*HEADER    HYDROLASE                               30-APR-98   1BCI      
*TITLE     C2 DOMAIN OF CYTOSOLIC PHOSPHOLIPASE A2, NMR, MINIMIZED       
*TITLE    2 AVERAGE STRUCTURE                                            
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: CYTOSOLIC PHOSPHOLIPASE A2;                        
*COMPND   3 CHAIN: NULL;                                                 
*COMPND   4 FRAGMENT: C2 DOMAIN;                                         
*COMPND   5 SYNONYM: CALB DOMAIN;                                        
*COMPND   6 EC: 3.1.1.4;                                                 
*COMPND   7 ENGINEERED: YES                                              
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                           
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                         
*SOURCE   5 EXPRESSION_SYSTEM_CELL_LINE: PROPRIETARY STRAIN/GI400;       
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR: PTRCHISB(INVITROGEN). A CDNA       
*SOURCE   7 FRAGMENT ENCODING AMINO ACIDS 1-138 OF HUMAN CYTOSOLIC       
*SOURCE   8 PHOSPHOLIPASE A2 WAS SUBCLONED INTO THE NCOI/ECORI SITES OF  
*SOURCE   9 THE VECTOR SUCH THAT THE 5' CODONS ENCODING THE N-TERMINAL   
*SOURCE  10 POLYHIS-TAG WERE REMOVED.                                    
*KEYWDS    HYDROLASE, LIPID DEGRADATION, CYTOSOLIC PHOSPHOLIPASE A2,     
*KEYWDS   2 CALCIUM-DEPENDENT LIPID BINDING, C2 DOMAIN, PHOSPHOCHOLINE   
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                              
*AUTHOR    G.Y.XU,T.MCDONAGH,H.A.YU,E.A.NALEFSKI,J.D.CLARK,D.A.CUMMING   
*REVDAT   1   12-OCT-04 1BCI    0   


