NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
2501 1bzf 4262 cing 1-original 1 XPLOR/CNS distance NOE simple


! trimetrexate (TMQ) is labelled as residue 170
!
! NOE restraints
!---------------------------------------
! Long-range noes 
! r-6 averaging for aromatics and some others
assign (resid   1 and name hg2*) (resid 106 and name hd* )  5.5  5.5  0.0 
assign (resid   3 and name ha  ) (resid 103 and name he* )  3.5  3.5  0.0 
assign (resid   3 and name ha  ) (resid 110 and name hg* )  5.5  5.5  0.0 
assign (resid   3 and name hb1 ) (resid 103 and name he* )  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid  96 and name hb  )  3.5  3.5  0.5 
assign (resid   3 and name hd* ) (resid  96 and name hn  )  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid  96 and name hg1*)  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid  96 and name hg2*)  5.5  5.5  0.0
assign (resid   3 and name hd* ) (resid 103 and name hd* )  4.5  4.5  0.0 
assign (resid   3 and name hd* ) (resid 110 and name hg1*)  5.5  5.5  0.0 
assign (resid   3 and name hd* ) (resid 110 and name hg2*)  3.5  3.5  0.0
assign (resid   3 and name hd* ) (resid 113 and name hd2*)  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid 128 and name he* )  3.5  3.5  1.0 
assign (resid   3 and name hd* ) (resid 131 and name hd2*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid  96 and name hg1*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hb1 )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hb2 )  5.5  5.5  0.0 
assign (resid   3 and name he* ) (resid 103 and name hd* )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name he* ) (resid 106 and name hb1 )  3.5  3.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hb2 )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 106 and name hd* )  5.5  5.5  0.5
assign (resid   3 and name he* ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name he* ) (resid 107 and name ha  )  3.5  3.5  0.5
assign (resid   3 and name he* ) (resid 110 and name hb  )  3.5  3.5  0.0 
assign (resid   3 and name he* ) (resid 128 and name he* )  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 129 and name hd1*)  4.5  4.5  0.0 
assign (resid   3 and name he* ) (resid 131 and name hd1*)  5.5  5.5  0.0 
assign (resid   3 and name he* ) (resid 131 and name hd2*)  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid   3 and name hz  ) (resid 110 and name hg* )  4.5  4.5  0.0
assign (resid   4 and name hb1 ) (resid  30 and name he* ) 10.0  5.5  0.0 
assign (resid   4 and name hg  ) (resid  30 and name hd* )  4.5  4.5  0.5 
assign (resid   4 and name hg  ) (resid  30 and name he* )  5.5  5.5  0.0 
assign (resid   4 and name hd1*) (resid  29 and name hd* )  5.5  5.5  0.0 
assign (resid   4 and name hd1*) (resid  29 and name he* )  3.5  3.5  1.0 
assign (resid   4 and name hd2*) (resid  29 and name he* )  5.5  5.5  1.0 
assign (resid   4 and name hd1*) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid   4 and name hd2*) (resid  30 and name hd* )  3.5  3.5  0.0 
assign (resid   4 and name hd2*) (resid  30 and name he* )  3.5  3.5  0.0
assign (resid   4 and name hb* ) (resid  95 and name hg* )  3.5  3.5  0.5 
assign (resid   4 and name hn  ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid   4 and name hn  ) (resid 103 and name he* )  3.5  3.5  0.0
assign (resid   5 and name hb* ) (resid 103 and name he* )  3.5  3.5  0.0
assign (resid   6 and name ha  ) (resid 115 and name hg* )  5.5  5.5  0.0 
assign (resid   6 and name hb* ) (resid  19 and name hd* )  4.5  4.5  0.0 
assign (resid   7 and name hb* ) (resid  11 and name ha* )  3.5  3.5  0.5  
assign (resid   7 and name hg* ) (resid 115 and name hg1*)  5.5  5.5  0.5  
assign (resid   7 and name hg* ) (resid 115 and name hg2*)  3.5  3.5  0.0  
assign (resid   8 and name hb1 ) (resid 122 and name hd* )  3.5  3.5  0.0 
assign (resid   8 and name hb2 ) (resid 122 and name hd* )  3.5  3.5  0.5 
assign (resid  13 and name ha  ) (resid  19 and name hd* )  5.5  5.5  1.5 
assign (resid  13 and name hd1*) (resid 103 and name hd* )  5.5  5.5  0.5  
assign (resid  13 and name hd1*) (resid 103 and name he* )  5.5  5.5  0.5 
assign (resid  14 and name ha* ) (resid  20 and name hd* )  3.5  3.5  0.0 
assign (resid  15 and name hb* ) (resid 124 and name ha* )  3.5  3.5  0.0  
assign (resid  21 and name hb1 ) (resid 122 and name he* )  5.5  5.5  0.0  
assign (resid  21 and name he3 ) (resid 122 and name hd* )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid 122 and name he* )  5.5  5.5  0.0 
assign (resid  21 and name hz3 ) (resid 122 and name hd* )  4.5  4.5  0.0  
assign (resid  26 and name ha  ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  26 and name hb2 ) (resid 155 and name he* )  5.5  5.5  0.0  
assign (resid  29 and name hb1 ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  29 and name hb2 ) (resid 155 and name he* )  4.5  4.5  0.0 
assign (resid  29 and name hd* ) (resid 155 and name hd* )  5.5  5.5  0.0  
assign (resid  29 and name hd* ) (resid 155 and name he* )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 114 and name hb1 )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 114 and name hb2 )  5.5  5.5  0.5  
assign (resid  29 and name he* ) (resid 114 and name hd1*)  5.5  5.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name hb* )  4.5  4.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name hd* )  5.5  5.5  0.0  
assign (resid  29 and name he* ) (resid 155 and name he* )  5.5  5.5  0.5  
assign (resid  30 and name hd* ) (resid  54 and name hd1*)  5.5  5.5  0.0 
assign (resid  30 and name hd* ) (resid  97 and name hb* )  5.5  5.5  1.0
assign (resid  30 and name he* ) (resid  39 and name he* )  5.5  5.5  1.0 
assign (resid  30 and name he* ) (resid  41 and name hg1*)  5.5  5.5  1.0 
assign (resid  30 and name he* ) (resid  97 and name hb* )  2.5  2.5  1.0 
assign (resid  30 and name he* ) (resid  54 and name hd1*)  3.5  3.5  0.0 
assign (resid  35 and name hg* ) (resid  57 and name he  )  5.5  5.5  0.0
assign (resid  35 and name hg* ) (resid  57 and name hb* )  5.5  5.5  1.0
assign (resid  38 and name hn  ) (resid  95 and name hg* )  5.5  5.5  0.0
assign (resid  38 and name hg1*) (resid  85 and name hd* )  5.5  5.5  0.0 
assign (resid  38 and name hg1*) (resid  85 and name he* )  4.5  4.5  0.0 
assign (resid  38 and name hg2*) (resid  85 and name hd* )  4.5  4.5  0.0 
assign (resid  38 and name hg2*) (resid  85 and name he* )  5.5  5.5  0.0 
assign (resid  38 and name hd1*) (resid  85 and name hd* )  3.5  3.5  0.0 
assign (resid  38 and name hd1*) (resid  85 and name he* )  3.5  3.5  0.0 
assign (resid  39 and name ha  ) (resid  95 and name hg* )  4.5  4.5  0.5
assign (resid  39 and name he* ) (resid  57 and name hd* )  3.5  3.5  1.0 
assign (resid  40 and name hg*)  (resid  60 and name hg*)   4.5  4.5  0.0
assign (resid  40 and name hg* ) (resid  82 and name hg* )  4.5  4.5  0.0 
assign (resid  40 and name hg* ) (resid  96 and name hd1*)  4.5  4.5  0.0 
assign (resid  41 and name hg1*) (resid  46 and name hd* )  5.5  5.5  1.0 
assign (resid  41 and name hg2*) (resid  46 and name hd* )  3.5  3.5  0.0 
assign (resid  41 and name hg1*) (resid  49 and name hd* )  5.5  1.5  2.0 
assign (resid  41 and name hg2*) (resid  49 and name hd* )  5.5  5.5  0.0 
assign (resid  41 and name hg* ) (resid  97 and name hb* )  5.5  5.5  0.0
assign (resid  43 and name ha  ) (resid  68 and name he* )  5.5  5.5  0.0 
assign (resid  43 and name hn  ) (resid  61 and name hg* )  5.5  5.5  0.0
assign (resid  43 and name hb* ) (resid  68 and name hd* )  5.5  5.5  1.0 
assign (resid  43 and name hb* ) (resid  68 and name he* )  5.5  5.5  1.0 
assign (resid  43 and name hd* ) (resid  68 and name hd* )  3.5  3.5  0.5 
assign (resid  43 and name hd* ) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hb* ) (resid  61 and name hg1*)  4.5  4.5  0.0 
assign (resid  46 and name hb* ) (resid  61 and name hg2*)  3.5  3.5  0.0 
assign (resid  46 and name hd* ) (resid  52 and name hg* )  5.5  5.5  0.5 
assign (resid  46 and name hd* ) (resid  59 and name hb1 )  5.5  5.5  0.0 
assign (resid  46 and name hd* ) (resid  61 and name hg1*)  5.5  5.5  0.0 
assign (resid  46 and name hd* ) (resid  61 and name hg2*)  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  70 and name ha  )  5.5  5.5  0.0 
assign (resid  46 and name he* ) (resid  70 and name hb* )  4.5  4.5  0.0 
assign (resid  46 and name he* ) (resid  54 and name hn  )  5.5  5.5  0.5
assign (resid  49 and name hb* ) (resid  54 and name hd2*)  5.5  5.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hg  )  4.5  4.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hd1*)  5.5  5.5  0.0 
assign (resid  49 and name hd* ) (resid  54 and name hd2*)  5.5  5.5  0.0 
assign (resid  49 and name he* ) (resid  54 and name hd1*)  3.5  3.5  0.0
assign (resid  49 and name he* ) (resid  54 and name hd2*)  5.5  5.5  0.0
assign (resid  53 and name hb* ) (resid  59 and name hd2*)  4.5  4.5  0.0 
assign (resid  60 and name hg2*) (resid  85 and name hd* )  5.5  5.5  0.0 
assign (resid  60 and name hg2*) (resid  85 and name he* )  5.5  5.5  0.5 
assign (resid  61 and name hb  ) (resid  68 and name hd* )  4.5  4.5  0.0 
assign (resid  61 and name hb  ) (resid  68 and name he* )  5.5  5.5  0.0 
assign (resid  61 and name hb  ) (resid  75 and name hg* )  3.5  3.5  0.0 
assign (resid  61 and name hg* ) (resid  68 and name hd* )  5.5  5.5  0.0
assign (resid  61 and name hg1*) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  61 and name hg2*) (resid  68 and name he* )  4.5  4.5  0.0 
assign (resid  63 and name hg2*) (resid  68 and name hd* )  4.5  4.5  0.0 
assign (resid  68 and name hd* ) (resid  75 and name hb  )  5.5  5.5  1.0 
assign (resid  68 and name hd* ) (resid  75 and name hg* )  4.5  4.5  0.0 
assign (resid  68 and name he* ) (resid  75 and name hg* )  5.5  5.5  0.5 
assign (resid  70 and name hn  ) (resid  75 and name hg* )  3.5  3.5  0.5
assign (resid  70 and name hb* ) (resid  75 and name hg* )  4.5  4.5  0.0 
assign (resid  74 and name hg* ) (resid  85 and name he* )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid 105 and name ha  )  5.5  5.5  0.0 
assign (resid  79 and name hg* ) (resid 105 and name hb* )  4.5  4.5  0.0 
assign (resid  79 and name hg* ) (resid 106 and name hd* )  5.5  5.5  0.0 
assign (resid  79 and name hg* ) (resid 106 and name he* )  5.5  5.5  0.5 
assign (resid  79 and name hg* ) (resid 106 and name hz  )  4.5  4.5  0.0 
assign (resid  82 and name hb  ) (resid 106 and name hd* )  5.5  5.5  1.0
assign (resid  82 and name hb  ) (resid 106 and name he* )  3.5  3.5  0.0 
assign (resid  82 and name hg2*) (resid 106 and name he* )  5.5  5.5  0.0 
assign (resid  86 and name hn  ) (resid  94 and name hd* )  5.5  5.5  0.0 
assign (resid  86 and name hb* ) (resid  94 and name hd* )  3.5  3.5  0.0 
assign (resid  96 and name hb  ) (resid 103 and name hd* )  4.5  4.5  0.0
assign (resid  96 and name hb  ) (resid 103 and name he* )  5.5  5.5  0.0
assign (resid  96 and name hg1*) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid  96 and name hg1*) (resid 106 and name hd* )  5.5  5.5  0.5 
assign (resid  96 and name hg2*) (resid 103 and name hd* )  3.5  3.5  0.5 
assign (resid  96 and name hg2*) (resid 103 and name he* )  3.5  3.5  0.0 
assign (resid  96 and name hg2*) (resid 106 and name hd* )  4.5  4.5  0.0
assign (resid  96 and name hd1*) (resid 106 and name hd* )  4.5  4.5  0.0 
assign (resid  96 and name hd1*) (resid 106 and name he* )  4.5  4.5  0.0 
assign (resid  98 and name hn  ) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid  98 and name ha* ) (resid 103 and name he* )  4.5  4.5  0.0 
assign (resid 103 and name hd* ) (resid 128 and name he* )  3.5  3.5  0.5 
assign (resid 103 and name hd* ) (resid 129 and name hd1*)  5.5  5.5  0.0 
assign (resid 103 and name he* ) (resid 128 and name he* )  4.5  4.5  0.5 
assign (resid 110 and name hg* ) (resid 131 and name hd2*)  5.5  5.5  0.0 
assign (resid 111 and name ha  ) (resid 136 and name hd* )  5.5  5.5  0.0 
assign (resid 111 and name ha  ) (resid 136 and name he* )  4.5  4.5  0.0
assign (resid 112 and name ha  ) (resid 159 and name hg* )  4.5  4.5  0.0
assign (resid 113 and name hn  ) (resid 136 and name hd* )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 136 and name he* )  5.5  5.5  0.5
assign (resid 113 and name hg  ) (resid 136 and name hd* )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 136 and name hd* )  4.5  4.5  0.0 
assign (resid 113 and name hd1*) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 113 and name hd2*) (resid 136 and name hd* )  5.5  5.5  1.0 
assign (resid 113 and name hd2*) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 115 and name hg1*) (resid 158 and name he1 )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 156 and name hb* )  4.5  4.5  0.0
assign (resid 115 and name hg* ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 116 and name ha  ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 116 and name hg1 ) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 116 and name hg1 ) (resid 155 and name he* )  4.5  4.5  0.0
assign (resid 116 and name hg2*) (resid 155 and name he* )  4.5  4.5  0.0
assign (resid 116 and name hg2*) (resid 155 and name hd* )  3.5  3.5  0.0
assign (resid 120 and name ha* ) (resid 150 and name hb* )  3.5  3.5  0.0 
assign (resid 122 and name he* ) (resid 150 and name hb* )  5.5  5.5  0.0 
assign (resid 122 and name he* ) (resid 151 and name hd2*)  5.5  5.5  0.0 
assign (resid 136 and name hd* ) (resid 158 and name hb1 )  4.5  4.5  0.0  
assign (resid 136 and name hd* ) (resid 159 and name ha  )  4.5  4.5  0.5
assign (resid 136 and name hd* ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 136 and name he* ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name he* ) (resid 160 and name hb2 )  4.5  4.5  0.0
assign (resid 139 and name hg* ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 139 and name hg* ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 142 and name hb* ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 142 and name hg1 ) (resid 155 and name hd* )  5.5  5.5  0.0 
assign (resid 142 and name hg2 ) (resid 155 and name hd* )  4.5  4.5  0.0 
assign (resid 144 and name hg1*) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 144 and name hg1*) (resid 155 and name he* )  3.5  3.5  0.0
!nh(i)-ha(j)
assign (resid   2 and name hn  ) (resid  95 and name ha  )  3.5  3.5  0.0
assign (resid   2 and name ha  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name ha  ) (resid 112 and name hn  )  3.5  3.5  0.0
assign (resid   2 and name ha  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name ha  ) (resid  96 and name hn  )  3.5  3.5  0.0
assign (resid   3 and name hn  ) (resid 113 and name ha  )  3.5  3.5  0.0
assign (resid   4 and name ha  ) (resid 114 and name hn  )  3.5  3.5  0.0
assign (resid   5 and name hn  ) (resid 115 and name ha  )  3.5  3.5  0.0
assign (resid   6 and name ha  ) (resid 116 and name hn  )  2.5  2.5  0.5
assign (resid   7 and name hn  ) (resid 117 and name ha  )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  13 and name ha  )  4.5  4.5  0.0
assign (resid   9 and name hn  ) (resid 121 and name ha  )  4.5  4.5  0.0
assign (resid  12 and name ha  ) (resid 128 and name hn  )  4.5  4.5  0.0
assign (resid  13 and name hn  ) (resid 127 and name ha  )  3.5  3.5  0.0
assign (resid  14 and name hn  ) (resid 124 and name ha* )  5.5  5.5  1.0
assign (resid  14 and name hn  ) (resid 127 and name ha  )  4.5  4.5  0.5
assign (resid  15 and name ha  ) (resid 125 and name hn  )  3.5  3.5  0.0
assign (resid  36 and name hn  ) (resid  57 and name ha  )  3.5  3.5  0.0
