASP  69  -3.554  -7.314  -3.458
  527    HA   ASP  69           HA       ASP  69  -1.584  -5.819  -1.917
  528    HB2  ASP  69           2HB      ASP  69  -1.233  -7.576  -4.363
  529    HB3  ASP  69           1HB      ASP  69   0.064  -6.930  -3.363
  530    H    PHE  70           H        PHE  70  -0.799  -3.848  -2.516
  531    HA   PHE  70           HA       PHE  70  -1.437  -2.902  -5.242
  532    HB2  PHE  70           2HB      PHE  70  -1.647  -0.630  -4.338
  533    HB3  PHE  70           1HB      PHE  70  -2.780  -1.732  -3.566
  534    HD1  PHE  70           HD1      PHE  70  -2.389  -2.480  -1.236
  535    HD2  PHE  70           HD2      PHE  70   0.062   0.476  -3.086
  536    HE1  PHE  70           HE1      PHE  70  -1.562  -1.781   0.972
  537    HE2  PHE  70           HE2      PHE  70   0.892   1.171  -0.879
  538    HZ   PHE  70           HZ       PHE  70   0.080   0.044   1.152
  539    HA   PRO  71           HA       PRO  71   2.944  -2.236  -5.826
  540    HB2  PRO  71           2HB      PRO  71   2.819  -0.427  -7.870
  541    HB3  PRO  71           1HB      PRO  71   2.533  -2.157  -8.090
  542    HG2  PRO  71           2HG      PRO  71   0.549   0.069  -7.781
  543    HG3  PRO  71           1HG      PRO  71   0.532  -1.296  -8.914
  544    HD2  PRO  71           2HD      PRO  71  -0.961  -1.286  -6.657
  545    HD3  PRO  71           1HD      PRO  71  -0.260  -2.779  -7.316
  546    H    GLY  72           H        GLY  72   4.032  -1.121  -4.305
  547    HA2  GLY  72           2HA      GLY  72   3.074   1.355  -3.225
  548    HA3  GLY  72           1HA      GLY  72   4.544   0.520  -2.769
  549    H    THR  73           H        THR  73   4.134   1.386  -6.131
  550    HA   THR  73           HA       THR  73   6.301   3.344  -5.857
  551    HB   THR  73           HB       THR  73   6.484   3.269  -8.291
  552    HG1  THR  73           HG1      THR  73   5.071   2.048  -9.524
  553   HG21  THR  73          3HG2      THR  73   6.222   0.495  -7.112
  554   HG22  THR  73          1HG2      THR  73   7.650   1.526  -7.019
  555   HG23  THR  73          2HG2      THR  73   7.106   0.910  -8.580
  556    H    TYR  74           H        TYR  74   2.890   3.273  -6.262
  557    HA   TYR  74           HA       TYR  74   2.852   6.053  -7.261
  558    HB2  TYR  74           2HB      TYR  74   0.571   4.060  -7.196
  559    HB3  TYR  74           1HB      TYR  74   0.575   5.632  -7.994
  560    HD1  TYR  74           HD2      TYR  74   2.316   5.973  -9.880
  561    HD2  TYR  74           HD1      TYR  74   1.210   2.142  -8.384
  562    HE1  TYR  74           HE2      TYR  74   3.175   4.927 -11.932
  563    HE2  TYR  74           HE1      TYR  74   2.074   1.088 -10.428
  564    HH   TYR  74           HH       TYR  74   2.489   1.799 -12.841
  565    H    VAL  75           H        VAL  75   2.995   4.739  -4.363
  566    HA   VAL  75           HA       VAL  75   0.890   6.452  -3.186
  567    HB   VAL  75           HB       VAL  75   0.650   4.886  -1.336
  568   HG11  VAL  75          1HG1      VAL  75   0.396   3.496  -4.010
  569   HG12  VAL  75          2HG1      VAL  75  -0.799   4.567  -3.277
  570   HG13  VAL  75          3HG1      VAL  75  -0.420   3.021  -2.519
  571   HG21  VAL  75          3HG2      VAL  75   2.895   3.985  -1.219
  572   HG22  VAL  75          1HG2      VAL  75   2.701   3.202  -2.788
  573   HG23  VAL  75          2HG2      VAL  75   1.746   2.663  -1.406
  574    H    GLU  76           H        GLU  76   1.343   7.554  -1.278
  575    HA   GLU  76           HA       GLU  76   4.162   7.617  -0.407
  576    HB2  GLU  76           2HB      GLU  76   3.597   9.856   0.570