!!   S17
assign (resid  16 and name C ) (resid  17 and name N )
       (resid  17 and name CA) (resid  17 and name C )  1.0  -120.0  50.0 2
!!   H18
assign (resid  17 and name C ) (resid  18 and name N )
       (resid  18 and name CA) (resid  18 and name C )  1.0  -120.0  40.0 2
!!   K19
assign (resid  18 and name C ) (resid  19 and name N )
       (resid  19 and name CA) (resid  19 and name C )  1.0  -120.0  40.0 2
!!   F20
assign (resid  19 and name C ) (resid  20 and name N )
       (resid  20 and name CA) (resid  20 and name C )  1.0  -120.0  30.0 2 
!!   T21
assign (resid  20 and name C ) (resid  21 and name N )
       (resid  21 and name CA) (resid  21 and name C )  1.0  -120.0  40.0 2
!!   V22
assign (resid  21 and name C ) (resid  22 and name N )
       (resid  22 and name CA) (resid  22 and name C )  1.0  -120.0  40.0 2
!!   V23
assign (resid  22 and name C ) (resid  23 and name N )
       (resid  23 and name CA) (resid  23 and name C )  1.0  -120.0  40.0 2
!!   R26
assign (resid  25 and name C ) (resid  26 and name N )
       (resid  26 and name CA) (resid  26 and name C )  1.0  -120.0  60.0 2
!!   A27
assign (resid  26 and name C ) (resid  27 and name N )
       (resid  27 and name CA) (resid  27 and name C )  1.0  -120.0  50.0 2
!!   T28
assign (resid  27 and name C ) (resid  28 and name N )
       (resid  28 and name CA) (resid  28 and name C )  1.0  -120.0  30.0 2
!!   T31
assign (resid  30 and name C ) (resid  31 and name N )
       (resid  31 and name CA) (resid  31 and name C )  1.0  -120.0  50.0 2
!!   A34
assign (resid  33 and name C ) (resid  34 and name N )
       (resid  34 and name CA) (resid  34 and name C )  1.0  -60.0   30.0 2
!!   F35
assign (resid  34 and name C ) (resid  35 and name N )
       (resid  35 and name CA) (resid  35 and name C )  1.0  -60.0  30.0 2
!!   L39
assign (resid  38 and name C ) (resid  39 and name N )
       (resid  39 and name CA) (resid  39 and name C )  1.0  -120.0  50.0 2
!!  D43
assign (resid  42 and name C ) (resid  43 and name N )
       (resid  43 and name CA) (resid  43 and name C )  1.0  -120.0  60.0 2
!!   V46
assign (resid  45 and name C ) (resid  46 and name N )
       (resid  46 and name CA) (resid  46 and name C )  1.0  -120.0  30.0 2
!!   E47
assign (resid  46 and name C ) (resid  47 and name N )
       (resid  47 and name CA) (resid  47 and name C )  1.0  -120.0  50.0 2
!!   L48
assign (resid  47 and name C ) (resid  48 and name N )
       (resid  48 and name CA) (resid  48 and name C )  1.0  -120.0  40.0 2
!!   F49
assign (resid  48 and name C ) (resid  49 and name N )
       (resid  49 and name CA) (resid  49 and name C )  1.0  -120.0  50.0 2
!!   T53
assign (resid  52 and name C ) (resid  53 and name N )
       (resid  53 and name CA) (resid  53 and name C )  1.0  -60.0  30.0 2
!!   D55
assign (resid  54 and name C ) (resid  55 and name N )
       (resid  55 and name CA) (resid  55 and name C )  1.0  -120.0  50.0 2
!!   S56
assign (resid  55 and name C ) (resid  56 and name N )
       (resid  56 and name CA) (resid  56 and name C )  1.0  -120.0  50.0 2
!!   R57
assign (resid  56 and name C ) (resid  57 and name N )
       (resid  57 and name CA) (resid  57 and name C )  1.0  -120.0  50.0 2
!!   K58
assign (resid  57 and name C ) (resid  58 and name N )
       (resid  58 and name CA) (resid  58 and name C )  1.0  -120.0  40.0 2
!!   R59
assign (resid  58 and name C ) (resid  59 and name N )
       (resid  59 and name CA) (resid  59 and name C )  1.0  -120.0  50.0 2
!!   T60
assign (resid  59 and name C ) (resid  60 and name N )
       (resid  60 and name CA) (resid  60 and name C )  1.0  -120.0  50.0 2
!!   H62
assign (resid  61 and name C ) (resid  62 and name N )
       (resid  62 and name CA) (resid  62 and name C )  1.0  -120.0  50.0 2
!!   F63
assign (resid  62 and name C ) (resid  63 and name N )
       (resid  63 and name CA) (resid  63 and name C )  1.0  -120.0  50.0 2
!!   N64
assign (resid  63 and name C ) (resid  64 and name N )
       (resid  64 and name CA) (resid  64 and name C )  1.0  -120.0  60.0 2
!!   D66
assign (resid  65 and name C ) (resid  66 and name N )
       (resid  66 and name CA) (resid  66 and name C )  1.0  -120.0  60.0 2
!!   I67
assign (resid  66 and name C ) (resid  67 and name N )
       (resid  67 and name CA) (resid  67 and name C )  1.0  -120.0  60.0 2
!!   N68
assign (resid  67 and name C ) (resid  68 and name N )
       (resid  68 and name CA) (resid  68 and name C )  1.0  -120.0  60.0 2
!!  V70
assign (resid  69 and name C ) (resid  70 and name N )
       (resid  70 and name CA) (resid  70 and name C )  1.0  -120.0  30.0 2
!!   W71
assign (resid  70 and name C ) (resid  71 and name N )
       (resid  71 and name CA) (resid  71 and name C )  1.0  -120.0  50.0 2
!!   E73
assign (resid  72 and name C ) (resid  73 and name N )
       (resid  73 and name CA) (resid  73 and name C )  1.0  -120.0  30.0 2
!!   T74
assign (resid  73 and name C ) (resid  74 and name N )
       (resid  74 and name CA) (resid  74 and name C )  1.0  -120.0  30.0 2
!!   F75
assign (resid  74 and name C ) (resid  75 and name N )
       (resid  75 and name CA) (resid  75 and name C )  1.0  -120.0  40.0 2
!!   E76
assign (resid  75 and name C ) (resid  76 and name N )
       (resid  76 and name CA) (resid  76 and name C )  1.0  -120.0  40.0 2
!!   F77
assign (resid  76 and name C ) (resid  77 and name N )
       (resid  77 and name CA) (resid  77 and name C )  1.0  -120.0  30.0 2
!!   I78
assign (resid  77 and name C ) (resid  78 and name N )
       (resid  78 and name CA) (resid  78 and name C )  1.0  -120.0  30.0 2
!!  L79*
assign (resid  78 and name C ) (resid  79 and name N )
       (resid  79 and name CA) (resid  79 and name C )  1.0  -120.0  40.0 2
!!   D80
assign (resid  79 and name C ) (resid  80 and name N )
       (resid  80 and name CA) (resid  80 and name C )  1.0  -120  50.0 2
!!   N82
assign (resid  81 and name C ) (resid  82 and name N )
       (resid  82 and name CA) (resid  82 and name C )  1.0  -120.0  40.0 2
!!   Q83
assign (resid  82 and name C ) (resid  83 and name N )
       (resid  83 and name CA) (resid  83 and name C )  1.0  -120.0  40.0 2
!!   E84
assign (resid  83 and name C ) (resid  84 and name N )
       (resid  84 and name CA) (resid  84 and name C )  1.0  -120.0  40.0 2
!!   V86
assign (resid  85 and name C ) (resid  86 and name N )
       (resid  86 and name CA) (resid  86 and name C )  1.0  -120.0  40.0 2
!!   L87
assign (resid  86 and name C ) (resid  87 and name N )
       (resid  87 and name CA) (resid  87 and name C )  1.0  -120.0  60.0 2
!!   E88
assign (resid  87 and name C ) (resid  88 and name N )
       (resid  88 and name CA) (resid  88 and name C )  1.0  -120.0  40.0 2
!!   I89
assign (resid  88 and name C ) (resid  89 and name N )
       (resid  89 and name CA) (resid  89 and name C )  1.0  -120.0  40.0 2
!!   T90
assign (resid  89 and name C ) (resid  90 and name N )
       (resid  90 and name CA) (resid  90 and name C )  1.0  -120.0  40.0 2
!!   L91
assign (resid  90 and name C ) (resid  91 and name N )
       (resid  91 and name CA) (resid  91 and name C )  1.0  -120.0  40.0 2
!!   M92
assign (resid  91 and name C ) (resid  92 and name N )
       (resid  92 and name CA) (resid  92 and name C )  1.0  -120.0  40.0 2
!!   D93
assign (resid  92 and name C ) (resid  93 and name N )
       (resid  93 and name CA) (resid  93 and name C )  1.0  -120.0  30.0 2
!!   A94
assign (resid  93 and name C ) (resid  94 and name N )
       (resid  94 and name CA) (resid  94 and name C )  1.0  -120.0  50.0 2
!!   N95
assign (resid  94 and name C ) (resid  95 and name N )
       (resid  95 and name CA) (resid  95 and name C )  1.0  -120.0  60.0 2
!!   D99
assign (resid  98 and name C ) (resid  99 and name N )
       (resid  99 and name CA) (resid  99 and name C )  1.0  -120.0  60.0 2
!!  E100
assign (resid  99 and name C ) (resid 100 and name N )
       (resid 100 and name CA) (resid 100 and name C )  1.0  -120.0  60.0 2
!!  T101
assign (resid 100 and name C ) (resid 101 and name N )
       (resid 101 and name CA) (resid 101 and name C )  1.0  -120.0  50.0 2
!!  T104
assign (resid 103 and name C ) (resid 104 and name N )
       (resid 104 and name CA) (resid 104 and name C )  1.0  -120.0  40.0 2
!!  A105
assign (resid 104 and name C ) (resid 105 and name N )
       (resid 105 and name CA) (resid 105 and name C )  1.0  -120.0  40.0 2
!!  T106
assign (resid 105 and name C ) (resid 106 and name N )
       (resid 106 and name CA) (resid 106 and name C )  1.0  -120.0  30.0 2
!!  F107
assign (resid 106 and name C ) (resid 107 and name N )
       (resid 107 and name CA) (resid 107 and name C )  1.0  -120.0  30.0 2
!!  V109
assign (resid 108 and name C ) (resid 109 and name N )
       (resid 109 and name CA) (resid 109 and name C )  1.0  -70.0   30.0 2
!!  S110
assign (resid 109 and name C ) (resid 110 and name N )
       (resid 110 and name CA) (resid 110 and name C )  1.0  -60.0   20.0 2
!!  S111
assign (resid 110 and name C ) (resid 111 and name N )
       (resid 111 and name CA) (resid 111 and name C )  1.0  -120.0  60.0 2
!! M112*
assign (resid 111 and name C ) (resid 112 and name N )
       (resid 112 and name CA) (resid 112 and name C )  1.0  -120.0  40.0 2
!! K113*
assign (resid 112 and name C ) (resid 113 and name N )
       (resid 113 and name CA) (resid 113 and name C )  1.0  -120.0  40.0 2
!!  V114
assign (resid 113 and name C ) (resid 114 and name N )
       (resid 114 and name CA) (resid 114 and name C )  1.0  -70.0   30.0 2
!!  E116
assign (resid 115 and name C ) (resid 116 and name N )
       (resid 116 and name CA) (resid 116 and name C )  1.0  -120.0  40.0 2
!!  K117
assign (resid 116 and name C ) (resid 117 and name N )
       (resid 117 and name CA) (resid 117 and name C )  1.0  -120.0  40.0 2
!!  K118
assign (resid 117 and name C ) (resid 118 and name N )
       (resid 118 and name CA) (resid 118 and name C )  1.0  -120.0  40.0 2
!!  E119
assign (resid 118 and name C ) (resid 119 and name N )
       (resid 119 and name CA) (resid 119 and name C )  1.0  -120.0  40.0 2
!!  V120
assign (resid 119 and name C ) (resid 120 and name N )
       (resid 120 and name CA) (resid 120 and name C )  1.0  -120.0  30.0 2
!!  F122
assign (resid 121 and name C ) (resid 122 and name N )
       (resid 122 and name CA) (resid 122 and name C )  1.0  -120.0  30.0 2
!!  I123
assign (resid 122 and name C ) (resid 123 and name N )
       (resid 123 and name CA) (resid 123 and name C )  1.0  -120.0  30.0 2
!!  F124
assign (resid 123 and name C ) (resid 124 and name N )
       (resid 124 and name CA) (resid 124 and name C )  1.0  -120.0  50.0 2
!!  Q126
assign (resid 125 and name C ) (resid 126 and name N )  !may7
       (resid 126 and name CA) (resid 126 and name C )  1.0  -120.0  40.0 2  !may6
!!  V127
assign (resid 126 and name C ) (resid 127 and name N )
       (resid 127 and name CA) (resid 127 and name C )  1.0  -120.0  30.0 2
!! T128*
assign (resid 127 and name C ) (resid 128 and name N )
       (resid 128 and name CA) (resid 128 and name C )  1.0  -120.0  50.0 2
!!  E129
assign (resid 128 and name C ) (resid 129 and name N )
       (resid 129 and name CA) (resid 129 and name C )  1.0  -120.0  40.0 2
!!  M130
assign (resid 129 and name C ) (resid 130 and name N )
       (resid 130 and name CA) (resid 130 and name C )  1.0  -120.0  40.0 2
!!  V131
assign (resid 130 and name C ) (resid 131 and name N )
       (resid 131 and name CA) (resid 131 and name C )  1.0  -120.0  50.0 2
!!  L132
assign (resid 131 and name C ) (resid 132 and name N )
       (resid 132 and name CA) (resid 132 and name C )  1.0  -120.0  50.0 2
!!  E133
assign (resid 132 and name C ) (resid 133 and name N )
       (resid 133 and name CA) (resid 133 and name C )  1.0  -120.0  40.0 2
!!  M134
assign (resid 133 and name C ) (resid 134 and name N )
       (resid 134 and name CA) (resid 134 and name C )  1.0  -120.0  40.0 2
!!  S135
assign (resid 134 and name C ) (resid 135 and name N )
       (resid 135 and name CA) (resid 135 and name C )  1.0  -120.0  40.0 2
!!  L136
assign (resid 135 and name C ) (resid 136 and name N )
       (resid 136 and name CA) (resid 136 and name C )  1.0  -120.0  30.0 2
!!  E137
assign (resid 136 and name C ) (resid 137 and name N )
       (resid 137 and name CA) (resid 137 and name C )  1.0  -120.0  50.0 2
!T21
assign (resid  21 and name N ) (resid  21 and name CA)
       (resid  21 and name CB) (resid  21 and name OG1)  1.0  -60.0  30.0 2
!T28
assign (resid  28 and name N ) (resid  28 and name CA)
       (resid  28 and name CB) (resid  28 and name OG1)  1.0  60.0  30.0 2
!T31
assign (resid  31 and name N ) (resid  31 and name CA)
       (resid  31 and name CB) (resid  31 and name OG1)  1.0  -60.0  30.0 2
!T60
assign (resid  60 and name N ) (resid  60 and name CA)
       (resid  60 and name CB) (resid  60 and name OG1)  1.0  60.0  30.0 2
!T74
assign (resid  74 and name N ) (resid  74 and name CA)
       (resid  74 and name CB) (resid  74 and name OG1)  1.0  -60.0  30.0 2
!T90
assign (resid  90 and name N ) (resid  90 and name CA)
       (resid  90 and name CB) (resid  90 and name OG1)  1.0  -60.0  30.0 2
!T101
assign (resid  101 and name N ) (resid  101 and name CA)
       (resid  101 and name CB) (resid  101 and name OG1)  1.0  -60.0  30.0 2
!T104 (Jan31)
assign (resid 104 and name N ) (resid 104 and name CA)
       (resid 104 and name CB) (resid 104 and name OG1)   1.0  180.0 30.0 2
!T106
assign (resid  106 and name N ) (resid  106 and name CA)
       (resid  106 and name CB) (resid  106 and name OG1)  1.0  60.0  30.0 2
!T128
assign (resid  128 and name N ) (resid  128 and name CA)
       (resid  128 and name CB) (resid  128 and name OG1)  1.0  -60.0  30.0 2
!I50
assign (resid  50 and name N ) (resid  50 and name CA)
       (resid  50 and name CB) (resid  50 and name CG1)  1.0  -60.0  30.0 2
assign (resid  50 and name CA) (resid  50 and name CB)
       (resid  50 and name CG1) (resid 50 and name CD1)  1.0  180.0  30.0 2
!I67
assign (resid  67 and name N ) (resid  67 and name CA)
       (resid  67 and name CB) (resid  67 and name CG1)  1.0  60.0  30.0 2
assign (resid  67 and name CA) (resid  67 and name CB)
       (resid  67 and name CG1) (resid 67 and name CD1)  1.0  180.0  30.0 2
!I78
assign (resid  78 and name N ) (resid  78 and name CA)
       (resid  78 and name CB) (resid  78 and name CG1)  1.0  -60.0  30.0 2
assign (resid  78 and name CA) (resid  78 and name CB)
       (resid  78 and name CG1) (resid 78 and name CD1)  1.0  180.0  30.0 2
!I89
assign (resid  89 and name N ) (resid  89 and name CA)
       (resid  89 and name CB) (resid  89 and name CG1)  1.0  -60.0  30.0 2
!I123
assign (resid  123 and name N ) (resid  123 and name CA)
       (resid  123 and name CB) (resid  123 and name CG1)  1.0  -60.0  30.0 2
assign (resid  123 and name CA) (resid  123 and name CB)
       (resid  123 and name CG1) (resid 123 and name CD1)  1.0  180.0  30.0 2
!L25
assign (resid  25 and name N ) (resid  25 and name CA)
       (resid  25 and name CB) (resid  25 and name CG)  1.0  180.0  30.0 2
!L39
assign (resid  39 and name N ) (resid  39 and name CA)
       (resid  39 and name CB) (resid  39 and name CG)  1.0  -60.0  30.0 2
assign (resid  39 and name CA ) (resid  39 and name CB)
       (resid  39 and name CG) (resid  39 and name CD1)  1.0  180.0 30.0 2
!L48
assign (resid  48 and name CA ) (resid  48 and name CB)
       (resid  48 and name CG) (resid  48 and name CD1)  1.0  60.0 30.0 2
!L87
assign (resid  87 and name N ) (resid  87 and name CA)
       (resid  87 and name CB) (resid  87 and name CG)  1.0  180.0 30.0 2
assign (resid  87 and name CA ) (resid 87 and name CB)
       (resid  87 and name CG) (resid  87 and name CD1)  1.0  60.0 30.0 2
!L91
assign (resid  91 and name N ) (resid  91 and name CA)
       (resid  91 and name CB) (resid  91 and name CG)  1.0  180.0  30.0 2
assign (resid  91 and name CA ) (resid  91 and name CB)
       (resid  91 and name CG) (resid  91 and name CD1)  1.0 -60.0  30.0 2
!L102 (Jan31)
assign (resid  102 and name N ) (resid 102 and name CA)
       (resid  102 and name CB) (resid 102 and name CG)  1.0  -60.0 30.0 2
assign (resid  102 and name CA ) (resid 102 and name CB)
       (resid  102 and name CG) (resid  102 and name CD1)  1.0 180.0 30.0 2
!L136
assign (resid  136 and name N ) (resid  136 and name CA)
       (resid  136 and name CB) (resid  136 and name CG)  1.0  180.0 30.0 2
assign (resid  136 and name CA ) (resid  136 and name CB)
       (resid  136 and name CG) (resid  136 and name CD1)  1.0  60.0 30.0 2
!V22
assign (resid  22 and name N ) (resid  22 and name CA)
       (resid  22 and name CB) (resid  22 and name CG1)  1.0  180.0 30.0 2
!V23
assign (resid  23 and name N ) (resid  23 and name CA)
       (resid  23 and name CB) (resid  23 and name CG1)  1.0  180.0 30.0 2
!V24
assign (resid  24 and name N ) (resid  24 and name CA)
       (resid  24 and name CB) (resid  24 and name CG1)  1.0  -60.0 30.0 2
!V30
assign (resid  30 and name N ) (resid  30 and name CA)
       (resid  30 and name CB) (resid  30 and name CG1)  1.0  60.0 30.0 2
!V46
assign (resid  46 and name N ) (resid  46 and name CA)
       (resid  46 and name CB) (resid  46 and name CG1)  1.0  180.0 30.0 2
!V70
assign (resid  70 and name N ) (resid  70 and name CA)
       (resid  70 and name CB) (resid  70 and name CG1)  1.0  180.0 30.0 2
!V86 
assign (resid  86 and name N ) (resid  86 and name CA)
       (resid  86 and name CB) (resid  86 and name CG1)  1.0  180.0 30.0 2
!V97
assign (resid  97 and name N ) (resid  97 and name CA)
       (resid  97 and name CB) (resid  97 and name CG1)  1.0  -60.0 30.0 2
!V109
assign (resid  109 and name N ) (resid  109 and name CA)
       (resid  109 and name CB) (resid  109 and name CG1)  1.0  60.0 30.0 2
!V120
assign (resid  120 and name N ) (resid  120 and name CA)
       (resid  120 and name CB) (resid  120 and name CG1)  1.0  180.0 30.0 2
!V127
assign (resid  127 and name N ) (resid  127 and name CA)
       (resid  127 and name CB) (resid  127 and name CG1)  1.0  -60.0  30.0 2
!V131
assign (resid  131 and name N ) (resid  131 and name CA)
       (resid  131 and name CB) (resid  131 and name CG1)  1.0  180.0 30.0 2
!V138
assign (resid  138 and name N ) (resid  138 and name CA)
       (resid  138 and name CB) (resid  138 and name CG1)  1.0  -60.0  30.0 2
!D40
assign (resid  40 and name N ) (resid  40 and name CA)
       (resid  40 and name CB) (resid  40 and name CG)  1.0  180.0  30.0 2
!D43
assign (resid  43 and name N ) (resid  43 and name CA)
       (resid  43 and name CB) (resid  43 and name CG)  1.0  -60.0  30.0 2
!D55
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assign (resid  56 and name N ) (resid  56 and name CA)
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assign (resid  110 and name N ) (resid  110 and name CA)
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assign (resid  58 and name N ) (resid  58 and name CA)
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assign (resid  113 and name N ) (resid  113 and name CA)
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assign (resid  118 and name N ) (resid  118 and name CA)
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assign (resid   23 and name HG2# )(resid   74 and name HB   )  4.0  2.2  2.5
assign (resid   23 and name HG2# )(resid  133 and name HN   )  4.0  2.2  2.5
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assign (resid   23 and name HN   )(resid  134 and name HB#  )  4.0  2.2  2.0
assign (resid   23 and name HN   )(resid  134 and name HN   )  4.0  2.2  1.0
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assign (resid   24 and name HA   )(resid   24 and name HG1# )  3.0  1.2  1.8
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assign (resid   24 and name HA   )(resid   24 and name HN   )  4.0  2.2  1.0
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assign (resid   24 and name HA   )(resid   26 and name HN   )  4.0  2.2  1.0
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assign (resid   24 and name HA   )(resid  132 and name HG   )  3.0  1.2  0.3
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assign (resid   24 and name HB   )(resid   24 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HB   )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HB   )(resid   72 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HB   )(resid   73 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HB   )(resid  132 and name HD2# )  4.0  2.2  2.5
assign (resid   24 and name HG#  )(resid   26 and name HN   )  4.0  2.2  3.4
assign (resid   24 and name HG1# )(resid   24 and name HB   )  3.0  1.2  1.8
assign (resid   24 and name HG1# )(resid   24 and name HN   )  3.0  1.2  1.8
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assign (resid   24 and name HG1# )(resid   71 and name HB#  )  4.0  2.2  3.5
assign (resid   24 and name HG1# )(resid   75 and name HE#  )  4.0  2.2  4.5
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assign (resid   24 and name HG2# )(resid   25 and name HD1# )  4.0  2.2  4.0
assign (resid   24 and name HG2# )(resid   27 and name HB#  )  4.0  2.2  4.0
assign (resid   24 and name HG2# )(resid   46 and name HB   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid   46 and name HG2# )  3.0  1.2  3.3
assign (resid   24 and name HG2# )(resid   71 and name HN   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid   72 and name HN   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid   73 and name HN   )  3.0  1.2  1.8
assign (resid   24 and name HG2# )(resid   74 and name HA   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid   75 and name HD#  )  4.0  2.2  4.5
assign (resid   24 and name HG2# )(resid   75 and name HN   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid  132 and name HA   )  4.0  2.2  2.5
assign (resid   24 and name HG2# )(resid  132 and name HD1# )  3.0  1.2  3.3
assign (resid   24 and name HG2# )(resid  132 and name HD2# )  4.0  2.2  4.0
assign (resid   24 and name HG2# )(resid  133 and name HN   )  4.0  2.2  3.0
assign (resid   24 and name HN   )(resid   73 and name HB#  )  4.0  2.2  2.0
assign (resid   24 and name HN   )(resid   73 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HN   )(resid   74 and name HA   )  4.0  2.2  1.0
assign (resid   24 and name HN   )(resid   75 and name HD#  )  4.0  2.2  3.0
assign (resid   24 and name HN   )(resid   75 and name HN   )  4.0  2.2  1.0
assign (resid   24 and name HN   )(resid  132 and name HB#  )  4.0  2.2  3.0
assign (resid   25 and name HA   )(resid   25 and name HB1  )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid   25 and name HB2  )  2.5  0.7  0.2
assign (resid   25 and name HA   )(resid   25 and name HD1# )  2.5  0.7  1.7
assign (resid   25 and name HA   )(resid   25 and name HD2# )  4.0  2.2  2.5
assign (resid   25 and name HA   )(resid   25 and name HG   )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid   25 and name HN   )  3.0  1.2  0.5
assign (resid   25 and name HA   )(resid   26 and name HN   )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid   72 and name HA   )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid   72 and name HB#  )  4.0  2.2  2.0
assign (resid   25 and name HA   )(resid   72 and name HN   )  3.0  1.2  0.5
assign (resid   25 and name HA   )(resid   73 and name HN   )  4.0  2.2  1.0
assign (resid   25 and name HA   )(resid  132 and name HD1# )  4.0  2.2  2.5
assign (resid   25 and name HB#  )(resid   25 and name HG   )  2.5  0.7  1.2
assign (resid   25 and name HB#  )(resid   72 and name HA   )  4.0  2.2  2.0
assign (resid   25 and name HB#  )(resid  131 and name HB   )  4.0  2.2  2.0
assign (resid   25 and name HB#  )(resid  132 and name HA   )  4.0  2.2  2.0
assign (resid   25 and name HB1  )(resid   25 and name HN   )  3.0  1.2  0.5
assign (resid   25 and name HB2  )(resid   25 and name HN   )  3.0  1.2  0.5
assign (resid   25 and name HD#  )(resid   25 and name HB#  )  2.5  0.7  2.9
assign (resid   25 and name HD#  )(resid   25 and name HG   )  2.5  0.7  1.9
assign (resid   25 and name HD1# )(resid   25 and name HN   )  4.0  2.2  2.5
assign (resid   25 and name HD1# )(resid   72 and name HA   )  2.5  0.7  1.7
assign (resid   25 and name HD1# )(resid   72 and name HB#  )  4.0  2.2  3.5
assign (resid   25 and name HD1# )(resid   72 and name HN   )  4.0  2.2  2.5
assign (resid   25 and name HD1# )(resid  132 and name HA   )  4.0  2.2  3.5
assign (resid   25 and name HD1# )(resid  133 and name HN   )  4.0  2.2  3.5
assign (resid   25 and name HD2# )(resid   25 and name HN   )  4.0  2.2  2.5
assign (resid   25 and name HD2# )(resid   26 and name HA   )  4.0  2.2  3.5
assign (resid   25 and name HD2# )(resid   73 and name HA   )  4.0  2.2  3.5
assign (resid   25 and name HD2# )(resid  133 and name HA   )  4.0  2.2  3.5
assign (resid   25 and name HD2# )(resid  133 and name HN   )  3.0  1.2  2.0
assign (resid   25 and name HG   )(resid   25 and name HN   )  4.0  2.2  1.0
assign (resid   25 and name HG   )(resid   26 and name HN   )  4.0  2.2  1.0 
assign (resid   25 and name HG   )(resid   72 and name HA   )  4.0  2.2  1.0
assign (resid   25 and name HG   )(resid   72 and name HB#  )  4.0  2.2  2.5
assign (resid   25 and name HN   )(resid   26 and name HN   )  3.0  1.2  0.5
assign (resid   25 and name HN   )(resid  130 and name HE#  )  4.0  2.2  2.5
assign (resid   25 and name HN   )(resid  131 and name HB   )  4.0  2.2  1.0
assign (resid   25 and name HN   )(resid  131 and name HG1# )  4.0  2.2  2.5
assign (resid   25 and name HN   )(resid  132 and name HA   )  3.0  1.2  0.5
assign (resid   25 and name HN   )(resid  132 and name HD1# )  4.0  2.2  2.5
assign (resid   25 and name HN   )(resid  132 and name HD2# )  4.0  2.2  2.5
assign (resid   25 and name HN   )(resid  132 and name HG#  )  3.0  1.2  3.3
assign (resid   25 and name HN   )(resid  133 and name HN   )  4.0  2.2  1.0
assign (resid   26 and name HA   )(resid   26 and name HB#  )  4.0  2.2  2.0
assign (resid   26 and name HA   )(resid   26 and name HN   )  3.0  1.2  0.5
assign (resid   26 and name HA   )(resid   27 and name HB#  )  4.0  2.2  3.0
assign (resid   26 and name HA   )(resid   27 and name HN   )  3.0  1.2  0.5
assign (resid   26 and name HA   )(resid   70 and name HA   )  4.0  2.2  1.0
assign (resid   26 and name HA   )(resid   70 and name HG1# )  4.0  2.2  2.5
assign (resid   26 and name HA   )(resid   70 and name HG2# )  3.0  1.2  1.8
assign (resid   26 and name HA   )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   26 and name HA   )(resid   72 and name HN   )  4.0  2.2  1.0
assign (resid   26 and name HB#  )(resid   26 and name HN   )  3.0  1.2  1.1
assign (resid   26 and name HB#  )(resid   27 and name HN   )  4.0  2.2  2.0
assign (resid   26 and name HB#  )(resid   28 and name HN   )  4.0  2.2  2.0
assign (resid   26 and name HB#  )(resid   70 and name HA   )  4.0  2.2  2.0
assign (resid   26 and name HB#  )(resid   70 and name HG2# )  2.5  0.7  2.7
assign (resid   26 and name HB#  )(resid  131 and name HN   )  4.0  2.2  2.0
assign (resid   26 and name HD#  )(resid   26 and name HB#  )  4.0  2.2  3.0
assign (resid   26 and name HD#  )(resid   26 and name HG#  )  3.0  1.2  2.3
assign (resid   26 and name HD#  )(resid   26 and name HN   )  4.0  2.2  2.0
assign (resid   26 and name HD#  )(resid   27 and name HN   )  4.0  2.2  2.0
assign (resid   26 and name HD#  )(resid   28 and name HG2# )  4.0  2.2  3.5
assign (resid   26 and name HD#  )(resid   70 and name HA   )  4.0  2.2  2.0
assign (resid   26 and name HD#  )(resid   70 and name HG1# )  3.0  1.2  2.8
assign (resid   26 and name HD#  )(resid   70 and name HG2# )  3.0  1.2  2.8
assign (resid   26 and name HE#  )(resid   26 and name HA   )  4.0  2.2  2.0
assign (resid   26 and name HG#  )(resid   26 and name HA   )  3.0  1.2  1.3
assign (resid   26 and name HG#  )(resid   26 and name HN   )  3.0  1.2  1.3
assign (resid   26 and name HG#  )(resid   70 and name HG2# )  4.0  2.2  3.5
assign (resid   26 and name HN   )(resid  131 and name HB   )  4.0  2.2  1.0
assign (resid   26 and name HN   )(resid  131 and name HN   )  4.0  2.2  1.0
assign (resid   27 and name HA   )(resid   27 and name HB#  )  2.5  0.7  1.7
assign (resid   27 and name HA   )(resid   27 and name HN   )  3.0  1.2  0.5
assign (resid   27 and name HA   )(resid   28 and name HN   )  2.5  0.7  0.4
assign (resid   27 and name HA   )(resid   30 and name HG#  )  4.0  2.2  3.4
assign (resid   27 and name HA   )(resid  130 and name HA   )  3.0  1.2  0.3
assign (resid   27 and name HA   )(resid  130 and name HB#  )  4.0  2.2  2.0
assign (resid   27 and name HA   )(resid  130 and name HE#  )  4.0  2.2  2.5
assign (resid   27 and name HA   )(resid  130 and name HG#  )  4.0  2.2  2.0
assign (resid   27 and name HA   )(resid  131 and name HG2# )  4.0  2.2  3.5
assign (resid   27 and name HA   )(resid  131 and name HN   )  4.0  2.2  1.0
assign (resid   27 and name HB#  )(resid   28 and name HA   )  4.0  2.2  2.5
assign (resid   27 and name HB#  )(resid   28 and name HN   )  4.0  2.2  2.5