assign (resid  37 and name ha  ) (resid  93 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hn  ) (resid  94 and name ha  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  59 and name ha  )  3.5  3.5  1.0
assign (resid  40 and name ha  ) (resid  60 and name hn  )  3.5  3.5  0.0
assign (resid  41 and name hn  ) (resid  61 and name ha  )  3.5  3.5  0.0
assign (resid  41 and name ha  ) (resid  98 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name ha  ) (resid  99 and name hn  )  5.5  5.5  0.0
assign (resid  42 and name ha* ) (resid  99 and name hn  )  3.5  3.5  1.0
assign (resid  59 and name hn  ) (resid  73 and name ha  )  4.5  4.5  0.0
assign (resid  62 and name ha  ) (resid  76 and name hn  )  3.5  3.5  0.5
assign (resid  39 and name ha  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  98 and name ha* ) (resid 103 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name ha  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 159 and name ha  )  4.5  4.5  0.0
assign (resid 115 and name hn  ) (resid 157 and name ha  )  4.5  4.5  0.0
assign (resid 116 and name ha  ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 116 and name ha  ) (resid 156 and name hn  )  3.5  3.5  0.5
assign (resid 117 and name hn  ) (resid 155 and name ha  )  4.5  4.5  0.0
assign (resid 119 and name hn  ) (resid 151 and name ha  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name ha  )  4.5  4.5  0.0
assign (resid 120 and name hn  ) (resid 150 and name ha  )  3.5  3.5  0.0
assign (resid 120 and name hn  ) (resid 151 and name ha  )  4.5  4.5  0.0
assign (resid 121 and name hn  ) (resid 150 and name ha  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 158 and name ha  )  3.5  3.5  0.0
assign (resid 136 and name ha  ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name ha  ) (resid 161 and name hn  )  3.5  3.5  0.0
assign (resid 136 and name hn  ) (resid 160 and name ha  )  4.5  4.5  1.0
assign (resid 137 and name hn  ) (resid 158 and name ha  )  4.5  4.5  0.0
assign (resid 137 and name hn  ) (resid 160 and name ha  )  4.5  4.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 138 and name ha  ) (resid 159 and name hn  )  4.5  4.5  0.0
assign (resid 138 and name hn  ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 140 and name hn  ) (resid 158 and name ha  )  5.5  5.5  0.0
assign (resid 143 and name hn  ) (resid 154 and name ha  )  5.5  5.5  0.0
assign (resid 144 and name hn  ) (resid 154 and name ha  )  3.5  3.5  0.0
assign (resid 145 and name ha  ) (resid 153 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 152 and name ha  )  4.5  4.5  0.0
!nh(i)-nh(j)
assign (resid   2 and name hn  ) (resid  96 and name hn  )  3.5  3.5  0.5
assign (resid   3 and name hn  ) (resid 112 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hn  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   4 and name hn  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid   4 and name hn  ) (resid  97 and name hn  )  5.5  5.5  1.0
assign (resid   4 and name hn  ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid 116 and name hn  )  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hn  )  4.5  4.5  0.0
assign (resid   9 and name hn  ) (resid 118 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hn  ) (resid 122 and name hn  )  5.5  5.5  0.0
assign (resid  12 and name ha  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hn  ) (resid 126 and name hn  )  5.5  5.5  1.0
assign (resid  13 and name hn  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hn  ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hn  ) (resid 125 and name hn  )  4.5  4.5  0.5
assign (resid  36 and name hn  ) (resid  58 and name hn  )  5.5  5.5  0.0
assign (resid  38 and name hn  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hn  ) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name hn  ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hn  ) (resid  62 and name hn  )  4.5  4.5  0.0
assign (resid  42 and name hn  ) (resid  99 and name hn  )  3.5  3.5  0.0
assign (resid  63 and name hn  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name hn  ) (resid 160 and name hn  )  5.5  5.5  0.5
assign (resid 113 and name hn  ) (resid 158 and name hn  )  3.5  3.5  0.0
assign (resid 113 and name hn  ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 115 and name hn  ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 117 and name hn  ) (resid 154 and name hn  )  3.5  3.5  0.0
assign (resid 119 and name hn  ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name hn  )  5.5  5.5  0.0
assign (resid 120 and name hn  ) (resid 151 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hn  ) (resid 159 and name hn  )  3.5  3.5  0.0
assign (resid 137 and name hn  ) (resid 161 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 157 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 142 and name hn  ) (resid 155 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hn  ) (resid 153 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 152 and name hn  )  5.5  5.5  0.0
!nh(i)-hb(j)
assign (resid   1 and name hb  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name hn  ) (resid 112 and name hb  )  5.5  5.5  0.5
assign (resid   3 and name hn  ) (resid 112 and name hb  )  4.5  4.5  0.0
assign (resid   3 and name hb1 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hb2 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid   4 and name hn  ) (resid  96 and name hb  )  4.5  4.5  0.5
assign (resid   5 and name hn  ) (resid 114 and name hb1 )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid 114 and name hb2 )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hb  )  3.5  3.5  0.0
assign (resid  13 and name hn  ) (resid 126 and name hb  )  4.5  4.5  0.0
assign (resid  15 and name hb1 ) (resid 125 and name hn  )  5.5  5.5  0.0
assign (resid  15 and name hb2 ) (resid 125 and name hn  )  4.0  4.0  0.0
assign (resid  36 and name hn  ) (resid  56 and name hb1 )  5.5  5.5  0.0
assign (resid  38 and name hn  ) (resid  93 and name hb* )  4.5  4.5  1.0
assign (resid  41 and name hb  ) (resid  46 and name hn  )  4.5  4.5  0.0
assign (resid  43 and name hn  ) (resid  63 and name hb  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  73 and name hb* )  4.5  4.5  1.0
assign (resid  61 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hb* ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 113 and name hb1 ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hb2 ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 158 and name hb1 )  5.5  5.5  0.0
assign (resid 113 and name hn  ) (resid 158 and name hb2 )  4.5  4.5  0.0
assign (resid 117 and name hb* ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hb* ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 119 and name hn  ) (resid 153 and name hb* )  5.5  5.5  0.0
assign (resid 121 and name hn  ) (resid 150 and name hb* )  4.5  4.5  1.0
assign (resid 136 and name hb* ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hb  ) (resid 159 and name hn  )  4.5  4.5  0.0
assign (resid 137 and name hn  ) (resid 159 and name hb* )  6.0  6.0  0.0
assign (resid 140 and name hn  ) (resid 157 and name hb  )  4.5  4.5  0.0
assign (resid 144 and name hb  ) (resid 153 and name hn  )  5.5  5.5  0.5
assign (resid 146 and name hb1 ) (resid 152 and name hn  )  5.5  5.5  0.0
assign (resid 146 and name hb2 ) (resid 152 and name hn  )  4.5  4.5  0.5
assign (resid 146 and name hn  ) (resid 152 and name hb  )  5.5  5.5  0.0
!ha(i)-ha(j)
assign (resid   2 and name ha  ) (resid 112 and name ha  )  5.5  5.5  0.0
assign (resid   6 and name ha  ) (resid 115 and name ha  )  5.5  5.5  0.0  
assign (resid   7 and name ha  ) (resid  13 and name ha  )  2.5  2.5  0.5
assign (resid   8 and name ha  ) (resid 121 and name ha  )  5.5  5.5  0.5
assign (resid  12 and name ha  ) (resid 127 and name ha  )  3.5  3.5  0.0
assign (resid  15 and name ha  ) (resid 124 and name ha* )  4.5  4.5  1.0
assign (resid  35 and name ha  ) (resid  57 and name ha  )  5.5  5.5  0.0
assign (resid  64 and name ha  ) (resid  77 and name ha  )  4.5  4.5  0.0
assign (resid  41 and name ha  ) (resid  98 and name ha* )  5.5  5.5  0.0
assign (resid  41 and name ha  ) (resid  45 and name ha  ) 10.0  4.5  0.0   
assign (resid 114 and name ha  ) (resid 157 and name ha  )  3.5  3.5  0.0
assign (resid 116 and name ha  ) (resid 155 and name ha  )  3.5  3.5  0.0
assign (resid 118 and name ha  ) (resid 153 and name ha  )  3.5  3.5  0.0
assign (resid 136 and name ha  ) (resid 160 and name ha  )  3.5  3.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name ha  )  2.5  2.5  0.0
assign (resid 143 and name ha  ) (resid 154 and name ha  )  2.5  2.5  0.0
assign (resid 145 and name ha  ) (resid 152 and name ha  )  3.5  3.5  0.0
!ha(i)-hb(j)
assign (resid   1 and name ha  ) (resid  94 and name hb1 )  3.5  3.5  0.0
assign (resid   1 and name ha  ) (resid  94 and name hb2 )  4.5  4.5  0.0
assign (resid   1 and name hb  ) (resid 110 and name ha  )  2.5  2.5  0.5
assign (resid   2 and name hb* ) (resid  95 and name ha  )  3.5  3.5  1.0
assign (resid   2 and name ha  ) (resid 112 and name hb  )  3.5  3.5  0.0 
assign (resid   3 and name ha  ) (resid  96 and name hb  )  3.5  3.5  0.0 
assign (resid   4 and name hb1 ) (resid  97 and name ha  )  3.5  3.5  0.0 
assign (resid   4 and name ha  ) (resid 114 and name hb1 )  4.5  4.5  0.0 
assign (resid   4 and name ha  ) (resid 114 and name hb2 )  2.5  2.5  0.5 
assign (resid   6 and name ha  ) (resid 116 and name hb  )  2.5  2.5  0.0
assign (resid  38 and name hb  ) (resid  94 and name ha  )  4.5  4.5  0.0
assign (resid  39 and name ha  ) (resid  95 and name hb  )  3.5  3.5  0.0
assign (resid  59 and name hb1 ) (resid  73 and name ha  )  4.5  4.5  0.0 
assign (resid  59 and name hb2 ) (resid  73 and name ha  )  3.5  3.5  0.0 
assign (resid  61 and name hb  ) (resid  75 and name ha  )  3.5  3.5  0.0
assign (resid  64 and name ha  ) (resid  77 and name hb* )  5.5  5.5  1.0
assign (resid 111 and name ha  ) (resid 160 and name hb1 )  4.5  4.5  0.0
assign (resid 111 and name ha  ) (resid 160 and name hb2 )  2.5  2.5  0.5
assign (resid 118 and name hb* ) (resid 153 and name ha  )  4.5  4.5  1.0
assign (resid 119 and name hb* ) (resid 153 and name ha  )  5.5  5.5  0.0
!other long-range noes
assign (resid   1 and name hg2*) (resid  96 and name hd1*)  2.5  2.5  2.0
assign (resid   1 and name hg2*) (resid 110 and name ha  )  3.5  3.5  1.0
assign (resid   2 and name ha  ) (resid 110 and name hg2*)  4.5  4.5  0.5 
assign (resid   2 and name hb* ) (resid 112 and name hb  )  3.5  3.5  0.5 
assign (resid   3 and name hn  ) (resid 110 and name hg2*)  3.5  3.5  1.0
assign (resid   3 and name ha  ) (resid 103 and name hz  )  5.5  5.5  0.0 
assign (resid   3 and name ha  ) (resid  96 and name hg1*)  4.5  4.5  1.0
assign (resid   3 and name ha  ) (resid  96 and name hg2*)  4.5  4.5  1.0
assign (resid   3 and name hb1 ) (resid 113 and name hd2*)  4.5  4.5  1.0
assign (resid   3 and name hb2 ) (resid 113 and name hd2*)  3.5  3.5  1.0
assign (resid   3 and name hz  ) (resid 106 and name hb2 )  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 107 and name ha  )  2.5  2.5  0.5 
assign (resid   3 and name hz  ) (resid 107 and name hb* )  4.5  4.5  1.0 
assign (resid   3 and name hz  ) (resid 108 and name hn  )  5.5  5.5  0.5
assign (resid   3 and name hz  ) (resid 109 and name hn  )  5.5  5.5  0.0
assign (resid   3 and name hz  ) (resid 110 and name hb  )  4.5  4.5  0.0 
assign (resid   3 and name hz  ) (resid 110 and name hg1*)  4.5  4.5  1.0 
assign (resid   3 and name hz  ) (resid 129 and name hd1*)  5.5  5.5  1.0 
assign (resid   4 and name ha  ) (resid 114 and name hd1*)  4.5  4.5  1.0
assign (resid   4 and name hd1*) (resid  97 and name ha  )  5.5  5.5  1.5 
assign (resid   4 and name hd2*) (resid  97 and name ha  )  4.5  4.5  1.0 
assign (resid   4 and name hd1*) (resid 114 and name hb* )  2.5  2.5  2.0 
assign (resid   4 and name hn  ) (resid 103 and name hz  )  5.5  5.5  0.0
assign (resid   5 and name ha  ) (resid 103 and name hz  )  5.5  5.5  0.0 
assign (resid   5 and name hb* ) (resid 103 and name hz  )  2.5  2.5  1.0 
assign (resid   5 and name hd1 ) (resid  13 and name hg2*)  2.5  2.5  1.0
assign (resid   5 and name hd1 ) (resid 115 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name he1 ) (resid  13 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name he1 ) (resid 115 and name hb  )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid 115 and name hg2*)  3.5  3.5  1.0
assign (resid   5 and name he1 ) (resid 128 and name he* )  5.5  5.5  1.5
assign (resid   5 and name he1 ) (resid 128 and name hg* )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid 133 and name hh2 )  5.5  5.5  0.0
assign (resid   5 and name he3 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name he3 ) (resid 128 and name he* )  5.5  5.5  0.0
assign (resid   5 and name hz2 ) (resid 113 and name hd1*)  5.5  5.5  1.0
assign (resid   5 and name hz2 ) (resid 113 and name hd2*)  5.5  5.5  0.5
assign (resid   5 and name hz2 ) (resid 115 and name hb  )  3.5  3.5  0.0 
assign (resid   5 and name hz2 ) (resid 115 and name hg2*)  4.5  4.5  1.0
assign (resid   5 and name hz2 ) (resid 128 and name he* )  5.5  5.5  0.5
assign (resid   5 and name hz2 ) (resid 131 and name hd1*)  3.5  3.5  1.0
assign (resid   5 and name hz2 ) (resid 133 and name hz2 )  3.5  3.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name ha  )  3.5  3.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name hb1 )  3.5  3.5  0.5 
assign (resid   5 and name hz3 ) (resid 113 and name hb2 )  5.5  5.5  0.0 
assign (resid   5 and name hz3 ) (resid 113 and name hd1*)  5.5  5.5  1.0 
assign (resid   5 and name hz3 ) (resid 113 and name hd2*)  2.5  2.5  1.0 
assign (resid   5 and name hz3 ) (resid 114 and name hn  )  3.5  3.5  1.0
assign (resid   5 and name hz3 ) (resid 128 and name he* )  5.5  5.5  1.0 
assign (resid   5 and name hh2 ) (resid 113 and name hb1 )  2.5  2.5  0.0
assign (resid   5 and name hh2 ) (resid 113 and name hb2 )  4.5  4.5  0.0 
assign (resid   5 and name hh2 ) (resid 113 and name hd2*)  3.5  3.5  1.0 
assign (resid   5 and name hh2 ) (resid 115 and name hb  )  4.5  4.5  0.0 
assign (resid   5 and name hh2 ) (resid 115 and name hg2*)  4.5  4.5  1.0 
assign (resid   5 and name hh2 ) (resid 131 and name hd1*)  2.5  2.5  1.0 
assign (resid   6 and name ha  ) (resid 115 and name hg2*)  5.5  5.5  1.0
assign (resid   6 and name ha  ) (resid 116 and name hg2*)  4.5  4.5  1.0 
assign (resid   6 and name ha  ) (resid 118 and name hd1*)  6.5  6.5  0.0
assign (resid   6 and name hb* ) (resid  21 and name hz2 )  2.5  2.5  1.0 
assign (resid   6 and name hb* ) (resid 116 and name hb  )  5.5  5.5  0.0 
assign (resid   6 and name hb* ) (resid 116 and name hg2*)  5.5  5.5  1.0 
assign (resid   6 and name hb* ) (resid 118 and name hd1*)  3.5  3.5  2.5
assign (resid   7 and name hn  ) (resid  21 and name hh2 )  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid  21 and name hz2 )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid   7 and name hn  ) (resid 115 and name hg2*)  5.5  5.5  0.0
assign (resid   7 and name hn  ) (resid 116 and name hg2*)  6.5  6.5  0.0
assign (resid   7 and name ha  ) (resid  13 and name hg2*)  3.5  3.5  1.0 
assign (resid   7 and name ha  ) (resid  21 and name hz2 )  4.5  4.5  0.0
assign (resid   7 and name ha  ) (resid  21 and name hh2 )  3.5  3.5  0.0
assign (resid   7 and name ha  ) (resid  21 and name hz3 )  5.5  5.5  0.0
assign (resid   7 and name hg* ) (resid 117 and name ha  )  3.5  3.5  1.0
assign (resid   7 and name he2*) (resid 117 and name hg* )  3.5  3.5  2.0
assign (resid   8 and name hn  ) (resid  21 and name hz2 )  5.5  5.5  1.0