  577    HB3  GLU  76           1HB      GLU  76   3.476   9.785  -1.183
  578    HG2  GLU  76           2HG      GLU  76   1.079   9.668  -1.074
  579    HG3  GLU  76           1HG      GLU  76   1.122   9.533   0.684
  580    H    PHE  77           H        PHE  77   4.520   7.997   1.935
  581    HA   PHE  77           HA       PHE  77   2.776   6.220   3.472
  582    HB2  PHE  77           2HB      PHE  77   5.204   5.785   3.425
  583    HB3  PHE  77           1HB      PHE  77   5.502   7.361   4.147
  584    HD1  PHE  77           HD2      PHE  77   3.098   4.599   4.952
  585    HD2  PHE  77           HD1      PHE  77   6.290   7.083   6.300
  586    HE1  PHE  77           HE2      PHE  77   2.963   3.568   7.178
  587    HE2  PHE  77           HE1      PHE  77   6.149   6.052   8.529
  588    HZ   PHE  77           HZ       PHE  77   4.484   4.295   8.970
  589    H    LEU  78           H        LEU  78   1.185   7.079   4.667
  590    HA   LEU  78           HA       LEU  78   1.264   9.860   5.498
  591    HB2  LEU  78           2HB      LEU  78  -0.837   7.737   5.970
  592    HB3  LEU  78           1HB      LEU  78  -1.018   9.446   6.324
  593    HG   LEU  78           HG       LEU  78  -0.669   8.242   3.566
  594   HD11  LEU  78          1HD1      LEU  78  -3.086   9.495   4.871
  595   HD12  LEU  78          2HD1      LEU  78  -2.860   7.779   4.534
  596   HD13  LEU  78          3HD1      LEU  78  -2.981   8.928   3.204
  597   HD21  LEU  78          3HD2      LEU  78  -1.110  10.507   2.738
  598   HD22  LEU  78          1HD2      LEU  78   0.358  10.453   3.716
  599   HD23  LEU  78          2HD2      LEU  78  -1.131  11.113   4.394
  600    H    GLY  79           H        GLY  79   1.170   6.677   7.105
  601    HA2  GLY  79           2HA      GLY  79   2.806   6.572   9.028
  602    HA3  GLY  79           1HA      GLY  79   2.005   8.017   9.619
  603    HA   PRO  80           HA       PRO  80   0.042   4.115  11.501
  604    HB2  PRO  80           2HB      PRO  80   0.841   5.404  14.042
  605    HB3  PRO  80           1HB      PRO  80   1.059   3.734  13.513
  606    HG2  PRO  80           2HG      PRO  80   3.131   5.431  13.678
  607    HG3  PRO  80           1HG      PRO  80   3.034   4.199  12.405
  608    HD2  PRO  80           2HD      PRO  80   2.433   7.137  12.247
  609    HD3  PRO  80           1HD      PRO  80   3.300   6.101  11.092
  610    H    LEU  81           H        LEU  81  -1.846   4.106  12.980
  611    HA   LEU  81           HA       LEU  81  -3.358   6.617  12.711
  612    HB2  LEU  81           2HB      LEU  81  -4.332   3.801  13.249
  613    HB3  LEU  81           1HB      LEU  81  -5.365   5.211  13.100
  614    HG   LEU  81           HG       LEU  81  -4.454   5.478  10.736
  615   HD11  LEU  81          1HD1      LEU  81  -3.550   3.466   9.668
  616   HD12  LEU  81          2HD1      LEU  81  -3.471   2.671  11.240
  617   HD13  LEU  81          3HD1      LEU  81  -2.474   4.090  10.917
  618   HD21  LEU  81          3HD2      LEU  81  -6.690   4.629  11.199
  619   HD22  LEU  81          1HD2      LEU  81  -6.047   2.994  11.370
  620   HD23  LEU  81          2HD2      LEU  81  -5.976   3.814   9.809
  621    H    GLU  82           H        GLU  82  -4.630   7.440  14.449
  622    HA   GLU  82           HA       GLU  82  -3.523   6.769  17.089
  623    HB2  GLU  82           2HB      GLU  82  -4.394   8.995  17.820
  624    HB3  GLU  82           1HB      GLU  82  -3.160   9.070  16.576
  625    HG2  GLU  82           2HG      GLU  82  -6.095   9.250  15.934
  626    HG3  GLU  82           1HG      GLU  82  -5.142  10.660  16.382