assign (resid   27 and name HB#  )(resid   30 and name HA   )  4.0  2.2  3.0
assign (resid   27 and name HB#  )(resid   30 and name HB   )  4.0  2.2  2.0
assign (resid   27 and name HB#  )(resid   46 and name HG2# )  4.0  2.2  4.0
assign (resid   27 and name HB#  )(resid   68 and name HA   )  4.0  2.2  2.5
assign (resid   27 and name HB#  )(resid   69 and name HD#  )  4.0  2.2  3.5
assign (resid   27 and name HB#  )(resid   71 and name HE3  )  4.0  2.2  2.5
assign (resid   27 and name HB#  )(resid  129 and name HA   )  4.0  2.2  3.5
assign (resid   27 and name HB#  )(resid  130 and name HA   )  2.5  0.7  1.7
assign (resid   27 and name HB#  )(resid  130 and name HB#  )  3.0  1.2  2.8
assign (resid   27 and name HB#  )(resid  130 and name HE#  )  2.5  0.7  3.2
assign (resid   27 and name HB#  )(resid  130 and name HG#  )  3.0  1.2  2.8
assign (resid   27 and name HN   )(resid   70 and name HA   )  4.0  2.2  1.0
assign (resid   27 and name HN   )(resid   70 and name HG2# )  4.0  2.2  2.5
assign (resid   27 and name HN   )(resid  129 and name HG#  )  4.0  2.2  3.0
assign (resid   27 and name HN   )(resid  131 and name HN   )  4.0  2.2  1.0
assign (resid   28 and name HA   )(resid   28 and name HB   )  2.5  0.7  0.2
assign (resid   28 and name HA   )(resid   28 and name HG2# )  2.5  0.7  1.7
assign (resid   28 and name HA   )(resid   28 and name HN   )  3.0  1.2  0.5
assign (resid   28 and name HA   )(resid   29 and name HA   )  4.0  2.2  1.0
assign (resid   28 and name HA   )(resid   29 and name HN   )  2.5  0.7  0.4
assign (resid   28 and name HA   )(resid   68 and name HA   )  2.5  0.7  0.2
assign (resid   28 and name HA   )(resid   68 and name HB#  )  4.0  2.2  2.0
assign (resid   28 and name HA   )(resid   69 and name HD#  )  4.0  2.2  2.0
assign (resid   28 and name HB   )(resid   28 and name HG2# )  2.5  0.7  1.7
assign (resid   28 and name HB   )(resid   28 and name HN   )  4.0  2.2  1.0
assign (resid   28 and name HB   )(resid   29 and name HA   )  4.0  2.2  1.0
assign (resid   28 and name HB   )(resid   29 and name HG#  )  4.0  2.2  2.0
assign (resid   28 and name HB   )(resid   29 and name HN   )  3.0  1.2  0.5
assign (resid   28 and name HB   )(resid   68 and name HA   )  4.0  2.2  1.0
assign (resid   28 and name HB   )(resid   69 and name HD1  )  4.0  2.2  2.0
assign (resid   28 and name HB   )(resid   69 and name HD2  )  4.0  2.2  1.0
assign (resid   28 and name HB   )(resid  129 and name HB#  )  4.0  2.2  2.0
assign (resid   28 and name HG2# )(resid   28 and name HN   )  3.0  1.2  1.8
assign (resid   28 and name HG2# )(resid   29 and name HA   )  4.0  2.2  2.5
assign (resid   28 and name HG2# )(resid   29 and name HN   )  3.0  1.2  1.8
assign (resid   28 and name HG2# )(resid   68 and name HA   )  4.0  2.2  2.5
assign (resid   28 and name HG2# )(resid   68 and name HB#  )  3.0  1.2  2.8
assign (resid   28 and name HN   )(resid   68 and name HA   )  4.0  2.2  1.0
assign (resid   28 and name HN   )(resid   70 and name HG#  )  4.0  2.2  3.4
assign (resid   28 and name HN   )(resid  128 and name HA   )  4.0  2.2  2.0
assign (resid   28 and name HN   )(resid  129 and name HG#  )  3.0  1.2  1.3
assign (resid   28 and name HN   )(resid  129 and name HN   )  3.0  1.2  0.7
assign (resid   28 and name HN   )(resid  130 and name HA   )  4.0  2.2  1.0
assign (resid   28 and name HN   )(resid  131 and name HN   )  4.0  2.2  2.0
assign (resid   29 and name HA   )(resid   29 and name HB#  )  3.0  1.2  1.3
assign (resid   29 and name HA   )(resid   29 and name HG#  )  3.0  1.2  1.3
assign (resid   29 and name HA   )(resid   29 and name HN   )  3.0  1.2  0.5
assign (resid   29 and name HA   )(resid   30 and name HN   )  3.0  1.2  0.5
assign (resid   29 and name HA   )(resid   67 and name HB   )  4.0  2.2  1.0
assign (resid   29 and name HA   )(resid   67 and name HD#  )  2.5  0.7  1.7
assign (resid   29 and name HA   )(resid  127 and name HG2# )  4.0  2.2  2.5
assign (resid   29 and name HA   )(resid  128 and name HA   )  4.0  2.2  2.0
assign (resid   29 and name HB#  )(resid   29 and name HG#  )  3.0  1.2  2.3
assign (resid   29 and name HB#  )(resid   29 and name HN   )  3.0  1.2  1.1
assign (resid   29 and name HB#  )(resid  127 and name HG2# )  3.0  1.2  2.8
assign (resid   29 and name HB#  )(resid  128 and name HA   )  3.0  1.2  1.3
assign (resid   29 and name HB#  )(resid  128 and name HG2# )  4.0  2.2  3.5
assign (resid   29 and name HB#  )(resid  129 and name HN   )  4.0  2.2  2.0
assign (resid   29 and name HD#  )(resid   29 and name HB#  )  4.0  2.2  3.0
assign (resid   29 and name HD#  )(resid   29 and name HG#  )  2.5  0.7  2.2
assign (resid   29 and name HD#  )(resid  127 and name HB   )  3.0  1.2  1.3
assign (resid   29 and name HD#  )(resid  127 and name HG1# )  3.0  1.2  2.8
assign (resid   29 and name HE#  )(resid   29 and name HG#  )  4.0  2.2  3.0
assign (resid   29 and name HE#  )(resid   67 and name HD#  )  4.0  2.2  3.5
assign (resid   29 and name HE#  )(resid  127 and name HG1# )  4.0  2.2  3.5 
assign (resid   29 and name HE#  )(resid  127 and name HG2# )  4.0  2.2  3.5 
assign (resid   29 and name HE#  )(resid  128 and name HN   )  4.0  2.2  2.0
assign (resid   29 and name HG#  )(resid   29 and name HN   )  3.0  1.2  1.3
assign (resid   29 and name HG#  )(resid   67 and name HG1# )  4.0  2.2  3.5
assign (resid   29 and name HG#  )(resid   67 and name HG2# )  4.0  2.2  3.5
assign (resid   29 and name HG#  )(resid  127 and name HG2# )  3.0  1.2  2.8
assign (resid   29 and name HG#  )(resid  129 and name HN   )  4.0  2.2  2.0
assign (resid   29 and name HN   )(resid   30 and name HN   )  3.0  1.2  0.5
assign (resid   29 and name HN   )(resid   67 and name HB   )  4.0  2.2  1.0
assign (resid   29 and name HN   )(resid   67 and name HD#  )  4.0  2.2  2.5
assign (resid   29 and name HN   )(resid   67 and name HG2# )  4.0  2.2  2.5
assign (resid   29 and name HN   )(resid   68 and name HA   )  3.0  1.2  0.5
assign (resid   29 and name HN   )(resid   69 and name HD#  )  4.0  2.2  2.0
assign (resid   30 and name HA   )(resid   30 and name HB   )  3.0  1.2  0.3
assign (resid   30 and name HA   )(resid   30 and name HG1# )  4.0  2.2  2.5
assign (resid   30 and name HA   )(resid   30 and name HG2# )  2.5  0.7  1.7
assign (resid   30 and name HA   )(resid   30 and name HN   )  4.0  2.2  1.0
assign (resid   30 and name HA   )(resid   31 and name HN   )  3.0  1.2  0.5
assign (resid   30 and name HA   )(resid   91 and name HD1# )  4.0  2.2  3.5
assign (resid   30 and name HA   )(resid  128 and name HA   )  4.0  2.2  1.0
assign (resid   30 and name HA   )(resid  128 and name HB   )  4.0  2.2  2.0
assign (resid   30 and name HA   )(resid  128 and name HG2# )  3.0  1.2  1.8
assign (resid   30 and name HA   )(resid  128 and name HG1 )   4.0  2.2  1.0 
assign (resid   30 and name HA   )(resid  128 and name HN   )  4.0  2.2  1.0
assign (resid   30 and name HB   )(resid   30 and name HG#  )  2.5  0.7  1.9
assign (resid   30 and name HB   )(resid   30 and name HN   )  3.0  1.2  0.5
assign (resid   30 and name HB   )(resid   67 and name HB   )  4.0  2.2  1.0
assign (resid   30 and name HB   )(resid   67 and name HG1# )  4.0  2.2  2.5
assign (resid   30 and name HG#  )(resid   44 and name HD#  )  4.0  2.2  4.0
assign (resid   30 and name HG#  )(resid   68 and name HA   )  4.0  2.2  4.0
assign (resid   30 and name HG1# )(resid   30 and name HN   )  2.5  0.7  1.7
assign (resid   30 and name HG2# )(resid   30 and name HN   )  3.0  1.2  1.8
assign (resid   30 and name HN   )(resid   67 and name HA   )  4.0  2.2  1.0
assign (resid   30 and name HN   )(resid   67 and name HB   )  3.0  1.2  0.5
assign (resid   30 and name HN   )(resid   67 and name HD#  )  3.0  1.2  2.0
assign (resid   31 and name HA   )(resid   31 and name HB   )  4.0  2.2  1.0
assign (resid   31 and name HA   )(resid   31 and name HG2# )  2.5  0.7  1.7
assign (resid   31 and name HA   )(resid   31 and name HN   )  3.0  1.2  0.5
assign (resid   31 and name HA   )(resid   32 and name HN   )  3.0  1.2  0.5
assign (resid   31 and name HA   )(resid   33 and name HN   )  4.0  2.2  2.0
assign (resid   31 and name HA   )(resid   42 and name HG#  )  4.0  2.2  2.0
assign (resid   31 and name HA   )(resid   67 and name HG2# )  4.0  2.2  2.5
assign (resid   31 and name HA   )(resid  128 and name HG1  )  4.0  2.2  1.0
assign (resid   31 and name HB   )(resid   31 and name HG2# )  2.5  0.7  1.7
assign (resid   31 and name HB   )(resid   31 and name HN   )  3.0  1.2  0.5
assign (resid   31 and name HB   )(resid   32 and name HA   )  4.0  2.2  2.0
assign (resid   31 and name HB   )(resid   42 and name HG#  )  4.0  2.2  3.0
assign (resid   31 and name HB   )(resid   67 and name HG2# )  4.0  2.2  3.5
assign (resid   31 and name HB   )(resid  127 and name HG2# )  3.0  1.2  2.5
assign (resid   31 and name HG1  )(resid  128 and name HB   )  4.0  2.2  1.0
assign (resid   31 and name HG1  )(resid  128 and name HN   )  4.0  2.2  1.0
assign (resid   31 and name HG1  )(resid  129 and name HN   )  4.0  2.2  2.0
assign (resid   31 and name HG2# )(resid   31 and name HN   )  3.0  1.2  1.8
assign (resid   31 and name HG2# )(resid   32 and name HN   )  4.0  2.2  2.5
assign (resid   31 and name HG2# )(resid   33 and name HA#  )  4.0  2.2  3.5
assign (resid   31 and name HG2# )(resid   33 and name HN   )  4.0  2.2  2.5
assign (resid   31 and name HG2# )(resid  127 and name HB   )  4.0  2.2  2.5
assign (resid   31 and name HN   )(resid  128 and name HB   )  4.0  2.2  1.0
assign (resid   31 and name HN   )(resid  128 and name HG1  )  4.0  2.2  1.0
assign (resid   31 and name HN   )(resid  128 and name HN   )  4.0  2.2  1.0
assign (resid   32 and name HA   )(resid   32 and name HB#  )  4.0  2.2  2.0
assign (resid   32 and name HA   )(resid   32 and name HG#  )  4.0  2.2  2.0
assign (resid   32 and name HA   )(resid   32 and name HN   )  4.0  2.2  1.0
assign (resid   32 and name HA   )(resid   33 and name HN   )  3.0  1.2  0.5
assign (resid   32 and name HA   )(resid  102 and name HD2# )  4.0  2.2  2.5
assign (resid   32 and name HB#  )(resid   32 and name HG#  )  4.0  2.2  3.0
assign (resid   32 and name HB#  )(resid   67 and name HD#  )  4.0  2.2  4.5
assign (resid   32 and name HD#  )(resid  102 and name HD2# )  4.0  2.2  3.5
assign (resid   32 and name HE#  )(resid   32 and name HD#  )  3.0  1.2  2.3
assign (resid   32 and name HE#  )(resid   42 and name HA   )  4.0  2.2  2.0
assign (resid   32 and name HE#  )(resid   67 and name HG2# )  4.0  2.2  3.5
assign (resid   32 and name HE#  )(resid   91 and name HD1# )  4.0  2.2  3.5
assign (resid   32 and name HE#  )(resid  102 and name HD1# )  4.0  2.2  3.5
assign (resid   32 and name HE#  )(resid  102 and name HD2# )  3.0  1.2  2.8
assign (resid   32 and name HG#  )(resid   32 and name HN   )  4.0  2.2  2.0
assign (resid   32 and name HG#  )(resid   33 and name HN   )  3.0  1.2  1.5
assign (resid   32 and name HG#  )(resid  102 and name HD1# )  4.0  2.2  3.5
assign (resid   32 and name HG#  )(resid  102 and name HD2# )  4.0  2.2  3.5
assign (resid   32 and name HN   )(resid   33 and name HN   )  3.0  1.2  0.5
assign (resid   33 and name HA#  )(resid   34 and name HB#  )  4.0  2.2  3.5
assign (resid   33 and name HA1  )(resid   33 and name HN   )  3.0  1.2  0.5
assign (resid   33 and name HA1  )(resid   34 and name HN   )  3.0  1.2  0.5
assign (resid   33 and name HA2  )(resid   33 and name HN   )  3.0  1.2  0.5
assign (resid   33 and name HA2  )(resid   34 and name HN   )  3.0  1.2  0.5
assign (resid   33 and name HN   )(resid   34 and name HN   )  4.0  2.2  1.0
assign (resid   34 and name HA   )(resid   34 and name HB#  )  2.5  0.7  1.7
assign (resid   34 and name HA   )(resid   34 and name HN   )  4.0  2.2  1.0
assign (resid   34 and name HA   )(resid   35 and name HN   )  4.0  2.2  1.0
assign (resid   34 and name HA   )(resid   37 and name HB#  )  3.0  1.2  1.3
assign (resid   34 and name HA   )(resid   37 and name HN   )  4.0  2.2  2.0
assign (resid   34 and name HB#  )(resid   35 and name HA   )  4.0  2.2  2.0
assign (resid   34 and name HB#  )(resid   35 and name HN   )  3.0  1.2  1.8
assign (resid   34 and name HB#  )(resid   38 and name HE#  )  3.0  1.2  3.3
assign (resid   35 and name HA   )(resid   35 and name HB1  )  2.5  0.7  0.2
assign (resid   35 and name HA   )(resid   35 and name HB2  )  3.0  1.2  0.3
assign (resid   35 and name HA   )(resid   35 and name HN   )  3.0  1.2  0.5
assign (resid   35 and name HA   )(resid   36 and name HN   )  4.0  2.2  1.0
assign (resid   35 and name HA   )(resid   38 and name HB#  )  4.0  2.2  2.0 
assign (resid   35 and name HA   )(resid   38 and name HE#  )  2.5  0.7  1.7
assign (resid   35 and name HA   )(resid   38 and name HG#  )  4.0  2.2  2.0
assign (resid   35 and name HA   )(resid   38 and name HN   )  4.0  2.2  1.0
assign (resid   35 and name HB#  )(resid   35 and name HN   )  3.0  1.2  1.1
assign (resid   35 and name HB#  )(resid   36 and name HN   )  3.0  1.2  1.3
assign (resid   35 and name HB#  )(resid   38 and name HE#  )  4.0  2.2  3.5
assign (resid   35 and name HN   )(resid   36 and name HN   )  3.0  1.2  0.5
assign (resid   36 and name HA#  )(resid   36 and name HN   )  3.0  1.2  1.1
assign (resid   36 and name HA#  )(resid   37 and name HN   )  4.0  2.2  2.0
assign (resid   36 and name HA#  )(resid   39 and name HB#  )  4.0  2.2  3.0 
assign (resid   36 and name HA#  )(resid   39 and name HD1# )  4.0  2.2  3.5
assign (resid   36 and name HA#  )(resid   39 and name HN   )  4.0  2.2  2.0
assign (resid   36 and name HN   )(resid   37 and name HN   )  3.0  1.2  0.5
assign (resid   36 and name HN   )(resid   38 and name HN   )  4.0  2.2  1.0
assign (resid   37 and name HA   )(resid   37 and name HB#  )  3.0  1.2  1.3
assign (resid   37 and name HA   )(resid   37 and name HN   )  3.0  1.2  0.5
assign (resid   37 and name HA   )(resid   38 and name HN   )  4.0  2.2  1.0
assign (resid   37 and name HA   )(resid   41 and name HA   )  4.0  2.2  1.0
assign (resid   37 and name HA   )(resid   41 and name HG2# )  4.0  2.2  2.5
assign (resid   37 and name HA   )(resid   42 and name HD1  )  4.0  2.2  1.0
assign (resid   37 and name HA   )(resid   42 and name HD2  )  4.0  2.2  1.0
assign (resid   37 and name HB#  )(resid   37 and name HN   )  3.0  1.2  1.1
assign (resid   37 and name HB#  )(resid   38 and name HN   )  3.0  1.2  1.3
assign (resid   37 and name HB#  )(resid   41 and name HG2# )  4.0  2.2  3.5
assign (resid   37 and name HN   )(resid   38 and name HB#  )  4.0  2.2  2.0
assign (resid   37 and name HN   )(resid   38 and name HN   )  3.0  1.2  0.5
assign (resid   38 and name HA   )(resid   38 and name HB#  )  2.5  0.7  1.2
assign (resid   38 and name HA   )(resid   38 and name HE#  )  4.0  2.2  2.5
assign (resid   38 and name HA   )(resid   38 and name HN   )  3.0  1.2  0.5
assign (resid   38 and name HA   )(resid   39 and name HG   )  4.0  2.2  1.0
assign (resid   38 and name HA   )(resid   39 and name HN   )  4.0  2.2  1.0
assign (resid   38 and name HB#  )(resid   38 and name HN   )  3.0  1.2  1.1
assign (resid   38 and name HB#  )(resid   39 and name HD1# )  4.0  2.2  3.5
assign (resid   38 and name HB#  )(resid   39 and name HN   )  3.0  1.2  1.3
assign (resid   38 and name HG#  )(resid   38 and name HA   )  3.0  1.2  1.3
assign (resid   38 and name HG#  )(resid   38 and name HB#  )  2.5  0.7  1.2
assign (resid   38 and name HG#  )(resid   38 and name HN   )  3.0  1.2  1.3
assign (resid   38 and name HG#  )(resid   39 and name HD#  )  4.0  2.2  4.4
assign (resid   38 and name HG#  )(resid   39 and name HN   )  4.0  2.2  2.0
assign (resid   38 and name HN   )(resid   39 and name HB#  )  4.0  2.2  2.0
assign (resid   38 and name HN   )(resid   39 and name HD#  )  4.0  2.2  3.4
assign (resid   38 and name HN   )(resid   39 and name HG   )  4.0  2.2  1.0
assign (resid   38 and name HN   )(resid   39 and name HN   )  3.0  1.2  0.5
assign (resid   38 and name HN   )(resid   40 and name HN   )  4.0  2.2  1.0
assign (resid   39 and name HA   )(resid   39 and name HB1  )  2.5  0.7  0.2
assign (resid   39 and name HA   )(resid   39 and name HB2  )  4.0  2.2  1.0
assign (resid   39 and name HA   )(resid   39 and name HD1# )  4.0  2.2  2.5
assign (resid   39 and name HA   )(resid   39 and name HD2# )  2.5  0.7  1.7
assign (resid   39 and name HA   )(resid   39 and name HG   )  3.0  1.2  0.3
assign (resid   39 and name HA   )(resid   39 and name HN   )  3.0  1.2  0.5
assign (resid   39 and name HA   )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   39 and name HB#  )(resid   39 and name HN   )  4.0  2.2  2.0
assign (resid   39 and name HB#  )(resid   40 and name HN   )  3.0  1.2  1.3
assign (resid   39 and name HD#  )(resid   39 and name HB#  )  2.5  0.7  2.9
assign (resid   39 and name HD#  )(resid   39 and name HG   )  2.5  0.7  1.9
assign (resid   39 and name HD1# )(resid   39 and name HN   )  4.0  2.2  2.5
assign (resid   39 and name HD1# )(resid   96 and name HA   )  4.0  2.2  2.5
assign (resid   39 and name HD2# )(resid   39 and name HN   )  4.0  2.2  2.5
assign (resid   39 and name HG   )(resid   39 and name HN   )  2.5  0.7  0.4
assign (resid   39 and name HG   )(resid   40 and name HA   )  4.0  2.2  2.0
assign (resid   39 and name HG   )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   39 and name HN   )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   39 and name HN   )(resid   64 and name HB#  )  4.0  2.2  3.0 
assign (resid   40 and name HA   )(resid   40 and name HB1  )  4.0  2.2  1.0
assign (resid   40 and name HA   )(resid   40 and name HB2  )  2.5  0.7  0.2
assign (resid   40 and name HA   )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   40 and name HB1  )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   40 and name HB2  )(resid   40 and name HN   )  3.0  1.2  0.5
assign (resid   41 and name HA   )(resid   41 and name HB   )  3.0  1.2  0.3
assign (resid   41 and name HA   )(resid   41 and name HG2# )  2.5  0.7  1.7
assign (resid   41 and name HA   )(resid   42 and name HD1  )  3.0  1.2  0.3
assign (resid   41 and name HA   )(resid   42 and name HD2  )  3.0  1.2  0.3
assign (resid   41 and name HA   )(resid   42 and name HG#  )  4.0  2.2  2.0
assign (resid   41 and name HA   )(resid   65 and name HA   )  4.0  2.2  2.0
assign (resid   41 and name HA   )(resid   67 and name HG2# )  4.0  2.2  2.5
assign (resid   41 and name HB   )(resid   41 and name HG2# )  2.5  0.7  1.7
assign (resid   41 and name HB   )(resid   65 and name HA   )  4.0  2.2  1.0
assign (resid   41 and name HB   )(resid   65 and name HB1  )  4.0  2.2  1.0
assign (resid   41 and name HB   )(resid   65 and name HB2  )  4.0  2.2  1.0
assign (resid   41 and name HB   )(resid   67 and name HG2# )  4.0  2.2  3.5
assign (resid   41 and name HG2# )(resid   42 and name HD#  )  3.0  1.2  2.8
assign (resid   41 and name HG2# )(resid   42 and name HG#  )  4.0  2.2  3.5
assign (resid   41 and name HG2# )(resid   65 and name HA   )  2.5  0.7  1.7
assign (resid   41 and name HG2# )(resid   65 and name HB1  )  3.0  1.2  1.8
assign (resid   41 and name HG2# )(resid   65 and name HB2  )  3.0  1.2  1.8
assign (resid   41 and name HG2# )(resid   65 and name HN   )  4.0  2.2  2.5
assign (resid   42 and name HA   )(resid   43 and name HN   )  3.0  1.2  0.5
assign (resid   42 and name HA   )(resid   93 and name HB#  )  4.0  2.2  2.0
assign (resid   42 and name HA   )(resid  102 and name HD1# )  4.0  2.2  2.5 
assign (resid   42 and name HB#  )(resid   42 and name HA   )  2.5  0.7  1.2
assign (resid   42 and name HB#  )(resid   43 and name HN   )  3.0  1.2  2.0
assign (resid   42 and name HB#  )(resid  102 and name HD1# )  4.0  2.2  3.5
assign (resid   42 and name HD#  )(resid   67 and name HG2# )  2.5  0.7  2.7
assign (resid   43 and name HA   )(resid   43 and name HB1  )  2.5  0.7  0.2 
assign (resid   43 and name HA   )(resid   43 and name HB2  )  4.0  2.2  1.0 
assign (resid   43 and name HA   )(resid   43 and name HN   )  4.0  2.2  1.0
assign (resid   43 and name HA   )(resid   44 and name HD#  )  3.0  1.2  1.3
assign (resid   43 and name HA   )(resid   64 and name HA   )  4.0  2.2  1.0
assign (resid   43 and name HA   )(resid   64 and name HB#  )  4.0  2.2  3.0 
assign (resid   43 and name HA   )(resid   65 and name HN   )  3.0  1.2  0.5
assign (resid   43 and name HA   )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   43 and name HA   )(resid   94 and name HB#  )  4.0  2.2  2.5
assign (resid   43 and name HB#  )(resid   44 and name HG#  )  4.0  2.2  3.0
assign (resid   43 and name HB1  )(resid   43 and name HN   )  4.0  2.2  1.0 
assign (resid   43 and name HB1  )(resid   64 and name HA   )  4.0  2.2  1.0
assign (resid   43 and name HB1  )(resid   94 and name HB#  )  3.0  1.2  1.8 
assign (resid   43 and name HB2  )(resid   94 and name HN   )  3.0  1.2  0.5
assign (resid   43 and name HB2  )(resid   43 and name HN   )  3.0  1.2  0.5
assign (resid   43 and name HB2  )(resid   64 and name HA   )  4.0  2.2  1.0 
assign (resid   43 and name HB2  )(resid   94 and name HB#  )  3.0  1.2  1.8 
assign (resid   43 and name HB1  )(resid   94 and name HN   )  4.0  2.2  1.0 
assign (resid   43 and name HN   )(resid   93 and name HA   )  4.0  2.2  2.0
assign (resid   43 and name HN   )(resid   93 and name HB2  )  4.0  2.2  1.0
assign (resid   43 and name HN   )(resid  102 and name HD1# )  4.0  2.2  2.5
assign (resid   44 and name HA   )(resid   45 and name HN   )  2.5  0.7  0.4
assign (resid   44 and name HA   )(resid   71 and name HZ2  )  4.0  2.2  1.0
assign (resid   44 and name HA   )(resid   91 and name HD1# )  4.0  2.2  2.5
assign (resid   44 and name HA   )(resid   93 and name HA   )  3.0  1.2  0.3
assign (resid   44 and name HA   )(resid   93 and name HB#  )  4.0  2.2  2.0
assign (resid   44 and name HA   )(resid   94 and name HN   )  4.0  2.2  1.0
assign (resid   44 and name HB#  )(resid   45 and name HD#  )  4.0  2.2  4.0
assign (resid   44 and name HB#  )(resid   45 and name HN   )  3.0  1.2  1.3
assign (resid   44 and name HB#  )(resid   46 and name HG2# )  4.0  2.2  3.5
assign (resid   44 and name HB#  )(resid   63 and name HN   )  4.0  2.2  2.0
assign (resid   44 and name HB#  )(resid   63 and name HN   )  4.0  2.2  3.0 
assign (resid   44 and name HB#  )(resid   69 and name HG#  )  4.0  2.2  3.0
assign (resid   44 and name HB#  )(resid   91 and name HD1# )  4.0  2.2  3.5
assign (resid   44 and name HD#  )(resid   63 and name HA   )  4.0  2.2  2.0
assign (resid   44 and name HD#  )(resid   63 and name HN   )  4.0  2.2  2.0
assign (resid   44 and name HG#  )(resid   93 and name HA   )  4.0  2.2  3.0
assign (resid   45 and name HA   )(resid   45 and name HB#  )  4.0  2.2  2.0
assign (resid   45 and name HA   )(resid   45 and name HN   )  3.0  1.2  0.5
assign (resid   45 and name HA   )(resid   46 and name HG2# )  4.0  2.2  2.5
assign (resid   45 and name HA   )(resid   46 and name HN   )  3.0  1.2  0.5
assign (resid   45 and name HA   )(resid   60 and name HG2# )  4.0  2.2  2.5
assign (resid   45 and name HA   )(resid   62 and name HA   )  4.0  2.2  1.0
assign (resid   45 and name HA   )(resid   71 and name HH2  )  4.0  2.2  1.0
assign (resid   45 and name HA   )(resid   71 and name HZ2  )  4.0  2.2  1.0
assign (resid   45 and name HA   )(resid   93 and name HA   )  4.0  2.2  2.0
assign (resid   45 and name HB#  )(resid   45 and name HN   )  4.0  2.2  1.6
assign (resid   45 and name HB#  )(resid   46 and name HN   )  3.0  1.2  1.3
assign (resid   45 and name HB#  )(resid   62 and name HA   )  4.0  2.2  2.0 
assign (resid   45 and name HB#  )(resid   62 and name HB#  )  4.0  2.2  3.0
assign (resid   45 and name HB#  )(resid   63 and name HN   )  3.0  1.2  1.3
assign (resid   45 and name HB#  )(resid   71 and name HE1  )  4.0  2.2  2.0
assign (resid   45 and name HD#  )(resid   45 and name HN   )  3.0  1.2  2.3
assign (resid   45 and name HD#  )(resid   46 and name HN   )  4.0  2.2  3.0
assign (resid   45 and name HD#  )(resid   60 and name HN   )  4.0  2.2  3.0
assign (resid   45 and name HD#  )(resid   61 and name HN   )  4.0  2.2  3.0
assign (resid   45 and name HD#  )(resid   62 and name HA   )  4.0  2.2  3.0
assign (resid   45 and name HD#  )(resid   94 and name HB#  )  4.0  2.2  4.5
assign (resid   45 and name HD#  )(resid   94 and name HN   )  4.0  2.2  3.0
assign (resid   45 and name HE#  )(resid   46 and name HG2# )  4.0  2.2  4.5
assign (resid   45 and name HN   )(resid   71 and name HH2  )  4.0  2.2  1.0
assign (resid   45 and name HN   )(resid   71 and name HZ2  )  4.0  2.2  1.0
assign (resid   45 and name HN   )(resid   91 and name HA   )  4.0  2.2  2.0
assign (resid   45 and name HN   )(resid   92 and name HB#  )  4.0  2.2  2.0
assign (resid   45 and name HN   )(resid   92 and name HN   )  3.0  1.2  0.8
assign (resid   45 and name HN   )(resid   93 and name HA   )  3.0  1.2  0.5
assign (resid   46 and name HA   )(resid   46 and name HB   )  4.0  2.2  1.0
assign (resid   46 and name HA   )(resid   46 and name HG1# )  2.5  0.7  1.7
assign (resid   46 and name HA   )(resid   46 and name HG2# )  2.5  0.7  1.7
assign (resid   46 and name HA   )(resid   46 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HA   )(resid   47 and name HN   )  2.5  0.7  0.4
assign (resid   46 and name HA   )(resid   60 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HA   )(resid   90 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HA   )(resid   91 and name HA   )  4.0  2.2  1.0
assign (resid   46 and name HA   )(resid   92 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HB   )(resid   46 and name HN   )  3.0  1.2  0.5
assign (resid   46 and name HB   )(resid   47 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HB   )(resid   48 and name HD1# )  4.0  2.2  2.5
assign (resid   46 and name HB   )(resid   60 and name HG2# )  4.0  2.2  2.5
assign (resid   46 and name HB   )(resid   60 and name HN   )  4.0  2.2  1.0
assign (resid   46 and name HG1# )(resid   46 and name HB   )  3.0  1.2  1.8
assign (resid   46 and name HG1# )(resid   46 and name HN   )  4.0  2.2  2.5
assign (resid   46 and name HG1# )(resid   47 and name HN   )  3.0  1.2  1.8
assign (resid   46 and name HG1# )(resid   47 and name HA   )  4.0  2.2  2.5
assign (resid   46 and name HG1# )(resid   60 and name HA   )  4.0  2.2  3.5
assign (resid   46 and name HG1# )(resid   60 and name HG2# )  4.0  2.2  4.0
assign (resid   46 and name HG1# )(resid   89 and name HD#  )  4.0  2.2  4.0
assign (resid   46 and name HG1# )(resid   90 and name HB   )  4.0  2.2  2.5
assign (resid   46 and name HG1# )(resid   90 and name HN   )  3.0  1.2  2.0
assign (resid   46 and name HG1# )(resid   91 and name HA   )  4.0  2.2  3.5
assign (resid   46 and name HG1# )(resid   92 and name HN   )  4.0  2.2  2.5
assign (resid   46 and name HG1# )(resid  132 and name HD1# )  4.0  2.2  5.0
assign (resid   46 and name HG1# )(resid  132 and name HD2# )  4.0  2.2  4.0
assign (resid   46 and name HG2# )(resid   46 and name HB   )  3.0  1.2  1.8
assign (resid   46 and name HG2# )(resid   46 and name HN   )  3.0  1.2  1.8
assign (resid   46 and name HG2# )(resid   47 and name HN   )  3.0  1.2  1.8
assign (resid   46 and name HG2# )(resid   48 and name HD1# )  4.0  2.2  4.0
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assign (resid   52 and name HG2# )(resid   53 and name HN   )  3.0  1.2  1.8
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assign (resid   52 and name HG2# )(resid   83 and name HA   )  4.0  2.2  3.5
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assign (resid   57 and name HA   )(resid   57 and name HB#  )  3.0  1.2  1.3
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assign (resid   57 and name HD#  )(resid   57 and name HN   )  4.0  2.2  2.0
assign (resid   57 and name HD#  )(resid   58 and name HN   )  4.0  2.2  2.0
assign (resid   57 and name HG#  )(resid   57 and name HA   )  3.0  1.2  1.3
assign (resid   57 and name HG#  )(resid   57 and name HB#  )  3.0  1.2  2.3
assign (resid   57 and name HG#  )(resid   57 and name HN   )  3.0  1.2  1.3
assign (resid   57 and name HN   )(resid   58 and name HG#  )  3.0  1.2  1.3
assign (resid   57 and name HN   )(resid   58 and name HN   )  4.0  2.2  1.0
assign (resid   58 and name HA   )(resid   58 and name HB1  )  3.0  1.2  0.3
assign (resid   58 and name HA   )(resid   58 and name HB2  )  4.0  2.2  1.0
assign (resid   58 and name HA   )(resid   58 and name HD#  )  4.0  2.2  2.0
assign (resid   58 and name HA   )(resid   58 and name HE#  )  4.0  2.2  2.0
assign (resid   58 and name HA   )(resid   58 and name HG#  )  4.0  2.2  2.0
assign (resid   58 and name HA   )(resid   58 and name HN   )  3.0  1.2  0.5
assign (resid   58 and name HA   )(resid   59 and name HN   )  4.0  2.2  1.0
assign (resid   58 and name HB#  )(resid   59 and name HN   )  4.0  2.2  2.0
assign (resid   58 and name HB1  )(resid   58 and name HN   )  4.0  2.2  1.0
assign (resid   58 and name HB2  )(resid   58 and name HN   )  3.0  1.2  0.5
assign (resid   58 and name HD#  )(resid   58 and name HG#  )  3.0  1.2  2.3
assign (resid   58 and name HD#  )(resid   58 and name HN   )  3.0  1.2  1.3