assign (resid   8 and name hn  ) (resid  21 and name hz3 )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  21 and name hh2 )  4.5  4.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hb2 )  3.5  3.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hd1*)  5.5  5.5  0.0
assign (resid   8 and name ha  ) (resid 118 and name hd2*)  5.5  5.5  0.0
assign (resid   8 and name hb1 ) (resid  21 and name hz3 )  3.5  3.5  0.0 
assign (resid   8 and name hb2 ) (resid  21 and name hz3 )  5.5  5.5  0.0 
assign (resid   9 and name hg* ) (resid 121 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hg* ) (resid 121 and name ha  )  3.5  3.5  1.0
assign (resid  12 and name hn  ) (resid 127 and name hg* )  6.5  6.5  0.0
assign (resid  12 and name hb* ) (resid  21 and name hz3 )  4.5  4.5  1.0 
assign (resid  12 and name hg  ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hd1*) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid 125 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid 126 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd2*) (resid  21 and name hz3 )  3.5  3.5  1.0
assign (resid  12 and name hd2*) (resid  21 and name he3 )  5.5  5.5  0.0
assign (resid  12 and name hd2*) (resid 122 and name hb* )  2.5  2.5  2.0
assign (resid  12 and name hd2*) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd2*) (resid 126 and name hn  )  6.5  6.5  0.0
assign (resid  13 and name ha  ) (resid  21 and name hh2 )  3.5  3.5  0.5 
assign (resid  13 and name ha  ) (resid  21 and name he3 )  5.5  5.5  1.5 
assign (resid  13 and name ha  ) (resid  21 and name hz2 )  5.5  5.5  0.5 
assign (resid  13 and name ha  ) (resid  21 and name hz3 )  5.5  5.5  0.0
assign (resid  13 and name hg1*) (resid 128 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hg2*) (resid  21 and name hz3 )  5.5  5.5  1.5  
assign (resid  13 and name hg2*) (resid 128 and name hb2 )  3.5  3.5  1.0  
assign (resid  13 and name hd1*) (resid 100 and name hn  )  4.5  4.5  1.0
assign (resid  13 and name hd1*) (resid 126 and name hg2*)  2.5  2.5  2.0
assign (resid  14 and name hn  ) (resid  20 and name hd* )  5.5  5.5  0.0
assign (resid  14 and name hn  ) (resid 126 and name hg2*)  5.5  5.5  1.0
assign (resid  15 and name hn  ) (resid  20 and name hd* )  5.5  5.5  0.0
assign (resid  15 and name hg* ) (resid 125 and name hn  )  4.5  4.5  1.0
assign (resid  20 and name hb* ) (resid 122 and name hb* )  4.5  4.5  1.0 
assign (resid  21 and name hb2 ) (resid 151 and name hd2*)  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  26 and name hb1 )  6.5  6.5  0.0 
assign (resid  21 and name hd1 ) (resid 118 and name hd2*)  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid 151 and name hd2*)  4.5  4.5  1.0 
assign (resid  21 and name he1 ) (resid 118 and name hd1*)  5.5  5.5  1.0 
assign (resid  21 and name he1 ) (resid 118 and name hd2*)  5.5  5.5  1.0 
assign (resid  21 and name he3 ) (resid 118 and name hd2*)  5.5  5.5  1.0 
assign (resid  21 and name he3 ) (resid 122 and name hb1 )  5.5  5.5  0.0  
assign (resid  21 and name he3 ) (resid 122 and name hb2 )  5.5  5.5  0.0  
assign (resid  21 and name hz2 ) (resid 118 and name hd1*)  4.5  4.5  1.0 
assign (resid  21 and name hz2 ) (resid 118 and name hd2*)  6.0  6.0  1.0 
assign (resid  21 and name hz3 ) (resid 122 and name hb2 )  5.5  5.5  0.0  
assign (resid  22 and name hd2 ) (resid  27 and name hd1*)  5.5  5.5  1.0  
assign (resid  22 and name he1 ) (resid  27 and name hd1*)  3.5  3.5  1.0  
assign (resid  22 and name he1 ) (resid  27 and name hd2*)  5.5  5.5  1.0  
assign (resid  23 and name hg  ) (resid 153 and name hd2 )  5.5  5.5  0.5
assign (resid  23 and name hd1*) (resid 153 and name he1 )  3.5  3.5  1.0
assign (resid  23 and name hd1*) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid  23 and name hd1*) (resid 118 and name hd1*)  5.5  5.5  0.5 
assign (resid  23 and name hd2*) (resid 116 and name hg2*)  4.5  4.5  1.0 
assign (resid  23 and name hd2*) (resid 118 and name hd1*)  3.5  3.5  1.0
assign (resid  23 and name hd2*) (resid 118 and name hd2*)  3.5  3.5  1.0
assign (resid  23 and name hd2*) (resid 151 and name hd2*)  4.5  4.5  1.5
assign (resid  23 and name hd2*) (resid 153 and name he1 )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid  25 and name hb1 ) (resid 153 and name he1 )  5.5  2.0  1.0  
assign (resid  25 and name hb2 ) (resid 153 and name he1 )  4.5  4.5  1.0  
assign (resid  26 and name hb1 ) (resid 116 and name hg2*)  5.5  5.5  1.0 
assign (resid  26 and name hb2 ) (resid 116 and name hg2*)  3.5  3.5  1.0 
assign (resid  26 and name hb2 ) (resid 153 and name he1 )  4.5  4.5  1.0 
assign (resid  30 and name hz  ) (resid  41 and name hg1*)  4.5  4.5  0.5 
assign (resid  30 and name hz  ) (resid  54 and name hd1*)  5.5  5.5  1.0 
assign (resid  30 and name hz  ) (resid  97 and name hb* )  4.5  4.5  1.0 
assign (resid  35 and name ha  ) (resid  57 and name he  )  5.5  5.5  0.0
assign (resid  35 and name ha  ) (resid  57 and name hd* )  5.5  5.5  1.0
assign (resid  37 and name ha  ) (resid  92 and name he2*)  4.5  4.5  1.0
assign (resid  38 and name hg1*) (resid  92 and name hn  )  5.5  5.5  1.0
assign (resid  38 and name hg1*) (resid  92 and name he2*)  4.5  4.5  2.0
assign (resid  38 and name hd1*) (resid  92 and name he2*)  5.5  5.5  2.0
assign (resid  38 and name hd1*) (resid  86 and name ha  )  2.5  2.5  1.0 
assign (resid  38 and name hd1*) (resid  89 and name hb2 )  3.5  3.5  1.0 
assign (resid  39 and name hb* ) (resid  54 and name hd1*)  4.5  4.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hg  )  3.5  3.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hd1*)  2.5  2.5  1.0
assign (resid  39 and name he* ) (resid  59 and name ha  )  2.5  2.5  1.0
assign (resid  39 and name he* ) (resid  59 and name hb* )  3.5  3.5  2.0
assign (resid  39 and name he* ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  39 and name hb* ) (resid  59 and name ha  )  5.5  5.5  1.0
assign (resid  39 and name he* ) (resid  54 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name ha  ) (resid  60 and name hg2*)  5.5  5.5  1.0  
assign (resid  40 and name hg2*) (resid  96 and name hd1*)  2.5  2.5  2.0  
assign (resid  40 and name hb  ) (resid  96 and name hd1*)  2.5  2.5  1.0  
assign (resid  41 and name hn  ) (resid  61 and name hg1*)  5.5  5.5  0.5
assign (resid  41 and name hn  ) (resid  61 and name hg2*)  5.5  5.5  0.0
assign (resid  41 and name ha  ) (resid  97 and name hb* )  5.5  5.5  1.0
assign (resid  41 and name ha  ) (resid 102 and name hg2*)  3.5  3.5  1.0
assign (resid  41 and name hb  ) (resid  99 and name hn  )  5.5  5.5  0.5
assign (resid  41 and name hg1*) (resid  49 and name hz  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  49 and name hz  )  3.5  3.5  1.0
assign (resid  41 and name hg2*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  41 and name hg2*) (resid  61 and name hg1*)  4.5  4.5  2.0
assign (resid  41 and name hg2*) (resid  61 and name hg2*)  2.5  2.5  2.0
assign (resid  41 and name hg1*) (resid  97 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg1*) (resid  98 and name hn  )  5.5  5.5  1.0
assign (resid  43 and name ha  ) (resid  61 and name hg1*)  2.5  2.5  1.0
assign (resid  43 and name ha  ) (resid  61 and name hg2*)  4.5  4.5  1.0
assign (resid  45 and name hg2*) (resid  99 and name hn  )  5.5  5.5  1.0
assign (resid  46 and name hn  ) (resid  61 and name hg1*)  5.5  5.5  1.0
assign (resid  46 and name hn  ) (resid  61 and name hg2*)  5.5  5.5  1.0
assign (resid  46 and name ha  ) (resid  61 and name hg1*)  5.5  5.5  1.0
assign (resid  46 and name ha  ) (resid  61 and name hg2*)  5.5  5.5  1.0
assign (resid  47 and name ha  ) (resid  52 and name he  )  3.5  3.5  0.0
assign (resid  47 and name ha  ) (resid  52 and name hd* )  3.5  3.5  1.0
assign (resid  49 and name hz  ) (resid  54 and name hd1*)  4.5  4.5  1.0
assign (resid  54 and name hb* ) (resid  59 and name hd2*)  3.5  3.5  2.0
assign (resid  58 and name hb  ) (resid  92 and name he2*)  5.5  5.5  1.0
assign (resid  59 and name hb2 ) (resid  73 and name hb* )  3.5  3.5  1.0
assign (resid  60 and name hg1*) (resid  74 and name ha  )  5.5  5.5  1.0
assign (resid  60 and name hg2*) (resid  74 and name ha  )  5.5  5.5  1.0
assign (resid  60 and name hg1*) (resid  74 and name hb  )  4.5  4.5  1.0
assign (resid  60 and name hg2*) (resid  74 and name hb  )  3.5  3.5  1.0
assign (resid  61 and name hb  ) (resid  70 and name hb* )  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  70 and name hb* )  3.5  3.5  1.0 
assign (resid  61 and name hg1*) (resid  75 and name hg1*)  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  75 and name hg2*)  4.5  4.5  1.0 
assign (resid  61 and name hg2*) (resid  73 and name ha  )  5.5  5.5  1.0 
assign (resid  61 and name hg2*) (resid  73 and name hb* )  2.5  2.5  2.0
assign (resid  62 and name ha  ) (resid  76 and name hg2*)  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  77 and name ha  )  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  62 and name hd1*) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  62 and name hd1*) (resid  78 and name ha  )  3.5  3.5  1.0 
assign (resid  62 and name hd1*) (resid  79 and name ha  )  4.5  4.5  1.0 
assign (resid  63 and name hg2*) (resid  68 and name hb* )  4.5  4.5  2.0
assign (resid  63 and name hg2*) (resid  77 and name ha  )  5.5  5.5  1.0 
assign (resid  63 and name hg2*) (resid  77 and name he1 )  3.5  3.5  1.0 
assign (resid  66 and name ha  ) (resid  77 and name he1 )  4.5  4.5  0.0 
assign (resid  66 and name hg* ) (resid  77 and name he1 )  4.5  4.5  1.0 
assign (resid  68 and name hb1 ) (resid  77 and name he1 )  4.5  4.5  0.5 
assign (resid  68 and name hb2 ) (resid  77 and name he1 )  5.5  5.5  0.5 
assign (resid  79 and name ha  ) (resid 106 and name hz  )  3.5  3.5  0.0 
assign (resid  82 and name hn  ) (resid 106 and name hz  )  5.5  5.5  0.0
assign (resid  82 and name hg2*) (resid 106 and name hz  )  2.5  2.5  1.0 
assign (resid  96 and name hg2*) (resid 106 and name hn  )  6.0  6.0  0.0
assign (resid  96 and name hd1*) (resid 102 and name hb  )  5.5  5.5  0.5
assign (resid  96 and name hd1*) (resid 106 and name hb* )  4.5  4.5  2.0
assign (resid  96 and name hd1*) (resid 106 and name hz  )  5.5  5.5  1.0 
assign (resid 100 and name hn  ) (resid 126 and name hg2*)  5.5  5.5  0.0
assign (resid 100 and name hb* ) (resid 126 and name hg2*)  2.5  2.5  2.0
assign (resid 100 and name hb* ) (resid 129 and name hg2*)  3.5  3.5  2.0
assign (resid 103 and name ha  ) (resid 128 and name he* )  5.5  5.5  0.5
assign (resid 103 and name hb1 ) (resid 128 and name he* )  3.5  3.5  1.0
assign (resid 103 and name hb2 ) (resid 128 and name he* )  4.5  4.5  1.0
assign (resid 103 and name hb* ) (resid 129 and name hd1*)  5.5  5.5  1.0
assign (resid 104 and name hn  ) (resid 129 and name hg2*)  4.5  4.5  1.0
assign (resid 104 and name hn  ) (resid 129 and name hd1*)  4.5  4.5  1.0
assign (resid 107 and name hn  ) (resid 129 and name hd1*)  5.5  5.5  1.0
assign (resid 110 and name hg1*) (resid 136 and name hz  )  2.5  2.5  1.0
assign (resid 111 and name ha  ) (resid 160 and name hd* )  4.5  4.5  1.0
assign (resid 111 and name hb1 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hb2 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 112 and name hg2*) (resid 159 and name ha  )  4.5  4.5  1.0
assign (resid 113 and name hb1 ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 113 and name hb2 ) (resid 158 and name hd1 )  3.5  3.5  0.5
assign (resid 113 and name hg  ) (resid 159 and name ha  )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 131 and name hd2*)  5.6  5.6  1.0
assign (resid 113 and name hd1*) (resid 131 and name hd1*)  5.6  5.6  1.0
assign (resid 113 and name hd1*) (resid 133 and name he3 )  4.5  4.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hz2 )  5.5  5.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hz3 )  3.5  3.5  1.0
assign (resid 113 and name hd1*) (resid 133 and name hh2 )  4.5  4.5  0.5
assign (resid 113 and name hd1*) (resid 158 and name hb1 )  5.5  5.5  0.0
assign (resid 113 and name hd1*) (resid 158 and name hb2 )  3.5  3.5  0.5
assign (resid 113 and name hd1*) (resid 158 and name he3 )  4.5  4.5  1.5
assign (resid 113 and name hd2*) (resid 131 and name hd2*)  3.5  3.5  1.0
assign (resid 114 and name hd2*) (resid 157 and name ha  )  3.5  3.5  1.0
assign (resid 114 and name hd2*) (resid 157 and name hb  )  4.5  4.5  1.0
assign (resid 114 and name hd2*) (resid 158 and name hn  )  4.5  4.5  0.5
assign (resid 115 and name hg1*) (resid 158 and name hd1 )  3.5  3.5  1.0 
assign (resid 115 and name hg1*) (resid 133 and name hh2 )  3.5  3.5  1.0 
assign (resid 115 and name hg2*) (resid 133 and name hh2 )  3.5  3.5  1.0 
assign (resid 116 and name hg2*) (resid 153 and name ha  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 154 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 153 and name hb2 )  3.5  3.5  1.0
assign (resid 116 and name hg2*) (resid 153 and name hd2 )  2.5  2.5  1.0
assign (resid 117 and name hn  ) (resid 153 and name hd2 )  5.5  5.5  1.0
assign (resid 118 and name hg  ) (resid 153 and name ha  )  4.5  4.5  0.0
assign (resid 118 and name hd1*) (resid 153 and name ha  )  5.5  5.5  0.0
assign (resid 118 and name hd1*) (resid 153 and name hb1 )  3.5  3.5  1.0 
assign (resid 118 and name hd1*) (resid 153 and name hb2 )  3.5  3.5  1.0 
assign (resid 118 and name hd1*) (resid 153 and name hd2 )  5.5  5.5  1.0 
assign (resid 118 and name hd1*) (resid 151 and name ha  )  5.5  5.5  1.0
assign (resid 118 and name hd2*) (resid 151 and name ha  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 151 and name hd2*)  4.5  4.5  1.0
assign (resid 122 and name hz  ) (resid 150 and name hb* )  2.5  2.5  1.5 
assign (resid 122 and name hz  ) (resid 151 and name hg  )  5.5  5.5  0.0 
assign (resid 122 and name hz  ) (resid 151 and name hd2*)  3.5  3.5  1.5 
assign (resid 133 and name he3 ) (resid 158 and name he3 )  5.5  5.5  0.0 
assign (resid 133 and name he3 ) (resid 158 and name hz3 )  4.5  4.5  0.0 
assign (resid 133 and name hz3 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 133 and name hz3 ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 136 and name ha  ) (resid 158 and name he3 )  5.5  5.5  2.0
assign (resid 136 and name hn  ) (resid 158 and name he3 )  3.5  3.5  2.0
assign (resid 136 and name hb1 ) (resid 158 and name he3 )  2.5  2.5  0.0  
assign (resid 136 and name hb2 ) (resid 158 and name he3 )  3.5  3.5  0.0  
assign (resid 136 and name hb1 ) (resid 158 and name hz3 )  5.5  5.5  0.0  
assign (resid 136 and name hb2 ) (resid 158 and name hz3 )  4.5  4.5  0.0  
assign (resid 137 and name hn  ) (resid 158 and name he3 )  3.5  3.5  0.0
assign (resid 137 and name ha  ) (resid 158 and name he3 )  5.5  5.5  0.0
assign (resid 137 and name ha  ) (resid 158 and name hz3 )  4.5  4.5  0.0 
assign (resid 137 and name hg2*) (resid 159 and name hn  )  5.5  5.5  1.0
assign (resid 138 and name hn  ) (resid 158 and name he3 )  4.5  4.5  0.0
assign (resid 138 and name ha  ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 138 and name ha  ) (resid 158 and name he3 )  5.5  5.5  0.0 
assign (resid 138 and name hb* ) (resid 158 and name hz3 )  5.5  5.5  1.0
assign (resid 138 and name hg1 ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 138 and name hd* ) (resid 158 and name he1 )  4.5  4.5  1.0
assign (resid 138 and name he* ) (resid 158 and name hh2 )  5.5  5.5  0.0
assign (resid 138 and name he* ) (resid 158 and name hz2 )  4.5  4.5  1.0
assign (resid 142 and name hn  ) (resid 154 and name hg2*)  3.5  3.5  1.0
assign (resid 143 and name hn  ) (resid 154 and name hg2*)  5.5  5.5  0.0
assign (resid 143 and name ha  ) (resid 154 and name hg2*)  4.5  4.5  1.0
assign (resid 144 and name hg1*) (resid 153 and name hd2 )  3.5  3.5  1.0 
assign (resid 143 and name hg2*) (resid 154 and name hg2*)  2.5  2.5  2.0
assign (resid 144 and name hg2*) (resid 153 and name he1 )  3.5  3.5  1.0
assign (resid 144 and name hg2*) (resid 153 and name hd2 )  5.5  5.5  1.0 
assign (resid 145 and name ha  ) (resid 152 and name hg1 )  4.5  4.5  1.0 
assign (resid 145 and name ha  ) (resid 152 and name hg2*)  3.5  3.5  1.0 
assign (resid 145 and name hg* ) (resid 152 and name hg1 )  5.5  5.5  1.0
assign (resid 146 and name hb* ) (resid 151 and name hd1*)  4.5  4.5  2.0
assign (resid 146 and name hn  ) (resid 152 and name hg2*)  5.5  5.5  1.0
!medium-range noes
!r-6 averaging for aromatics and some others
assign (resid   1 and name hg2*) (resid   3 and name he* )  4.5  4.5  1.0 
assign (resid  19 and name hd* ) (resid  21 and name hn  )  5.5  5.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name hd1 )  5.5  5.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name he1 )  4.5  4.5  1.0
assign (resid  19 and name hd* ) (resid  21 and name hz2 )  5.5  5.5  1.0
assign (resid  26 and name ha  ) (resid  29 and name hd* )  5.5  5.5  0.0 
assign (resid  27 and name ha  ) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid  29 and name hd* ) (resid  32 and name hb* )  4.5  4.5  1.0
assign (resid  29 and name hd* ) (resid  33 and name hn  )  5.5  5.5  0.0
assign (resid  29 and name hd* ) (resid  33 and name hb2 )  5.5  5.5  0.0 
assign (resid  29 and name hd* ) (resid  33 and name hg* )  5.5  5.5  0.0 
assign (resid  29 and name he* ) (resid  33 and name hb2 )  4.5  4.5  1.0 
assign (resid  29 and name he* ) (resid  33 and name hg* )  4.5  4.5  0.0 
assign (resid  30 and name hd* ) (resid  34 and name hg2*)  5.5  5.5  0.0
assign (resid  30 and name he* ) (resid  34 and name hg2*)  4.5  4.5  0.0
assign (resid  32 and name ha  ) (resid  35 and name hg* )  3.5  3.5  0.0
assign (resid  43 and name ha  ) (resid  46 and name hd* )  4.5  4.5  0.0 
assign (resid  46 and name ha  ) (resid  49 and name hd* )  3.5  3.5  0.0 
assign (resid  46 and name ha  ) (resid  49 and name he* )  4.5  4.5  0.0 
assign (resid  46 and name hd* ) (resid  49 and name hd* )  4.5  4.5  0.0
assign (resid  46 and name hd* ) (resid  49 and name he* )  4.5  4.5  0.0
assign (resid  68 and name hd* ) (resid  70 and name hb* )  3.5  3.5  0.5 
assign (resid  68 and name he* ) (resid  70 and name ha  )  5.5  5.5  0.0 
assign (resid  68 and name he* ) (resid  70 and name hb* )  3.5  3.5  0.0 
assign (resid  75 and name hg* ) (resid  77 and name he1 )  4.5  4.5  0.0 
assign (resid  80 and name ha  ) (resid  83 and name hd* )  3.5  3.5  0.0
assign (resid  80 and name hn  ) (resid  83 and name hd* )  5.5  5.5  0.0
assign (resid  94 and name hb* ) (resid  96 and name hd1*)  5.5  5.5  0.5
assign (resid  94 and name hd* ) (resid  96 and name hd1*)  3.5  3.5  0.5
assign (resid 100 and name hn  ) (resid 103 and name hd* )  5.5  5.5  0.0
assign (resid 100 and name ha  ) (resid 103 and name he* )  5.5  5.5  0.0 
assign (resid 100 and name hb* ) (resid 103 and name hd* )  5.5  5.5  0.0 
assign (resid 106 and name hd* ) (resid 109 and name hb1 )  5.5  5.5  0.0 
assign (resid 106 and name hd* ) (resid 109 and name hb2 )  4.5  4.5  0.0 
assign (resid 107 and name ha  ) (resid 110 and name hg* )  3.5  3.5  0.5
assign (resid 110 and name hg* ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 110 and name hg* ) (resid 113 and name hd2*)  3.5  3.5  0.0
assign (resid 113 and name hb* ) (resid 115 and name hg* )  5.5  5.5  0.5
assign (resid 118 and name hb1 ) (resid 122 and name he* )  4.5  4.5  0.0 
assign (resid 118 and name hd1*) (resid 122 and name he* )  5.5  5.5  1.0 
assign (resid 118 and name hd2*) (resid 122 and name hd* )  4.5  4.5  0.5 
assign (resid 118 and name hd2*) (resid 122 and name he* )  3.5  3.5  0.0 
assign (resid 120 and name ha* ) (resid 122 and name he* )  5.5  5.5  0.0 
assign (resid 120 and name hn  ) (resid 122 and name he* )  4.5  4.5  0.0
assign (resid 133 and name ha  ) (resid 136 and name he* )  4.5  4.5  1.0 
assign (resid 134 and name hn  ) (resid 136 and name hd* )  4.5  4.5  1.0
assign (resid 153 and name hd2 ) (resid 155 and name hd* )  4.5  4.5  0.0
assign (resid 153 and name hd2 ) (resid 155 and name he* )  3.5  3.5  0.0
!hn(i)-hn(i+2)
assign (resid   9 and name hn  ) (resid  11 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hn  ) (resid  17 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hn  ) (resid  18 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name hn  ) (resid  28 and name hn  )  5.5  5.5  0.0
assign (resid  27 and name hn  ) (resid  29 and name hn  )  5.5  5.5  0.0
assign (resid  28 and name hn  ) (resid  30 and name hn  )  4.5  4.5  0.0
assign (resid  30 and name hn  ) (resid  32 and name hn  )  5.5  5.5  0.0
assign (resid  31 and name hn  ) (resid  33 and name hn  )  4.5  4.5  0.0
assign (resid  32 and name hn  ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  33 and name hn  ) (resid  35 and name hn  )  4.5  4.5  0.0
assign (resid  44 and name hn  ) (resid  46 and name hn  )  4.5  4.5  0.0
assign (resid  46 and name hn  ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  47 and name hn  ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  80 and name hn  ) (resid  82 and name hn  )  4.5  4.5  0.0
assign (resid  82 and name hn  ) (resid  84 and name hn  )  4.5  4.5  0.0
assign (resid  84 and name hn  ) (resid  86 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name hn  ) (resid  87 and name hn  )  4.5  4.5  0.0
assign (resid  86 and name hn  ) (resid  88 and name hn  )  5.5  5.5  0.0
assign (resid  87 and name hn  ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid 102 and name hn  ) (resid 104 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hn  ) (resid 105 and name hn  )  4.5  4.5  0.0
assign (resid 105 and name hn  ) (resid 107 and name hn  )  4.5  4.5  0.0
assign (resid 107 and name hn  ) (resid 109 and name hn  )  4.5  4.5  0.0
assign (resid 108 and name hn  ) (resid 110 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hn  ) (resid 135 and name hn  )  5.5  5.5  0.0
!ha(i)-hn(i+2)
assign (resid  19 and name ha  ) (resid  21 and name hn  )  5.5  5.5  1.0
assign (resid  24 and name ha  ) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  45 and name ha  ) (resid  47 and name hn  )  4.5  4.5  1.0
assign (resid  46 and name ha  ) (resid  48 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name ha  ) (resid  49 and name hn  )  4.5  4.5  1.0
assign (resid  52 and name ha  ) (resid  54 and name hn  )  4.5  4.5  0.0
assign (resid  55 and name ha  ) (resid  57 and name hn  )  3.5  3.5  1.0
assign (resid  65 and name ha  ) (resid  67 and name hn  )  4.5  4.5  1.0
assign (resid  66 and name ha  ) (resid  68 and name hn  )  4.5  4.5  0.0
assign (resid  71 and name ha  ) (resid  73 and name hn  )  4.5  4.5  0.0
assign (resid  76 and name ha  ) (resid  78 and name hn  )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  81 and name hn  )  4.5  4.5  1.0
assign (resid  84 and name ha  ) (resid  86 and name hn  )  4.5  4.5  1.0
assign (resid  86 and name ha  ) (resid  88 and name hn  )  4.5  4.5  1.0
assign (resid  89 and name ha  ) (resid  91 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name ha  ) (resid 104 and name hn  )  4.5  4.5  1.0
assign (resid 104 and name ha  ) (resid 106 and name hn  )  5.5  5.5  1.0
assign (resid 106 and name ha  ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 107 and name ha  ) (resid 109 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name ha  ) (resid 110 and name hn  )  5.5  5.5  1.0
assign (resid 118 and name ha  ) (resid 120 and name hn  )  4.5  4.5  1.0
assign (resid 132 and name ha  ) (resid 134 and name hn  )  3.5  3.5  1.0
assign (resid 133 and name ha  ) (resid 135 and name hn  )  3.5  3.5  1.0
assign (resid 134 and name ha  ) (resid 136 and name hn  )  5.5  5.5  0.0
assign (resid 146 and name ha  ) (resid 148 and name hn  )  5.5  5.5  0.0
assign (resid 148 and name ha  ) (resid 150 and name hn  )  4.5  4.5  1.0
!hn(i)-hn(i+3)
assign (resid   8 and name hn  ) (resid  11 and name hn  )  4.5  4.5  1.0
assign (resid   8 and name hn  ) (resid  12 and name hn  )  3.5  3.5  1.0
assign (resid  15 and name hn  ) (resid  18 and name hn  )  4.5  4.5  0.0
assign (resid  26 and name hn  ) (resid  29 and name hn  )  5.5  5.5  0.0
assign (resid  27 and name hn  ) (resid  30 and name hn  )  5.5  5.5  0.0
assign (resid  28 and name hn  ) (resid  31 and name hn  )  5.5  5.5  0.0
assign (resid  30 and name hn  ) (resid  33 and name hn  )  5.5  5.5  0.0
assign (resid  32 and name hn  ) (resid  35 and name hn  )  5.5  5.5  0.0
assign (resid  43 and name hn  ) (resid  46 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hn  ) (resid  47 and name hn  )  5.5  5.5  0.0
assign (resid  45 and name hn  ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  46 and name hn  ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  65 and name hn  ) (resid  68 and name hn  )  5.5  5.5  0.0
assign (resid  78 and name hn  ) (resid  81 and name hn  )  4.5  4.5  0.0
assign (resid  79 and name hn  ) (resid  82 and name hn  )  5.5  5.5  0.0
assign (resid  81 and name hn  ) (resid  84 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hn  ) (resid  85 and name hn  )  4.5  4.5  1.0
assign (resid  86 and name hn  ) (resid  89 and name hn  )  5.5  5.5  0.0
!ha(i)-hn(i+3)
assign (resid  15 and name ha  ) (resid  18 and name hn  )  5.5  5.5  0.5
assign (resid  24 and name ha  ) (resid  27 and name hn  )  3.5  3.5  0.5
assign (resid  26 and name ha  ) (resid  29 and name hn  )  3.5  3.5  0.5
assign (resid  27 and name ha  ) (resid  30 and name hn  )  3.5  3.5  0.5
assign (resid  28 and name ha  ) (resid  31 and name hn  )  3.5  3.5  0.5
assign (resid  30 and name ha  ) (resid  33 and name hn  )  3.5  3.5  0.5
assign (resid  43 and name ha  ) (resid  46 and name hn  )  3.5  3.5  0.5
assign (resid  44 and name ha  ) (resid  47 and name hn  )  3.5  3.5  0.5
assign (resid  45 and name ha  ) (resid  48 and name hn  )  3.5  3.5  0.5
assign (resid  46 and name ha  ) (resid  49 and name hn  )  4.5  4.5  0.5
assign (resid  79 and name ha  ) (resid  82 and name hn  )  3.5  3.5  0.5
assign (resid  80 and name ha  ) (resid  83 and name hn  )  3.5  3.5  0.5
assign (resid  81 and name ha  ) (resid  84 and name hn  )  3.5  3.5  0.5
assign (resid  82 and name ha  ) (resid  85 and name hn  )  3.5  3.5  0.5
assign (resid  83 and name ha  ) (resid  86 and name hn  )  3.5  3.5  0.5
assign (resid  84 and name ha  ) (resid  87 and name hn  )  3.5  3.5  0.5
assign (resid  86 and name ha  ) (resid  89 and name hn  )  3.5  3.5  0.5
assign (resid 101 and name ha  ) (resid 104 and name hn  )  3.5  3.5  0.5
assign (resid 102 and name ha  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 104 and name ha  ) (resid 107 and name hn  )  3.5  3.5  0.5
assign (resid 107 and name ha  ) (resid 110 and name hn  )  4.5  4.5  1.0 
!ha(i)-hb(i+3)
assign (resid  24 and name ha  ) (resid  27 and name hb2 )  2.5  2.5  0.5
assign (resid  25 and name ha  ) (resid  28 and name hb* )  3.5  3.5  0.5
assign (resid  26 and name ha  ) (resid  29 and name hb* )  3.5  3.5  1.0
assign (resid  27 and name ha  ) (resid  27 and name hb1 )  2.5  2.5  0.5
assign (resid  27 and name ha  ) (resid  27 and name hb2 )  3.5  3.5  0.0
assign (resid  28 and name ha  ) (resid  31 and name hb* )  3.5  3.5  1.0
assign (resid  29 and name ha  ) (resid  32 and name hb* )  3.5  3.5  1.0
assign (resid  30 and name ha  ) (resid  33 and name hb* )  3.5  3.5  1.0
assign (resid  43 and name ha  ) (resid  46 and name hb* )  3.5  3.5  1.0
assign (resid  44 and name ha  ) (resid  47 and name hb* )  3.5  3.5  1.0
assign (resid  45 and name ha  ) (resid  48 and name hb* )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  82 and name hb  )  3.5  3.5  0.0
assign (resid  80 and name ha  ) (resid  83 and name hb2 )  3.5  3.5  0.0
assign (resid  81 and name ha  ) (resid  84 and name hb* )  3.5  3.5  1.0
assign (resid  82 and name ha  ) (resid  85 and name hb* )  3.5  3.5  1.0
assign (resid  83 and name ha  ) (resid  86 and name hb* )  3.5  3.5  1.0
assign (resid  84 and name ha  ) (resid  87 and name hb* )  3.5  3.5  1.0
assign (resid  85 and name ha  ) (resid  88 and name hb* )  3.5  3.5  1.0
assign (resid  86 and name ha  ) (resid  89 and name hb* )  3.5  3.5  1.0
assign (resid 102 and name ha  ) (resid 105 and name hb* )  3.5  3.5  1.0
assign (resid 103 and name ha  ) (resid 106 and name hb2 )  3.5  3.5  0.5
assign (resid 104 and name ha  ) (resid 107 and name hb* )  3.5  3.5  1.0
!ha(i)-hn(i+4)
assign (resid  24 and name ha  ) (resid  28 and name hn  )  4.5  4.5  1.0
assign (resid  26 and name ha  ) (resid  30 and name hn  )  4.5  4.5  1.0
assign (resid  27 and name ha  ) (resid  31 and name hn  )  4.5  4.5  1.0
assign (resid  28 and name ha  ) (resid  32 and name hn  )  4.5  4.5  1.0
assign (resid  29 and name ha  ) (resid  33 and name hn  )  4.5  4.5  1.0
assign (resid  31 and name ha  ) (resid  35 and name hn  )  4.5  4.5  1.0
assign (resid  80 and name ha  ) (resid  84 and name hn  )  4.5  4.5  1.0
assign (resid  81 and name ha  ) (resid  85 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name ha  ) (resid  86 and name hn  )  4.5  4.5  1.0
! other medium-range noes
assign (resid   3 and name ha  ) (resid   5 and name he3 )  4.5  4.5  0.0 
assign (resid   3 and name hb1 ) (resid   5 and name he3 )  3.5  3.5  0.0 
assign (resid   3 and name hb1 ) (resid   5 and name hz3 )  2.5  2.5  0.0 
assign (resid   3 and name hb2 ) (resid   5 and name hz3 )  3.5  3.5  0.0 
assign (resid   5 and name hd1 ) (resid   7 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name hd1 ) (resid   7 and name ha  )  5.5  5.5  0.0 
assign (resid   5 and name hd1 ) (resid   7 and name hb1 )  3.5  3.5  0.0
assign (resid   5 and name hd1 ) (resid   7 and name hb2 )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hb1 )  3.5  3.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hb2 )  5.5  5.5  0.0
assign (resid   5 and name he1 ) (resid   7 and name hg* )  3.5  3.5  1.0
assign (resid   7 and name he2*) (resid  11 and name hn  )  4.5  4.5  1.0
assign (resid   7 and name he2*) (resid  11 and name ha* )  4.5  4.5  2.0
assign (resid   8 and name hn  ) (resid  12 and name hb1 )  4.5  4.5  0.0
assign (resid   8 and name hn  ) (resid  12 and name hb2 )  5.5  5.5  0.0
assign (resid   8 and name hb* ) (resid  12 and name hd2*)  5.5  5.5  2.0
assign (resid  12 and name hg  ) (resid  14 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hb* ) (resid  14 and name hn  )  5.5  5.5  0.0
assign (resid  12 and name hd1*) (resid  14 and name hn  )  5.5  5.5  1.0
assign (resid  12 and name hd2*) (resid  14 and name hn  )  4.5  4.5  1.0
assign (resid  15 and name hn  ) (resid  19 and name ha  )  4.5  4.5  0.0
assign (resid  15 and name hb* ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  15 and name hg* ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  16 and name hb1 ) (resid  18 and name hd2 )  4.5  4.5  0.0 
assign (resid  16 and name hb2 ) (resid  18 and name hd2 )  5.5  5.5  0.0 
assign (resid  16 and name hb1 ) (resid  18 and name he1 )  5.5  5.5  0.0 
assign (resid  18 and name he1 ) (resid  20 and name ha  )  5.5  5.5  0.0 
assign (resid  19 and name hg  ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  19 and name hb1 ) (resid  21 and name hn  )  2.5  2.5  0.5 
assign (resid  19 and name hb1 ) (resid  21 and name hd1 )  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid  23 and name ha  )  4.4  4.4  0.0
assign (resid  21 and name hd1 ) (resid  23 and name hb1 )  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hb2 )  3.5  3.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hd1*)  4.5  4.5  1.0 