assign (resid   58 and name HE#  )(resid   58 and name HB#  )  4.0  2.2  3.0
assign (resid   58 and name HE#  )(resid   58 and name HD#  )  3.0  1.2  2.3
assign (resid   58 and name HE#  )(resid   58 and name HG#  )  3.0  1.2  2.3
assign (resid   58 and name HE#  )(resid   58 and name HN   )  4.0  2.2  2.0
assign (resid   58 and name HG#  )(resid   58 and name HB#  )  4.0  2.2  3.0
assign (resid   58 and name HG#  )(resid   58 and name HN   )  3.0  1.2  1.3
assign (resid   58 and name HN   )(resid   59 and name HN   )  4.0  2.2  1.0
assign (resid   59 and name HA   )(resid   59 and name HG#  )  4.0  2.2  2.0
assign (resid   59 and name HA   )(resid   59 and name HN   )  3.0  1.2  0.5
assign (resid   59 and name HA   )(resid   60 and name HG2# )  4.0  2.2  2.5
assign (resid   59 and name HA   )(resid   60 and name HN   )  3.0  1.2  0.5
assign (resid   59 and name HB#  )(resid   59 and name HA   )  2.5  0.7  1.2
assign (resid   59 and name HB#  )(resid   59 and name HD#  )  3.0  1.2  2.3
assign (resid   59 and name HB#  )(resid   59 and name HG#  )  3.0  1.2  2.3
assign (resid   59 and name HB#  )(resid   59 and name HN   )  3.0  1.2  1.1
assign (resid   59 and name HB#  )(resid   60 and name HN   )  4.0  2.2  2.0
assign (resid   59 and name HD#  )(resid   59 and name HG#  )  3.0  1.2  2.3
assign (resid   59 and name HE#  )(resid   59 and name HA   )  4.0  2.2  2.0
assign (resid   59 and name HG#  )(resid   59 and name HN   )  3.0  1.2  1.5 
assign (resid   59 and name HG#  )(resid   60 and name HN   )  4.0  2.2  2.0
assign (resid   59 and name HN   )(resid   60 and name HG2# )  4.0  2.2  2.5
assign (resid   60 and name HA   )(resid   60 and name HB   )  2.5  0.7  0.2
assign (resid   60 and name HA   )(resid   60 and name HG2# )  2.5  0.7  1.7
assign (resid   60 and name HA   )(resid   60 and name HN   )  3.0  1.2  0.5
assign (resid   60 and name HA   )(resid   61 and name HN   )  3.0  1.2  0.5
assign (resid   60 and name HB   )(resid   60 and name HG2# )  2.5  0.7  1.7
assign (resid   60 and name HB   )(resid   60 and name HN   )  4.0  2.2  1.0
assign (resid   60 and name HG1  )(resid   61 and name HN   )  3.0  1.2  0.8 
assign (resid   60 and name HG1  )(resid   71 and name HE1  )  4.0  2.2  1.0
assign (resid   60 and name HG2# )(resid   60 and name HN   )  3.0  1.2  1.8
assign (resid   60 and name HG2# )(resid   61 and name HN   )  4.0  2.2  2.5
assign (resid   60 and name HG2# )(resid   71 and name HB#  )  4.0  2.2  3.5
assign (resid   60 and name HG2# )(resid   71 and name HE1  )  4.0  2.2  2.5
assign (resid   60 and name HG2# )(resid   73 and name HB#  )  4.0  2.2  3.5
assign (resid   60 and name HG2# )(resid   73 and name HG#  )  4.0  2.2  3.5
assign (resid   60 and name HG2# )(resid   89 and name HG2# )  4.0  2.2  4.0
assign (resid   61 and name HA   )(resid   61 and name HB#  )  3.0  1.2  1.3
assign (resid   61 and name HA   )(resid   61 and name HG#  )  4.0  2.2  2.0
assign (resid   61 and name HA   )(resid   61 and name HN   )  3.0  1.2  0.5
assign (resid   61 and name HA   )(resid   62 and name HN   )  2.5  0.7  0.4
assign (resid   61 and name HB#  )(resid   61 and name HN   )  3.0  1.2  1.1
assign (resid   61 and name HB#  )(resid   62 and name HN   )  3.0  1.2  1.3
assign (resid   61 and name HD#  )(resid   61 and name HA   )  4.0  2.2  2.0
assign (resid   61 and name HD#  )(resid   61 and name HB#  )  4.0  2.2  3.0
assign (resid   61 and name HD#  )(resid   61 and name HG#  )  3.0  1.2  2.3
assign (resid   61 and name HG#  )(resid   61 and name HB#  )  4.0  2.2  3.0
assign (resid   61 and name HG#  )(resid   61 and name HN   )  3.0  1.2  1.3
assign (resid   61 and name HN   )(resid   62 and name HN   )  4.0  2.2  1.0
assign (resid   62 and name HA   )(resid   62 and name HB1  )  4.0  2.2  1.0
assign (resid   62 and name HA   )(resid   62 and name HB2  )  4.0  2.2  1.0
assign (resid   62 and name HA   )(resid   62 and name HN   )  3.0  1.2  0.5
assign (resid   62 and name HA   )(resid   63 and name HN   )  3.0  1.2  0.5
assign (resid   62 and name HA   )(resid   71 and name HE1  )  4.0  2.2  1.0
assign (resid   62 and name HA   )(resid   94 and name HB#  )  4.0  2.2  2.5
assign (resid   62 and name HB#  )(resid   62 and name HN   )  3.0  1.2  1.1
assign (resid   62 and name HB#  )(resid   63 and name HN   )  4.0  2.2  2.0
assign (resid   62 and name HB#  )(resid   94 and name HB#  )  4.0  2.2  3.5
assign (resid   62 and name HD2  )(resid   63 and name HN   )  4.0  2.2  1.0
assign (resid   63 and name HA   )(resid   63 and name HB1  )  2.5  0.7  0.2
assign (resid   63 and name HA   )(resid   63 and name HB2  )  4.0  2.2  1.0
assign (resid   63 and name HA   )(resid   63 and name HN   )  3.0  1.2  0.5
assign (resid   63 and name HA   )(resid   64 and name HN   )  3.0  1.2  0.5
assign (resid   63 and name HB1  )(resid   63 and name HN   )  4.0  2.2  1.0
assign (resid   63 and name HB1  )(resid   64 and name HN   )  4.0  2.2  1.0
assign (resid   63 and name HB2  )(resid   63 and name HN   )  3.0  1.2  0.5
assign (resid   63 and name HB2  )(resid   64 and name HN   )  4.0  2.2  1.0
assign (resid   63 and name HD#  )(resid   63 and name HN   )  4.0  2.2  3.0
assign (resid   63 and name HN   )(resid   64 and name HN   )  4.0  2.2  1.0
assign (resid   63 and name HN   )(resid   71 and name HE1  )  4.0  2.2  2.0
assign (resid   64 and name HA   )(resid   64 and name HB1  )  3.0  1.2  0.3
assign (resid   64 and name HA   )(resid   64 and name HB2  )  3.0  1.2  0.3
assign (resid   64 and name HA   )(resid   64 and name HN   )  4.0  2.2  1.0
assign (resid   64 and name HA   )(resid   65 and name HN   )  3.0  1.2  0.5
assign (resid   64 and name HA   )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   64 and name HA   )(resid   94 and name HB#  )  4.0  2.2  2.5
assign (resid   64 and name HB1  )(resid   64 and name HN   )  3.0  1.2  0.5
assign (resid   64 and name HB1  )(resid   65 and name HN   )  4.0  2.2  1.0
assign (resid   64 and name HB2  )(resid   64 and name HN   )  4.0  2.2  1.0
assign (resid   64 and name HB2  )(resid   65 and name HN   )  4.0  2.2  1.0
assign (resid   65 and name HA   )(resid   65 and name HB1  )  3.0  1.2  0.3
assign (resid   65 and name HA   )(resid   65 and name HB2  )  3.0  1.2  0.3
assign (resid   65 and name HA   )(resid   65 and name HN   )  3.0  1.2  0.5
assign (resid   65 and name HA   )(resid   66 and name HN   )  3.0  1.2  0.5
assign (resid   65 and name HB1  )(resid   65 and name HN   )  4.0  2.2  1.0 
assign (resid   65 and name HB1  )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   65 and name HB2  )(resid   65 and name HN   )  4.0  2.2  1.0
assign (resid   65 and name HB2  )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   65 and name HN   )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   66 and name HA   )(resid   66 and name HN   )  3.0  1.2  0.5
assign (resid   66 and name HA   )(resid   67 and name HN   )  3.0  1.2  0.5
assign (resid   66 and name HB1  )(resid   66 and name HA   )  2.5  0.7  0.2
assign (resid   66 and name HB1  )(resid   66 and name HN   )  4.0  2.2  1.0
assign (resid   66 and name HB1  )(resid   67 and name HN   )  4.0  2.2  1.0
assign (resid   66 and name HB2  )(resid   66 and name HA   )  3.0  1.2  0.3
assign (resid   66 and name HB2  )(resid   66 and name HN   )  3.0  1.2  0.5
assign (resid   66 and name HB2  )(resid   67 and name HN   )  4.0  2.2  1.0
assign (resid   66 and name HN   )(resid   67 and name HD#  )  4.0  2.2  3.5
assign (resid   66 and name HN   )(resid   67 and name HG1# )  4.0  2.2  2.0
assign (resid   67 and name HA   )(resid   67 and name HB   )  2.5  0.7  0.2
assign (resid   67 and name HA   )(resid   67 and name HD#  )  4.0  2.2  2.5
assign (resid   67 and name HA   )(resid   67 and name HG1# )  4.0  2.2  2.0
assign (resid   67 and name HA   )(resid   67 and name HG2# )  2.5  0.7  1.7
assign (resid   67 and name HA   )(resid   67 and name HN   )  3.0  1.2  0.5
assign (resid   67 and name HA   )(resid   68 and name HN   )  4.0  2.2  1.0
assign (resid   67 and name HA   )(resid   69 and name HD#  )  4.0  2.2  2.0
assign (resid   67 and name HB   )(resid   67 and name HD#  )  2.5  0.7  1.7
assign (resid   67 and name HB   )(resid   67 and name HG1# )  4.0  2.2  2.0
assign (resid   67 and name HB   )(resid   67 and name HG2# )  2.5  0.7  1.7
assign (resid   67 and name HB   )(resid   67 and name HN   )  4.0  2.2  1.0
assign (resid   67 and name HB   )(resid   68 and name HN   )  4.0  2.2  1.0
assign (resid   67 and name HD#  )(resid   67 and name HN   )  4.0  2.2  2.5
assign (resid   67 and name HD#  )(resid   68 and name HD2# )  3.0  1.2  3.5
assign (resid   67 and name HD#  )(resid   68 and name HN   )  4.0  2.2  2.5
assign (resid   67 and name HG1# )(resid   67 and name HD#  )  2.5  0.7  2.7
assign (resid   67 and name HG1# )(resid   67 and name HG2# )  2.5  0.7  2.7
assign (resid   67 and name HG1# )(resid   68 and name HD2# )  4.0  2.2  3.0
assign (resid   67 and name HG2# )(resid   67 and name HN   )  3.0  1.2  1.3
assign (resid   67 and name HG2# )(resid   68 and name HB#  )  4.0  2.2  3.5
assign (resid   67 and name HG2# )(resid   68 and name HN   )  4.0  2.2  2.5
assign (resid   67 and name HN   )(resid   68 and name HN   )  4.0  2.2  1.0
assign (resid   68 and name HA   )(resid   68 and name HB1  )  4.0  2.2  1.0
assign (resid   68 and name HA   )(resid   68 and name HB2  )  4.0  2.2  1.0
assign (resid   68 and name HA   )(resid   68 and name HN   )  3.0  1.2  0.5
assign (resid   68 and name HA   )(resid   69 and name HD1  )  3.0  1.2  0.3
assign (resid   68 and name HA   )(resid   69 and name HD2  )  4.0  2.2  1.0 
assign (resid   68 and name HA   )(resid   69 and name HG#  )  4.0  2.2  2.0
assign (resid   68 and name HB#  )(resid   68 and name HN   )  3.0  1.2  1.1
assign (resid   68 and name HN   )(resid   69 and name HD#  )  3.0  1.2  1.3
assign (resid   69 and name HA   )(resid   70 and name HG2# )  4.0  2.2  2.5
assign (resid   69 and name HA   )(resid   70 and name HN   )  3.0  1.2  0.3
assign (resid   69 and name HB#  )(resid   70 and name HN   )  4.0  2.2  2.0
assign (resid   70 and name HA   )(resid   70 and name HB   )  4.0  2.2  1.0
assign (resid   70 and name HA   )(resid   70 and name HG1# )  3.0  1.2  1.8
assign (resid   70 and name HA   )(resid   70 and name HG2# )  3.0  1.2  1.8
assign (resid   70 and name HA   )(resid   70 and name HN   )  3.0  1.2  0.5
assign (resid   70 and name HA   )(resid   71 and name HN   )  3.0  1.2  0.5
assign (resid   70 and name HA   )(resid   72 and name HN   )  4.0  2.2  1.0
assign (resid   70 and name HB   )(resid   70 and name HG1# )  2.5  0.7  1.7
assign (resid   70 and name HB   )(resid   70 and name HG2# )  2.5  0.7  1.7
assign (resid   70 and name HB   )(resid   70 and name HN   )  3.0  1.2  0.5
assign (resid   70 and name HG1# )(resid   70 and name HN   )  4.0  2.2  2.5
assign (resid   70 and name HG1# )(resid   71 and name HE3  )  4.0  2.2  2.5
assign (resid   70 and name HG2# )(resid   70 and name HN   )  3.0  1.2  1.8
assign (resid   70 and name HN   )(resid   71 and name HE3  )  4.0  2.2  1.0
assign (resid   70 and name HN   )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   71 and name HA   )(resid   71 and name HB#  )  4.0  2.2  2.0
assign (resid   71 and name HA   )(resid   71 and name HN   )  3.0  1.2  0.5
assign (resid   71 and name HA   )(resid   72 and name HN   )  4.0  2.2  1.0
assign (resid   71 and name HB#  )(resid   71 and name HN   )  3.0  1.2  1.1
assign (resid   71 and name HB#  )(resid   72 and name HN   )  4.0  2.2  2.0
assign (resid   71 and name HB#  )(resid   73 and name HG#  )  4.0  2.2  3.0
assign (resid   71 and name HB#  )(resid   73 and name HN   )  4.0  2.2  2.0
assign (resid   71 and name HD1  )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   71 and name HE3  )(resid   71 and name HN   )  4.0  2.2  1.0
assign (resid   71 and name HE3  )(resid   73 and name HG#  )  4.0  2.2  2.5
assign (resid   71 and name HN   )(resid   72 and name HA   )  4.0  2.2  1.0
assign (resid   71 and name HN   )(resid   72 and name HN   )  2.5  0.7  0.4
assign (resid   72 and name HA   )(resid   72 and name HB1  )  2.5  0.7  0.2
assign (resid   72 and name HA   )(resid   72 and name HB2  )  3.0  1.2  0.3
assign (resid   72 and name HA   )(resid   72 and name HN   )  3.0  1.2  0.5
assign (resid   72 and name HA   )(resid   73 and name HN   )  3.0  1.2  0.5
assign (resid   72 and name HA   )(resid  130 and name HE#  )  4.0  2.0  3.5
assign (resid   72 and name HB1  )(resid   72 and name HN   )  3.0  1.2  0.5
assign (resid   72 and name HB2  )(resid   72 and name HN   )  4.0  2.2  1.0
assign (resid   72 and name HN   )(resid   73 and name HB#  )  4.0  2.2  2.0
assign (resid   72 and name HN   )(resid   73 and name HN   )  4.0  2.2  1.0
assign (resid   73 and name HA   )(resid   73 and name HB1  )  3.0  1.2  0.3
assign (resid   73 and name HA   )(resid   73 and name HB2  )  4.0  2.2  1.0
assign (resid   73 and name HA   )(resid   73 and name HG1  )  3.0  1.2  0.3
assign (resid   73 and name HA   )(resid   73 and name HG2  )  3.0  1.2  0.3
assign (resid   73 and name HA   )(resid   73 and name HN   )  3.0  1.2  0.5
assign (resid   73 and name HA   )(resid   74 and name HN   )  3.0  1.2  0.5
assign (resid   73 and name HB#  )(resid   74 and name HN   )  4.0  2.2  2.0
assign (resid   73 and name HB#  )(resid   75 and name HD#  )  4.0  2.2  4.0
assign (resid   73 and name HB1  )(resid   73 and name HN   )  4.0  2.2  1.0
assign (resid   73 and name HB2  )(resid   73 and name HN   )  3.0  1.2  1.3
assign (resid   73 and name HG#  )(resid   73 and name HN   )  3.0  1.2  1.3
assign (resid   73 and name HN   )(resid   75 and name HD#  )  4.0  2.2  3.0
assign (resid   74 and name HA   )(resid   74 and name HB   )  4.0  2.2  1.0
assign (resid   74 and name HA   )(resid   74 and name HG2# )  2.5  0.7  1.7
assign (resid   74 and name HA   )(resid   74 and name HN   )  3.0  1.2  0.5
assign (resid   74 and name HA   )(resid   75 and name HN   )  3.0  1.2  0.5
assign (resid   74 and name HB   )(resid   74 and name HG2# )  2.5  0.7  1.7
assign (resid   74 and name HB   )(resid   74 and name HN   )  3.0  1.2  0.5
assign (resid   74 and name HG2# )(resid   74 and name HN   )  4.0  2.2  2.5
assign (resid   74 and name HG2# )(resid   75 and name HA   )  4.0  2.2  2.5
assign (resid   74 and name HG2# )(resid   75 and name HN   )  3.0  1.2  1.8
assign (resid   74 and name HG2# )(resid   76 and name HA   )  4.0  2.2  2.5
assign (resid   75 and name HA   )(resid   75 and name HB#  )  3.0  1.2  1.3
assign (resid   75 and name HA   )(resid   75 and name HN   )  3.0  1.2  0.5
assign (resid   75 and name HA   )(resid   76 and name HN   )  3.0  1.2  0.5
assign (resid   75 and name HB#  )(resid   75 and name HN   )  3.0  1.2  1.1
assign (resid   75 and name HB#  )(resid   76 and name HN   )  4.0  2.2  2.0
assign (resid   75 and name HD#  )(resid   75 and name HN   )  3.0  1.2  2.3
assign (resid   75 and name HD#  )(resid   76 and name HN   )  4.0  2.2  3.4
assign (resid   75 and name HN   )(resid   76 and name HN   )  4.0  2.2  1.0
assign (resid   76 and name HA   )(resid   76 and name HB#  )  2.5  0.7  1.2
assign (resid   76 and name HA   )(resid   76 and name HG#  )  3.0  1.2  1.3
assign (resid   76 and name HA   )(resid   76 and name HN   )  3.0  1.2  0.5
assign (resid   76 and name HA   )(resid   77 and name HN   )  2.5  0.7  0.4
assign (resid   76 and name HB#  )(resid   76 and name HG#  )  2.5  0.7  2.2
assign (resid   76 and name HB#  )(resid   77 and name HA   )  4.0  2.2  2.0
assign (resid   76 and name HB#  )(resid   77 and name HN   )  4.0  2.2  2.0
assign (resid   76 and name HB#  )(resid   78 and name HB   )  4.0  2.2  3.0
assign (resid   76 and name HB#  )(resid   78 and name HD#  )  4.0  2.2  3.5
assign (resid   76 and name HG#  )(resid   76 and name HN   )  3.0  1.2  1.3
assign (resid   76 and name HG#  )(resid   77 and name HA   )  3.0  1.2  1.3
assign (resid   76 and name HG#  )(resid   77 and name HN   )  3.0  1.2  1.3
assign (resid   77 and name HA   )(resid   77 and name HB#  )  4.0  2.2  2.0
assign (resid   77 and name HA   )(resid   77 and name HN   )  3.0  1.2  0.5
assign (resid   77 and name HA   )(resid   78 and name HG1# )  4.0  2.2  2.0
assign (resid   77 and name HA   )(resid   78 and name HN   )  3.0  1.2  0.5
assign (resid   77 and name HA   )(resid   79 and name HD1# )  4.0  2.2  2.5
assign (resid   77 and name HB#  )(resid   77 and name HN   )  3.0  1.2  1.1
assign (resid   77 and name HB1  )(resid   78 and name HN   )  4.0  2.2  1.0
assign (resid   77 and name HB2  )(resid   78 and name HN   )  4.0  2.2  1.0
assign (resid   77 and name HD#  )(resid   77 and name HN   )  3.0  1.2  2.3
assign (resid   77 and name HD#  )(resid   78 and name HN   )  4.0  2.2  3.4
assign (resid   78 and name HA   )(resid   78 and name HB   )  4.0  2.2  1.0
assign (resid   78 and name HA   )(resid   78 and name HD#  )  3.0  1.2  1.8
assign (resid   78 and name HA   )(resid   78 and name HG1# )  4.0  2.2  2.0
assign (resid   78 and name HA   )(resid   78 and name HG2# )  2.5  0.7  1.7
assign (resid   78 and name HA   )(resid   78 and name HN   )  3.0  1.2  0.5
assign (resid   78 and name HA   )(resid   79 and name HG   )  4.0  2.2  1.0
assign (resid   78 and name HA   )(resid   79 and name HN   )  3.0  1.2  0.5
assign (resid   78 and name HB   )(resid   78 and name HD#  )  2.5  0.7  1.7
assign (resid   78 and name HB   )(resid   78 and name HG1# )  2.5  0.7  1.2
assign (resid   78 and name HB   )(resid   78 and name HG2# )  2.5  0.7  1.7
assign (resid   78 and name HB   )(resid   78 and name HN   )  3.0  1.2  0.5
assign (resid   78 and name HB   )(resid   79 and name HN   )  4.0  2.2  1.0
assign (resid   78 and name HD#  )(resid   78 and name HG1# )  2.5  0.7  2.7
assign (resid   78 and name HD#  )(resid   78 and name HN   )  4.0  2.2  2.5
assign (resid   78 and name HG1# )(resid   78 and name HG2# )  2.5  0.7  2.7
assign (resid   78 and name HG1# )(resid   78 and name HN   )  3.0  1.2  1.3
assign (resid   78 and name HG2# )(resid   78 and name HD#  )  2.5  0.7  3.2
assign (resid   78 and name HG2# )(resid   78 and name HN   )  4.0  2.2  2.5
assign (resid   78 and name HG2# )(resid   79 and name HN   )  3.0  1.2  1.8
assign (resid   79 and name HA   )(resid   79 and name HB#  )  3.0  1.2  1.3
assign (resid   79 and name HA   )(resid   79 and name HD#  )  3.0  1.2  2.0
assign (resid   79 and name HA   )(resid   79 and name HG   )  4.0  2.2  1.0
assign (resid   79 and name HA   )(resid   79 and name HN   )  3.0  1.2  0.5
assign (resid   79 and name HA   )(resid   80 and name HN   )  3.0  1.2  0.5
assign (resid   79 and name HB#  )(resid   79 and name HG   )  4.0  2.2  2.0
assign (resid   79 and name HB#  )(resid   79 and name HN   )  3.0  1.2  1.1
assign (resid   79 and name HB#  )(resid   80 and name HN   )  4.0  2.2  2.0
assign (resid   79 and name HD#  )(resid   79 and name HN   )  3.0  1.2  2.5
assign (resid   79 and name HD#  )(resid   80 and name HN   )  4.0  2.2  3.4
assign (resid   79 and name HD1# )(resid   79 and name HB#  )  3.0  1.2  2.8
assign (resid   79 and name HD1# )(resid   79 and name HG   )  3.0  1.2  1.8
assign (resid   79 and name HD1# )(resid   85 and name HD2# )  4.0  2.2  3.5
assign (resid   79 and name HD2# )(resid   79 and name HB#  )  3.0  1.2  2.8
assign (resid   79 and name HD2# )(resid   79 and name HG   )  3.0  1.2  1.8
assign (resid   79 and name HG   )(resid   79 and name HN   )  4.0  2.2  1.0 
assign (resid   79 and name HG   )(resid   80 and name HN   )  4.0  2.2  1.0
assign (resid   80 and name HA   )(resid   80 and name HB2  )  3.0  1.2  0.3
assign (resid   80 and name HA   )(resid   80 and name HN   )  4.0  2.2  1.0
assign (resid   80 and name HA   )(resid   81 and name HD#  )  2.5  0.7  1.2
assign (resid   80 and name HA   )(resid   81 and name HG#  )  4.0  2.2  2.0
assign (resid   80 and name HA   )(resid   82 and name HN   )  4.0  2.2  1.0
assign (resid   80 and name HB1  )(resid   80 and name HA   )  3.0  1.2  0.3
assign (resid   80 and name HB1  )(resid   80 and name HN   )  3.0  1.2  0.5
assign (resid   80 and name HB2  )(resid   80 and name HN   )  3.0  1.2  0.5
assign (resid   81 and name HA   )(resid   82 and name HN   )  3.0  1.2  0.5
assign (resid   81 and name HA   )(resid   83 and name HN   )  4.0  2.2  1.0
assign (resid   81 and name HA   )(resid   85 and name HD2# )  3.0  1.2  1.5
assign (resid   81 and name HB#  )(resid   82 and name HN   )  4.0  2.2  2.0
assign (resid   82 and name HA   )(resid   82 and name HB#  )  2.5  0.7  1.2
assign (resid   82 and name HA   )(resid   82 and name HN   )  3.0  1.2  0.5
assign (resid   82 and name HA   )(resid   83 and name HN   )  3.0  1.2  0.5
assign (resid   82 and name HB#  )(resid   82 and name HN   )  3.0  1.2  1.1
assign (resid   82 and name HB#  )(resid   82 and name HD21 )  4.0  2.2  1.0
assign (resid   82 and name HB#  )(resid   82 and name HD21 )  3.0  1.2  0.5
assign (resid   82 and name HB#  )(resid   83 and name HN   )  4.0  2.2  2.0
assign (resid   82 and name HD2# )(resid   82 and name HN   )  4.0  2.2  2.0
assign (resid   82 and name HD2# )(resid  110 and name HB#  )  4.0  2.2  3.0
assign (resid   82 and name HN   )(resid   83 and name HN   )  3.0  1.2  0.5
assign (resid   83 and name HA   )(resid   83 and name HB1  )  3.0  1.2  0.3
assign (resid   83 and name HA   )(resid   83 and name HB2  )  4.0  2.2  1.0
assign (resid   83 and name HA   )(resid   83 and name HG1  )  3.0  1.2  0.3
assign (resid   83 and name HA   )(resid   83 and name HG2  )  3.0  1.2  0.3
assign (resid   83 and name HA   )(resid   83 and name HN   )  3.0  1.2  0.5
assign (resid   83 and name HA   )(resid   84 and name HN   )  3.0  1.2  0.5
assign (resid   83 and name HB1  )(resid   83 and name HN   )  4.0  2.2  1.0
assign (resid   83 and name HB2  )(resid   83 and name HN   )  3.0  1.2  0.5
assign (resid   83 and name HG#  )(resid   83 and name HN   )  3.0  1.2  1.3
assign (resid   83 and name HN   )(resid   84 and name HN   )  4.0  2.2  1.0
assign (resid   83 and name HN   )(resid   85 and name HD2# )  4.0  2.2  2.0
assign (resid   84 and name HA   )(resid   84 and name HN   )  3.0  1.2  0.5
assign (resid   84 and name HA   )(resid   85 and name HN   )  2.5  0.7  0.4
assign (resid   84 and name HA   )(resid   86 and name HG2# )  4.0  2.2  2.5
assign (resid   84 and name HB#  )(resid   84 and name HA   )  2.5  0.7  1.2
assign (resid   84 and name HB#  )(resid   84 and name HN   )  3.0  1.2  1.1
assign (resid   84 and name HB#  )(resid   85 and name HN   )  4.0  2.2  2.0
assign (resid   84 and name HB#  )(resid   86 and name HG2# )  4.0  2.2  3.5
assign (resid   84 and name HG#  )(resid   84 and name HA   )  2.5  0.7  1.2
assign (resid   84 and name HG#  )(resid   84 and name HB#  )  2.5  0.7  2.2
assign (resid   84 and name HG#  )(resid   86 and name HG1# )  3.0  1.2  2.8
assign (resid   84 and name HG#  )(resid   86 and name HG2# )  3.0  1.2  2.8
assign (resid   85 and name HA   )(resid   85 and name HB1  )  2.5  0.7  0.2
assign (resid   85 and name HA   )(resid   85 and name HB2  )  4.0  2.2  1.0
assign (resid   85 and name HA   )(resid   85 and name HN   )  3.0  1.2  0.5
assign (resid   85 and name HA   )(resid   86 and name HG2# )  4.0  2.2  2.5
assign (resid   85 and name HA   )(resid   86 and name HN   )  3.0  1.2  0.5
assign (resid   85 and name HA   )(resid   88 and name HG#  )  4.0  2.2  3.0
assign (resid   85 and name HA   )(resid  109 and name HG1# )  4.0  2.2  2.5
assign (resid   85 and name HB#  )(resid  109 and name HB#  )  3.0  1.2  3.0
assign (resid   85 and name HB1  )(resid   85 and name HN   )  4.0  2.2  1.0
assign (resid   85 and name HB1  )(resid   86 and name HN   )  4.0  2.2  1.0
assign (resid   85 and name HB1  )(resid  109 and name HG1# )  3.0  1.2  1.8
assign (resid   85 and name HB1  )(resid  109 and name HG2# )  4.0  2.2  1.0
assign (resid   85 and name HB2  )(resid   85 and name HN   )  3.0  1.2  0.5
assign (resid   85 and name HB2  )(resid   86 and name HN   )  4.0  2.2  1.0
assign (resid   85 and name HB2  )(resid  109 and name HG1# )  3.0  1.2  1.8
assign (resid   85 and name HB2  )(resid  109 and name HG2# )  4.0  2.2  2.5
assign (resid   85 and name HD#  )(resid   85 and name HN   )  3.0  1.2  1.3
assign (resid   85 and name HD2# )(resid  109 and name HG1# )  4.0  2.2  3.5
assign (resid   85 and name HN   )(resid   86 and name HG#  )  4.0  2.2  3.4
assign (resid   85 and name HN   )(resid   86 and name HN   )  4.0  2.2  1.0
assign (resid   85 and name HN   )(resid  109 and name HG1# )  4.0  2.2  2.5
assign (resid   86 and name HA   )(resid   86 and name HG1# )  2.5  0.7  1.7
assign (resid   86 and name HA   )(resid   86 and name HG2# )  2.5  0.7  1.7
assign (resid   86 and name HA   )(resid   86 and name HN   )  4.0  2.2  1.0
assign (resid   86 and name HA   )(resid   87 and name HN   )  3.0  1.2  0.5
assign (resid   86 and name HA   )(resid  107 and name HN   )  4.0  2.2  1.0
assign (resid   86 and name HA   )(resid  108 and name HA   )  2.5  0.7  0.2
assign (resid   86 and name HA   )(resid  108 and name HB   )  4.0  2.2  1.0
assign (resid   86 and name HA   )(resid  108 and name HG2# )  3.0  1.2  1.8
assign (resid   86 and name HA   )(resid  109 and name HG1# )  4.0  2.2  2.5
assign (resid   86 and name HA   )(resid  109 and name HN   )  4.0  2.2  1.0
assign (resid   86 and name HB   )(resid   86 and name HA   )  3.0  1.2  0.3
assign (resid   86 and name HB   )(resid   86 and name HG#  )  2.5  0.7  1.9
assign (resid   86 and name HB   )(resid   86 and name HN   )  3.0  1.2  0.5
assign (resid   86 and name HB   )(resid   87 and name HN   )  4.0  2.2  1.0
assign (resid   86 and name HB   )(resid  108 and name HG2# )  3.0  1.2  3.5
assign (resid   86 and name HG1# )(resid   86 and name HN   )  3.0  1.2  1.8
assign (resid   86 and name HG1# )(resid   88 and name HG#  )  4.0  2.2  3.5
assign (resid   86 and name HG2# )(resid   86 and name HN   )  2.5  0.7  1.7
assign (resid   86 and name HG2# )(resid   88 and name HA   )  4.0  2.2  3.5
assign (resid   86 and name HG2# )(resid   88 and name HG#  )  4.0  2.2  3.5
assign (resid   87 and name HA   )(resid   87 and name HD1# )  2.5  0.7  1.7
assign (resid   87 and name HA   )(resid   87 and name HD2# )  4.0  2.2  2.5
assign (resid   87 and name HA   )(resid   87 and name HG   )  3.0  1.2  0.3
assign (resid   87 and name HA   )(resid   87 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HA   )(resid   88 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HB#  )(resid  107 and name HN   )  4.0  2.2  2.0
assign (resid   87 and name HB1  )(resid   87 and name HA   )  4.0  2.2  1.0
assign (resid   87 and name HB1  )(resid   87 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HB2  )(resid   87 and name HA   )  2.5  0.7  0.2
assign (resid   87 and name HB2  )(resid   87 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HD1# )(resid   87 and name HN   )  4.0  2.2  2.5
assign (resid   87 and name HD1# )(resid   88 and name HN   )  3.0  1.2  1.8
assign (resid   87 and name HD1# )(resid  107 and name HB#  )  4.0  2.2  3.5
assign (resid   87 and name HD1# )(resid  134 and name HE#  )  4.0  2.2  4.0
assign (resid   87 and name HD2# )(resid   87 and name HN   )  4.0  2.2  2.5
assign (resid   87 and name HD2# )(resid   89 and name HD#  )  2.5  0.7  3.2
assign (resid   87 and name HD2# )(resid   89 and name HG1# )  3.0  1.2  2.8
assign (resid   87 and name HD2# )(resid   89 and name HG2# )  3.0  1.2  3.3
assign (resid   87 and name HD2# )(resid  107 and name HA   )  4.0  2.2  2.5
assign (resid   87 and name HD2# )(resid  107 and name HB#  )  4.0  2.2  3.5
assign (resid   87 and name HD2# )(resid  107 and name HN   )  4.0  2.2  2.5
assign (resid   87 and name HD2# )(resid  109 and name HG1# )  4.0  2.2  4.0
assign (resid   87 and name HG   )(resid   87 and name HN   )  4.0  2.2  1.0
assign (resid   87 and name HG   )(resid   88 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HG   )(resid   89 and name HA   )  4.0  2.2  1.0
assign (resid   87 and name HG   )(resid  107 and name HN   )  4.0  2.2  1.0
assign (resid   87 and name HN   )(resid   88 and name HN   )  4.0  2.2  1.0
assign (resid   87 and name HN   )(resid   89 and name HD#  )  4.0  2.2  2.5
assign (resid   87 and name HN   )(resid  107 and name HN   )  3.0  1.2  0.5
assign (resid   87 and name HN   )(resid  109 and name HG1# )  3.0  1.2  2.0
assign (resid   87 and name HN   )(resid  109 and name HG2# )  4.0  2.2  2.5
assign (resid   87 and name HN   )(resid  109 and name HN   )  4.0  2.2  1.0
assign (resid   88 and name HA   )(resid   88 and name HN   )  3.0  1.2  0.5
assign (resid   88 and name HA   )(resid   89 and name HD#  )  4.0  2.2  2.5
assign (resid   88 and name HA   )(resid   89 and name HN   )  2.5  0.7  0.4
assign (resid   88 and name HA   )(resid   90 and name HG2# )  4.0  2.2  3.5
assign (resid   88 and name HA   )(resid  105 and name HN   )  4.0  2.2  1.0
assign (resid   88 and name HA   )(resid  106 and name HA   )  3.0  1.2  0.3
assign (resid   88 and name HA   )(resid  106 and name HB   )  4.0  2.2  1.0
assign (resid   88 and name HA   )(resid  106 and name HG2# )  4.0  2.2  2.5
assign (resid   88 and name HA   )(resid  107 and name HN   )  4.0  2.2  1.0
assign (resid   88 and name HB#  )(resid  106 and name HA   )  4.0  2.2  2.0
assign (resid   88 and name HB#  )(resid   88 and name HA   )  3.0  1.2  1.3
assign (resid   88 and name HB#  )(resid   88 and name HN   )  3.0  1.2  1.1
assign (resid   88 and name HB#  )(resid   89 and name HN   )  4.0  2.2  2.0
assign (resid   88 and name HG#  )(resid   88 and name HA   )  4.0  2.2  2.0
assign (resid   88 and name HG#  )(resid   88 and name HN   )  3.0  1.2  1.3
assign (resid   88 and name HG#  )(resid  106 and name HG2# )  3.0  1.2  2.8
assign (resid   88 and name HN   )(resid   89 and name HD#  )  4.0  2.2  2.5
assign (resid   88 and name HN   )(resid   89 and name HG1# )  4.0  2.2  2.0
assign (resid   89 and name HA   )(resid   89 and name HB   )  4.0  2.2  1.0
assign (resid   89 and name HA   )(resid   89 and name HD#  )  3.0  1.2  1.8
assign (resid   89 and name HA   )(resid   89 and name HG1# )  4.0  2.2  2.0
assign (resid   89 and name HA   )(resid   89 and name HG2# )  2.5  0.7  1.7
assign (resid   89 and name HA   )(resid   89 and name HN   )  3.0  1.2  0.5
assign (resid   89 and name HA   )(resid   90 and name HB   )  4.0  2.2  1.0
assign (resid   89 and name HA   )(resid   90 and name HN   )  2.5  0.7  0.4
assign (resid   89 and name HB   )(resid   89 and name HG1# )  4.0  2.2  2.0
assign (resid   89 and name HB   )(resid   89 and name HG2# )  2.5  0.7  1.7
assign (resid   89 and name HB   )(resid   89 and name HN   )  3.0  1.2  0.5
assign (resid   89 and name HB   )(resid   90 and name HN   )  4.0  2.2  1.0
assign (resid   89 and name HB   )(resid   91 and name HN   )  4.0  2.2  2.0
assign (resid   89 and name HB   )(resid  105 and name HA   )  4.0  2.2  1.0
assign (resid   89 and name HB   )(resid  105 and name HN   )  4.0  2.2  1.0
assign (resid   89 and name HD#  )(resid   89 and name HB   )  3.0  1.2  1.8
assign (resid   89 and name HD#  )(resid   89 and name HG1# )  3.0  1.2  2.8
assign (resid   89 and name HD#  )(resid   89 and name HG2# )  2.5  0.7  3.2
assign (resid   89 and name HD#  )(resid   89 and name HN   )  3.0  1.2  1.8
assign (resid   89 and name HD#  )(resid  105 and name HB#  )  3.0  1.2  3.3
assign (resid   89 and name HD#  )(resid  105 and name HN   )  4.0  2.2  2.5
assign (resid   89 and name HD#  )(resid  106 and name HA   )  3.0  1.2  1.8
assign (resid   89 and name HD#  )(resid  106 and name HB   )  4.0  2.2  2.5
assign (resid   89 and name HD#  )(resid  106 and name HN   )  4.0  2.2  2.5
assign (resid   89 and name HD#  )(resid  107 and name HA   )  4.0  2.2  2.5
assign (resid   89 and name HD#  )(resid  107 and name HB#  )  3.0  1.2  2.8
assign (resid   89 and name HD#  )(resid  107 and name HN   )  4.0  2.2  2.5
assign (resid   89 and name HD#  )(resid  130 and name HE#  )  4.0  2.2  4.0
assign (resid   89 and name HD#  )(resid  132 and name HD2# )  3.0  1.2  3.3
assign (resid   89 and name HG1# )(resid   89 and name HN   )  3.0  1.2  1.3
assign (resid   89 and name HG1# )(resid  105 and name HN   )  4.0  2.2  2.0
assign (resid   89 and name HG2# )(resid   89 and name HG1# )  3.0  1.2  2.8
assign (resid   89 and name HG2# )(resid   89 and name HN   )  4.0  2.2  2.5
assign (resid   89 and name HG2# )(resid   90 and name HG2# )  4.0  2.2  4.0
assign (resid   89 and name HG2# )(resid   90 and name HN   )  3.0  1.2  1.8
assign (resid   89 and name HG2# )(resid  104 and name HA   )  4.0  2.2  2.5
assign (resid   89 and name HG2# )(resid  105 and name HB#  )  3.0  1.2  3.3
assign (resid   89 and name HG2# )(resid  105 and name HN   )  4.0  2.2  2.5
assign (resid   89 and name HG2# )(resid  130 and name HE#  )  2.5  0.7  3.2
assign (resid   89 and name HN   )(resid  105 and name HB#  )  3.0  1.2  2.0
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assign (resid   89 and name HN   )(resid  106 and name HA   )  3.0  1.2  0.5
assign (resid   90 and name HA   )(resid   90 and name HG2# )  2.5  0.7  1.7
assign (resid   90 and name HA   )(resid   90 and name HN   )  3.0  1.2  0.5
assign (resid   90 and name HA   )(resid   91 and name HD2# )  4.0  2.2  3.5
assign (resid   90 and name HA   )(resid   91 and name HN   )  2.5  0.7  0.4
assign (resid   90 and name HA   )(resid  104 and name HA   )  2.5  0.7  0.2
assign (resid   90 and name HA   )(resid  104 and name HB   )  4.0  2.2  1.0
assign (resid   90 and name HA   )(resid  104 and name HG2# )  3.0  1.2  1.8
assign (resid   90 and name HA   )(resid  105 and name HB#  )  4.0  2.2  2.5
assign (resid   90 and name HA   )(resid  105 and name HN   )  3.0  1.2  0.5
assign (resid   90 and name HB   )(resid   90 and name HA   )  4.0  2.2  1.0
assign (resid   90 and name HB   )(resid   90 and name HG2# )  2.5  0.7  1.7
assign (resid   90 and name HB   )(resid   90 and name HN   )  3.0  1.2  0.5
assign (resid   90 and name HB   )(resid  104 and name HA   )  4.0  2.2  1.0
assign (resid   90 and name HG2# )(resid   90 and name HN   )  4.0  2.2  2.5
assign (resid   90 and name HG2# )(resid   92 and name HE#  )  3.0  1.2  3.3
assign (resid   90 and name HG2# )(resid   92 and name HG#  )  4.0  2.2  3.5
assign (resid   90 and name HG2# )(resid  101 and name HA   )  4.0  2.2  2.5
assign (resid   90 and name HG2# )(resid  101 and name HN   )  4.0  2.2  2.5
assign (resid   90 and name HG2# )(resid  102 and name HN   )  4.0  2.2  2.5
assign (resid   90 and name HG2# )(resid  103 and name HN   )  4.0  2.2  2.5
assign (resid   90 and name HG2# )(resid  104 and name HA   )  3.0  1.2  1.8
assign (resid   91 and name HA   )(resid   91 and name HB1  )  4.0  2.2  1.0
assign (resid   91 and name HA   )(resid   91 and name HB2  )  2.5  0.7  0.2
assign (resid   91 and name HA   )(resid   91 and name HD1# )  4.0  2.2  2.5
assign (resid   91 and name HA   )(resid   91 and name HN   )  4.0  2.2  1.0
assign (resid   91 and name HA   )(resid   92 and name HE#  )  4.0  2.2  3.5
assign (resid   91 and name HA   )(resid   92 and name HN   )  2.5  0.7  0.4
assign (resid   91 and name HA   )(resid  102 and name HD1# )  4.0  2.2  2.5
assign (resid   91 and name HA   )(resid  130 and name HE#  )  4.0  2.2  2.5
assign (resid   91 and name HB#  )(resid   92 and name HN   )  4.0  2.2  2.0
assign (resid   91 and name HB#  )(resid  130 and name HE#  )  3.0  1.2  2.3
assign (resid   91 and name HB1  )(resid   91 and name HN   )  3.0  1.2  0.5
assign (resid   91 and name HB1  )(resid  103 and name HN   )  4.0  2.2  1.0
assign (resid   91 and name HB2  )(resid   91 and name HN   )  3.0  1.2  0.5
assign (resid   91 and name HB2  )(resid  103 and name HN   )  4.0  2.2  1.0
assign (resid   91 and name HD1# )(resid   91 and name HB#  )  3.0  1.2  2.8
assign (resid   91 and name HD1# )(resid   91 and name HN   )  4.0  2.2  2.5
assign (resid   91 and name HD1# )(resid   92 and name HN   )  4.0  2.2  2.5
assign (resid   91 and name HD1# )(resid  102 and name HA   )  4.0  2.2  2.5
assign (resid   91 and name HD1# )(resid  125 and name HD2# )  4.0  2.2  4.0 
assign (resid   91 and name HD1# )(resid  128 and name HB   )  4.0  2.2  2.5
assign (resid   91 and name HD1# )(resid  128 and name HG2# )  3.0  1.2  3.3
assign (resid   91 and name HD2# )(resid   91 and name HA   )  3.0  1.2  1.4
assign (resid   91 and name HD2# )(resid   91 and name HB#  )  4.0  2.2  3.5
assign (resid   91 and name HD2# )(resid   91 and name HN   )  4.0  2.2  2.5
assign (resid   91 and name HD2# )(resid   92 and name HN   )  3.0  1.2  1.8
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assign (resid   92 and name HA   )(resid  102 and name HG   )  4.0  2.2  1.0
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assign (resid   92 and name HE#  )(resid   99 and name HA   )  4.0  2.2  2.5
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assign (resid   92 and name HE#  )(resid  101 and name HB   )  4.0  2.2  2.5
assign (resid   92 and name HE#  )(resid  101 and name HN   )  4.0  2.2  2.5
assign (resid   92 and name HG#  )(resid   92 and name HN   )  3.0  1.2  1.3
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assign (resid   92 and name HG#  )(resid  104 and name HG2# )  4.0  2.2  3.5
assign (resid   92 and name HN   )(resid  102 and name HD1# )  4.0  2.2  2.5
assign (resid   93 and name HA   )(resid   93 and name HB1  )  4.0  2.2  1.0
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assign (resid   93 and name HA   )(resid   93 and name HN   )  3.0  1.2  0.5
assign (resid   93 and name HA   )(resid   94 and name HN   )  3.0  1.2  0.5
assign (resid   93 and name HA   )(resid  102 and name HD1# )  4.0  2.2  2.5
assign (resid   93 and name HA   )(resid  102 and name HD2# )  4.0  2.2  2.5
assign (resid   93 and name HB#  )(resid  100 and name HB#  )  4.0  2.2  3.0
assign (resid   93 and name HB#  )(resid  100 and name HN   )  4.0  2.2  2.0
assign (resid   93 and name HB1  )(resid   93 and name HN   )  3.0  1.2  0.5
assign (resid   93 and name HB1  )(resid  102 and name HD1# )  3.0  1.2  1.8
assign (resid   93 and name HB1  )(resid  102 and name HD2# )  3.0  1.2  1.8
assign (resid   93 and name HB2  )(resid   93 and name HN   )  3.0  1.2  0.5
assign (resid   93 and name HB2  )(resid  102 and name HD1# )  2.5  0.7  1.7
assign (resid   93 and name HB2  )(resid  102 and name HD2# )  2.5  0.7  1.7
assign (resid   93 and name HB2  )(resid  102 and name HG   )  4.0  2.2  1.0
assign (resid   93 and name HN   )(resid  100 and name HN   )  4.0  2.2  1.0
assign (resid   93 and name HN   )(resid  101 and name HA   )  3.0  1.2  0.5
assign (resid   93 and name HN   )(resid  102 and name HD1# )  4.0  2.2  2.5
assign (resid   93 and name HN   )(resid  102 and name HG   )  3.0  1.2  0.5
assign (resid   94 and name HA   )(resid   94 and name HB#  )  2.5  0.7  1.7
assign (resid   94 and name HA   )(resid   94 and name HN   )  3.0  1.2  0.5
assign (resid   94 and name HA   )(resid   95 and name HN   )  3.0  1.2  0.5
assign (resid   94 and name HA   )(resid   99 and name HA   )  4.0  2.2  1.0
assign (resid   94 and name HB#  )(resid   95 and name HA   )  4.0  2.2  2.5
assign (resid   94 and name HB#  )(resid   95 and name HN   )  4.0  2.2  2.5
assign (resid   94 and name HB#  )(resid  100 and name HN   )  4.0  2.2  2.5
assign (resid   95 and name HA   )(resid   95 and name HB1  )  3.0  1.2  0.3
assign (resid   95 and name HA   )(resid   95 and name HB2  )  4.0  2.2  1.0
assign (resid   95 and name HA   )(resid   95 and name HN   )  3.0  1.2  0.5
assign (resid   95 and name HB#  )(resid   97 and name HB   )  4.0  2.2  2.0
assign (resid   95 and name HB1  )(resid   99 and name HA   )  4.0  2.2  1.0
assign (resid   95 and name HB2  )(resid   99 and name HA   )  4.0  2.2  1.0
assign (resid   95 and name HB1  )(resid   95 and name HN   )  4.0  2.2  1.0
assign (resid   95 and name HB1  )(resid   97 and name HG#  )  4.0  2.2  4.0
assign (resid   95 and name HB2  )(resid   95 and name HN   )  3.0  1.2  0.5
assign (resid   95 and name HD2# )(resid  100 and name HB#  )  4.0  2.2  3.0
assign (resid   95 and name HD2# )(resid  100 and name HG#  )  4.0  2.2  2.0 
assign (resid   95 and name HD2# )(resid  100 and name HN   )  4.0  2.2  2.0
assign (resid   96 and name HA   )(resid   96 and name HB1  )  2.5  0.7  0.2
assign (resid   96 and name HA   )(resid   96 and name HB2  )  3.0  1.2  0.3
assign (resid   96 and name HA   )(resid   97 and name HA   )  4.0  2.2  2.0
assign (resid   96 and name HB#  )(resid   97 and name HG#  )  3.0  1.2  4.0
assign (resid   97 and name HA   )(resid   97 and name HB   )  2.5  0.7  0.2
assign (resid   97 and name HA   )(resid   98 and name HA   )  4.0  2.2  2.0
assign (resid   97 and name HB   )(resid   97 and name HG#  )  2.5  0.7  1.9
assign (resid   97 and name HB   )(resid   98 and name HG#  )  2.5  0.7  1.2
assign (resid   97 and name HG#  )(resid   97 and name HA   )  2.5  0.7  1.9
assign (resid   97 and name HG#  )(resid   98 and name HA   )  4.0  2.2  3.4
assign (resid   98 and name HA   )(resid   98 and name HB#  )  2.5  0.7  1.2
assign (resid   98 and name HA   )(resid   98 and name HG#  )  2.5  0.7  1.2
assign (resid   98 and name HA   )(resid   99 and name HN   )  3.0  1.2  0.5
assign (resid   98 and name HB#  )(resid   98 and name HG#  )  2.5  0.7  2.2
assign (resid   98 and name HB#  )(resid   99 and name HN   )  3.0  1.2  1.3
assign (resid   99 and name HA   )(resid   99 and name HB#  )  3.0  1.2  1.3
assign (resid   99 and name HA   )(resid   99 and name HN   )  3.0  1.2  0.5
assign (resid   99 and name HA   )(resid  100 and name HN   )  3.0  1.2  0.5
assign (resid   99 and name HB#  )(resid   99 and name HN   )  3.0  1.2  1.1
assign (resid   99 and name HB#  )(resid  100 and name HN   )  4.0  2.2  2.0
assign (resid   99 and name HN   )(resid  100 and name HN   )  4.0  2.2  1.0
assign (resid  100 and name HA   )(resid  100 and name HN   )  3.0  1.2  0.5
assign (resid  100 and name HA   )(resid  101 and name HN   )  3.0  1.2  0.5
assign (resid  100 and name HB#  )(resid  100 and name HA   )  2.5  0.7  1.2
assign (resid  100 and name HB#  )(resid  100 and name HN   )  3.0  1.2  1.1
assign (resid  100 and name HG#  )(resid  100 and name HA   )  2.5  0.7  1.2
assign (resid  100 and name HG#  )(resid  100 and name HN   )  3.0  1.2  1.3
assign (resid  100 and name HG#  )(resid  101 and name HN   )  4.0  2.2  1.0 
assign (resid  101 and name HA   )(resid  101 and name HB   )  4.0  2.2  1.0
assign (resid  101 and name HA   )(resid  101 and name HG2# )  2.5  0.7  1.7
assign (resid  101 and name HA   )(resid  101 and name HN   )  3.0  1.2  0.5
assign (resid  101 and name HA   )(resid  102 and name HN   )  3.0  1.2  0.5
assign (resid  101 and name HA   )(resid  103 and name HN   )  4.0  2.2  1.0
assign (resid  101 and name HB   )(resid  101 and name HG2# )  2.5  0.7  1.7
assign (resid  101 and name HB   )(resid  101 and name HN   )  3.0  1.2  0.5
assign (resid  101 and name HG2# )(resid  101 and name HN   )  4.0  2.2  2.5
assign (resid  101 and name HG2# )(resid  102 and name HN   )  3.0  1.2  1.8
assign (resid  101 and name HG2# )(resid  103 and name HA#  )  4.0  2.2  3.5
assign (resid  101 and name HG2# )(resid  104 and name HB   )  4.0  2.2  2.5
assign (resid  101 and name HN   )(resid  102 and name HN   )  4.0  2.2  1.0
assign (resid  102 and name HA   )(resid  102 and name HB#  )  3.0  1.2  1.3
assign (resid  102 and name HA   )(resid  102 and name HG   )  3.0  1.2  0.3
assign (resid  102 and name HA   )(resid  102 and name HN   )  3.0  1.2  0.5
assign (resid  102 and name HA   )(resid  103 and name HN   )  3.0  1.2  0.5
assign (resid  102 and name HB#  )(resid  102 and name HN   )  3.0  1.2  1.1
assign (resid  102 and name HB#  )(resid  103 and name HN   )  4.0  2.2  2.0
assign (resid  102 and name HD1# )(resid  102 and name HA   )  4.0  2.2  2.5
assign (resid  102 and name HD1# )(resid  102 and name HB#  )  3.0  1.2  2.8
assign (resid  102 and name HD1# )(resid  102 and name HG   )  3.0  1.2  1.8
assign (resid  102 and name HD1# )(resid  102 and name HN   )  3.0  1.2  1.8
assign (resid  102 and name HD1# )(resid  103 and name HN   )  4.0  2.2  2.5
assign (resid  102 and name HD2# )(resid  102 and name HA   )  2.5  0.7  1.7
assign (resid  102 and name HD2# )(resid  102 and name HB#  )  3.0  1.2  2.8
assign (resid  102 and name HD2# )(resid  102 and name HG   )  2.5  0.7  1.7
assign (resid  102 and name HD2# )(resid  102 and name HN   )  4.0  2.2  2.5
assign (resid  102 and name HD2# )(resid  103 and name HN   )  4.0  2.2  2.5
assign (resid  102 and name HD2# )(resid  125 and name HD2# )  4.0  2.2  3.5 
assign (resid  102 and name HG   )(resid  102 and name HB#  )  3.0  1.2  1.3
assign (resid  102 and name HG   )(resid  102 and name HN   )  3.0  1.2  0.5
assign (resid  102 and name HG   )(resid  103 and name HN   )  4.0  2.2  1.0
assign (resid  102 and name HN   )(resid  103 and name HN   )  3.0  1.2  0.5
assign (resid  103 and name HA1  )(resid  103 and name HN   )  3.0  1.2  0.5
assign (resid  103 and name HA1  )(resid  104 and name HN   )  3.0  1.2  0.5
assign (resid  103 and name HA2  )(resid  103 and name HN   )  3.0  1.2  0.5
assign (resid  103 and name HA2  )(resid  104 and name HN   )  3.0  1.2  0.5
assign (resid  103 and name HN   )(resid  104 and name HN   )  4.0  2.2  1.0
assign (resid  104 and name HA   )(resid  104 and name HB   )  2.5  0.7  0.2
assign (resid  104 and name HA   )(resid  104 and name HG2# )  3.0  1.2  1.8
assign (resid  104 and name HA   )(resid  104 and name HN   )  3.0  1.2  0.5
assign (resid  104 and name HA   )(resid  105 and name HB#  )  4.0  2.2  2.5
assign (resid  104 and name HA   )(resid  105 and name HN   )  2.5  0.7  0.4
assign (resid  104 and name HB   )(resid  104 and name HG2# )  2.5  0.7  1.7
assign (resid  104 and name HB   )(resid  104 and name HN   )  3.0  1.2  0.5
assign (resid  104 and name HB   )(resid  105 and name HN   )  4.0  2.2  1.0
assign (resid  104 and name HG2# )(resid  104 and name HN   )  3.0  1.2  1.8
assign (resid  104 and name HG2# )(resid  105 and name HA   )  3.0  1.2  1.8
assign (resid  104 and name HG2# )(resid  105 and name HN   )  3.0  1.2  1.8
assign (resid  105 and name HA   )(resid  105 and name HB#  )  2.5  0.7  1.7
assign (resid  105 and name HA   )(resid  105 and name HN   )  3.0  1.2  0.5
assign (resid  105 and name HA   )(resid  106 and name HA   )  4.0  2.2  1.0
assign (resid  105 and name HA   )(resid  106 and name HG2# )  3.0  1.2  1.8
assign (resid  105 and name HA   )(resid  106 and name HN   )  2.5  0.7  0.4
assign (resid  105 and name HB#  )(resid  106 and name HN   )  2.5  0.7  1.7
assign (resid  106 and name HA   )(resid  106 and name HB   )  2.5  0.7  0.2
assign (resid  106 and name HA   )(resid  106 and name HG2# )  2.5  0.7  1.7
assign (resid  106 and name HA   )(resid  106 and name HN   )  3.0  1.2  0.5
assign (resid  106 and name HA   )(resid  107 and name HN   )  2.5  0.7  0.4
assign (resid  106 and name HB   )(resid  106 and name HG2# )  2.5  0.7  1.7
assign (resid  106 and name HB   )(resid  106 and name HN   )  4.0  2.2  1.0
assign (resid  106 and name HB   )(resid  107 and name HN   )  3.0  1.2  0.5
assign (resid  106 and name HG2# )(resid  106 and name HN   )  3.0  1.2  1.8
assign (resid  106 and name HG2# )(resid  107 and name HN   )  3.0  1.2  1.8
assign (resid  106 and name HN   )(resid  107 and name HN   )  4.0  2.2  1.0
assign (resid  107 and name HA   )(resid  107 and name HB1  )  4.0  2.2  1.0
assign (resid  107 and name HA   )(resid  107 and name HB2  )  3.0  1.2  0.3
assign (resid  107 and name HA   )(resid  107 and name HN   )  3.0  1.2  0.5
assign (resid  107 and name HB#  )(resid  109 and name HG2# )  4.0  2.2  3.5
assign (resid  107 and name HB1  )(resid  107 and name HN   )  3.0  1.2  0.5
assign (resid  107 and name HB2  )(resid  107 and name HN   )  3.0  1.2  0.5
assign (resid  107 and name HD#  )(resid  107 and name HN   )  3.0  1.2  2.3
assign (resid  107 and name HD#  )(resid  109 and name HG2# )  3.0  1.2  3.8
assign (resid  107 and name HD#  )(resid  109 and name HN   )  3.0  1.2  2.5
assign (resid  108 and name HA   )(resid  108 and name HB   )  3.0  1.2  0.3
assign (resid  108 and name HA   )(resid  108 and name HG2# )  2.5  0.7  1.7
assign (resid  108 and name HA   )(resid  109 and name HG1# )  4.0  2.2  2.5
assign (resid  108 and name HA   )(resid  109 and name HN   )  3.0  1.2  0.5
assign (resid  108 and name HA   )(resid  110 and name HN   )  4.0  2.2  1.0
assign (resid  108 and name HB   )(resid  108 and name HG2# )  2.5  0.7  1.7
assign (resid  108 and name HB   )(resid  109 and name HN   )  4.0  2.2  1.0
assign (resid  108 and name HB   )(resid  110 and name HN   )  4.0  2.2  1.0
assign (resid  108 and name HG2# )(resid  109 and name HN   )  3.0  1.2  1.8
assign (resid  108 and name HG2# )(resid  110 and name HA   )  4.0  2.2  2.5
assign (resid  108 and name HG2# )(resid  110 and name HB#  )  3.0  1.2  3.5
assign (resid  108 and name HG2# )(resid  110 and name HN   )  3.0  1.2  1.8
assign (resid  108 and name HG2# )(resid  111 and name HB#  )  4.0  2.2  3.5
assign (resid  108 and name HG2# )(resid  111 and name HN   )  4.0  2.2  2.5
assign (resid  109 and name HA   )(resid  109 and name HB   )  2.5  0.7  0.2
assign (resid  109 and name HA   )(resid  109 and name HG1# )  4.0  2.2  2.5
assign (resid  109 and name HA   )(resid  109 and name HG2# )  2.5  0.7  1.7
assign (resid  109 and name HA   )(resid  109 and name HN   )  3.0  1.2  0.5
assign (resid  109 and name HA   )(resid  110 and name HN   )  4.0  2.2  1.0
assign (resid  109 and name HA   )(resid  111 and name HN   )  4.0  2.2  1.0
assign (resid  109 and name HA   )(resid  112 and name HG#  )  4.0  2.2  2.0
assign (resid  109 and name HB   )(resid  109 and name HG1# )  2.5  0.7  1.7
assign (resid  109 and name HB   )(resid  109 and name HG2# )  2.5  0.7  1.7
assign (resid  109 and name HB   )(resid  109 and name HN   )  3.0  1.2  0.5
assign (resid  109 and name HB   )(resid  110 and name HN   )  4.0  2.2  1.0
assign (resid  109 and name HG#  )(resid  110 and name HN   )  4.0  2.2  3.4
assign (resid  109 and name HG1# )(resid  109 and name HN   )  3.0  1.2  1.8
assign (resid  109 and name HG1# )(resid  136 and name HD1# )  4.0  2.2  4.0
assign (resid  109 and name HG1# )(resid  136 and name HD2# )  2.5  0.7  3.2
assign (resid  109 and name HG2# )(resid  109 and name HN   )  4.0  2.2  2.5
assign (resid  109 and name HG2# )(resid  110 and name HA   )  4.0  2.2  2.5
assign (resid  109 and name HG2# )(resid  112 and name HG#  )  4.0  2.2  3.5
assign (resid  109 and name HG2# )(resid  134 and name HE#  )  4.0  2.2  4.0
assign (resid  109 and name HG2# )(resid  136 and name HA   )  4.0  2.2  2.5
assign (resid  109 and name HG2# )(resid  136 and name HD1# )  2.5  0.7  3.2
assign (resid  109 and name HG2# )(resid  136 and name HD2# )  3.0  1.2  3.3
assign (resid  109 and name HN   )(resid  110 and name HN   )  3.0  1.2  0.5
assign (resid  110 and name HA   )(resid  110 and name HN   )  3.0  1.2  0.5
assign (resid  110 and name HA   )(resid  111 and name HN   )  3.0  1.2  0.5
assign (resid  110 and name HA   )(resid  136 and name HD2# )  4.0  2.2  2.5
assign (resid  110 and name HB1  )(resid  110 and name HA   )  2.5  0.7  0.2
assign (resid  110 and name HB1  )(resid  110 and name HN   )  4.0  2.2  1.0
assign (resid  110 and name HB2  )(resid  110 and name HA   )  2.5  0.7  0.2
assign (resid  110 and name HN   )(resid  111 and name HN   )  3.0  1.2  0.5
assign (resid  111 and name HA   )(resid  111 and name HB1  )  2.5  0.7  0.2
assign (resid  111 and name HA   )(resid  111 and name HB2  )  2.5  0.7  0.2
assign (resid  111 and name HA   )(resid  111 and name HN   )  3.0  1.2  0.5
assign (resid  111 and name HA   )(resid  112 and name HN   )  3.0  1.2  0.5
assign (resid  111 and name HB#  )(resid  111 and name HN   )  3.0  1.2  1.1
assign (resid  111 and name HB#  )(resid  112 and name HN   )  4.0  2.2  2.0
assign (resid  111 and name HN   )(resid  112 and name HN   )  3.0  1.2  0.5
assign (resid  112 and name HA   )(resid  112 and name HE#  )  4.0  2.2  2.5
assign (resid  112 and name HA   )(resid  112 and name HG#  )  2.5  0.7  1.2
assign (resid  112 and name HA   )(resid  112 and name HN   )  3.0  1.2  0.5
assign (resid  112 and name HA   )(resid  113 and name HE#  )  4.0  2.2  2.0
assign (resid  112 and name HA   )(resid  113 and name HN   )  3.0  1.2  0.5
assign (resid  112 and name HA   )(resid  114 and name HN   )  4.0  2.2  1.0
assign (resid  112 and name HA   )(resid  136 and name HD2# )  4.0  2.2  3.5
assign (resid  112 and name HB#  )(resid  112 and name HA   )  2.5  0.7  1.2
assign (resid  112 and name HB#  )(resid  112 and name HN   )  3.0  1.2  1.1
assign (resid  112 and name HB#  )(resid  113 and name HN   )  3.0  1.2  1.3
assign (resid  112 and name HB#  )(resid  115 and name HN   )  4.0  2.2  3.0
assign (resid  112 and name HB#  )(resid  136 and name HD2# )  2.5  0.7  2.7
assign (resid  112 and name HE#  )(resid  112 and name HN   )  4.0  2.2  2.5
assign (resid  112 and name HE#  )(resid  113 and name HE#  )  3.0  1.2  2.8
assign (resid  112 and name HE#  )(resid  113 and name HN   )  3.0  1.2  1.8
assign (resid  112 and name HE#  )(resid  114 and name HA   )  4.0  2.2  2.5
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assign (resid  115 and name HN   )(resid  137 and name HA   )  4.0  2.2  1.0
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assign (resid  116 and name HB1  )(resid  116 and name HA   )  4.0  2.2  1.0
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assign (resid  118 and name HB1  )(resid  118 and name HN   )  4.0  2.2  1.0
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assign (resid  124 and name HB#  )(resid  128 and name HA   )  4.0  2.2  2.0
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assign (resid  125 and name HB#  )(resid  125 and name HA   )  3.0  1.2  1.3
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assign (resid  125 and name HB1  )(resid  126 and name HN   )  4.0  2.2  1.0
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assign (resid  126 and name HA   )(resid  127 and name HA   )  4.0  2.2  2.0
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assign (resid  126 and name HA   )(resid  128 and name HN   )  4.0  2.2  1.0
assign (resid  126 and name HB#  )(resid  126 and name HA   )  2.5  0.7  1.2
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assign (resid  126 and name HB#  )(resid  126 and name HN   )  3.0  1.2  1.1
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assign (resid  126 and name HB#  )(resid  127 and name HN   )  4.0  2.2  2.0
assign (resid  126 and name HG#  )(resid  127 and name HA   )  4.0  2.2  2.0
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assign (resid  126 and name HG#  )(resid  127 and name HG2# )  3.0  1.2  2.8
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assign (resid  127 and name HA   )(resid  127 and name HB   )  2.5  0.7  0.2
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assign (resid  127 and name HB   )(resid  128 and name HA   )  4.0  2.2  1.0
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assign (resid  127 and name HG1# )(resid  127 and name HA   )  2.5  0.7  1.7
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assign (resid  127 and name HG2# )(resid  127 and name HA   )  4.0  2.2  2.5
assign (resid  127 and name HG2# )(resid  127 and name HN   )  3.0  1.2  1.8
assign (resid  127 and name HG2# )(resid  128 and name HA   )  3.0  1.2  1.8
assign (resid  128 and name HA   )(resid  128 and name HB   )  4.0  2.2  1.0
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assign (resid  128 and name HA   )(resid  128 and name HN   )  3.0  1.2  0.5
assign (resid  128 and name HA   )(resid  129 and name HN   )  2.5  0.7  0.4
assign (resid  128 and name HB   )(resid  128 and name HG2# )  2.5  0.7  1.7
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assign (resid  128 and name HG2# )(resid  129 and name HN   )  3.0  1.2  1.8
assign (resid  128 and name HG2# )(resid  130 and name HN   )  4.0  2.2  2.5
assign (resid  129 and name HA   )(resid  129 and name HG1  )  3.0  1.2  0.3
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assign (resid  129 and name HA   )(resid  130 and name HN   )  2.5  0.7  0.4
assign (resid  129 and name HB#  )(resid  129 and name HA   )  2.5  0.7  1.2
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assign (resid  129 and name HG#  )(resid  129 and name HN   )  3.0  1.2  1.5
assign (resid  129 and name HG#  )(resid  130 and name HN   )  3.0  1.2  1.3
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assign (resid  130 and name HB#  )(resid  130 and name HA   )  3.0  1.2  1.3
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assign (resid  130 and name HE#  )(resid  130 and name HG#  )  4.0  2.2  3.5
assign (resid  130 and name HG#  )(resid  132 and name HD1# )  4.0  2.2  3.5
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assign (resid  130 and name HN   )(resid  131 and name HN   )  4.0  2.2  1.0
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assign (resid  131 and name HA   )(resid  131 and name HG2# )  2.5  0.7  1.7
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assign (resid  131 and name HA   )(resid  132 and name HA   )  4.0  2.2  1.0
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assign (resid  131 and name HB   )(resid  131 and name HA   )  4.0  2.2  1.0
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assign (resid  131 and name HG1# )(resid  131 and name HB   )  2.5  0.7  1.7
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assign (resid  131 and name HG2# )(resid  131 and name HN   )  2.5  0.7  1.7
assign (resid  131 and name HG2# )(resid  133 and name HG2# )  3.0  1.2  3.5
assign (resid  131 and name HN   )(resid  132 and name HN   )  4.0  2.2  1.0
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assign (resid  132 and name HD#  )(resid  132 and name HG   )  2.5  0.7  1.9
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assign (resid 93 and name O) (resid 100 and name N) 2.8 0.4 0.5
assign (resid 93 and name O) (resid 100 and name HN) 1.8 0.3 0.5