assign (resid  21 and name hd1 ) (resid  23 and name hd2*)  4.5  4.5  1.0
assign (resid  21 and name hd1 ) (resid  23 and name hn  )  3.5  3.5  0.0
assign (resid  21 and name hd1 ) (resid  23 and name hg  )  5.5  5.5  0.0
assign (resid  22 and name hd2 ) (resid  24 and name hb* )  4.5  4.5  1.0 
assign (resid  22 and name hd2 ) (resid  24 and name hg* )  3.5  3.5  1.0 
assign (resid  22 and name hd2 ) (resid  24 and name hd* )  4.5  4.5  1.0 
assign (resid  22 and name he1 ) (resid  24 and name hb* )  5.5  5.5  1.0 
assign (resid  22 and name he1 ) (resid  24 and name hg* )  5.5  5.5  1.0 
assign (resid  23 and name hn  ) (resid  27 and name hg  )  4.5  4.5  0.0
assign (resid  23 and name hn  ) (resid  27 and name hd1*)  6.5  6.5  0.0
assign (resid  23 and name hb* ) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hg  ) (resid  25 and name hn  )  5.5  5.5  0.0
assign (resid  23 and name hg  ) (resid  26 and name hn  )  3.5  3.5  0.0
assign (resid  23 and name hg  ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hg  ) (resid  26 and name hb1 )  3.5  3.5  0.0 
assign (resid  23 and name hg  ) (resid  26 and name hb2 )  3.5  3.5  0.0 
assign (resid  23 and name hd1*) (resid  25 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd1*) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid  26 and name hn  )  4.5  4.5  1.0
assign (resid  23 and name hd2*) (resid  26 and name hb1 )  3.5  3.5  1.0 
assign (resid  23 and name hd2*) (resid  26 and name hb2 )  4.5  4.5  1.0 
assign (resid  24 and name ha  ) (resid  27 and name hg  )  4.5  4.5  0.0
assign (resid  24 and name ha  ) (resid  27 and name hd1*)  3.5  3.5  1.0
assign (resid  24 and name hg* ) (resid  27 and name hd1*)  4.5  4.5  2.0
assign (resid  25 and name ha  ) (resid  28 and name hd2 )  3.5  3.5  0.0 
assign (resid  30 and name hn  ) (resid  32 and name hb* )  5.5  5.5  1.0
assign (resid  30 and name hz  ) (resid  34 and name hg2*)  4.5  4.5  1.0
assign (resid  31 and name ha  ) (resid  34 and name hg1 )  3.5  3.5  0.0
assign (resid  39 and name he* ) (resid  41 and name hg1*)  3.5  3.5  1.0
assign (resid  39 and name he* ) (resid  41 and name hg2*)  3.5  3.5  1.0
assign (resid  41 and name ha  ) (resid  45 and name hb  )  5.5  5.5  0.0
assign (resid  41 and name hb  ) (resid  45 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hb  ) (resid  45 and name hb  )  2.5  2.5  0.0
assign (resid  49 and name hb* ) (resid  51 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hn  ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  54 and name hb* ) (resid  57 and name he  )  3.5  3.5  1.0
assign (resid  54 and name hd1*) (resid  57 and name he  )  5.5  5.5  2.0
assign (resid  54 and name hd1*) (resid  57 and name hd* )  4.5  4.5  2.0
assign (resid  57 and name hn  ) (resid  59 and name hd2*)  4.5  4.5  1.0
assign (resid  58 and name hg2*) (resid  60 and name hg2*)  3.5  3.5  2.0
assign (resid  58 and name hg2*) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  61 and name hg1*) (resid  63 and name hb  )  4.5  4.5  1.0
assign (resid  61 and name hg1*) (resid  63 and name hg2*)  4.5  4.5  2.0
assign (resid  63 and name hg2*) (resid  68 and name hn  )  4.5  4.5  1.0
assign (resid  70 and name hb* ) (resid  73 and name ha  )  5.5  5.5  1.0
assign (resid  70 and name hn  ) (resid  75 and name hb  )  5.5  5.5  0.0
assign (resid  73 and name hb* ) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hg1*) (resid  77 and name he1 )  3.5  3.5  1.0 
assign (resid  75 and name hb  ) (resid  77 and name he1 )  5.5  5.5  1.0 
assign (resid  76 and name hb  ) (resid  78 and name hn  )  3.5  3.5  0.0
assign (resid  76 and name hb  ) (resid  81 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hg2*) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  81 and name hb* )  5.5  5.5  1.0
assign (resid  77 and name hn  ) (resid  81 and name hb* )  4.5  4.5  1.0
assign (resid  78 and name hb* ) (resid  81 and name hn  )  6.5  6.5  0.0
assign (resid  78 and name hb* ) (resid  80 and name hn  )  4.5  4.5  1.0
assign (resid  78 and name hn  ) (resid  81 and name hb* )  3.5  3.5  1.0
assign (resid  79 and name ha  ) (resid  82 and name hg2*)  3.5  3.5  1.0
assign (resid  82 and name hb  ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  82 and name hg1*) (resid  85 and name hn  )  5.5  5.5  1.0
assign (resid  84 and name hb* ) (resid  86 and name hn  )  5.5  5.5  1.0
assign (resid  84 and name hn  ) (resid  87 and name hb* )  5.5  5.5  1.0
assign (resid  84 and name ha  ) (resid  87 and name hd* )  3.5  3.5  1.0
assign (resid  86 and name ha  ) (resid  89 and name hd2 )  5.5  5.5  1.0 
assign (resid  89 and name hb* ) (resid  92 and name hn  )  4.5  4.5  1.0
assign (resid  94 and name hg  ) (resid  96 and name hd1*)  4.5  4.5  1.0
assign (resid  96 and name hg2*) (resid  98 and name hn  )  3.5  3.5  1.0
assign (resid  98 and name hn  ) (resid 102 and name hg1*)  4.5  4.5  1.0
assign (resid  98 and name hn  ) (resid 102 and name hg2*)  4.5  4.5  1.0
assign (resid 100 and name hb* ) (resid 103 and name hn  )  5.5  5.5  1.0
assign (resid 102 and name hg2*) (resid 106 and name hn  )  4.5  4.5  1.0
assign (resid 104 and name hn  ) (resid 107 and name hb* )  6.5  6.5  0.0
assign (resid 107 and name hb* ) (resid 109 and name hn  )  6.5  6.5  0.0
assign (resid 116 and name hb  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 118 and name hd1*)  2.5  2.5  2.0
assign (resid 118 and name hb1 ) (resid 120 and name hn  )  3.5  3.5  0.0
assign (resid 118 and name hb2 ) (resid 120 and name hn  )  5.5  5.5  0.0
assign (resid 118 and name hd2*) (resid 122 and name hz  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 131 and name hd1*)  2.5  2.5  2.0
assign (resid 128 and name he* ) (resid 131 and name hd2*)  3.5  3.5  2.0
assign (resid 130 and name ha  ) (resid 133 and name he1 )  5.5  5.5  0.0
assign (resid 131 and name hn  ) (resid 133 and name he1 )  4.5  4.5  0.0
assign (resid 131 and name hb1 ) (resid 133 and name hd1 )  5.5  5.5  0.0 
assign (resid 131 and name hb2 ) (resid 133 and name hd1 )  4.5  4.5  0.0 
assign (resid 131 and name hb1 ) (resid 133 and name he1 )  5.5  5.5  0.5
assign (resid 131 and name hb2 ) (resid 133 and name he1 )  4.5  4.5  0.5
assign (resid 131 and name hb1 ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 131 and name hb2 ) (resid 133 and name hn  )  4.5  4.5  0.0
assign (resid 131 and name hd1*) (resid 133 and name hd1 )  5.5  5.5  1.0 
assign (resid 131 and name hd1*) (resid 133 and name hz2 )  3.5  3.5  1.0 
assign (resid 132 and name hb1 ) (resid 135 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name he3 ) (resid 136 and name hb1 )  5.5  5.5  0.0
assign (resid 133 and name he3 ) (resid 136 and name hb2 )  5.5  5.5  0.0
assign (resid 138 and name hg* ) (resid 140 and name hn  )  4.5  4.5  1.0
assign (resid 146 and name hb1 ) (resid 148 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hb2 ) (resid 148 and name hn  )  5.5  5.5  0.0
assign (resid 148 and name hb* ) (resid 151 and name hn  )  5.5  5.5  1.0
assign (resid 148 and name hb* ) (resid 151 and name hd1*)  4.5  4.5  1.0
assign (resid 148 and name hb* ) (resid 151 and name hb* )  4.5  4.5  2.0
assign (resid 148 and name hd2*) (resid 150 and name hb* )  3.5  3.5  2.5
assign (resid 148 and name hd2*) (resid 151 and name hd1*)  4.5  4.5  2.0
assign (resid 149 and name ha  ) (resid 152 and name hg1 )  3.5  3.5  0.0
assign (resid 154 and name hg2*) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 156 and name ha  ) (resid 158 and name he1 )  5.5  5.5  0.0
assign (resid 156 and name hb1 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 156 and name hb2 ) (resid 158 and name hd1 )  4.5  4.5  0.0 
assign (resid 156 and name hb1 ) (resid 158 and name he1 )  2.5  2.5  0.0
assign (resid 156 and name hb2 ) (resid 158 and name he1 )  3.5  3.5  0.0
!sequential noes
!r-6 averaging for aromatics and some others
assign (resid   3 and name hd* ) (resid   4 and name hn  )  5.5  5.5  0.0
assign (resid  18 and name ha  ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid  23 and name ha  ) (resid  24 and name hd* )  2.5  2.5  0.0
assign (resid  29 and name hd* ) (resid  30 and name hn  )  4.5  4.5  0.5
assign (resid  29 and name hd* ) (resid  30 and name ha  )  5.5  5.5  0.0 
assign (resid  30 and name hd* ) (resid  31 and name hn  )  5.5  5.5  0.0
assign (resid  30 and name hd* ) (resid  31 and name ha  )  5.5  5.5  0.0 
assign (resid  35 and name hg* ) (resid  36 and name hn  )  4.5  4.5  0.5
assign (resid  46 and name hd* ) (resid  47 and name hn  )  5.5  5.5  0.0
assign (resid  46 and name hd* ) (resid  47 and name ha  )  5.5  5.5  0.0
assign (resid  46 and name hd* ) (resid  47 and name hg* )  4.5  4.5  0.0 
assign (resid  49 and name hd* ) (resid  50 and name hd* )  5.5  5.5  0.0 
assign (resid  68 and name hd* ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  68 and name he* ) (resid  69 and name hn  )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid  80 and name hn  )  5.5  5.5  0.0
assign (resid  83 and name hd* ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  85 and name hd* ) (resid  86 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hd* ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  98 and name ha* ) (resid  99 and name ha* )  3.5  3.5  0.0 
assign (resid 103 and name hd* ) (resid 104 and name hn  )  5.5  5.5  0.0
assign (resid 106 and name hd* ) (resid 105 and name hb* )  5.5  5.5  0.0 
assign (resid 107 and name hd* ) (resid 108 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name ha  ) (resid 115 and name hg* )  5.5  5.5  0.0
assign (resid 115 and name hg* ) (resid 116 and name hn  )  3.5  3.5  0.0
assign (resid 121 and name ha  ) (resid 122 and name hd* )  4.5  4.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name he* )  5.5  5.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name hd* )  3.5  3.5  0.0
assign (resid 136 and name hd* ) (resid 137 and name hn  )  4.5  4.5  0.0
assign (resid 139 and name hg* ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 156 and name hn  ) (resid 155 and name hd* )  5.5  5.5  0.0
assign (resid 157 and name hg* ) (resid 158 and name hn  )  4.5  4.5  0.0
assign (resid 157 and name hg* ) (resid 158 and name hd1 )  5.5  5.5  1.0 
!hn(i)-hn(i+1)
assign (resid   4 and name hn  ) (resid   5 and name hn  )  5.5  5.5  0.0
assign (resid   5 and name hn  ) (resid   6 and name hn  )  5.5  5.5  0.0
assign (resid   6 and name hn  ) (resid   7 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name hn  ) (resid   8 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hn  ) (resid  10 and name hn  )  3.5  3.5  0.0
assign (resid  10 and name hn  ) (resid  11 and name hn  )  2.5  2.5  0.5
assign (resid  11 and name hn  ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hn  ) (resid  13 and name hn  )  5.5  5.5  0.0
assign (resid  13 and name hn  ) (resid  14 and name hn  )  2.5  2.5  0.0
assign (resid  15 and name hn  ) (resid  16 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hn  ) (resid  17 and name hn  )  3.5  3.5  0.0
assign (resid  17 and name hn  ) (resid  18 and name hn  )  4.5  4.5  0.0
assign (resid  25 and name hn  ) (resid  26 and name hn  )  2.5  2.5  1.0
assign (resid  26 and name hn  ) (resid  27 and name hn  )  2.5  2.5  1.0
assign (resid  27 and name hn  ) (resid  28 and name hn  )  2.5  2.5  1.0
assign (resid  28 and name hn  ) (resid  29 and name hn  )  2.5  2.5  1.0
assign (resid  29 and name hn  ) (resid  30 and name hn  )  2.5  2.5  1.0
assign (resid  30 and name hn  ) (resid  31 and name hn  )  3.5  3.5  0.0
assign (resid  31 and name hn  ) (resid  32 and name hn  )  3.5  3.5  0.0
assign (resid  32 and name hn  ) (resid  33 and name hn  )  3.5  3.5  0.0
assign (resid  33 and name hn  ) (resid  34 and name hn  )  2.5  2.5  0.5
assign (resid  34 and name hn  ) (resid  35 and name hn  )  2.5  2.5  0.0
assign (resid  35 and name hn  ) (resid  36 and name hn  )  5.5  5.5  0.0
assign (resid  36 and name hn  ) (resid  37 and name hn  )  4.5  4.5  0.0
assign (resid  38 and name hn  ) (resid  39 and name hn  )  5.5  5.5  0.0
assign (resid  41 and name hn  ) (resid  42 and name hn  )  5.5  5.5  0.0
assign (resid  43 and name hn  ) (resid  44 and name hn  )  3.5  3.5  0.0
assign (resid  44 and name hn  ) (resid  45 and name hn  )  3.5  3.5  0.0
assign (resid  45 and name hn  ) (resid  46 and name hn  )  3.5  3.5  0.0
assign (resid  46 and name hn  ) (resid  47 and name hn  )  3.5  3.5  0.0
assign (resid  47 and name hn  ) (resid  48 and name hn  )  3.5  3.5  0.0
assign (resid  48 and name hn  ) (resid  49 and name hn  )  3.5  3.5  0.0
assign (resid  51 and name hn  ) (resid  52 and name hn  )  5.5  5.5  0.0
assign (resid  56 and name hn  ) (resid  57 and name hn  )  3.5  3.5  0.0
assign (resid  57 and name hn  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  60 and name hn  )  4.5  4.5  0.0
assign (resid  63 and name hn  ) (resid  64 and name hn  )  5.5  5.5  0.0
assign (resid  66 and name hn  ) (resid  67 and name hn  )  3.5  3.5  0.0
assign (resid  67 and name hn  ) (resid  68 and name hn  )  2.5  2.5  0.0
assign (resid  68 and name hn  ) (resid  69 and name hn  )  5.5  5.5  0.0
assign (resid  69 and name hn  ) (resid  70 and name hn  )  4.5  4.5  0.0
assign (resid  70 and name hn  ) (resid  71 and name hn  )  4.5  4.5  0.0
assign (resid  72 and name hn  ) (resid  73 and name hn  )  4.5  4.5  0.0
assign (resid  73 and name hn  ) (resid  74 and name hn  )  4.5  4.5  0.0
assign (resid  74 and name hn  ) (resid  75 and name hn  )  4.5  4.5  0.0
assign (resid  75 and name hn  ) (resid  76 and name hn  )  4.5  4.5  0.0
assign (resid  77 and name hn  ) (resid  78 and name hn  )  3.5  3.5  0.0
assign (resid  78 and name hn  ) (resid  79 and name hn  )  4.5  4.5  0.0
assign (resid  80 and name hn  ) (resid  81 and name hn  )  3.5  3.5  0.0
assign (resid  81 and name hn  ) (resid  82 and name hn  )  3.5  3.5  0.0
assign (resid  82 and name hn  ) (resid  83 and name hn  )  3.5  3.5  0.0
assign (resid  83 and name hn  ) (resid  84 and name hn  )  3.5  3.5  0.0
assign (resid  84 and name hn  ) (resid  85 and name hn  )  3.5  3.5  0.0
assign (resid  85 and name hn  ) (resid  86 and name hn  )  3.5  3.5  0.0
assign (resid  86 and name hn  ) (resid  87 and name hn  )  3.5  3.5  0.0
assign (resid  87 and name hn  ) (resid  88 and name hn  )  3.5  3.5  0.0
assign (resid  88 and name hn  ) (resid  89 and name hn  )  3.5  3.5  0.0
assign (resid  91 and name hn  ) (resid  92 and name hn  )  3.5  3.5  0.0
assign (resid  92 and name hn  ) (resid  93 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hn  ) (resid  95 and name hn  )  5.5  5.5  0.0
assign (resid  95 and name hn  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid  96 and name hn  ) (resid  97 and name hn  )  5.5  5.5  0.0
assign (resid  97 and name hn  ) (resid  98 and name hn  )  2.5  2.5  0.0
assign (resid 101 and name hn  ) (resid 102 and name hn  )  3.5  3.5  0.0
assign (resid 102 and name hn  ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 103 and name hn  ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hn  ) (resid 105 and name hn  )  3.5  3.5  0.0
assign (resid 105 and name hn  ) (resid 106 and name hn  )  3.5  3.5  0.0
assign (resid 106 and name hn  ) (resid 107 and name hn  )  3.5  3.5  0.0
assign (resid 107 and name hn  ) (resid 108 and name hn  )  3.5  3.5  0.0
assign (resid 108 and name hn  ) (resid 109 and name hn  )  3.5  3.5  0.0
assign (resid 109 and name hn  ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name hn  ) (resid 111 and name hn  )  5.5  5.5  0.0
assign (resid 111 and name hn  ) (resid 112 and name hn  )  2.5  2.5  0.0
assign (resid 113 and name hn  ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid 114 and name hn  ) (resid 115 and name hn  )  4.5  4.5  0.0
assign (resid 119 and name hn  ) (resid 120 and name hn  )  3.5  3.5  0.0
assign (resid 120 and name hn  ) (resid 121 and name hn  )  5.5  5.5  0.0
assign (resid 121 and name hn  ) (resid 122 and name hn  )  4.5  4.5  0.5
assign (resid 123 and name hn  ) (resid 124 and name hn  )  5.5  5.5  0.0
assign (resid 124 and name hn  ) (resid 125 and name hn  )  4.5  4.5  0.0
assign (resid 125 and name hn  ) (resid 126 and name hn  )  2.5  2.5  0.0
assign (resid 126 and name hn  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid 127 and name hn  ) (resid 128 and name hn  )  5.5  5.5  0.0
assign (resid 128 and name hn  ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 131 and name hn  ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name hn  ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hn  ) (resid 134 and name hn  )  3.5  3.5  0.0
assign (resid 134 and name hn  ) (resid 135 and name hn  )  3.5  3.5  0.0
assign (resid 135 and name hn  ) (resid 136 and name hn  )  3.5  3.5  0.0
assign (resid 136 and name hn  ) (resid 137 and name hn  )  5.5  5.5  0.0
assign (resid 137 and name hn  ) (resid 138 and name hn  )  4.5  4.5  0.0
assign (resid 138 and name hn  ) (resid 139 and name hn  )  5.5  5.5  0.0
assign (resid 139 and name hn  ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 140 and name hn  ) (resid 141 and name hn  )  4.5  4.5  0.0
assign (resid 141 and name hn  ) (resid 142 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hn  ) (resid 145 and name hn  )  4.5  4.5  0.0
assign (resid 145 and name hn  ) (resid 146 and name hn  )  4.5  4.5  0.0
assign (resid 146 and name hn  ) (resid 147 and name hn  )  5.5  5.5  0.0
assign (resid 147 and name hn  ) (resid 148 and name hn  )  3.5  3.5  0.0
assign (resid 150 and name hn  ) (resid 151 and name hn  )  3.5  3.5  0.0
assign (resid 151 and name hn  ) (resid 152 and name hn  )  3.5  3.5  0.0
assign (resid 152 and name hn  ) (resid 153 and name hn  )  4.5  4.5  0.5
assign (resid 154 and name hn  ) (resid 155 and name hn  )  5.5  5.5  0.0
assign (resid 155 and name hn  ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 156 and name hn  ) (resid 157 and name hn  )  4.5  4.5  0.5
assign (resid 159 and name hn  ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 161 and name hn  ) (resid 162 and name hn  )  4.5  4.5  0.0
!ha(i)-hn(i+1)
assign (resid   1 and name ha  ) (resid   2 and name hn  )  2.5  2.5  0.0
assign (resid   2 and name ha  ) (resid   3 and name hn  )  2.5  2.5  0.0
assign (resid   3 and name ha  ) (resid   4 and name hn  )  2.5  2.5  0.0
assign (resid   4 and name ha  ) (resid   5 and name hn  )  2.5  2.5  0.0
assign (resid   5 and name ha  ) (resid   6 and name hn  )  2.5  2.5  0.0
assign (resid   6 and name ha  ) (resid   7 and name hn  )  2.5  2.5  0.0
assign (resid   7 and name ha  ) (resid   8 and name hn  )  2.5  2.5  0.5
assign (resid   8 and name ha  ) (resid   9 and name hn  )  3.5  3.5  0.5
assign (resid  10 and name ha  ) (resid  11 and name hn  )  3.5  3.5  0.5
assign (resid  11 and name ha* ) (resid  12 and name hn  )  3.5  3.5  1.0
assign (resid  12 and name ha  ) (resid  13 and name hn  )  2.5  2.5  0.0
assign (resid  13 and name ha  ) (resid  14 and name hn  )  4.5  4.5  0.0
assign (resid  14 and name ha* ) (resid  15 and name hn  )  3.5  3.5  1.0
assign (resid  15 and name ha  ) (resid  16 and name hn  )  2.5  2.5  0.5
assign (resid  16 and name ha  ) (resid  17 and name hn  )  3.5  3.5  0.0
assign (resid  17 and name ha* ) (resid  18 and name hn  )  3.5  3.5  1.0
assign (resid  20 and name ha  ) (resid  21 and name hn  )  3.5  3.5  0.5
assign (resid  21 and name ha  ) (resid  22 and name hn  )  3.5  3.5  0.5
assign (resid  22 and name ha  ) (resid  23 and name hn  )  3.5  3.5  0.5
assign (resid  25 and name ha  ) (resid  26 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name ha  ) (resid  27 and name hn  )  4.5  4.5  0.5
assign (resid  27 and name ha  ) (resid  28 and name hn  )  4.5  4.5  0.5
assign (resid  28 and name ha  ) (resid  29 and name hn  )  4.5  4.5  0.5
assign (resid  29 and name ha  ) (resid  30 and name hn  )  3.5  3.5  0.5
assign (resid  30 and name ha  ) (resid  31 and name hn  )  4.5  4.5  0.5
assign (resid  31 and name ha  ) (resid  32 and name hn  )  3.5  3.5  0.5
assign (resid  32 and name ha  ) (resid  33 and name hn  )  3.5  3.5  0.5
assign (resid  33 and name ha  ) (resid  34 and name hn  )  3.5  3.5  0.5
assign (resid  34 and name ha  ) (resid  35 and name hn  )  3.5  3.5  0.5
assign (resid  35 and name ha  ) (resid  36 and name hn  )  2.5  2.5  0.5
assign (resid  36 and name ha* ) (resid  37 and name hn  )  3.5  3.5  1.0
assign (resid  37 and name ha  ) (resid  38 and name hn  )  4.5  4.5  0.5
assign (resid  38 and name ha  ) (resid  39 and name hn  )  2.5  2.5  0.5
assign (resid  40 and name ha  ) (resid  41 and name hn  )  2.5  2.5  0.5
assign (resid  41 and name ha  ) (resid  42 and name hn  )  2.5  2.5  0.5
assign (resid  42 and name ha* ) (resid  43 and name hn  )  3.5  3.5  1.0
assign (resid  43 and name ha  ) (resid  44 and name hn  )  3.5  3.5  0.5
assign (resid  44 and name ha  ) (resid  45 and name hn  )  3.5  3.5  0.5
assign (resid  45 and name ha  ) (resid  46 and name hn  )  4.5  4.5  0.5
assign (resid  46 and name ha  ) (resid  47 and name hn  )  4.5  4.5  0.5
assign (resid  47 and name ha  ) (resid  48 and name hn  )  4.5  4.5  0.5
assign (resid  48 and name ha  ) (resid  49 and name hn  )  3.5  3.5  0.5
assign (resid  51 and name ha  ) (resid  52 and name hn  )  2.5  2.5  0.5
assign (resid  53 and name ha  ) (resid  54 and name hn  )  2.5  2.5  0.5
assign (resid  55 and name ha  ) (resid  56 and name hn  )  2.5  2.5  0.5
assign (resid  56 and name ha  ) (resid  57 and name hn  )  3.5  3.5  0.5
assign (resid  57 and name ha  ) (resid  58 and name hn  )  3.5  3.5  0.5
assign (resid  58 and name ha  ) (resid  59 and name hn  )  2.5  2.5  0.5
assign (resid  59 and name ha  ) (resid  60 and name hn  )  2.5  2.5  0.5
assign (resid  60 and name ha  ) (resid  61 and name hn  )  2.5  2.5  0.5
assign (resid  65 and name ha  ) (resid  66 and name hn  )  2.5  2.5  0.5
assign (resid  66 and name ha  ) (resid  67 and name hn  )  3.5  3.5  0.5
assign (resid  67 and name ha  ) (resid  68 and name hn  )  4.5  4.5  0.5
assign (resid  68 and name ha  ) (resid  69 and name hn  )  2.5  2.5  0.5
assign (resid  70 and name ha  ) (resid  71 and name hn  )  2.5  2.5  0.5
assign (resid  71 and name ha  ) (resid  72 and name hn  )  3.5  3.5  0.5
assign (resid  72 and name ha* ) (resid  73 and name hn  )  3.5  3.5  1.0
assign (resid  73 and name ha  ) (resid  74 and name hn  )  3.5  3.5  0.5
assign (resid  74 and name ha  ) (resid  75 and name hn  )  2.5  2.5  0.5
assign (resid  75 and name ha  ) (resid  76 and name hn  )  2.5  2.5  0.5
assign (resid  76 and name ha  ) (resid  77 and name hn  )  2.5  2.5  0.5
assign (resid  77 and name ha  ) (resid  78 and name hn  )  4.5  4.5  0.5
assign (resid  78 and name ha  ) (resid  79 and name hn  )  3.5  3.5  0.5
assign (resid  79 and name ha  ) (resid  80 and name hn  )  4.5  4.5  0.5
assign (resid  81 and name ha  ) (resid  82 and name hn  )  4.5  4.5  0.5
assign (resid  82 and name ha  ) (resid  83 and name hn  )  4.5  4.5  0.5
assign (resid  83 and name ha  ) (resid  84 and name hn  )  3.5  3.5  0.5
assign (resid  84 and name ha  ) (resid  85 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name ha  ) (resid  86 and name hn  )  3.5  3.5  0.5
assign (resid  86 and name ha  ) (resid  87 and name hn  )  3.5  3.5  0.5
assign (resid  88 and name ha  ) (resid  89 and name hn  )  3.5  3.5  0.5
assign (resid  91 and name ha  ) (resid  92 and name hn  )  3.5  3.5  0.5
assign (resid  92 and name ha  ) (resid  93 and name hn  )  2.5  2.5  0.5
assign (resid  93 and name ha  ) (resid  94 and name hn  )  2.5  2.5  0.5
assign (resid  94 and name ha  ) (resid  95 and name hn  )  2.5  2.5  0.5
assign (resid  95 and name ha  ) (resid  96 and name hn  )  2.5  2.5  0.5
assign (resid  96 and name ha  ) (resid  97 and name hn  )  2.5  2.5  0.5
assign (resid  99 and name ha* ) (resid 100 and name hn  )  4.5  4.5  1.0
assign (resid 100 and name ha  ) (resid 101 and name hn  )  4.5  4.5  0.5
assign (resid 101 and name ha  ) (resid 102 and name hn  )  4.5  4.5  0.5
assign (resid 102 and name ha  ) (resid 103 and name hn  )  3.5  3.5  0.5
assign (resid 103 and name ha  ) (resid 104 and name hn  )  4.5  4.5  0.5
assign (resid 104 and name ha  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 105 and name ha  ) (resid 106 and name hn  )  3.5  3.5  0.5
assign (resid 106 and name ha  ) (resid 107 and name hn  )  3.5  3.5  0.5
assign (resid 107 and name ha  ) (resid 108 and name hn  )  3.5  3.5  0.5
assign (resid 108 and name ha  ) (resid 109 and name hn  )  4.5  4.5  0.5
assign (resid 109 and name ha  ) (resid 110 and name hn  )  3.5  3.5  0.5
assign (resid 110 and name ha  ) (resid 111 and name hn  )  2.5  2.5  0.5
assign (resid 111 and name ha  ) (resid 112 and name hn  )  3.5  3.5  0.5
assign (resid 112 and name ha  ) (resid 113 and name hn  )  2.5  2.5  0.5
assign (resid 113 and name ha  ) (resid 114 and name hn  )  2.5  2.5  0.5
assign (resid 114 and name ha  ) (resid 115 and name hn  )  2.5  2.5  0.5
assign (resid 115 and name ha  ) (resid 116 and name hn  )  2.5  2.5  0.5
assign (resid 116 and name ha  ) (resid 117 and name hn  )  2.5  2.5  0.5
assign (resid 118 and name ha  ) (resid 119 and name hn  )  2.5  2.5  0.5
assign (resid 119 and name ha  ) (resid 120 and name hn  )  3.5  3.5  0.5
assign (resid 120 and name ha* ) (resid 121 and name hn  )  2.5  2.5  1.0
assign (resid 121 and name ha  ) (resid 122 and name hn  )  2.5  2.5  0.5
assign (resid 122 and name ha  ) (resid 123 and name hn  )  3.5  3.5  0.5
assign (resid 123 and name ha  ) (resid 124 and name hn  )  2.5  2.5  0.5
assign (resid 124 and name ha* ) (resid 125 and name hn  )  2.5  2.5  1.0
assign (resid 125 and name ha  ) (resid 126 and name hn  )  3.5  3.5  0.5
assign (resid 126 and name ha  ) (resid 127 and name hn  )  2.5  2.5  0.5
assign (resid 127 and name ha  ) (resid 128 and name hn  )  2.5  2.5  0.5
assign (resid 128 and name ha  ) (resid 129 and name hn  )  2.5  2.5  0.5
assign (resid 130 and name ha  ) (resid 131 and name hn  )  2.5  2.5  0.5
assign (resid 131 and name ha  ) (resid 132 and name hn  )  2.5  2.5  0.5
assign (resid 132 and name ha  ) (resid 133 and name hn  )  2.5  2.5  0.5
assign (resid 133 and name ha  ) (resid 134 and name hn  )  4.5  4.5  0.5
assign (resid 135 and name ha  ) (resid 136 and name hn  )  3.5  3.5  0.5
assign (resid 136 and name ha  ) (resid 137 and name hn  )  2.5  2.5  0.5
assign (resid 137 and name ha  ) (resid 138 and name hn  )  2.5  2.5  0.5
assign (resid 138 and name ha  ) (resid 139 and name hn  )  2.5  2.5  0.5
assign (resid 139 and name ha  ) (resid 140 and name hn  )  3.5  3.5  0.5
assign (resid 140 and name ha  ) (resid 141 and name hn  )  2.5  2.5  0.5
assign (resid 141 and name ha  ) (resid 142 and name hn  )  2.5  2.5  0.5
assign (resid 142 and name ha  ) (resid 143 and name hn  )  2.5  2.5  0.5
assign (resid 143 and name ha  ) (resid 144 and name hn  )  2.5  2.5  0.5
assign (resid 144 and name ha  ) (resid 145 and name hn  )  2.5  2.5  0.5
assign (resid 145 and name ha  ) (resid 146 and name hn  )  2.5  2.5  0.5
assign (resid 146 and name ha  ) (resid 147 and name hn  )  2.5  2.5  0.5
assign (resid 147 and name ha  ) (resid 148 and name hn  )  3.5  3.5  0.5
assign (resid 149 and name ha  ) (resid 150 and name hn  )  3.5  3.5  0.5
assign (resid 150 and name ha  ) (resid 151 and name hn  )  3.5  3.5  0.5
assign (resid 152 and name ha  ) (resid 153 and name hn  )  2.5  2.5  0.5
assign (resid 153 and name ha  ) (resid 154 and name hn  )  2.5  2.5  0.5
assign (resid 154 and name ha  ) (resid 155 and name hn  )  2.5  2.5  0.5
assign (resid 155 and name ha  ) (resid 156 and name hn  )  2.5  2.5  0.5
assign (resid 156 and name ha  ) (resid 157 and name hn  )  2.5  2.5  0.5
assign (resid 157 and name ha  ) (resid 158 and name hn  )  2.5  2.5  0.5
assign (resid 158 and name ha  ) (resid 159 and name hn  )  2.5  2.5  0.5
assign (resid 159 and name ha  ) (resid 160 and name hn  )  2.5  2.5  0.5
assign (resid 160 and name ha  ) (resid 161 and name hn  )  2.5  2.5  0.5
!hb(i)-hn(i+1)
assign (resid   1 and name hb  ) (resid   2 and name hn  )  4.5  4.5  0.0
assign (resid   2 and name hb* ) (resid   3 and name hn  )  4.5  4.5  1.0
assign (resid   3 and name hb1 ) (resid   4 and name hn  )  3.5  3.5  1.0
assign (resid   3 and name hb2 ) (resid   4 and name hn  )  4.5  4.5  1.0
assign (resid   5 and name hb* ) (resid   6 and name hn  )  4.2  4.2  1.0
assign (resid   6 and name hb* ) (resid   7 and name hn  )  4.5  4.5  1.0
assign (resid   7 and name hb1 ) (resid   8 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name hb2 ) (resid   8 and name hn  )  3.5  3.5  0.0
assign (resid   8 and name hb1 ) (resid   9 and name hn  )  4.5  4.5  0.0
assign (resid   8 and name hb2 ) (resid   9 and name hn  )  3.5  3.5  0.0
assign (resid   9 and name hb1 ) (resid  10 and name hn  )  3.5  3.5  1.0
assign (resid  10 and name hb1 ) (resid  11 and name hn  )  5.5  5.5  0.0
assign (resid  10 and name hb2 ) (resid  11 and name hn  )  4.5  4.5  0.0
assign (resid  12 and name hb* ) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  15 and name hb1 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  15 and name hb2 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hb1 ) (resid  17 and name hn  )  5.5  5.5  0.0
assign (resid  16 and name hb2 ) (resid  17 and name hn  )  5.5  5.5  0.0
assign (resid  20 and name hb* ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  21 and name hb1 ) (resid  22 and name hn  )  4.5  4.5  0.0
assign (resid  21 and name hb2 ) (resid  22 and name hn  )  3.5  3.5  0.0
assign (resid  22 and name hb* ) (resid  23 and name hn  )  5.5  5.5  0.0
assign (resid  24 and name hb* ) (resid  25 and name hn  )  4.5  4.5  1.0
assign (resid  25 and name hb* ) (resid  26 and name hn  )  5.5  5.5  0.0
assign (resid  26 and name hb1 ) (resid  27 and name hn  )  3.5  3.5  0.0
assign (resid  26 and name hb2 ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb1 ) (resid  28 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb2 ) (resid  28 and name hn  )  3.5  3.5  0.0
assign (resid  28 and name hb* ) (resid  29 and name hn  )  3.5  3.5  1.0
assign (resid  29 and name hb1 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  29 and name hb2 ) (resid  30 and name hn  )  4.5  4.5  0.0
assign (resid  30 and name hb1 ) (resid  31 and name hn  )  2.5  2.5  0.0
assign (resid  30 and name hb2 ) (resid  31 and name hn  )  4.5  4.5  0.0
assign (resid  31 and name hb* ) (resid  32 and name hn  )  3.5  3.5  1.0
assign (resid  32 and name hb* ) (resid  33 and name hn  )  4.5  4.5  1.0
assign (resid  33 and name hb1 ) (resid  34 and name hn  )  5.5  5.5  0.0
assign (resid  33 and name hb2 ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  34 and name hb  ) (resid  35 and name hn  )  5.5  5.5  0.0
assign (resid  35 and name hb  ) (resid  36 and name hn  )  3.5  3.5  0.0
assign (resid  37 and name hb1 ) (resid  38 and name hn  )  2.5  2.5  0.0
assign (resid  37 and name hb2 ) (resid  38 and name hn  )  4.5  4.5  0.0
assign (resid  38 and name hb  ) (resid  39 and name hn  )  5.5  5.5  0.0
assign (resid  39 and name hb* ) (resid  40 and name hn  )  5.5  5.5  0.0
assign (resid  40 and name hb  ) (resid  41 and name hn  )  4.5  4.5  0.0
assign (resid  41 and name hb  ) (resid  42 and name hn  )  3.5  3.5  0.0