assign (resid 91 and name O) (resid 102 and name N) 2.8 0.4 0.5
assign (resid 91 and name O) (resid 102 and name HN) 1.8 0.3 0.5

assign (resid 91 and name O) (resid 103 and name N) 2.8 0.4 0.5
assign (resid 91 and name O) (resid 103 and name HN) 1.8 0.3 0.5

assign (resid 89 and name O) (resid 105 and name N) 2.8 0.4 0.5
assign (resid 89 and name O) (resid 105 and name HN) 1.8 0.3 0.5

assign (resid 87 and name O) (resid 107 and name N) 2.8 0.4 0.5
assign (resid 87 and name O) (resid 107 and name HN) 1.8 0.3 0.5

assign (resid 85 and name O) (resid 109 and name N) 2.8 0.4 0.5
assign (resid 85 and name O) (resid 109 and name HN) 1.8 0.3 0.5

assign (resid 92 and name O) (resid 45 and name N) 2.8 0.4 0.5
assign (resid 92 and name O) (resid 45 and name HN) 1.8 0.3 0.5

assign (resid 90 and name O) (resid 47 and name N) 2.8 0.4 0.5
assign (resid 90 and name O) (resid 47 and name HN) 1.8 0.3 0.5

assign (resid 88 and name O) (resid 49 and name N) 2.8 0.4 0.5
assign (resid 88 and name O) (resid 49 and name HN) 1.8 0.3 0.5

assign (resid 51 and name O) (resid 86 and name N) 2.8 0.4 0.5
assign (resid 51 and name O) (resid 86 and name HN) 1.8 0.3 0.5

assign (resid 49 and name O) (resid 88 and name N) 2.8 0.4 0.5
assign (resid 49 and name O) (resid 88 and name HN) 1.8 0.3 0.5

assign (resid 47 and name O) (resid 90 and name N) 2.8 0.4 0.5
assign (resid 47 and name O) (resid 90 and name HN) 1.8 0.3 0.5

assign (resid 45 and name O) (resid 92 and name N) 2.8 0.4 0.5
assign (resid 45 and name O) (resid 92 and name HN) 1.8 0.3 0.5
!calcium site 1
assign (segid ION and resid 1 and name CA)
       (segid CALB and resid 41 and name O  )  2.5  0.3  0.3
assign (segid ION and resid 1 and name CA)
       (segid CALB and resid 43 and name OD1)  2.5  0.3  0.3
assign (segid ION and resid 1 and name CA)
       (segid CALB and resid 65 and name OD1)  2.5  0.3  0.3