assign (resid  43 and name hb1 ) (resid  44 and name hn  )  4.5  4.5  0.0
assign (resid  43 and name hb2 ) (resid  44 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hb* ) (resid  45 and name hn  )  4.5  4.5  1.0
assign (resid  45 and name hb  ) (resid  46 and name hn  )  3.5  3.5  0.0
assign (resid  46 and name hb* ) (resid  47 and name hn  )  4.5  4.5  1.0
assign (resid  47 and name hb1 ) (resid  48 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name hb2 ) (resid  48 and name hn  )  3.5  3.5  0.0
assign (resid  48 and name hb* ) (resid  49 and name hn  )  5.5  5.5  0.0
assign (resid  49 and name ha  ) (resid  50 and name hd1 )  3.5  3.5  0.0
assign (resid  49 and name ha  ) (resid  50 and name hd2 )  3.5  3.5  0.0
assign (resid  49 and name hb* ) (resid  50 and name hd* )  3.5  3.5  2.0
assign (resid  50 and name hb2 ) (resid  51 and name hn  )  2.5  2.5  0.0
assign (resid  50 and name hb1 ) (resid  51 and name hn  )  4.5  4.5  0.0
assign (resid  51 and name hb* ) (resid  52 and name hn  )  3.5  3.5  1.0
assign (resid  53 and name hb* ) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  55 and name hb1 ) (resid  56 and name hn  )  5.5  5.5  0.0
assign (resid  55 and name hb2 ) (resid  56 and name hn  )  3.5  3.5  0.0
assign (resid  56 and name hb* ) (resid  57 and name hn  )  5.5  5.5  0.0
assign (resid  57 and name hb2 ) (resid  58 and name hn  )  5.5  5.5  0.0
assign (resid  57 and name hb1 ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  58 and name hb  ) (resid  59 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hb* ) (resid  60 and name hn  )  5.5  5.5  0.0
assign (resid  62 and name hb1 ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  62 and name hb2 ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  66 and name hb* ) (resid  67 and name hn  )  4.5  4.5  1.0
assign (resid  67 and name hb* ) (resid  68 and name hn  )  4.5  4.5  1.0
assign (resid  68 and name hb1 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  68 and name hb2 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb1 ) (resid  70 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb2 ) (resid  70 and name hn  )  4.5  4.5  1.0
assign (resid  70 and name hb* ) (resid  71 and name hn  )  4.5  4.5  1.0
assign (resid  73 and name hb* ) (resid  74 and name hn  )  3.5  3.5  1.0
assign (resid  74 and name hb  ) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hb  ) (resid  77 and name hn  )  3.5  3.5  0.0
assign (resid  77 and name hb1 ) (resid  78 and name hn  )  5.5  5.5  0.0
assign (resid  77 and name hb2 ) (resid  78 and name hn  )  5.5  5.5  0.0
assign (resid  78 and name hb* ) (resid  79 and name hn  )  3.5  3.5  1.0
assign (resid  79 and name hb  ) (resid  80 and name hn  )  4.5  4.5  0.0
assign (resid  80 and name hb* ) (resid  81 and name hn  )  3.5  3.5  1.0
assign (resid  81 and name hb* ) (resid  82 and name hn  )  3.5  3.5  1.0
assign (resid  82 and name hb  ) (resid  83 and name hn  )  3.5  3.5  0.0
assign (resid  83 and name hb1 ) (resid  84 and name hn  )  5.5  5.5  0.0
assign (resid  83 and name hb2 ) (resid  84 and name hn  )  3.5  3.5  0.0
assign (resid  84 and name hb* ) (resid  85 and name hn  )  3.5  3.5  1.0
assign (resid  85 and name hb1 ) (resid  86 and name hn  )  3.5  3.5  0.0
assign (resid  85 and name hb2 ) (resid  86 and name hn  )  4.5  4.5  0.0
assign (resid  86 and name hb* ) (resid  87 and name hn  )  3.5  3.5  1.0
assign (resid  88 and name hb* ) (resid  89 and name hn  )  4.5  4.5  1.0
assign (resid  91 and name hb* ) (resid  92 and name hn  )  4.5  4.5  1.0
assign (resid  93 and name hb* ) (resid  94 and name hn  )  4.5  4.5  1.0
assign (resid  95 and name hb  ) (resid  96 and name hn  )  5.5  5.5  0.0
assign (resid  97 and name hb* ) (resid  98 and name hn  )  5.5  5.5  0.0
assign (resid 100 and name hb* ) (resid 101 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name hb  ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 103 and name hb1 ) (resid 104 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hb2 ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hb  ) (resid 105 and name hn  )  3.5  3.5  0.5
assign (resid 105 and name hb* ) (resid 106 and name hn  )  3.5  3.5  1.0
assign (resid 106 and name hb1 ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid 106 and name hb2 ) (resid 107 and name hn  )  5.5  5.5  0.0
assign (resid 107 and name hb* ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name hb1 ) (resid 109 and name hn  )  5.5  5.5  0.0
assign (resid 108 and name hb2 ) (resid 109 and name hn  )  4.5  4.5  0.0
assign (resid 109 and name hb* ) (resid 110 and name hn  )  5.5  5.5  1.0
assign (resid 110 and name hb  ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb1 ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb2 ) (resid 112 and name hn  )  4.5  4.5  0.0
assign (resid 112 and name hb  ) (resid 113 and name hn  )  4.5  4.5  0.0
assign (resid 113 and name hb1 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid 113 and name hb2 ) (resid 114 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name hb1 ) (resid 115 and name hn  )  5.5  5.5  0.0
assign (resid 114 and name hb2 ) (resid 115 and name hn  )  5.5  5.5  0.0
assign (resid 115 and name hb  ) (resid 116 and name hn  )  4.5  4.5  0.0
assign (resid 116 and name hb  ) (resid 117 and name hn  )  4.5  4.5  0.0
assign (resid 118 and name hb1 ) (resid 119 and name hn  )  3.5  3.5  0.0
assign (resid 118 and name hb2 ) (resid 119 and name hn  )  4.5  4.5  0.0
assign (resid 119 and name hb* ) (resid 120 and name hn  )  3.5  3.5  1.0
assign (resid 121 and name hb* ) (resid 122 and name hn  )  5.5  5.5  0.0
assign (resid 123 and name hb* ) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid 125 and name hb1 ) (resid 126 and name hn  )  5.5  5.5  0.0
assign (resid 125 and name hb2 ) (resid 126 and name hn  )  4.5  4.5  0.0
assign (resid 126 and name hb  ) (resid 127 and name hn  )  5.5  5.5  0.0
assign (resid 127 and name hb1 ) (resid 128 and name hn  )  3.5  3.5  0.0
assign (resid 127 and name hb2 ) (resid 128 and name hn  )  4.5  4.5  0.0
assign (resid 128 and name hb1 ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 128 and name hb2 ) (resid 129 and name hn  )  5.5  5.5  0.0
assign (resid 130 and name hb* ) (resid 131 and name hn  )  4.5  4.5  1.0
assign (resid 131 and name hb1 ) (resid 132 and name hn  )  3.5  3.5  0.0
assign (resid 131 and name hb2 ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name hb* ) (resid 133 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hb1 ) (resid 134 and name hn  )  5.5  5.5  0.0
assign (resid 133 and name hb2 ) (resid 134 and name hn  )  3.5  3.5  0.0
assign (resid 134 and name hb* ) (resid 135 and name hn  )  3.5  3.5  1.0
assign (resid 135 and name hb* ) (resid 136 and name hn  )  5.5  5.5  0.0
assign (resid 136 and name hb1 ) (resid 137 and name hn  )  3.5  3.5  0.0 
assign (resid 136 and name hb2 ) (resid 137 and name hn  )  4.5  4.5  0.0 
assign (resid 137 and name hb  ) (resid 138 and name hn  )  4.5  4.5  0.0
assign (resid 139 and name hb  ) (resid 140 and name hn  )  4.5  4.5  0.0
assign (resid 140 and name hb* ) (resid 141 and name hn  )  4.5  4.5  1.0
assign (resid 143 and name hb  ) (resid 144 and name hn  )  4.5  4.5  0.0
assign (resid 144 and name hb  ) (resid 145 and name hn  )  4.5  4.5  0.0
assign (resid 145 and name hb* ) (resid 146 and name hn  )  3.5  3.5  1.0
assign (resid 147 and name hb  ) (resid 148 and name hn  )  4.5  4.5  0.0
assign (resid 149 and name hb* ) (resid 150 and name hn  )  3.5  3.5  1.0
assign (resid 150 and name hb* ) (resid 151 and name hn  )  3.5  3.5  1.0
assign (resid 151 and name hb* ) (resid 152 and name hn  )  3.5  3.5  1.0
assign (resid 152 and name hb  ) (resid 153 and name hn  )  5.5  5.5  0.0
assign (resid 153 and name hb1 ) (resid 154 and name hn  )  5.5  5.5  0.0
assign (resid 153 and name hb2 ) (resid 154 and name hn  )  3.5  3.5  0.0
assign (resid 154 and name hb  ) (resid 155 and name hn  )  5.5  5.5  0.0
assign (resid 155 and name hb* ) (resid 156 and name hn  )  5.5  5.5  0.0
assign (resid 157 and name hb  ) (resid 158 and name hn  )  5.5  5.5  0.0
assign (resid 158 and name hb1 ) (resid 159 and name hn  )  3.5  3.5  0.0
assign (resid 158 and name hb2 ) (resid 159 and name hn  )  5.5  5.5  0.0
assign (resid 159 and name hb1 ) (resid 160 and name hn  )  4.5  4.5  0.0
assign (resid 159 and name hb2 ) (resid 160 and name hn  )  5.5  5.5  0.0
assign (resid 161 and name hb* ) (resid 162 and name hn  )  3.5  3.5  1.0
!nh(i)-ha(i+1) or hb(i+1)
assign (resid   8 and name hn  ) (resid   9 and name ha  )  5.5  5.5  1.0
assign (resid  70 and name hn  ) (resid  71 and name ha  )  5.5  5.5  0.0
assign (resid  77 and name hn  ) (resid  78 and name ha  )  5.5  5.5  0.0
assign (resid  79 and name hn  ) (resid  80 and name hb* )  5.5  5.5  0.0
assign (resid  80 and name hn  ) (resid  81 and name hb* )  5.5  5.5  0.0
assign (resid  86 and name hn  ) (resid  87 and name hb* )  4.5  4.5  1.0
assign (resid 106 and name hn  ) (resid 107 and name hb* )  5.5  5.5  1.0
assign (resid 108 and name hn  ) (resid 109 and name hb* )  5.5  5.5  1.0
assign (resid 111 and name hn  ) (resid 112 and name hb  )  5.5  5.5  0.0
!other sequential noes
assign (resid   1 and name hg2*) (resid   2 and name hn  )  4.5  4.5  1.0
assign (resid   4 and name hn  ) (resid   5 and name he3 )  3.5  3.5  0.0
assign (resid   4 and name hd1*) (resid   5 and name hn  )  3.5  3.5  1.0
assign (resid   4 and name ha  ) (resid   5 and name he3 )  3.5  3.5  0.0 
assign (resid   4 and name hg  ) (resid   5 and name hn  )  4.5  4.5  0.0
assign (resid   5 and name hd1 ) (resid   6 and name hn  )  4.5  4.5  0.0
assign (resid   7 and name he2*) (resid   8 and name hn  )  5.5  5.5  1.0
assign (resid  12 and name hd2*) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hd1*) (resid  13 and name hn  )  4.5  4.5  1.0
assign (resid  12 and name hg  ) (resid  13 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hg  ) (resid  13 and name ha  )  5.5  5.5  0.0
assign (resid  13 and name ha  ) (resid  14 and name ha* )  5.5  5.5  1.0
assign (resid  17 and name ha* ) (resid  18 and name hd2 )  4.5  4.5  1.0 
assign (resid  20 and name hb* ) (resid  21 and name he3 )  3.5  3.5  1.0 
assign (resid  20 and name hg* ) (resid  21 and name he3 )  4.5  4.5  1.0 
assign (resid  20 and name hg* ) (resid  21 and name hz3 )  3.5  3.5  1.0 
assign (resid  20 and name hd* ) (resid  21 and name hn  )  3.5  3.5  1.0
assign (resid  21 and name hd1 ) (resid  22 and name ha  )  4.5  4.5  0.0 
assign (resid  23 and name ha  ) (resid  24 and name hd1 )  2.5  2.5  0.5 
assign (resid  23 and name ha  ) (resid  24 and name hd2 )  2.5  2.5  0.5 
assign (resid  34 and name hg2*) (resid  35 and name hn  )  4.5  4.5  1.0
assign (resid  38 and name hg2*) (resid  39 and name hn  )  3.5  3.5  1.0
assign (resid  40 and name hg1*) (resid  41 and name ha  )  4.5  4.5  1.0
assign (resid  40 and name hg1*) (resid  41 and name hn  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  42 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  42 and name hn  )  4.5  4.5  1.0
assign (resid  44 and name hg* ) (resid  45 and name hn  )  5.5  5.5  0.0
assign (resid  45 and name hg2*) (resid  46 and name hn  )  4.5  4.5  1.0
assign (resid  47 and name hg* ) (resid  48 and name hn  )  5.5  5.5  0.0
assign (resid  50 and name hg* ) (resid  51 and name hn  )  4.5  4.5  1.0
assign (resid  50 and name hd* ) (resid  51 and name hn  )  3.5  3.5  1.0
assign (resid  52 and name ha  ) (resid  53 and name ha  )  3.5  3.5  0.0
assign (resid  54 and name ha  ) (resid  55 and name hd1 )  2.5  2.5  0.5
assign (resid  54 and name ha  ) (resid  55 and name hd2 )  2.5  2.5  0.5
assign (resid  54 and name hd2*) (resid  55 and name hd1 )  4.5  4.5  0.5
assign (resid  54 and name hd2*) (resid  55 and name hd2 )  4.5  4.5  0.5
assign (resid  56 and name hg* ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  58 and name hg2*) (resid  59 and name hn  )  3.5  3.5  1.0
assign (resid  59 and name ha  ) (resid  60 and name hg2*)  4.5  4.5  1.0
assign (resid  60 and name hg1*) (resid  61 and name hn  )  3.5  3.5  1.0
assign (resid  61 and name hg1*) (resid  62 and name hn  )  3.5  3.5  1.0
assign (resid  62 and name hd2*) (resid  63 and name hn  )  5.5  5.5  1.0
assign (resid  62 and name hd1*) (resid  63 and name hn  )  3.5  3.5  1.0
assign (resid  62 and name hg  ) (resid  63 and name hn  )  3.5  3.5  0.0
assign (resid  74 and name hg1*) (resid  75 and name hn  )  4.5  4.5  1.0
assign (resid  75 and name hg1*) (resid  76 and name hn  )  3.5  3.5  1.0
assign (resid  76 and name ha  ) (resid  77 and name hd2 )  4.5  4.5  0.0
assign (resid  76 and name hg1*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  77 and name hn  )  4.5  4.5  1.0
assign (resid  81 and name hn  ) (resid  82 and name hg2*)  4.5  4.5  1.0
assign (resid  82 and name hg1*) (resid  83 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hg2*) (resid  83 and name hn  )  4.5  4.5  1.0
assign (resid  88 and name hn  ) (resid  89 and name hd2 )  5.5  5.5  0.0
assign (resid  88 and name ha  ) (resid  89 and name hd2 )  5.5  5.5  0.0 
assign (resid  88 and name hb* ) (resid  89 and name hd2 )  2.5  2.5  1.0 
assign (resid  88 and name hg* ) (resid  89 and name hd2 )  5.5  5.5  1.0 
assign (resid  90 and name hd* ) (resid  91 and name hn  )  2.5  2.5  1.0
assign (resid  92 and name hg* ) (resid  93 and name hn  )  4.5  4.5  1.0
assign (resid  96 and name hg2*) (resid  97 and name hn  )  3.5  3.5  1.0
assign (resid  96 and name hd1*) (resid  97 and name hn  )  4.5  4.5  1.0
assign (resid 102 and name hg2*) (resid 103 and name hn  )  4.5  4.5  0.5
assign (resid 107 and name hg* ) (resid 108 and name hn  )  4.5  4.5  1.0
assign (resid 110 and name hg2*) (resid 111 and name hn  )  4.5  4.5  1.0
assign (resid 112 and name ha  ) (resid 113 and name hg  )  4.5  4.5  0.0
assign (resid 112 and name hg2*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 117 and name hn  )  3.5  3.5  1.0
assign (resid 118 and name hg  ) (resid 119 and name hn  )  5.5  5.5  0.0
assign (resid 123 and name hg* ) (resid 124 and name hn  )  4.5  4.5  1.0
assign (resid 126 and name hg2*) (resid 127 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name hg* ) (resid 129 and name hn  )  4.5  4.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hd1*)  3.5  3.5  2.0
assign (resid 128 and name he* ) (resid 129 and name hg11)  3.5  3.5  1.0
assign (resid 128 and name he* ) (resid 129 and name hg12)  3.5  3.5  1.0
assign (resid 131 and name hg  ) (resid 132 and name hn  )  5.5  5.5  0.0
assign (resid 132 and name ha  ) (resid 133 and name hd1 )  5.5  5.5  0.0
assign (resid 133 and name hd1 ) (resid 134 and name hn  )  4.5  4.5  0.5
assign (resid 137 and name hg2*) (resid 138 and name hn  )  3.5  3.5  1.0
assign (resid 138 and name hg* ) (resid 139 and name hn  )  4.5  4.5  1.0
assign (resid 147 and name hg2*) (resid 148 and name hn  )  4.5  4.5  1.0
assign (resid 148 and name ha  ) (resid 149 and name hd* )  2.5  2.5  1.0
assign (resid 152 and name hg2*) (resid 153 and name hn  )  3.5  3.5  1.0
assign (resid 152 and name ha  ) (resid 153 and name he1 )  5.5  5.5  1.0 
assign (resid 154 and name hg2*) (resid 155 and name hn  )  3.5  3.5  1.0
assign (resid 154 and name hg2*) (resid 155 and name ha  )  5.5  5.5  1.0 
assign (resid 157 and name ha  ) (resid 158 and name hd1 )  3.5  3.5  0.0 
! intraresidue noes
assign (resid   3 and name ha  ) (resid   3 and name hd* )  2.5  2.5  1.0
assign (resid   3 and name hn  ) (resid   3 and name hd* )  4.5  4.5  0.0
assign (resid   3 and name hd* ) (resid   3 and name hb1 )  3.5  3.5  0.0 
assign (resid   3 and name hd* ) (resid   3 and name hb2 )  3.5  3.5  0.0 