!calcium site 2
assign (segid ION and resid 2 and name CA)
       (segid CALB and resid 43 and name OD2)  2.5  0.3  0.3
assign (segid ION and resid 2 and name CA)
       (segid CALB and resid 93 and name OD1)  2.5  0.3  0.3
assign (segid ION and resid 2 and name CA)
       (segid CALB and resid 94 and name O  )  2.5  0.3  0.3
assign (segid ION and resid 2 and name CA )
       (segid CALB and resid 95 and name OD1)  2.5  0.3  0.3


  Entry H atom name         Submitted Coord H atom name
    1    H    TYR  16           HN       TYR  16 -20.848   9.237   9.237
    2    HA   TYR  16           HA       TYR  16 -18.642   7.339   7.339
    3   1HB   TYR  16          2HB       TYR  16 -18.622   7.615   7.615
    4   2HB   TYR  16          1HB       TYR  16 -17.475   8.373   8.373
    5    HD1  TYR  16           HD2      TYR  16 -18.217  10.719  10.719
    6    HD2  TYR  16           HD1      TYR  16 -19.784   8.913   8.913
    7    HE1  TYR  16           HE2      TYR  16 -18.925  12.934  12.934
    8    HE2  TYR  16           HE1      TYR  16 -20.490  11.130  11.130
    9    HH   TYR  16           HH       TYR  16 -20.243  13.998  13.998
   10    H    SER  17           HN       SER  17 -20.315   5.891   5.891
   11    HA   SER  17           HA       SER  17 -21.752   4.766   4.766
   12   1HB   SER  17          2HB       SER  17 -23.777   4.612   4.612
   13   2HB   SER  17          1HB       SER  17 -23.182   6.210   6.210
   14    HG   SER  17           HG       SER  17 -23.932   4.988   4.988
   15    H    HIS  18           HN       HIS  18 -19.692   4.168   4.168
   16    HA   HIS  18           HA       HIS  18 -20.484   1.335   1.335
   17   1HB   HIS  18          2HB       HIS  18 -20.286   2.484   2.484
   18   2HB   HIS  18          1HB       HIS  18 -18.621   2.912   2.912
   19    HD1  HIS  18           HD1      HIS  18 -20.344   0.654   0.654
   20    HD2  HIS  18           HD2      HIS  18 -17.214   0.171   0.171
   21    HE1  HIS  18           HE1      HIS  18 -19.229  -1.472  -1.472
   22    H    LYS  19           HN       LYS  19 -19.287  -0.184  -0.184
   23    HA   LYS  19           HA       LYS  19 -16.961   0.615   0.615
   24   1HB   LYS  19          2HB       LYS  19 -18.713  -1.794  -1.794
   25   2HB   LYS  19          1HB       LYS  19 -17.107  -1.946  -1.946
   26   1HG   LYS  19          2HG       LYS  19 -17.594  -0.231  -0.231
   27   2HG   LYS  19          2HG       LYS  19 -19.121   0.149   0.149
   28   1HD   LYS  19          2HD       LYS  19 -20.161  -1.383  -1.383
   29   2HD   LYS  19          1HD       LYS  19 -19.101  -2.638  -2.638
   30   1HE   LYS  19          2HE       LYS  19 -17.493  -2.267  -2.267
   31   2HE   LYS  19          1HE       LYS  19 -18.329  -0.816  -0.816
   32   1HZ   LYS  19          1HZ       LYS  19 -20.233  -2.747  -2.747
   33   2HZ   LYS  19          3HZ       LYS  19 -18.833  -3.563  -3.563
   34   3HZ   LYS  19          2HZ       LYS  19 -19.330  -2.153  -2.153
   35    H    PHE  20           HN       PHE  20 -15.025   0.628   0.628
   36    HA   PHE  20           HA       PHE  20 -14.268  -1.467  -1.467
   37   1HB   PHE  20          2HB       PHE  20 -14.529   0.615   0.615
   38   2HB   PHE  20          1HB       PHE  20 -13.564   1.471   1.471
   39    HD1  PHE  20           HD2      PHE  20 -12.871  -1.850  -1.850
   40    HD2  PHE  20           HD1      PHE  20 -11.778   2.271   2.271
   41    HE1  PHE  20           HE2      PHE  20 -10.839  -2.316  -2.316
   42    HE2  PHE  20           HE1      PHE  20  -9.747   1.805   1.805
   43    HZ   PHE  20           HZ       PHE  20  -9.277  -0.489  -0.489
   44    H    THR  21           HN       THR  21 -12.818  -2.753  -2.753
   45    HA   THR  21           HA       THR  21 -10.913  -1.520  -1.520
   46    HB   THR  21           HB       THR  21 -11.644  -4.432  -4.432
   47    HG1  THR  21           HG1      THR  21 -13.310  -4.040  -4.040
   48   1HG2  THR  21          2HG2      THR  21  -9.598  -3.426  -3.426
   49   2HG2  THR  21          1HG2      THR  21 -10.806  -2.854  -2.854
   50   3HG2  THR  21          3HG2      THR  21 -10.638  -4.582  -4.582
   51    H    VAL  22           HN       VAL  22  -8.804  -1.736  -1.736
   52    HA   VAL  22           HA       VAL  22  -7.899  -3.473  -3.473
   53    HB   VAL  22           HB       VAL  22  -6.700  -0.840  -0.840
   54   1HG1  VAL  22          2HG1      VAL  22  -5.995  -2.918  -2.918
   55   2HG1  VAL  22          1HG1      VAL  22  -5.727  -1.227  -1.227
   56   3HG1  VAL  22          3HG1      VAL  22  -4.948  -1.910  -1.910
   57   1HG2  VAL  22          1HG2      VAL  22  -9.049  -1.261  -1.261
   58   2HG2  VAL  22          3HG2      VAL  22  -8.119   0.235   0.235
   59   3HG2  VAL  22          2HG2      VAL  22  -7.813  -0.902  -0.902
   60    H    VAL  23           HN       VAL  23  -5.769  -4.402  -4.402
   61    HA   VAL  23           HA       VAL  23  -4.634  -4.202  -4.202
   62    HB   VAL  23           HB       VAL  23  -5.275  -6.881  -6.881
   63   1HG1  VAL  23          1HG1      VAL  23  -4.397  -5.983  -5.983
   64   2HG1  VAL  23          3HG1      VAL  23  -4.909  -7.625  -7.625
   65   3HG1  VAL  23          2HG1      VAL  23  -3.473  -6.942  -6.942
   66   1HG2  VAL  23          3HG2      VAL  23  -6.915  -5.123  -5.123
   67   2HG2  VAL  23          2HG2      VAL  23  -7.424  -6.101  -6.101
   68   3HG2  VAL  23          1HG2      VAL  23  -7.015  -6.876  -6.876
   69    H    VAL  24           HN       VAL  24  -2.680  -3.390  -3.390
   70    HA   VAL  24           HA       VAL  24  -1.338  -4.465  -4.465
   71    HB   VAL  24           HB       VAL  24   0.649  -3.311  -3.311
   72   1HG1  VAL  24          3HG1      VAL  24  -1.978  -1.901  -1.901
   73   2HG1  VAL  24          2HG1      VAL  24  -0.538  -0.992  -0.992
   74   3HG1  VAL  24          1HG1      VAL  24  -0.603  -1.802  -1.802
   75   1HG2  VAL  24          2HG2      VAL  24  -0.714  -3.585  -3.585
   76   2HG2  VAL  24          1HG2      VAL  24   0.951  -3.101  -3.101
   77   3HG2  VAL  24          3HG2      VAL  24  -0.328  -1.891  -1.891
   78    H    LEU  25           HN       LEU  25  -0.854  -6.557  -6.557
   79    HA   LEU  25           HA       LEU  25  -0.300  -8.041  -8.041
   80   1HB   LEU  25          2HB       LEU  25  -1.474  -8.772  -8.772
   81   2HB   LEU  25          1HB       LEU  25   0.170  -9.222  -9.222
   82    HG   LEU  25           HG       LEU  25  -0.876 -11.127 -11.127
   83   1HD1  LEU  25          3HD1      LEU  25   1.513 -10.336 -10.336
   84   2HD1  LEU  25          2HD1      LEU  25   0.744 -10.115 -10.115
   85   3HD1  LEU  25          1HD1      LEU  25   0.749 -11.706 -11.706
   86   1HD2  LEU  25          2HD2      LEU  25  -2.001  -9.121  -9.121
   87   2HD2  LEU  25          1HD2      LEU  25  -2.609 -10.722 -10.722
   88   3HD2  LEU  25          3HD2      LEU  25  -1.405 -10.549 -10.549
   89    H    ARG  26           HN       ARG  26   1.631  -8.069  -8.069
   90    HA   ARG  26           HA       ARG  26   4.016  -7.586  -7.586
   91   1HB   ARG  26          2HB       ARG  26   5.165  -9.488  -9.488
   92   2HB   ARG  26          1HB       ARG  26   3.939  -9.952  -9.952
   93   1HG   ARG  26          2HG       ARG  26   2.414  -9.810  -9.810
   94   2HG   ARG  26          2HG       ARG  26   3.958 -10.254 -10.254
   95   1HD   ARG  26          2HD       ARG  26   3.812 -11.949 -11.949
   96   2HD   ARG  26          1HD       ARG  26   2.129 -11.851 -11.851
   97    HE   ARG  26           HE       ARG  26   3.395 -12.287 -12.287
   98   1HH1  ARG  26          1HH1      ARG  26   2.858 -14.026 -14.026
   99   2HH1  ARG  26          2HH1      ARG  26   3.660 -15.467 -15.467
  100   1HH2  ARG  26          1HH2      ARG  26   4.803 -14.077 -14.077
  101   2HH2  ARG  26          2HH2      ARG  26   4.766 -15.496 -15.496
  102    H    ALA  27           HN       ALA  27   6.000  -7.600  -7.600
  103    HA   ALA  27           HA       ALA  27   5.728  -6.724  -6.724
  104   1HB   ALA  27          3HB       ALA  27   5.113  -4.746  -4.746
  105   2HB   ALA  27          2HB       ALA  27   6.868  -4.630  -4.630
  106   3HB   ALA  27          1HB       ALA  27   6.100  -4.452  -4.452
  107    H    THR  28           HN       THR  28   7.119  -8.712  -8.712
  108    HA   THR  28           HA       THR  28   9.784  -8.245  -8.245
  109    HB   THR  28           HB       THR  28  10.127 -10.632 -10.632
  110    HG1  THR  28           HG1      THR  28   8.583 -11.774 -11.774
  111   1HG2  THR  28          3HG2      THR  28   8.592  -9.537  -9.537
  112   2HG2  THR  28          2HG2      THR  28   7.559 -10.817 -10.817
  113   3HG2  THR  28          1HG2      THR  28   9.181 -11.200 -11.200
  114    H    LYS  29           HN       LYS  29  11.465  -9.599  -9.599
  115    HA   LYS  29           HA       LYS  29  12.978  -9.217  -9.217
  116   1HB   LYS  29          2HB       LYS  29  10.415 -10.011 -10.011
  117   2HB   LYS  29          1HB       LYS  29  11.799  -9.572  -9.572
  118   1HG   LYS  29          2HG       LYS  29  13.170 -11.235 -11.235
  119   2HG   LYS  29          2HG       LYS  29  11.737 -11.717 -11.717
  120   1HD   LYS  29          2HD       LYS  29  11.558 -13.266 -13.266
  121   2HD   LYS  29          1HD       LYS  29  10.790 -11.937 -11.937
  122   1HE   LYS  29          2HE       LYS  29  12.375 -12.067 -12.067
  123   2HE   LYS  29          1HE       LYS  29  13.584 -11.649 -11.649
  124   1HZ   LYS  29          1HZ       LYS  29  12.646 -14.416 -14.416
  125   2HZ   LYS  29          3HZ       LYS  29  13.684 -13.889 -13.889
  126   3HZ   LYS  29          2HZ       LYS  29  14.182 -13.803 -13.803
  127    H    VAL  30           HN       VAL  30  11.727  -6.792  -6.792
  128    HA   VAL  30           HA       VAL  30  11.113  -5.065  -5.065
  129    HB   VAL  30           HB       VAL  30  10.520  -4.778  -4.778
  130   1HG1  VAL  30          2HG1      VAL  30  13.092  -4.946  -4.946
  131   2HG1  VAL  30          1HG1      VAL  30  13.026  -3.204  -3.204
  132   3HG1  VAL  30          3HG1      VAL  30  12.011  -3.948  -3.948
  133   1HG2  VAL  30          3HG2      VAL  30  10.623  -3.023  -3.023
  134   2HG2  VAL  30          2HG2      VAL  30   9.969  -2.641  -2.641
  135   3HG2  VAL  30          1HG2      VAL  30  11.628  -2.194  -2.194
  136    H    THR  31           HN       THR  31  12.523  -4.528  -4.528
  137    HA   THR  31           HA       THR  31  15.379  -4.692  -4.692
  138    HB   THR  31           HB       THR  31  14.149  -3.831  -3.831
  139    HG1  THR  31           HG1      THR  31  13.029  -5.711  -5.711
  140   1HG2  THR  31          1HG2      THR  31  16.703  -5.067  -5.067
  141   2HG2  THR  31          3HG2      THR  31  16.116  -5.443  -5.443
  142   3HG2  THR  31          2HG2      THR  31  16.435  -3.768  -3.768
  143    H    LYS  32           HN       LYS  32  16.806  -2.974  -2.974
  144    HA   LYS  32           HA       LYS  32  15.798  -0.277  -0.277
  145   1HB   LYS  32          2HB       LYS  32  15.747  -0.525  -0.525
  146   2HB   LYS  32          1HB       LYS  32  17.375  -1.195  -1.195
  147   1HG   LYS  32          2HG       LYS  32  18.362   0.846   0.846
  148   2HG   LYS  32          2HG       LYS  32  17.062   1.476   1.476
  149   1HD   LYS  32          2HD       LYS  32  16.821   1.011   1.011
  150   2HD   LYS  32          1HD       LYS  32  17.232   2.563   2.563
  151   1HE   LYS  32          2HE       LYS  32  14.916   1.557   1.557
  152   2HE   LYS  32          1HE       LYS  32  14.653   1.428   1.428
  153   1HZ   LYS  32          2HZ       LYS  32  15.670   3.903   3.903
  154   2HZ   LYS  32          1HZ       LYS  32  14.007   3.591   3.591
  155   3HZ   LYS  32          3HZ       LYS  32  14.983   3.712   3.712
  156    H    GLY  33           HN       GLY  33  18.873  -1.520  -1.520
  157   1HA   GLY  33          2HA       GLY  33  20.602  -1.942  -1.942
  158   2HA   GLY  33          1HA       GLY  33  20.246  -0.267  -0.267
  159    H    ALA  34           HN       ALA  34  22.384   0.380   0.380
  160    HA   ALA  34           HA       ALA  34  23.505   0.032   0.032
  161   1HB   ALA  34          3HB       ALA  34  24.482   1.373   1.373
  162   2HB   ALA  34          2HB       ALA  34  25.364   1.456   1.456
  163   3HB   ALA  34          1HB       ALA  34  25.086  -0.105  -0.105
  164    H    PHE  35           HN       PHE  35  21.672   2.372   2.372
  165    HA   PHE  35           HA       PHE  35  22.331   4.789   4.789
  166   1HB   PHE  35          2HB       PHE  35  19.708   3.621   3.621
  167   2HB   PHE  35          1HB       PHE  35  19.791   5.241   5.241
  168    HD1  PHE  35           HD2      PHE  35  21.244   6.960   6.960
  169    HD2  PHE  35           HD1      PHE  35  20.326   3.190   3.190
  170    HE1  PHE  35           HE2      PHE  35  21.898   7.843   7.843
  171    HE2  PHE  35           HE1      PHE  35  20.980   4.075   4.075
  172    HZ   PHE  35           HZ       PHE  35  21.766   6.401   6.401
  173    H    GLY  36           HN       GLY  36  19.692   2.709   2.709
  174   1HA   GLY  36          2HA       GLY  36  19.505   4.072   4.072
  175   2HA   GLY  36          1HA       GLY  36  18.715   2.554   2.554
  176    H    ASP  37           HN       ASP  37  21.497   1.518   1.518
  177    HA   ASP  37           HA       ASP  37  22.063   0.246   0.246
  178   1HB   ASP  37          2HB       ASP  37  22.389  -0.628  -0.628
  179   2HB   ASP  37          1HB       ASP  37  23.931   0.224   0.224
  180    H    MET  38           HN       MET  38  22.872   3.295   3.295
  181    HA   MET  38           HA       MET  38  25.519   3.738   3.738
  182   1HB   MET  38          2HB       MET  38  23.147   5.319   5.319
  183   2HB   MET  38          1HB       MET  38  24.080   5.908   5.908
  184   1HG   MET  38          2HG       MET  38  25.751   6.678   6.678
  185   2HG   MET  38          2HG       MET  38  25.690   5.283   5.283
  186   1HE   MET  38          1HE       MET  38  24.150   4.940   4.940
  187   2HE   MET  38          3HE       MET  38  23.662   6.285   6.285
  188   3HE   MET  38          2HE       MET  38  25.368   6.010   6.010
  189    H    LEU  39           HN       LEU  39  22.774   3.619   3.619
  190    HA   LEU  39           HA       LEU  39  24.595   3.808   3.808
  191   1HB   LEU  39          2HB       LEU  39  21.623   3.514   3.514
  192   2HB   LEU  39          1HB       LEU  39  22.744   4.366   4.366
  193    HG   LEU  39           HG       LEU  39  22.001   5.221   5.221
  194   1HD1  LEU  39          2HD1      LEU  39  20.301   5.352   5.352
  195   2HD1  LEU  39          1HD1      LEU  39  21.219   6.827   6.827
  196   3HD1  LEU  39          3HD1      LEU  39  20.396   6.612   6.612
  197   1HD2  LEU  39          2HD2      LEU  39  24.195   5.906   5.906
  198   2HD2  LEU  39          1HD2      LEU  39  23.673   6.694   6.694
  199   3HD2  LEU  39          3HD2      LEU  39  23.092   7.282   7.282
  200    H    ASP  40           HN       ASP  40  22.213   1.756   1.756
  201    HA   ASP  40           HA       ASP  40  23.415  -0.673  -0.673
  202   1HB   ASP  40          2HB       ASP  40  22.609   0.193   0.193
  203   2HB   ASP  40          1HB       ASP  40  21.075  -0.479  -0.479
  204    H    THR  41           HN       THR  41  21.677  -2.502  -2.502
  205    HA   THR  41           HA       THR  41  20.476  -2.638  -2.638
  206    HB   THR  41           HB       THR  41  19.470  -3.718  -3.718
  207    HG1  THR  41           HG1      THR  41  21.622  -4.271  -4.271
  208   1HG2  THR  41          1HG2      THR  41  17.749  -3.682  -3.682
  209   2HG2  THR  41          3HG2      THR  41  18.782  -4.895  -4.895
  210   3HG2  THR  41          2HG2      THR  41  18.050  -5.216  -5.216
  211    HA   PRO  42           HA       PRO  42  17.214   0.222   0.222
  212   1HB   PRO  42          2HB       PRO  42  15.285  -1.959  -1.959
  213   2HB   PRO  42          1HB       PRO  42  15.849  -0.854  -0.854
  214   1HG   PRO  42          2HG       PRO  42  16.694  -3.563  -3.563
  215   2HG   PRO  42          2HG       PRO  42  17.128  -2.511  -2.511
  216   1HD   PRO  42          2HD       PRO  42  18.895  -3.310  -3.310
  217   2HD   PRO  42          1HD       PRO  42  19.063  -1.812  -1.812
  218    H    ASP  43           HN       ASP  43  15.391   1.155   1.155
  219    HA   ASP  43           HA       ASP  43  14.787   0.118   0.118
  220   1HB   ASP  43          2HB       ASP  43  14.582   2.964   2.964
  221   2HB   ASP  43          1HB       ASP  43  14.358   2.406   2.406
  222    HA   PRO  44           HA       PRO  44  10.779  -0.416  -0.416
  223   1HB   PRO  44          2HB       PRO  44   9.738  -2.067  -2.067
  224   2HB   PRO  44          1HB       PRO  44  10.791  -2.617  -2.617
  225   1HG   PRO  44          2HG       PRO  44  11.454  -2.080  -2.080
  226   2HG   PRO  44          2HG       PRO  44  12.035  -3.369  -3.369
  227   1HD   PRO  44          2HD       PRO  44  13.503  -1.160  -1.160
  228   2HD   PRO  44          1HD       PRO  44  13.657  -2.041  -2.041
  229    H    TYR  45           HN       TYR  45   8.813   0.545   0.545
  230    HA   TYR  45           HA       TYR  45   7.655   1.231   1.231
  231   1HB   TYR  45          2HB       TYR  45   8.884   3.024   3.024
  232   2HB   TYR  45          1HB       TYR  45   9.643   3.098   3.098
  233    HD1  TYR  45           HD1      TYR  45   8.179   4.128   4.128
  234    HD2  TYR  45           HD2      TYR  45   7.464   4.715   4.715
  235    HE1  TYR  45           HE1      TYR  45   6.887   6.168   6.168
  236    HE2  TYR  45           HE2      TYR  45   6.171   6.750   6.750
  237    HH   TYR  45           HH       TYR  45   6.334   8.446   8.446
  238    H    VAL  46           HN       VAL  46   5.548   1.304   1.304
  239    HA   VAL  46           HA       VAL  46   4.701   1.537   1.537
  240    HB   VAL  46           HB       VAL  46   2.973   0.965   0.965
  241   1HG1  VAL  46          3HG1      VAL  46   2.714   0.713   0.713
  242   2HG1  VAL  46          2HG1      VAL  46   1.912  -0.487  -0.487
  243   3HG1  VAL  46          1HG1      VAL  46   1.526   1.226   1.226
  244   1HG2  VAL  46          2HG2      VAL  46   4.907  -0.800  -0.800
  245   2HG2  VAL  46          1HG2      VAL  46   4.528  -0.725  -0.725
  246   3HG2  VAL  46          3HG2      VAL  46   3.397  -1.487  -1.487
  247    H    GLU  47           HN       GLU  47   2.715   2.713   2.713
  248    HA   GLU  47           HA       GLU  47   2.130   5.064   5.064
  249   1HB   GLU  47          2HB       GLU  47   3.993   5.417   5.417
  250   2HB   GLU  47          1HB       GLU  47   2.574   5.543   5.543
  251   1HG   GLU  47          2HG       GLU  47   1.675   7.235   7.235
  252   2HG   GLU  47          2HG       GLU  47   3.297   7.252   7.252
  253    H    LEU  48           HN       LEU  48   0.046   4.446   4.446
  254    HA   LEU  48           HA       LEU  48  -1.588   3.466   3.466
  255   1HB   LEU  48          2HB       LEU  48  -1.565   2.979   2.979
  256   2HB   LEU  48          1HB       LEU  48  -2.896   4.124   4.124
  257    HG   LEU  48           HG       LEU  48  -3.948   2.726   2.726
  258   1HD1  LEU  48          1HD1      LEU  48  -1.415   1.167   1.167
  259   2HD1  LEU  48          3HD1      LEU  48  -2.905   0.326   0.326
  260   3HD1  LEU  48          2HD1      LEU  48  -2.304   1.633   1.633
  261   1HD2  LEU  48          2HD2      LEU  48  -4.045   2.295   2.295
  262   2HD2  LEU  48          1HD2      LEU  48  -4.860   1.219   1.219
  263   3HD2  LEU  48          3HD2      LEU  48  -3.294   0.767   0.767
  264    H    PHE  49           HN       PHE  49  -2.473   4.839   4.839
  265    HA   PHE  49           HA       PHE  49  -3.624   7.339   7.339
  266   1HB   PHE  49          2HB       PHE  49  -1.539   7.031   7.031
  267   2HB   PHE  49          1HB       PHE  49  -2.953   7.735   7.735
  268    HD1  PHE  49           HD2      PHE  49  -1.045   8.088   8.088
  269    HD2  PHE  49           HD1      PHE  49  -3.085  10.025  10.025
  270    HE1  PHE  49           HE2      PHE  49  -0.468  10.285  10.285
  271    HE2  PHE  49           HE1      PHE  49  -2.504  12.219  12.219
  272    HZ   PHE  49           HZ       PHE  49  -1.197  12.352  12.352
  273    H    ILE  50           HN       ILE  50  -5.590   7.946   7.946
  274    HA   ILE  50           HA       ILE  50  -6.785   6.213   6.213
  275    HB   ILE  50           HB       ILE  50  -7.859   6.760   6.760
  276   1HG1  ILE  50          2HG1      ILE  50  -7.489   4.223   4.223
  277   2HG1  ILE  50          1HG1      ILE  50  -6.420   4.800   4.800
  278   1HG2  ILE  50          1HG2      ILE  50  -9.398   5.788   5.788
  279   2HG2  ILE  50          3HG2      ILE  50  -9.962   5.650   5.650
  280   3HG2  ILE  50          2HG2      ILE  50  -9.709   7.243   7.243
  281   1HD1  ILE  50          3HD1      ILE  50  -9.344   4.118   4.118
  282   2HD1  ILE  50          2HD1      ILE  50  -7.995   3.061   3.061
  283   3HD1  ILE  50          1HD1      ILE  50  -8.211   4.597   4.597
  284    H    SER  51           HN       SER  51  -8.800   7.171   7.171
  285    HA   SER  51           HA       SER  51  -8.854  10.111  10.111
  286   1HB   SER  51          2HB       SER  51  -9.242   8.732   8.732
  287   2HB   SER  51          1HB       SER  51  -8.813  10.408  10.408
  288    HG   SER  51           HG       SER  51  -6.775   9.824   9.824
  289    H    THR  52           HN       THR  52 -10.721  10.097  10.097
  290    HA   THR  52           HA       THR  52 -13.163  10.315  10.315
  291    HB   THR  52           HB       THR  52 -13.220   8.031   8.031
  292    HG1  THR  52           HG1      THR  52 -15.202   8.280   8.280
  293   1HG2  THR  52          2HG2      THR  52 -11.419   7.241   7.241
  294   2HG2  THR  52          1HG2      THR  52 -12.518   7.340   7.340
  295   3HG2  THR  52          3HG2      THR  52 -12.835   6.191   6.191
  296    H    THR  53           HN       THR  53 -11.412   9.282   9.282
  297    HA   THR  53           HA       THR  53 -13.549  10.088  10.088
  298    HB   THR  53           HB       THR  53 -12.613   8.599   8.599
  299    HG1  THR  53           HG1      THR  53 -11.134   9.392   9.392
  300   1HG2  THR  53          2HG2      THR  53 -11.555   7.648   7.648
  301   2HG2  THR  53          1HG2      THR  53 -10.074   8.456   8.456
  302   3HG2  THR  53          3HG2      THR  53 -10.788   7.215   7.215
  303    HA   PRO  54           HA       PRO  54 -12.532  14.208  14.208
  304   1HB   PRO  54          2HB       PRO  54 -11.498  13.382  13.382
  305   2HB   PRO  54          1HB       PRO  54 -12.744  14.571  14.571
  306   1HG   PRO  54          2HG       PRO  54 -13.315  12.123  12.123
  307   2HG   PRO  54          2HG       PRO  54 -14.402  13.017  13.017
  308   1HD   PRO  54          2HD       PRO  54 -12.806  10.613  10.613
  309   2HD   PRO  54          1HD       PRO  54 -14.222  11.249  11.249
  310    H    ASP  55           HN       ASP  55 -10.090  12.121  12.121
  311    HA   ASP  55           HA       ASP  55  -7.985  13.203  13.203
  312   1HB   ASP  55          2HB       ASP  55  -8.315  14.036  14.036
  313   2HB   ASP  55          1HB       ASP  55  -6.693  13.834  13.834
  314    H    SER  56           HN       SER  56  -8.188  10.837  10.837
  315    HA   SER  56           HA       SER  56  -7.227   9.044   9.044
  316   1HB   SER  56          2HB       SER  56  -7.241   7.410   7.410
  317   2HB   SER  56          1HB       SER  56  -8.792   8.100   8.100
  318    HG   SER  56           HG       SER  56  -7.104   9.053   9.053
  319    H    ARG  57           HN       ARG  57  -5.219  10.270  10.270
  320    HA   ARG  57           HA       ARG  57  -3.133   9.533   9.533
  321   1HB   ARG  57          2HB       ARG  57  -2.781  11.871  11.871
  322   2HB   ARG  57          1HB       ARG  57  -2.085  11.580  11.580
  323   1HG   ARG  57          2HG       ARG  57  -4.953  12.329  12.329
  324   2HG   ARG  57          2HG       ARG  57  -3.731  13.367  13.367
  325   1HD   ARG  57          2HD       ARG  57  -3.777  11.054  11.054
  326   2HD   ARG  57          1HD       ARG  57  -5.468  11.424  11.424
  327    HE   ARG  57           HE       ARG  57  -3.557  13.199  13.199
  328   1HH1  ARG  57          1HH1      ARG  57  -5.028  15.311  15.311
  329   2HH1  ARG  57          2HH1      ARG  57  -6.546  15.277  15.277
  330   1HH2  ARG  57          1HH2      ARG  57  -6.298  11.903  11.903
  331   2HH2  ARG  57          2HH2      ARG  57  -7.269  13.336  13.336
  332    H    LYS  58           HN       LYS  58  -3.231   7.558   7.558
  333    HA   LYS  58           HA       LYS  58  -1.665   7.948   7.948
  334   1HB   LYS  58          2HB       LYS  58  -3.367   5.575   5.575
  335   2HB   LYS  58          1HB       LYS  58  -2.624   5.902   5.902
  336   1HG   LYS  58          2HG       LYS  58  -4.248   7.350   7.350
  337   2HG   LYS  58          2HG       LYS  58  -4.339   8.069   8.069
  338   1HD   LYS  58          2HD       LYS  58  -5.361   5.526   5.526
  339   2HD   LYS  58          1HD       LYS  58  -5.986   5.982   5.982
  340   1HE   LYS  58          2HE       LYS  58  -6.180   8.176   8.176
  341   2HE   LYS  58          1HE       LYS  58  -7.007   6.740   6.740
  342   1HZ   LYS  58          1HZ       LYS  58  -7.608   7.057   7.057
  343   2HZ   LYS  58          3HZ       LYS  58  -7.867   8.545   8.545
  344   3HZ   LYS  58          2HZ       LYS  58  -8.659   7.151   7.151
  345    H    ARG  59           HN       ARG  59  -0.321   5.901   5.901
  346    HA   ARG  59           HA       ARG  59   0.680   4.356   4.356
  347   1HB   ARG  59          2HB       ARG  59   2.874   5.345   5.345
  348   2HB   ARG  59          1HB       ARG  59   1.652   6.558   6.558
  349   1HG   ARG  59          2HG       ARG  59   2.104   6.689   6.689
  350   2HG   ARG  59          2HG       ARG  59   3.694   6.584   6.584
  351   1HD   ARG  59          2HD       ARG  59   3.557   8.692   8.692
  352   2HD   ARG  59          1HD       ARG  59   1.966   8.400   8.400
  353    HE   ARG  59           HE       ARG  59   1.371   8.635   8.635
  354   1HH1  ARG  59          1HH2      ARG  59   4.083  10.189  10.189
  355   2HH1  ARG  59          2HH2      ARG  59   3.509  11.819  11.819
  356   1HH2  ARG  59          1HH1      ARG  59   0.307  10.919  10.919
  357   2HH2  ARG  59          2HH1      ARG  59   1.362  12.234  12.234
  358    H    THR  60           HN       THR  60   2.847   3.317   3.317
  359    HA   THR  60           HA       THR  60   2.795   2.723   2.723
  360    HB   THR  60           HB       THR  60   2.988   0.470   0.470
  361    HG1  THR  60           HG1      THR  60   4.826   0.490   0.490
  362   1HG2  THR  60          1HG2      THR  60   1.494   1.508   1.508
  363   2HG2  THR  60          3HG2      THR  60   1.572  -0.206  -0.206
  364   3HG2  THR  60          2HG2      THR  60   0.830   0.940   0.940
  365    H    ARG  61           HN       ARG  61   4.553   3.450   3.450
  366    HA   ARG  61           HA       ARG  61   6.976   3.953   3.953
  367   1HB   ARG  61          2HB       ARG  61   5.946   4.684   4.684
  368   2HB   ARG  61          1HB       ARG  61   7.693   4.641   4.641
  369   1HG   ARG  61          2HG       ARG  61   7.207   6.056   6.056
  370   2HG   ARG  61          2HG       ARG  61   5.650   6.371   6.371
  371   1HD   ARG  61          2HD       ARG  61   8.283   6.840   6.840
  372   2HD   ARG  61          1HD       ARG  61   7.463   8.084   8.084
  373    HE   ARG  61           HE       ARG  61   5.550   7.780   7.780
  374   1HH1  ARG  61          1HH1      ARG  61   6.866   5.370   5.370
  375   2HH1  ARG  61          2HH1      ARG  61   7.422   6.121   6.121
  376   1HH2  ARG  61          1HH2      ARG  61   7.093   9.384   9.384
  377   2HH2  ARG  61          2HH2      ARG  61   7.551   8.407   8.407
  378    H    HIS  62           HN       HIS  62   7.894   2.013   2.013
  379    HA   HIS  62           HA       HIS  62   8.146   0.013   0.013
  380   1HB   HIS  62          2HB       HIS  62   7.730  -0.295  -0.295
  381   2HB   HIS  62          1HB       HIS  62   9.471  -0.265  -0.265
  382    HD1  HIS  62           HD1      HIS  62   7.405  -1.838  -1.838
  383    HD2  HIS  62           HD2      HIS  62   9.984  -2.973  -2.973
  384    HE1  HIS  62           HE1      HIS  62   7.758  -4.291  -4.291
  385    H    PHE  63           HN       PHE  63  10.982   0.089   0.089
  386    HA   PHE  63           HA       PHE  63  12.576   1.731   1.731
  387   1HB   PHE  63          2HB       PHE  63  12.657  -1.272  -1.272
  388   2HB   PHE  63          1HB       PHE  63  13.988  -0.244  -0.244
  389    HD1  PHE  63           HD1      PHE  63  13.559   1.514   1.514
  390    HD2  PHE  63           HD2      PHE  63  10.795  -1.613  -1.613
  391    HE1  PHE  63           HE1      PHE  63  12.450   1.864   1.864
  392    HE2  PHE  63           HE2      PHE  63   9.688  -1.262  -1.262
  393    HZ   PHE  63           HZ       PHE  63  10.515   0.476   0.476
  394    H    ASN  64           HN       ASN  64  15.053   0.766   0.766
  395    HA   ASN  64           HA       ASN  64  15.361   0.834   0.834
  396   1HB   ASN  64          2HB       ASN  64  17.806   1.278   1.278
  397   2HB   ASN  64          1HB       ASN  64  16.641   2.556   2.556
  398   1HD2  ASN  64          2HD2      ASN  64  17.955   2.668   2.668
  399   2HD2  ASN  64          1HD2      ASN  64  17.691   3.469   3.469
  400    H    ASN  65           HN       ASN  65  17.267  -0.438  -0.438
  401    HA   ASN  65           HA       ASN  65  17.986  -2.547  -2.547
  402   1HB   ASN  65          2HB       ASN  65  18.916  -3.684  -3.684
  403   2HB   ASN  65          1HB       ASN  65  19.820  -2.569  -2.569
  404   1HD2  ASN  65          2HD2      ASN  65  18.883  -1.569  -1.569
  405   2HD2  ASN  65          1HD2      ASN  65  18.688  -3.150  -3.150
  406    H    ASP  66           HN       ASP  66  16.009  -3.429  -3.429
  407    HA   ASP  66           HA       ASP  66  15.339  -5.867  -5.867
  408   1HB   ASP  66          2HB       ASP  66  13.872  -3.504  -3.504
  409   2HB   ASP  66          1HB       ASP  66  12.882  -4.894  -4.894
  410    H    ILE  67           HN       ILE  67  14.797  -6.942  -6.942
  411    HA   ILE  67           HA       ILE  67  13.085  -5.558  -5.558
  412    HB   ILE  67           HB       ILE  67  14.026  -7.110  -7.110
  413   1HG1  ILE  67          2HG1      ILE  67  16.111  -7.803  -7.803
  414   2HG1  ILE  67          1HG1      ILE  67  14.686  -8.804  -8.804
  415   1HG2  ILE  67          3HG2      ILE  67  15.858  -5.261  -5.261
  416   2HG2  ILE  67          2HG2      ILE  67  16.376  -6.102  -6.102
  417   3HG2  ILE  67          1HG2      ILE  67  15.012  -4.987  -4.987
  418   1HD1  ILE  67          1HD1      ILE  67  15.644  -8.349  -8.349
  419   2HD1  ILE  67          3HD1      ILE  67  17.109  -8.563  -8.563
  420   3HD1  ILE  67          2HD1      ILE  67  15.872  -9.822  -9.822
  421    H    ASN  68           HN       ASN  68  12.647  -7.507  -7.507
  422    HA   ASN  68           HA       ASN  68  10.539  -9.016  -9.016
  423   1HB   ASN  68          2HB       ASN  68  12.555 -10.284 -10.284
  424   2HB   ASN  68          1HB       ASN  68  11.147 -11.083 -11.083
  425   1HD2  ASN  68          2HD2      ASN  68  14.565 -10.998 -10.998
  426   2HD2  ASN  68          1HD2      ASN  68  14.386 -10.654 -10.654
  427    HA   PRO  69           HA       PRO  69   9.539  -7.271  -7.271
  428   1HB   PRO  69          2HB       PRO  69   8.150  -5.064  -5.064
  429   2HB   PRO  69          1HB       PRO  69   9.909  -5.059  -5.059
  430   1HG   PRO  69          2HG       PRO  69   8.304  -5.061  -5.061
  431   2HG   PRO  69          2HG       PRO  69   9.843  -4.258  -4.258
  432   1HD   PRO  69          2HD       PRO  69   9.582  -6.616  -6.616
  433   2HD   PRO  69          1HD       PRO  69  11.060  -6.071  -6.071
  434    H    VAL  70           HN       VAL  70   7.337  -6.935  -6.935
  435    HA   VAL  70           HA       VAL  70   5.095  -7.731  -7.731
  436    HB   VAL  70           HB       VAL  70   5.788  -9.312  -9.312
  437   1HG1  VAL  70          2HG1      VAL  70   3.373  -9.065  -9.065
  438   2HG1  VAL  70          1HG1      VAL  70   3.846 -10.024 -10.024
  439   3HG1  VAL  70          3HG1      VAL  70   3.978 -10.709 -10.709
  440   1HG2  VAL  70          2HG2      VAL  70   6.274  -9.942  -9.942
  441   2HG2  VAL  70          1HG2      VAL  70   7.465  -9.861  -9.861
  442   3HG2  VAL  70          3HG2      VAL  70   6.277 -11.165 -11.165
  443    H    TRP  71           HN       TRP  71   3.510  -6.355  -6.355
  444    HA   TRP  71           HA       TRP  71   3.464  -5.184  -5.184
  445   1HB   TRP  71          2HB       TRP  71   2.183  -4.275  -4.275
  446   2HB   TRP  71          1HB       TRP  71   2.040  -3.446  -3.446
  447    HD1  TRP  71           HD1      TRP  71   4.174  -2.030  -2.030
  448    HE1  TRP  71           HE1      TRP  71   6.268  -1.239  -1.239
  449    HE3  TRP  71           HE3      TRP  71   3.887  -4.933  -4.933
  450    HZ2  TRP  71           HZ2      TRP  71   7.643  -1.745  -1.745
  451    HZ3  TRP  71           HZ3      TRP  71   5.630  -4.735  -4.735
  452    HH2  TRP  71           HH2      TRP  71   7.494  -3.155  -3.155
  453    H    ASN  72           HN       ASN  72   1.371  -6.588  -6.588
  454    HA   ASN  72           HA       ASN  72  -0.790  -7.381  -7.381
  455   1HB   ASN  72          2HB       ASN  72  -1.096  -9.183  -9.183
  456   2HB   ASN  72          1HB       ASN  72   0.554  -9.228  -9.228
  457   1HD2  ASN  72          2HD2      ASN  72  -0.181  -8.648  -8.648
  458   2HD2  ASN  72          1HD2      ASN  72  -1.437  -8.845  -8.845
  459    H    GLU  73           HN       GLU  73  -0.640  -4.771  -4.771
  460    HA   GLU  73           HA       GLU  73  -2.282  -4.671  -4.671
  461   1HB   GLU  73          2HB       GLU  73  -1.230  -2.349  -2.349
  462   2HB   GLU  73          1HB       GLU  73  -1.804  -2.340  -2.340
  463   1HG   GLU  73          2HG       GLU  73   0.093  -3.576  -3.576
  464   2HG   GLU  73          2HG       GLU  73   0.585  -3.948  -3.948
  465    H    THR  74           HN       THR  74  -4.401  -4.498  -4.498
  466    HA   THR  74           HA       THR  74  -5.710  -3.878  -3.878
  467    HB   THR  74           HB       THR  74  -6.784  -5.079  -5.079
  468    HG1  THR  74           HG1      THR  74  -6.239  -6.919  -6.919
  469   1HG2  THR  74          1HG2      THR  74  -8.141  -3.908  -3.908
  470   2HG2  THR  74          3HG2      THR  74  -8.450  -5.645  -5.645
  471   3HG2  THR  74          2HG2      THR  74  -8.823  -4.662  -4.662
  472    H    PHE  75           HN       PHE  75  -6.107  -1.764  -1.764
  473    HA   PHE  75           HA       PHE  75  -7.033  -0.195  -0.195
  474   1HB   PHE  75          2HB       PHE  75  -5.856   0.613   0.613
  475   2HB   PHE  75          1HB       PHE  75  -6.571   1.759   1.759
  476    HD1  PHE  75           HD1      PHE  75  -5.515   2.181   2.181
  477    HD2  PHE  75           HD2      PHE  75  -3.714  -0.374  -0.374
  478    HE1  PHE  75           HE1      PHE  75  -3.371   2.317   2.317
  479    HE2  PHE  75           HE2      PHE  75  -1.570  -0.237  -0.237
  480    HZ   PHE  75           HZ       PHE  75  -1.398   1.109   1.109
  481    H    GLU  76           HN       GLU  76  -9.131   0.284   0.284
  482    HA   GLU  76           HA       GLU  76 -10.933  -0.482  -0.482
  483   1HB   GLU  76          2HB       GLU  76 -11.560  -0.862  -0.862
  484   2HB   GLU  76          1HB       GLU  76 -11.407   0.857   0.857
  485   1HG   GLU  76          2HG       GLU  76 -13.340   1.403   1.403
  486   2HG   GLU  76          2HG       GLU  76 -13.266  -0.048  -0.048
  487    H    PHE  77           HN       PHE  77 -12.411   0.907   0.907
  488    HA   PHE  77           HA       PHE  77 -11.967   3.787   3.787
  489   1HB   PHE  77          2HB       PHE  77 -11.410   2.140   2.140
  490   2HB   PHE  77          1HB       PHE  77 -11.635   3.884   3.884
  491    HD1  PHE  77           HD2      PHE  77 -10.189   4.871   4.871
  492    HD2  PHE  77           HD1      PHE  77  -9.196   1.633   1.633
  493    HE1  PHE  77           HE2      PHE  77  -7.802   5.177   5.177
  494    HE2  PHE  77           HE1      PHE  77  -6.809   1.939   1.939
  495    HZ   PHE  77           HZ       PHE  77  -6.112   3.711   3.711
  496    H    ILE  78           HN       ILE  78 -14.141   3.888   3.888
  497    HA   ILE  78           HA       ILE  78 -16.190   2.878   2.878
  498    HB   ILE  78           HB       ILE  78 -16.449   4.375   4.375
  499   1HG1  ILE  78          2HG1      ILE  78 -16.608   1.439   1.439
  500   2HG1  ILE  78          1HG1      ILE  78 -15.452   2.224   2.224
  501   1HG2  ILE  78          1HG2      ILE  78 -18.341   4.055   4.055
  502   2HG2  ILE  78          3HG2      ILE  78 -18.728   2.784   2.784
  503   3HG2  ILE  78          2HG2      ILE  78 -18.664   4.467   4.467
  504   1HD1  ILE  78          2HD1      ILE  78 -17.985   2.909   2.909
  505   2HD1  ILE  78          1HD1      ILE  78 -18.081   1.194   1.194
  506   3HD1  ILE  78          3HD1      ILE  78 -16.833   1.770   1.770
  507    H    LEU  79           HN       LEU  79 -16.158   4.081   4.081
  508    HA   LEU  79           HA       LEU  79 -16.796   6.935   6.935
  509   1HB   LEU  79          2HB       LEU  79 -15.384   7.174   7.174
  510   2HB   LEU  79          1HB       LEU  79 -14.566   7.139   7.139
  511    HG   LEU  79           HG       LEU  79 -14.052   4.781   4.781
  512   1HD1  LEU  79          2HD1      LEU  79 -15.804   5.075   5.075
  513   2HD1  LEU  79          1HD1      LEU  79 -14.477   3.912   3.912
  514   3HD1  LEU  79          3HD1      LEU  79 -15.730   3.772   3.772
  515   1HD2  LEU  79          3HD2      LEU  79 -13.259   6.757   6.757
  516   2HD2  LEU  79          2HD2      LEU  79 -12.276   5.961   5.961
  517   3HD2  LEU  79          1HD2      LEU  79 -12.759   5.081   5.081
  518    H    ASP  80           HN       ASP  80 -17.890   7.797   7.797
  519    HA   ASP  80           HA       ASP  80 -19.789   5.915   5.915
  520   1HB   ASP  80          2HB       ASP  80 -19.535   8.789   8.789
  521   2HB   ASP  80          1HB       ASP  80 -20.066   8.318   8.318
  522    HA   PRO  81           HA       PRO  81 -17.367   5.186   5.186
  523   1HB   PRO  81          2HB       PRO  81 -18.957   3.289   3.289
  524   2HB   PRO  81          1HB       PRO  81 -17.902   2.989   2.989
  525   1HG   PRO  81          2HG       PRO  81 -20.822   3.213   3.213
  526   2HG   PRO  81          2HG       PRO  81 -19.790   2.467   2.467
  527   1HD   PRO  81          2HD       PRO  81 -21.048   5.045   5.045
  528   2HD   PRO  81          1HD       PRO  81 -20.029   4.282   4.282
  529    H    ASN  82           HN       ASN  82 -19.470   7.337   7.337
  530    HA   ASN  82           HA       ASN  82 -20.832   7.177   7.177
  531   1HB   ASN  82          2HB       ASN  82 -20.644   9.761   9.761
  532   2HB   ASN  82          1HB       ASN  82 -22.031   9.008   9.008
  533   1HD2  ASN  82          2HD2      ASN  82 -22.186   6.687   6.687
  534   2HD2  ASN  82          1HD2      ASN  82 -21.726   6.448   6.448
  535    H    GLN  83           HN       GLN  83 -17.931   8.537   8.537
  536    HA   GLN  83           HA       GLN  83 -17.373  10.228  10.228
  537   1HB   GLN  83          2HB       GLN  83 -16.538  10.204  10.204
  538   2HB   GLN  83          1HB       GLN  83 -15.135   9.572   9.572
  539   1HG   GLN  83          2HG       GLN  83 -14.850  11.518  11.518
  540   2HG   GLN  83          2HG       GLN  83 -16.532  12.010  12.010
  541   1HE2  GLN  83          2HE2      GLN  83 -14.602  14.216  14.216
  542   2HE2  GLN  83          1HE2      GLN  83 -14.820  13.929  13.929
  543    H    GLU  84           HN       GLU  84 -14.589   9.675   9.675
  544    HA   GLU  84           HA       GLU  84 -14.728   7.211   7.211
  545   1HB   GLU  84          2HB       GLU  84 -14.008   9.444   9.444
  546   2HB   GLU  84          1HB       GLU  84 -12.535   9.275   9.275
  547   1HG   GLU  84          2HG       GLU  84 -11.667   7.929   7.929
  548   2HG   GLU  84          2HG       GLU  84 -13.019   6.811   6.811
  549    H    ASN  85           HN       ASN  85 -14.615   6.130   6.130
  550    HA   ASN  85           HA       ASN  85 -12.433   6.129   6.129
  551   1HB   ASN  85          2HB       ASN  85 -14.150   3.822   3.822
  552   2HB   ASN  85          1HB       ASN  85 -13.027   3.726   3.726
  553   1HD2  ASN  85          2HD2      ASN  85 -15.855   4.614   4.614
  554   2HD2  ASN  85          1HD2      ASN  85 -14.828   3.327   3.327
  555    H    VAL  86           HN       VAL  86 -10.507   6.454   6.454
  556    HA   VAL  86           HA       VAL  86  -9.590   4.202   4.202
  557    HB   VAL  86           HB       VAL  86  -8.579   7.042   7.042
  558   1HG1  VAL  86          1HG1      VAL  86  -6.924   5.181   5.181
  559   2HG1  VAL  86          3HG1      VAL  86  -7.861   4.958   4.958
  560   3HG1  VAL  86          2HG1      VAL  86  -7.073   6.504   6.504
  561   1HG2  VAL  86          2HG2      VAL  86 -10.853   6.051   6.051
  562   2HG2  VAL  86          1HG2      VAL  86 -10.036   7.576   7.576
  563   3HG2  VAL  86          3HG2      VAL  86  -9.640   6.131   6.131
  564    H    LEU  87           HN       LEU  87  -8.867   2.875   2.875
  565    HA   LEU  87           HA       LEU  87  -7.338   3.650   3.650
  566   1HB   LEU  87          2HB       LEU  87  -8.445   1.448   1.448
  567   2HB   LEU  87          1HB       LEU  87  -7.236   1.017   1.017
  568    HG   LEU  87           HG       LEU  87  -5.560   1.701   1.701
  569   1HD1  LEU  87          1HD1      LEU  87  -7.951   2.070   2.070
  570   2HD1  LEU  87          3HD1      LEU  87  -7.383   0.502   0.502
  571   3HD1  LEU  87          2HD1      LEU  87  -6.352   1.927   1.927
  572   1HD2  LEU  87          3HD2      LEU  87  -6.003  -0.573  -0.573
  573   2HD2  LEU  87          2HD2      LEU  87  -5.294  -0.585  -0.585
  574   3HD2  LEU  87          1HD2      LEU  87  -7.014  -0.919  -0.919
  575    H    GLU  88           HN       GLU  88  -5.749   5.090   5.090
  576    HA   GLU  88           HA       GLU  88  -3.695   4.276   4.276
  577   1HB   GLU  88          2HB       GLU  88  -3.817   6.857   6.857
  578   2HB   GLU  88          1HB       GLU  88  -2.954   6.523   6.523
  579   1HG   GLU  88          2HG       GLU  88  -5.535   5.907   5.907
  580   2HG   GLU  88          2HG       GLU  88  -5.768   7.252   7.252
  581    H    ILE  89           HN       ILE  89  -2.768   2.587   2.587
  582    HA   ILE  89           HA       ILE  89  -1.539   3.235   3.235
  583    HB   ILE  89           HB       ILE  89  -1.088   0.746   0.746
  584   1HG1  ILE  89          2HG1      ILE  89  -3.076   0.146   0.146
  585   2HG1  ILE  89          1HG1      ILE  89  -3.581   1.682   1.682
  586   1HG2  ILE  89          1HG2      ILE  89  -0.625   1.604   1.604
  587   2HG2  ILE  89          3HG2      ILE  89  -1.229  -0.041  -0.041
  588   3HG2  ILE  89          2HG2      ILE  89   0.268   0.457   0.457
  589   1HD1  ILE  89          1HD1      ILE  89  -2.609  -0.056  -0.056
  590   2HD1  ILE  89          3HD1      ILE  89  -3.840  -0.892  -0.892
  591   3HD1  ILE  89          2HD1      ILE  89  -4.212   0.658   0.658
  592    H    THR  90           HN       THR  90   0.893   2.628   2.628
  593    HA   THR  90           HA       THR  90   2.434   2.893   2.893
  594    HB   THR  90           HB       THR  90   2.921   5.111   5.111
  595    HG1  THR  90           HG1      THR  90   1.151   6.128   6.128
  596   1HG2  THR  90          2HG2      THR  90   3.980   4.306   4.306
  597   2HG2  THR  90          1HG2      THR  90   2.931   5.663   5.663
  598   3HG2  THR  90          3HG2      THR  90   4.215   5.876   5.876
  599    H    LEU  91           HN       LEU  91   3.862   1.340   1.340
  600    HA   LEU  91           HA       LEU  91   4.973   0.921   0.921
  601   1HB   LEU  91          2HB       LEU  91   4.536  -1.080  -1.080
  602   2HB   LEU  91          1HB       LEU  91   5.331  -0.452  -0.452
  603    HG   LEU  91           HG       LEU  91   6.569  -2.195  -2.195
  604   1HD1  LEU  91          3HD1      LEU  91   7.442  -0.384  -0.384
  605   2HD1  LEU  91          2HD1      LEU  91   8.326   0.166   0.166
  606   3HD1  LEU  91          1HD1      LEU  91   8.524  -1.490  -1.490
  607   1HD2  LEU  91          1HD2      LEU  91   6.055  -0.857  -0.857
  608   2HD2  LEU  91          3HD2      LEU  91   7.675  -1.532  -1.532
  609   3HD2  LEU  91          2HD2      LEU  91   7.393   0.182   0.182
  610    H    MET  92           HN       MET  92   6.444   2.336   2.336
  611    HA   MET  92           HA       MET  92   8.384   3.329   3.329
  612   1HB   MET  92          2HB       MET  92   7.373   4.726   4.726
  613   2HB   MET  92          1HB       MET  92   8.456   5.389   5.389
  614   1HG   MET  92          2HG       MET  92   6.565   4.878   4.878
  615   2HG   MET  92          2HG       MET  92   5.538   4.698   4.698
  616   1HE   MET  92          2HE       MET  92   8.414   6.675   6.675
  617   2HE   MET  92          1HE       MET  92   7.811   8.304   8.304
  618   3HE   MET  92          3HE       MET  92   8.374   7.840   7.840
  619    H    ASP  93           HN       ASP  93  10.187   4.509   4.509
  620    HA   ASP  93           HA       ASP  93  11.299   2.514   2.514
  621   1HB   ASP  93          2HB       ASP  93  12.340   2.864   2.864
  622   2HB   ASP  93          1HB       ASP  93  13.021   4.322   4.322
  623    H    ALA  94           HN       ALA  94  11.303   3.317   3.317
  624    HA   ALA  94           HA       ALA  94  11.078   6.098   6.098
  625   1HB   ALA  94          2HB       ALA  94  11.162   3.566   3.566
  626   2HB   ALA  94          1HB       ALA  94  11.769   4.978   4.978
  627   3HB   ALA  94          3HB       ALA  94  10.129   4.981   4.981
  628    H    ASN  95           HN       ASN  95  12.713   7.442   7.442
  629    HA   ASN  95           HA       ASN  95  15.466   6.553   6.553
  630   1HB   ASN  95          2HB       ASN  95  14.514   9.058   9.058
  631   2HB   ASN  95          1HB       ASN  95  16.164   8.434   8.434
  632   1HD2  ASN  95          2HD2      ASN  95  15.099   7.248   7.248
  633   2HD2  ASN  95          1HD2      ASN  95  15.733   8.643   8.643
  634    H    TYR  96           HN       TYR  96  16.653   9.010   9.010
  635    HA   TYR  96           HA       TYR  96  15.530   9.742   9.742
  636   1HB   TYR  96          2HB       TYR  96  17.703  10.086  10.086
  637   2HB   TYR  96          1HB       TYR  96  17.795   8.597   8.597
  638    HD1  TYR  96           HD2      TYR  96  18.572   8.848   8.848
  639    HD2  TYR  96           HD1      TYR  96  19.219  11.779  11.779
  640    HE1  TYR  96           HE2      TYR  96  20.410   9.818   9.818
  641    HE2  TYR  96           HE1      TYR  96  21.058  12.743  12.743
  642    HH   TYR  96           HH       TYR  96  22.211  11.217  11.217
  643    H    VAL  97           HN       VAL  97  15.870  10.903  10.903
  644    HA   VAL  97           HA       VAL  97  15.651  13.681  13.681
  645    HB   VAL  97           HB       VAL  97  16.806  14.315  14.315
  646   1HG1  VAL  97          3HG1      VAL  97  17.755  14.221  14.221
  647   2HG1  VAL  97          2HG1      VAL  97  18.693  12.865  12.865
  648   3HG1  VAL  97          1HG1      VAL  97  18.849  14.460  14.460
  649   1HG2  VAL  97          2HG2      VAL  97  17.407  11.371  11.371
  650   2HG2  VAL  97          1HG2      VAL  97  16.837  12.330  12.330
  651   3HG2  VAL  97          3HG2      VAL  97  18.499  12.502  12.502
  652    H    MET  98           HN       MET  98  15.189  11.518  11.518
  653    HA   MET  98           HA       MET  98  12.502  12.607  12.607
  654   1HB   MET  98          2HB       MET  98  14.570  12.550  12.550
  655   2HB   MET  98          1HB       MET  98  12.867  12.950  12.950
  656   1HG   MET  98          2HG       MET  98  13.334  14.752  14.752
  657   2HG   MET  98          2HG       MET  98  15.022  14.504  14.504
  658   1HE   MET  98          1HE       MET  98  16.166  15.429  15.429
  659   2HE   MET  98          3HE       MET  98  15.751  15.794  15.794
  660   3HE   MET  98          2HE       MET  98  15.645  17.052  17.052
  661    H    ASP  99           HN       ASP  99  11.114  11.024  11.024
  662    HA   ASP  99           HA       ASP  99  11.884   8.311   8.311
  663   1HB   ASP  99          2HB       ASP  99   9.261   9.555   9.555
  664   2HB   ASP  99          1HB       ASP  99   9.529   7.859   7.859
  665    H    GLU 100           HN       GLU 100  11.551   6.787   6.787
  666    HA   GLU 100           HA       GLU 100  11.685   7.979   7.979
  667   1HB   GLU 100          2HB       GLU 100  13.598   6.133   6.133
  668   2HB   GLU 100          1HB       GLU 100  13.261   5.866   5.866
  669   1HG   GLU 100          2HG       GLU 100  13.649   8.664   8.664
  670   2HG   GLU 100          2HG       GLU 100  14.981   7.809   7.809
  671    H    THR 101           HN       THR 101   9.889   7.322   7.322
  672    HA   THR 101           HA       THR 101   8.408   5.011   5.011
  673    HB   THR 101           HB       THR 101   8.235   6.466   6.466
  674    HG1  THR 101           HG1      THR 101   7.026   8.001   8.001
  675   1HG2  THR 101          2HG2      THR 101   6.406   4.739   4.739
  676   2HG2  THR 101          1HG2      THR 101   5.736   5.950   5.950
  677   3HG2  THR 101          3HG2      THR 101   6.773   4.669   4.669
  678    H    LEU 102           HN       LEU 102   8.436   2.980   2.980
  679    HA   LEU 102           HA       LEU 102  10.458   2.325   2.325
  680   1HB   LEU 102          2HB       LEU 102   9.307   0.521   0.521
  681   2HB   LEU 102          1HB       LEU 102  10.638   0.150   0.150
  682    HG   LEU 102           HG       LEU 102  10.735   2.497   2.497
  683   1HD1  LEU 102          2HD1      LEU 102  10.854  -0.320  -0.320
  684   2HD1  LEU 102          1HD1      LEU 102  12.337   0.533   0.533
  685   3HD1  LEU 102          3HD1      LEU 102  10.783   1.099   1.099
  686   1HD2  LEU 102          2HD2      LEU 102  12.340   1.895   1.895
  687   2HD2  LEU 102          1HD2      LEU 102  12.929   2.675   2.675
  688   3HD2  LEU 102          3HD2      LEU 102  13.126   0.935   0.935
  689    H    GLY 103           HN       GLY 103   7.166   1.587   1.587
  690   1HA   GLY 103          2HA       GLY 103   6.257   1.170   1.170
  691   2HA   GLY 103          1HA       GLY 103   6.383  -0.344  -0.344
  692    H    THR 104           HN       THR 104   4.304   2.062   2.062
  693    HA   THR 104           HA       THR 104   2.727   1.890   1.890
  694    HB   THR 104           HB       THR 104   3.139   4.144   4.144
  695    HG1  THR 104           HG1      THR 104   0.953   4.805   4.805
  696   1HG2  THR 104          1HG2      THR 104   2.235   3.186   3.186
  697   2HG2  THR 104          3HG2      THR 104   2.268   4.897   4.897
  698   3HG2  THR 104          2HG2      THR 104   3.761   3.956   3.956
  699    H    ALA 105           HN       ALA 105   0.272   1.942   1.942
  700    HA   ALA 105           HA       ALA 105  -0.491   0.413   0.413
  701   1HB   ALA 105          1HB       ALA 105   0.091  -0.993  -0.993
  702   2HB   ALA 105          3HB       ALA 105  -1.617  -0.647  -0.647
  703   3HB   ALA 105          2HB       ALA 105  -1.118  -1.497  -1.497
  704    H    THR 106           HN       THR 106  -2.745   0.453   0.453
  705    HA   THR 106           HA       THR 106  -4.384   2.243   2.243
  706    HB   THR 106           HB       THR 106  -5.120   3.496   3.496
  707    HG1  THR 106           HG1      THR 106  -4.180   3.148   3.148
  708   1HG2  THR 106          1HG2      THR 106  -2.693   3.765   3.765
  709   2HG2  THR 106          3HG2      THR 106  -2.261   3.856   3.856
  710   3HG2  THR 106          2HG2      THR 106  -3.455   4.971   4.971
  711    H    PHE 107           HN       PHE 107  -6.453   1.580   1.580
  712    HA   PHE 107           HA       PHE 107  -7.607  -0.180  -0.180
  713   1HB   PHE 107          2HB       PHE 107  -6.395  -1.602  -1.602
  714   2HB   PHE 107          1HB       PHE 107  -7.591  -1.045  -1.045
  715    HD1  PHE 107           HD1      PHE 107 -10.113  -1.273  -1.273
  716    HD2  PHE 107           HD2      PHE 107  -6.792  -3.593  -3.593
  717    HE1  PHE 107           HE1      PHE 107 -11.652  -3.030  -3.030
  718    HE2  PHE 107           HE2      PHE 107  -8.334  -5.353  -5.353
  719    HZ   PHE 107           HZ       PHE 107 -10.765  -5.071  -5.071
  720    H    THR 108           HN       THR 108  -9.535   0.665   0.665
  721    HA   THR 108           HA       THR 108 -10.886   2.438   2.438
  722    HB   THR 108           HB       THR 108 -12.483   1.312   1.312
  723    HG1  THR 108           HG1      THR 108 -10.153   2.773   2.773
  724   1HG2  THR 108          2HG2      THR 108 -13.023   3.386   3.386
  725   2HG2  THR 108          1HG2      THR 108 -11.555   4.125   4.125
  726   3HG2  THR 108          3HG2      THR 108 -12.858   3.656   3.656
  727    H    VAL 109           HN       VAL 109 -11.712   1.610   1.610
  728    HA   VAL 109           HA       VAL 109 -12.870  -1.054  -1.054
  729    HB   VAL 109           HB       VAL 109 -11.367  -0.201  -0.201
  730   1HG1  VAL 109          3HG1      VAL 109 -13.685   1.655   1.655
  731   2HG1  VAL 109          2HG1      VAL 109 -12.466   1.293   1.293
  732   3HG1  VAL 109          1HG1      VAL 109 -11.995   2.074   2.074
  733   1HG2  VAL 109          3HG2      VAL 109 -13.524  -1.836  -1.836
  734   2HG2  VAL 109          2HG2      VAL 109 -12.360  -1.548  -1.548
  735   3HG2  VAL 109          1HG2      VAL 109 -13.876  -0.645  -0.645
  736    H    SER 110           HN       SER 110 -13.994   2.201   2.201
  737    HA   SER 110           HA       SER 110 -16.504   2.051   2.051
  738   1HB   SER 110          2HB       SER 110 -17.124   3.692   3.692
  739   2HB   SER 110          1HB       SER 110 -16.018   4.187   4.187
  740    HG   SER 110           HG       SER 110 -15.560   3.945   3.945
  741    H    SER 111           HN       SER 111 -15.338   0.481   0.481
  742    HA   SER 111           HA       SER 111 -18.048  -0.568  -0.568
  743   1HB   SER 111          2HB       SER 111 -17.333  -0.683  -0.683
  744   2HB   SER 111          1HB       SER 111 -17.684   0.921   0.921
  745    HG   SER 111           HG       SER 111 -15.654   0.663   0.663
  746    H    MET 112           HN       MET 112 -17.266  -2.285  -2.285
  747    HA   MET 112           HA       MET 112 -15.662  -4.265  -4.265
  748   1HB   MET 112          2HB       MET 112 -15.131  -3.086  -3.086
  749   2HB   MET 112          1HB       MET 112 -15.170  -4.847  -4.847
  750   1HG   MET 112          2HG       MET 112 -13.726  -3.948  -3.948
  751   2HG   MET 112          2HG       MET 112 -13.076  -3.171  -3.171
  752   1HE   MET 112          3HE       MET 112 -13.385  -4.627  -4.627
  753   2HE   MET 112          2HE       MET 112 -13.378  -6.390  -6.390
  754   3HE   MET 112          1HE       MET 112 -11.853  -5.510  -5.510
  755    H    LYS 113           HN       LYS 113 -15.867  -6.459  -6.459
  756    HA   LYS 113           HA       LYS 113 -18.747  -6.982  -6.982
  757   1HB   LYS 113          2HB       LYS 113 -16.332  -8.666  -8.666
  758   2HB   LYS 113          1HB       LYS 113 -17.810  -9.420  -9.420
  759   1HG   LYS 113          2HG       LYS 113 -17.638  -9.411  -9.411
  760   2HG   LYS 113          2HG       LYS 113 -19.064  -8.569  -8.569
  761   1HD   LYS 113          2HD       LYS 113 -18.007  -7.286  -7.286
  762   2HD   LYS 113          1HD       LYS 113 -17.896  -6.417  -6.417
  763   1HE   LYS 113          2HE       LYS 113 -15.685  -6.288  -6.288
  764   2HE   LYS 113          1HE       LYS 113 -15.598  -8.042  -8.042
  765   1HZ   LYS 113          1HZ       LYS 113 -16.282  -7.931  -7.931
  766   2HZ   LYS 113          3HZ       LYS 113 -15.662  -6.355  -6.355
  767   3HZ   LYS 113          2HZ       LYS 113 -14.663  -7.680  -7.680
  768    H    VAL 114           HN       VAL 114 -18.189  -5.648  -5.648
  769    HA   VAL 114           HA       VAL 114 -16.952  -6.608  -6.608
  770    HB   VAL 114           HB       VAL 114 -18.075  -4.500  -4.500
  771   1HG1  VAL 114          1HG1      VAL 114 -19.956  -5.255  -5.255
  772   2HG1  VAL 114          3HG1      VAL 114 -20.717  -5.950  -5.950
  773   3HG1  VAL 114          2HG1      VAL 114 -20.435  -4.210  -4.210
  774   1HG2  VAL 114          2HG2      VAL 114 -18.148  -6.258  -6.258
  775   2HG2  VAL 114          1HG2      VAL 114 -18.540  -4.541  -4.541
  776   3HG2  VAL 114          3HG2      VAL 114 -19.828  -5.731  -5.731
  777    H    GLY 115           HN       GLY 115 -17.414  -7.985  -7.985
  778   1HA   GLY 115          2HA       GLY 115 -19.478  -9.380  -9.380
  779   2HA   GLY 115          1HA       GLY 115 -19.181 -10.219 -10.219
  780    H    GLU 116           HN       GLU 116 -16.178  -9.444  -9.444
  781    HA   GLU 116           HA       GLU 116 -15.511 -11.169 -11.169
  782   1HB   GLU 116          2HB       GLU 116 -16.058 -12.550 -12.550
  783   2HB   GLU 116          1HB       GLU 116 -14.408 -12.092 -12.092
  784   1HG   GLU 116          2HG       GLU 116 -13.550 -13.579 -13.579
  785   2HG   GLU 116          2HG       GLU 116 -14.613 -13.038 -13.038
  786    H    LYS 117           HN       LYS 117 -12.951 -11.698 -11.698
  787    HA   LYS 117           HA       LYS 117 -11.668  -9.115  -9.115
  788   1HB   LYS 117          2HB       LYS 117 -11.188 -11.648 -11.648
  789   2HB   LYS 117          1HB       LYS 117  -9.831 -11.325 -11.325
  790   1HG   LYS 117          2HG       LYS 117  -9.878  -8.961  -8.961
  791   2HG   LYS 117          2HG       LYS 117 -10.731  -9.826  -9.826
  792   1HD   LYS 117          2HD       LYS 117  -8.277 -11.123 -11.123
  793   2HD   LYS 117          1HD       LYS 117  -8.039  -9.623  -9.623
  794   1HE   LYS 117          2HE       LYS 117  -9.222 -10.510 -10.510
  795   2HE   LYS 117          1HE       LYS 117  -9.668 -11.958 -11.958
  796   1HZ   LYS 117          2HZ       LYS 117  -6.837 -11.231 -11.231
  797   2HZ   LYS 117          1HZ       LYS 117  -7.693 -12.068 -12.068
  798   3HZ   LYS 117          3HZ       LYS 117  -7.513 -12.753 -12.753
  799    H    LYS 118           HN       LYS 118  -9.417  -9.043  -9.043
  800    HA   LYS 118           HA       LYS 118  -9.573 -10.294 -10.294
  801   1HB   LYS 118          2HB       LYS 118  -9.459  -7.338  -7.338
  802   2HB   LYS 118          1HB       LYS 118  -9.005  -8.047  -8.047
  803   1HG   LYS 118          2HG       LYS 118 -11.648  -8.766  -8.766
  804   2HG   LYS 118          2HG       LYS 118 -11.470  -7.202  -7.202
  805   1HD   LYS 118          2HD       LYS 118 -10.953  -9.906  -9.906
  806   2HD   LYS 118          1HD       LYS 118 -12.309  -8.837  -8.837
  807   1HE   LYS 118          2HE       LYS 118 -10.364  -7.125  -7.125
  808   2HE   LYS 118          1HE       LYS 118  -9.447  -8.606  -8.606
  809   1HZ   LYS 118          2HZ       LYS 118 -12.095  -8.228  -8.228
  810   2HZ   LYS 118          1HZ       LYS 118 -10.698  -7.580  -7.580
  811   3HZ   LYS 118          3HZ       LYS 118 -10.828  -9.254  -9.254
  812    H    GLU 119           HN       GLU 119  -7.727 -11.418 -11.418
  813    HA   GLU 119           HA       GLU 119  -5.269 -10.290 -10.290
  814   1HB   GLU 119          2HB       GLU 119  -6.035 -12.964 -12.964
  815   2HB   GLU 119          1HB       GLU 119  -4.350 -12.537 -12.537
  816   1HG   GLU 119          2HG       GLU 119  -4.572 -12.609 -12.609
  817   2HG   GLU 119          2HG       GLU 119  -6.256 -12.084 -12.084
  818    H    VAL 120           HN       VAL 120  -4.818  -8.594  -8.594
  819    HA   VAL 120           HA       VAL 120  -4.667  -9.077  -9.077
  820    HB   VAL 120           HB       VAL 120  -3.777  -6.555  -6.555
  821   1HG1  VAL 120          1HG1      VAL 120  -4.943  -7.331  -7.331
  822   2HG1  VAL 120          3HG1      VAL 120  -4.989  -5.660  -5.660
  823   3HG1  VAL 120          2HG1      VAL 120  -3.439  -6.475  -6.475
  824   1HG2  VAL 120          3HG2      VAL 120  -6.460  -7.717  -7.717
  825   2HG2  VAL 120          2HG2      VAL 120  -5.771  -6.367  -6.367
  826   3HG2  VAL 120          1HG2      VAL 120  -6.427  -6.103  -6.103
  827    HA   PRO 121           HA       PRO 121  -0.258  -9.891  -9.891
  828   1HB   PRO 121          2HB       PRO 121   0.074 -10.938 -10.938
  829   2HB   PRO 121          1HB       PRO 121  -0.556 -11.859 -11.859
  830   1HG   PRO 121          2HG       PRO 121  -1.955 -10.867 -10.867
  831   2HG   PRO 121          2HG       PRO 121  -2.426 -12.136 -12.136
  832   1HD   PRO 121          2HD       PRO 121  -3.387  -9.447  -9.447
  833   2HD   PRO 121          1HD       PRO 121  -3.830 -10.712 -10.712
  834    H    PHE 122           HN       PHE 122   0.706  -7.893  -7.893
  835    HA   PHE 122           HA       PHE 122   0.885  -6.481  -6.481
  836   1HB   PHE 122          2HB       PHE 122   0.844  -5.505  -5.505
  837   2HB   PHE 122          1HB       PHE 122   1.525  -4.518  -4.518
  838    HD1  PHE 122           HD2      PHE 122  -0.191  -4.833  -4.833
  839    HD2  PHE 122           HD1      PHE 122  -1.227  -4.723  -4.723
  840    HE1  PHE 122           HE2      PHE 122  -2.455  -4.056  -4.056
  841    HE2  PHE 122           HE1      PHE 122  -3.491  -3.945  -3.945
  842    HZ   PHE 122           HZ       PHE 122  -4.105  -3.612  -3.612
  843    H    ILE 123           HN       ILE 123   2.701  -7.316  -7.316
  844    HA   ILE 123           HA       ILE 123   5.151  -7.270  -7.270
  845    HB   ILE 123           HB       ILE 123   4.377  -8.737  -8.737
  846   1HG1  ILE 123          2HG1      ILE 123   5.501  -9.657  -9.657
  847   2HG1  ILE 123          1HG1      ILE 123   3.797  -9.690  -9.690
  848   1HG2  ILE 123          2HG2      ILE 123   7.030  -7.798  -7.798
  849   2HG2  ILE 123          1HG2      ILE 123   6.966  -9.561  -9.561
  850   3HG2  ILE 123          3HG2      ILE 123   6.477  -8.650  -8.650
  851   1HD1  ILE 123          2HD1      ILE 123   5.440 -10.960 -10.960
  852   2HD1  ILE 123          1HD1      ILE 123   5.677 -11.705 -11.705
  853   3HD1  ILE 123          3HD1      ILE 123   4.058 -11.605 -11.605
  854    H    PHE 124           HN       PHE 124   6.712  -5.870  -5.870
  855    HA   PHE 124           HA       PHE 124   6.339  -3.978  -3.978
  856   1HB   PHE 124          2HB       PHE 124   7.967  -3.759  -3.759
  857   2HB   PHE 124          1HB       PHE 124   7.889  -2.531  -2.531
  858    HD1  PHE 124           HD2      PHE 124   5.105  -2.446  -2.446
  859    HD2  PHE 124           HD1      PHE 124   6.856  -2.960  -2.960
  860    HE1  PHE 124           HE2      PHE 124   3.064  -1.543  -1.543
  861    HE2  PHE 124           HE1      PHE 124   4.813  -2.066  -2.066
  862    HZ   PHE 124           HZ       PHE 124   2.918  -1.355  -1.355
  863    H    ASN 125           HN       ASN 125   7.957  -3.611  -3.611
  864    HA   ASN 125           HA       ASN 125   9.754  -4.117  -4.117
  865   1HB   ASN 125          2HB       ASN 125  10.854  -4.976  -4.976
  866   2HB   ASN 125          1HB       ASN 125  11.794  -5.078  -5.078
  867   1HD2  ASN 125          2HD2      ASN 125  11.401  -1.582  -1.582
  868   2HD2  ASN 125          1HD2      ASN 125  10.839  -3.094  -3.094
  869    H    GLN 126           HN       GLN 126  10.371  -6.821  -6.821
  870    HA   GLN 126           HA       GLN 126   8.837  -8.709  -8.709
  871   1HB   GLN 126          2HB       GLN 126  10.689  -9.995  -9.995
  872   2HB   GLN 126          1HB       GLN 126  10.802  -8.341  -8.341
  873   1HG   GLN 126          2HG       GLN 126  12.344  -7.920  -7.920
  874   2HG   GLN 126          2HG       GLN 126  12.439  -9.677  -9.677
  875   1HE2  GLN 126          2HE2      GLN 126  15.077  -9.663  -9.663
  876   2HE2  GLN 126          1HE2      GLN 126  14.443 -10.123 -10.123
  877    H    VAL 127           HN       VAL 127  11.409  -8.142  -8.142
  878    HA   VAL 127           HA       VAL 127  10.861 -10.678 -10.678
  879    HB   VAL 127           HB       VAL 127  12.828 -10.207 -10.207
  880   1HG1  VAL 127          2HG1      VAL 127  12.872 -10.860 -10.860
  881   2HG1  VAL 127          1HG1      VAL 127  13.647  -9.283  -9.283
  882   3HG1  VAL 127          3HG1      VAL 127  14.366 -10.517 -10.517
  883   1HG2  VAL 127          1HG2      VAL 127  12.242  -7.474  -7.474
  884   2HG2  VAL 127          3HG2      VAL 127  13.244  -8.074  -8.074
  885   3HG2  VAL 127          2HG2      VAL 127  13.931  -7.896  -7.896
  886    H    THR 128           HN       THR 128  10.077  -7.301  -7.301
  887    HA   THR 128           HA       THR 128   9.688  -7.372  -7.372
  888    HB   THR 128           HB       THR 128   8.609  -5.552  -5.552
  889    HG1  THR 128           HG1      THR 128  10.910  -5.603  -5.603
  890   1HG2  THR 128          2HG2      THR 128   7.758  -5.817  -5.817
  891   2HG2  THR 128          1HG2      THR 128   8.334  -4.195  -4.195
  892   3HG2  THR 128          3HG2      THR 128   7.023  -4.915  -4.915
  893    H    GLU 129           HN       GLU 129   8.043  -8.080  -8.080
  894    HA   GLU 129           HA       GLU 129   5.527  -8.838  -8.838
  895   1HB   GLU 129          2HB       GLU 129   6.778 -10.882 -10.882
  896   2HB   GLU 129          1HB       GLU 129   7.132 -10.496 -10.496
  897   1HG   GLU 129          2HG       GLU 129   5.260 -11.549 -11.549
  898   2HG   GLU 129          2HG       GLU 129   4.311 -10.391 -10.391
  899    H    MET 130           HN       MET 130   3.886  -7.810  -7.810
  900    HA   MET 130           HA       MET 130   3.868  -7.407  -7.407
  901   1HB   MET 130          2HB       MET 130   4.649  -5.296  -5.296
  902   2HB   MET 130          1HB       MET 130   3.427  -5.273  -5.273
  903   1HG   MET 130          2HG       MET 130   1.892  -4.387  -4.387
  904   2HG   MET 130          2HG       MET 130   2.234  -5.563  -5.563
  905   1HE   MET 130          3HE       MET 130   1.289  -3.468  -3.468
  906   2HE   MET 130          2HE       MET 130   2.470  -4.012  -4.012
  907   3HE   MET 130          1HE       MET 130   2.372  -2.302  -2.302
  908    H    VAL 131           HN       VAL 131   2.150  -8.534  -8.534
  909    HA   VAL 131           HA       VAL 131  -0.241  -8.626  -8.626
  910    HB   VAL 131           HB       VAL 131   0.512 -10.226 -10.226
  911   1HG1  VAL 131          3HG1      VAL 131  -2.021  -9.793  -9.793
  912   2HG1  VAL 131          2HG1      VAL 131  -1.523 -11.412 -11.412
  913   3HG1  VAL 131          1HG1      VAL 131  -1.576 -10.993 -10.993
  914   1HG2  VAL 131          3HG2      VAL 131   0.766 -10.695 -10.695
  915   2HG2  VAL 131          2HG2      VAL 131   1.929 -11.013 -11.013
  916   3HG2  VAL 131          1HG2      VAL 131   0.525 -12.063 -12.063
  917    H    LEU 132           HN       LEU 132  -2.014  -7.517  -7.517
  918    HA   LEU 132           HA       LEU 132  -2.263  -6.325  -6.325
  919   1HB   LEU 132          2HB       LEU 132  -1.847  -4.814  -4.814
  920   2HB   LEU 132          1HB       LEU 132  -3.554  -5.116  -5.116
  921    HG   LEU 132           HG       LEU 132  -3.676  -4.505  -4.505
  922   1HD1  LEU 132          3HD1      LEU 132  -1.152  -4.071  -4.071
  923   2HD1  LEU 132          2HD1      LEU 132  -1.588  -2.589  -2.589
  924   3HD1  LEU 132          1HD1      LEU 132  -2.163  -2.861  -2.861
  925   1HD2  LEU 132          2HD2      LEU 132  -3.935  -2.902  -2.902
  926   2HD2  LEU 132          1HD2      LEU 132  -5.143  -3.293  -3.293
  927   3HD2  LEU 132          3HD2      LEU 132  -3.955  -2.024  -2.024
  928    H    GLU 133           HN       GLU 133  -3.843  -7.258  -7.258
  929    HA   GLU 133           HA       GLU 133  -6.086  -8.501  -8.501
  930   1HB   GLU 133          2HB       GLU 133  -5.494  -8.668  -8.668
  931   2HB   GLU 133          1HB       GLU 133  -6.467  -9.761  -9.761
  932   1HG   GLU 133          2HG       GLU 133  -4.129  -9.985  -9.985
  933   2HG   GLU 133          2HG       GLU 133  -3.518  -9.594  -9.594
  934    H    MET 134           HN       MET 134  -7.673  -7.109  -7.109
  935    HA   MET 134           HA       MET 134  -8.655  -5.426  -5.426
  936   1HB   MET 134          2HB       MET 134  -9.439  -3.839  -3.839
  937   2HB   MET 134          1HB       MET 134  -7.695  -3.909  -3.909
  938   1HG   MET 134          2HG       MET 134  -7.388  -4.509  -4.509
  939   2HG   MET 134          2HG       MET 134  -8.471  -5.880  -5.880
  940   1HE   MET 134          1HE       MET 134 -11.241  -4.673  -4.673
  941   2HE   MET 134          3HE       MET 134 -11.938  -4.400  -4.400
  942   3HE   MET 134          2HE       MET 134 -11.025  -5.869  -5.869
  943    H    SER 135           HN       SER 135 -10.696  -5.781  -5.781
  944    HA   SER 135           HA       SER 135 -12.369  -7.374  -7.374
  945   1HB   SER 135          2HB       SER 135 -13.228  -8.518  -8.518
  946   2HB   SER 135          1HB       SER 135 -11.633  -8.151  -8.151
  947    HG   SER 135           HG       SER 135 -13.248  -7.575  -7.575
  948    H    LEU 136           HN       LEU 136 -14.311  -6.629  -6.629
  949    HA   LEU 136           HA       LEU 136 -15.009  -3.912  -3.912
  950   1HB   LEU 136          2HB       LEU 136 -14.710  -4.722  -4.722
  951   2HB   LEU 136          1HB       LEU 136 -16.361  -5.284  -5.284
  952    HG   LEU 136           HG       LEU 136 -17.120  -3.074  -3.074
  953   1HD1  LEU 136          2HD1      LEU 136 -14.200  -2.441  -2.441
  954   2HD1  LEU 136          1HD1      LEU 136 -15.357  -1.174  -1.174
  955   3HD1  LEU 136          3HD1      LEU 136 -15.484  -2.014  -2.014
  956   1HD2  LEU 136          3HD2      LEU 136 -16.249  -3.839  -3.839
  957   2HD2  LEU 136          2HD2      LEU 136 -17.170  -2.369  -2.369
  958   3HD2  LEU 136          1HD2      LEU 136 -15.410  -2.301  -2.301
  959    H    GLU 137           HN       GLU 137 -17.156  -3.403  -3.403
  960    HA   GLU 137           HA       GLU 137 -19.200  -5.378  -5.378
  961   1HB   GLU 137          2HB       GLU 137 -17.313  -5.016  -5.016
  962   2HB   GLU 137          1HB       GLU 137 -19.005  -4.865  -4.865
  963   1HG   GLU 137          2HG       GLU 137 -19.326  -7.057  -7.057
  964   2HG   GLU 137          2HG       GLU 137 -17.578  -7.223  -7.223
  965    H    VAL 138           HN       VAL 138 -21.114  -4.533  -4.533
  966    HA   VAL 138           HA       VAL 138 -21.218  -1.722  -1.722
  967    HB   VAL 138           HB       VAL 138 -23.021  -1.329  -1.329
  968   1HG1  VAL 138          2HG1      VAL 138 -20.624  -0.475  -0.475
  969   2HG1  VAL 138          1HG1      VAL 138 -20.287  -1.780  -1.780
  970   3HG1  VAL 138          3HG1      VAL 138 -21.465  -0.532  -0.532
  971   1HG2  VAL 138          2HG2      VAL 138 -22.622  -4.022  -4.022
  972   2HG2  VAL 138          1HG2      VAL 138 -23.505  -2.888  -2.888
  973   3HG2  VAL 138          3HG2      VAL 138 -21.799  -3.218  -3.218