assign (resid  19 and name ha  ) (resid  19 and name hd* )  2.5  2.5  0.5
assign (resid  29 and name hd* ) (resid  29 and name ha  )  3.5  3.5  0.0 
assign (resid  29 and name hd* ) (resid  29 and name hb* )  3.5  3.5  0.0 
assign (resid  30 and name hd* ) (resid  30 and name ha  )  3.5  3.5  0.0
assign (resid  30 and name hd* ) (resid  30 and name hb1 )  2.5  2.5  0.5
assign (resid  30 and name hd* ) (resid  30 and name hb2 )  2.5  2.5  0.5
assign (resid  35 and name hg* ) (resid  35 and name hn  )  3.5  3.5  0.0
assign (resid  35 and name hg* ) (resid  35 and name ha  )  3.5  3.5  0.0
assign (resid  39 and name hb* ) (resid  39 and name he* )  3.5  3.5  1.0
assign (resid  46 and name hd* ) (resid  46 and name ha  )  2.5  2.5  0.0 
assign (resid  46 and name hd* ) (resid  46 and name hb* )  3.5  3.5  0.0 
assign (resid  46 and name hn  ) (resid  46 and name hd* )  5.5  5.5  0.0
assign (resid  49 and name hd* ) (resid  49 and name ha  )  2.5  2.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name ha  )  3.5  3.5  0.0 
assign (resid  68 and name hd* ) (resid  68 and name hb1 )  2.5  2.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name hb2 )  3.5  3.5  0.5 
assign (resid  68 and name hd* ) (resid  68 and name hn  )  5.5  5.5  0.0
assign (resid  79 and name hg* ) (resid  79 and name hn  )  2.5  2.5  1.0
assign (resid  79 and name hg* ) (resid  79 and name ha  )  2.5  2.5  1.0 
assign (resid  83 and name hd* ) (resid  83 and name ha  )  3.5  3.5  0.0
assign (resid  83 and name hd* ) (resid  83 and name hn  )  4.5  4.5  0.0
assign (resid  85 and name hd* ) (resid  85 and name ha  )  3.5  3.5  0.0 
assign (resid  85 and name hd* ) (resid  85 and name hb* )  3.5  3.5  0.0 
assign (resid  85 and name hd* ) (resid  85 and name hn  )  4.5  4.5  0.5
assign (resid  85 and name he* ) (resid  85 and name ha  )  5.5  5.5  0.0 
assign (resid  94 and name hd* ) (resid  94 and name hn  )  5.5  5.5  0.0
assign (resid  94 and name hd* ) (resid  94 and name ha  )  3.5  3.5  0.0
assign (resid  95 and name hg* ) (resid  95 and name hn  )  4.5  4.5  0.0
assign (resid  95 and name hg* ) (resid  95 and name ha  )  4.5  4.5  0.0
assign (resid 102 and name hg1*) (resid 102 and name ha  )  3.5  3.5  0.0
assign (resid 103 and name hd* ) (resid 103 and name ha  )  4.5  4.5  0.0
assign (resid 106 and name hd* ) (resid 106 and name ha  )  3.5  3.5  0.0
assign (resid 106 and name hd* ) (resid 106 and name hn  )  3.5  3.5  0.5
assign (resid 106 and name he* ) (resid 106 and name hn  )  5.5  5.5  0.0
assign (resid 110 and name hg* ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name hg* ) (resid 110 and name ha  )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 115 and name ha  )  3.5  3.5  0.0
assign (resid 115 and name hg* ) (resid 115 and name hn  )  3.5  3.5  0.0
assign (resid 117 and name ha  ) (resid 118 and name hd1*)  4.5  4.5  1.0
assign (resid 122 and name hd* ) (resid 122 and name ha  )  3.5  3.5  0.0 
assign (resid 136 and name hd* ) (resid 136 and name ha  )  3.5  3.5  0.0 
assign (resid 136 and name hn  ) (resid 136 and name hd* )  4.5  4.5  0.0 
assign (resid 139 and name hg* ) (resid 139 and name hn  )  3.5  3.5  0.0 
assign (resid 155 and name hb1 ) (resid 155 and name hd* )  3.5  3.5  0.0 
assign (resid 155 and name hb2 ) (resid 155 and name hd* )  3.5  3.5  0.0 
assign (resid 155 and name hd* ) (resid 155 and name ha  )  3.5  3.5  0.0 
assign (resid 155 and name hd* ) (resid 155 and name hn  )  4.5  4.5  0.0 
assign (resid 157 and name hg* ) (resid 157 and name hn  )  3.5  3.5  0.0 
assign (resid 157 and name hg* ) (resid 157 and name ha  )  3.5  3.5  0.0 
assign (resid   1 and name hg2*) (resid   1 and name ha  )  3.5  3.5  0.0
assign (resid   2 and name hb* ) (resid   2 and name ha  )  2.5  2.5  1.0
assign (resid   3 and name hb1 ) (resid   3 and name hn  )  4.5  4.5  0.0
assign (resid   3 and name hb2 ) (resid   3 and name hn  )  3.5  3.5  0.0
assign (resid   4 and name ha  ) (resid   4 and name hd1*)  2.5  2.5  1.0 
assign (resid   4 and name ha  ) (resid   4 and name hd2*)  5.5  5.5  1.0 
assign (resid   4 and name ha  ) (resid   4 and name hg  )  4.5  4.5  0.0
assign (resid   4 and name hb1 ) (resid   4 and name hn  )  3.5  3.5  0.0
assign (resid   4 and name hb2 ) (resid   4 and name hn  )  4.5  4.5  0.0
assign (resid   4 and name hd2*) (resid   4 and name hb1 )  4.5  4.5  1.0
assign (resid   4 and name hd2*) (resid   4 and name hb2 )  4.5  4.5  1.0
assign (resid   5 and name hn  ) (resid   5 and name hb* )  4.5  4.5  0.0
assign (resid   5 and name hn  ) (resid   5 and name he3 )  3.5  3.5  0.0
assign (resid   5 and name ha  ) (resid   5 and name he3 )  5.5  5.5  0.0 
assign (resid   5 and name hd1 ) (resid   5 and name hb* )  3.5  3.5  1.0 
assign (resid   5 and name he3 ) (resid   5 and name hb* )  3.5  3.5  1.0 
assign (resid   6 and name hb* ) (resid   6 and name hn  )  3.5  3.5  1.0
assign (resid   7 and name ha  ) (resid   7 and name hn  )  3.5  3.5  0.0
assign (resid   7 and name hb1 ) (resid   7 and name hn  )  3.5  3.5  0.0
assign (resid   7 and name hb2 ) (resid   7 and name hn  )  5.5  5.5  0.0
assign (resid   7 and name hb* ) (resid   7 and name he2*)  4.5  4.5  2.0
assign (resid   8 and name hb1 ) (resid   8 and name hn  )  3.5  3.5  0.0
assign (resid   8 and name hb2 ) (resid   8 and name hn  )  5.5  5.5  0.0
assign (resid   9 and name hb1 ) (resid   9 and name hn  )  3.5  3.5  0.0
assign (resid   9 and name hb2 ) (resid   9 and name hn  )  4.5  4.5  0.0
assign (resid   9 and name hg* ) (resid   9 and name hn  )  3.5  3.5  1.0
assign (resid   9 and name hd* ) (resid   9 and name hn  )  5.5  5.5  1.0
assign (resid  10 and name hb1 ) (resid  10 and name hn  )  4.5  4.5  0.0
assign (resid  10 and name hb2 ) (resid  10 and name hn  )  2.5  2.5  0.5
assign (resid  12 and name hb1 ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hb2 ) (resid  12 and name hn  )  3.5  3.5  0.0
assign (resid  12 and name hd1*) (resid  12 and name ha  )  3.5  3.5  1.0
assign (resid  12 and name hd2*) (resid  12 and name ha  )  4.5  4.5  1.0
assign (resid  13 and name hg2*) (resid  13 and name ha  )  3.5  3.5  1.0
assign (resid  13 and name hd1*) (resid  13 and name hb  )  3.5  3.5  1.0
assign (resid  15 and name hb1 ) (resid  15 and name hn  )  3.5  3.5  0.0
assign (resid  15 and name hb2 ) (resid  15 and name hn  )  4.5  4.5  0.0
assign (resid  16 and name hb2 ) (resid  16 and name hn  )  3.5  3.5  0.0
assign (resid  16 and name hb1 ) (resid  16 and name hn  )  4.5  4.5  0.0
assign (resid  18 and name ha  ) (resid  18 and name hd2 )  5.5  5.5  0.0 
assign (resid  18 and name hb* ) (resid  18 and name hd2 )  4.5  4.5  1.0
assign (resid  19 and name ha  ) (resid  19 and name hg  )  2.5  2.5  0.5 
assign (resid  21 and name hb1 ) (resid  21 and name hn  )  4.5  4.5  0.0
assign (resid  21 and name hb2 ) (resid  21 and name hn  )  5.5  5.5  0.0
assign (resid  21 and name hd1 ) (resid  21 and name hb1 )  4.5  4.5  0.0 
assign (resid  21 and name hd1 ) (resid  21 and name hb2 )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid  21 and name hb1 )  3.5  3.5  0.0 
assign (resid  21 and name he3 ) (resid  21 and name hb2 )  4.5  4.5  0.0 
assign (resid  22 and name hb1 ) (resid  22 and name hn  )  3.5  3.5  0.0
assign (resid  22 and name hb2 ) (resid  22 and name hn  )  5.5  5.5  0.0
assign (resid  22 and name hb1 ) (resid  22 and name hd2 )  3.5  3.5  0.0 
assign (resid  22 and name hb2 ) (resid  22 and name hd2 )  4.5  4.5  0.0 
assign (resid  23 and name hb1 ) (resid  23 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hb2 ) (resid  23 and name hn  )  4.5  4.5  0.0
assign (resid  23 and name hd1*) (resid  23 and name ha  )  2.5  2.5  1.0
assign (resid  23 and name hd2*) (resid  23 and name ha  )  5.5  5.5  1.0
assign (resid  25 and name hb1 ) (resid  25 and name hn  )  4.5  4.5  0.0
assign (resid  25 and name hb2 ) (resid  25 and name hn  )  3.5  3.5  0.0
assign (resid  26 and name hb1 ) (resid  26 and name hn  )  2.5  2.5  0.5
assign (resid  26 and name hb2 ) (resid  26 and name hn  )  3.5  3.5  0.0
assign (resid  27 and name hb1 ) (resid  27 and name hn  )  4.5  4.5  0.0
assign (resid  27 and name hb2 ) (resid  27 and name hn  )  2.5  2.5  0.0
assign (resid  27 and name hd1*) (resid  27 and name ha  )  5.5  5.5  1.0
assign (resid  27 and name hd2*) (resid  27 and name ha  )  2.5  2.5  1.0
assign (resid  27 and name hd1*) (resid  27 and name hn  )  4.5  4.5  1.0
assign (resid  27 and name hd2*) (resid  27 and name hn  )  4.5  4.5  1.0
assign (resid  28 and name hb* ) (resid  28 and name hn  )  3.5  3.5  1.0
assign (resid  28 and name hd2 ) (resid  28 and name ha  )  5.5  5.5  0.0
assign (resid  28 and name hd2 ) (resid  28 and name hb* )  4.5  4.5  1.0
assign (resid  29 and name hb1 ) (resid  29 and name hn  )  4.5  4.5  0.0
assign (resid  29 and name hb2 ) (resid  29 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb1 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb2 ) (resid  30 and name hn  )  3.5  3.5  0.0
assign (resid  30 and name hb* ) (resid  30 and name hn  )  2.5  2.5  1.0
assign (resid  31 and name ha  ) (resid  31 and name hg* )  3.5  3.5  1.0
assign (resid  32 and name hb* ) (resid  32 and name ha  )  2.5  2.5  1.0
assign (resid  33 and name hb1 ) (resid  33 and name hn  )  4.5  4.5  0.0
assign (resid  33 and name hb2 ) (resid  33 and name hn  )  2.5  2.5  0.0
assign (resid  33 and name hg* ) (resid  33 and name hn  )  3.5  3.5  1.0
assign (resid  34 and name hb  ) (resid  34 and name hn  )  4.5  4.5  0.0
assign (resid  34 and name hg2*) (resid  34 and name hn  )  3.5  3.5  1.0
assign (resid  34 and name hg2*) (resid  34 and name ha  )  3.5  3.5  1.0
assign (resid  37 and name hb1 ) (resid  37 and name hn  )  4.5  4.5  0.0
assign (resid  37 and name hb2 ) (resid  37 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hb  ) (resid  38 and name hn  )  3.5  3.5  0.0
assign (resid  38 and name hg2*) (resid  38 and name hn  )  4.5  4.5  1.0
assign (resid  39 and name ha  ) (resid  39 and name hg* )  4.5  4.5  1.0
assign (resid  39 and name hb1 ) (resid  39 and name hn  )  4.5  4.5  0.0
assign (resid  39 and name hb2 ) (resid  39 and name hn  )  4.5  4.5  0.0
assign (resid  40 and name hb  ) (resid  40 and name hn  )  3.5  3.5  0.0
assign (resid  40 and name hg1*) (resid  40 and name hn  )  4.5  4.5  1.0
assign (resid  40 and name hg2*) (resid  40 and name hn  )  3.5  3.5  1.0
assign (resid  40 and name hg1*) (resid  40 and name ha  )  3.5  3.5  1.0
assign (resid  40 and name hg2*) (resid  40 and name ha  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  41 and name hn  )  4.5  4.5  1.0
assign (resid  41 and name hg2*) (resid  41 and name hn  )  3.5  3.5  1.0
assign (resid  41 and name hg1*) (resid  41 and name ha  )  2.5  2.5  1.0
assign (resid  41 and name hg2*) (resid  41 and name ha  )  4.5  4.5  1.0
assign (resid  43 and name hb1 ) (resid  43 and name hn  )  3.5  3.5  0.5
assign (resid  43 and name hb2 ) (resid  43 and name hn  )  5.5  5.5  0.0
assign (resid  44 and name hb* ) (resid  44 and name hn  )  3.5  3.5  1.0
assign (resid  44 and name hn  ) (resid  44 and name hd* )  5.5  5.5  0.0
assign (resid  45 and name hb  ) (resid  45 and name hn  )  3.5  3.5  0.0
assign (resid  45 and name hg2*) (resid  45 and name ha  )  3.5  3.5  1.0
assign (resid  46 and name hb* ) (resid  46 and name hn  )  3.5  3.5  1.0
assign (resid  47 and name hb1 ) (resid  47 and name hn  )  4.5  4.5  0.0
assign (resid  47 and name hb2 ) (resid  47 and name hn  )  2.5  2.5  0.0
assign (resid  48 and name hb* ) (resid  48 and name hn  )  3.5  3.5  1.0
assign (resid  49 and name hb* ) (resid  49 and name hn  )  3.5  3.5  1.0
assign (resid  51 and name hb* ) (resid  51 and name hn  )  3.5  3.5  1.0
assign (resid  52 and name hb* ) (resid  52 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hb1 ) (resid  54 and name hn  )  4.5  4.5  0.0
assign (resid  54 and name hb2 ) (resid  54 and name hn  )  3.5  3.5  0.0
assign (resid  54 and name hd1*) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hd2*) (resid  54 and name hn  )  4.5  4.5  1.0
assign (resid  54 and name hd1*) (resid  54 and name ha  )  4.5  4.5  1.0
assign (resid  54 and name hd2*) (resid  54 and name ha  )  3.5  3.5  1.0
assign (resid  56 and name hb* ) (resid  56 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name hb1 ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name hb2 ) (resid  57 and name hn  )  4.5  4.5  1.0
assign (resid  57 and name he  ) (resid  57 and name hn  )  4.5  4.5  0.5
assign (resid  58 and name hb  ) (resid  58 and name hn  )  4.5  4.5  0.0
assign (resid  58 and name hg2*) (resid  58 and name ha  )  2.5  2.5  1.0
assign (resid  58 and name hg2*) (resid  58 and name hn  )  4.5  4.5  1.0
assign (resid  59 and name hb2 ) (resid  59 and name hn  )  3.5  3.5  0.0
assign (resid  59 and name hb1 ) (resid  59 and name hn  )  4.5  4.5  0.0
assign (resid  59 and name hn  ) (resid  59 and name hd2*)  3.5  3.5  1.0
assign (resid  59 and name hd2*) (resid  59 and name ha  )  4.5  4.5  1.0
assign (resid  60 and name hn  ) (resid  60 and name hb  )  3.5  3.5  0.0
assign (resid  60 and name hn  ) (resid  60 and name hg1*)  4.5  4.5  1.0
assign (resid  60 and name hn  ) (resid  60 and name hg2*)  3.5  3.5  1.0
assign (resid  60 and name hg1*) (resid  60 and name ha  )  4.5  4.5  1.0
assign (resid  60 and name hg2*) (resid  60 and name ha  )  3.5  3.5  1.0
assign (resid  61 and name hn  ) (resid  61 and name hb  )  3.5  3.5  0.0
assign (resid  61 and name hn  ) (resid  61 and name hg1*)  4.5  4.5  1.0
assign (resid  61 and name hn  ) (resid  61 and name hg2*)  3.5  3.5  1.0
assign (resid  61 and name hg1*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  61 and name hg2*) (resid  61 and name ha  )  3.5  3.5  1.0
assign (resid  62 and name hb1 ) (resid  62 and name ha  )  3.5  3.5  0.0
assign (resid  62 and name hb2 ) (resid  62 and name ha  )  2.5  2.5  0.5
assign (resid  62 and name hb1 ) (resid  62 and name hn  )  3.5  3.5  0.0
assign (resid  62 and name hb2 ) (resid  62 and name hn  )  3.5  3.5  0.0
assign (resid  62 and name hd1*) (resid  62 and name ha  )  2.5  2.5  1.0
assign (resid  62 and name hd2*) (resid  62 and name ha  )  4.5  4.5  1.0
assign (resid  63 and name hb  ) (resid  63 and name hn  )  5.5  5.5  0.0
assign (resid  63 and name hg2*) (resid  63 and name hn  )  3.5  3.5  1.0
assign (resid  63 and name hg2*) (resid  63 and name ha  )  3.5  3.5  1.0
assign (resid  64 and name ha  ) (resid  64 and name hd2 )  4.5  4.5  0.0
assign (resid  64 and name hb1 ) (resid  64 and name hd2 )  4.5  4.5  0.0 
assign (resid  64 and name hb2 ) (resid  64 and name hd2 )  4.5  4.5  0.0 
assign (resid  65 and name ha  ) (resid  65 and name hg* )  5.5  5.5  1.0
assign (resid  65 and name he2*) (resid  65 and name hg* )  3.5  3.5  2.0
assign (resid  66 and name hb* ) (resid  66 and name hn  )  2.5  2.5  1.0
assign (resid  66 and name hg* ) (resid  66 and name hn  )  3.5  3.5  1.0
assign (resid  67 and name hb1 ) (resid  67 and name hn  )  4.5  4.5  0.0
assign (resid  67 and name hb2 ) (resid  67 and name hn  )  3.5  3.5  0.0
assign (resid  68 and name hb1 ) (resid  68 and name hn  )  3.5  3.5  0.0
assign (resid  68 and name hb2 ) (resid  68 and name hn  )  2.5  2.5  0.5
assign (resid  69 and name hb1 ) (resid  69 and name hn  )  4.5  4.5  0.0
assign (resid  69 and name hb2 ) (resid  69 and name hn  )  2.5  2.5  0.5
assign (resid  69 and name hg* ) (resid  69 and name hn  )  3.5  3.5  1.0
assign (resid  69 and name hg* ) (resid  69 and name he2*)  3.5  3.5  2.0
assign (resid  70 and name hb* ) (resid  70 and name ha  )  3.5  3.5  1.0
assign (resid  73 and name hb* ) (resid  73 and name ha  )  2.5  2.5  1.0
assign (resid  74 and name hb  ) (resid  74 and name hn  )  3.5  3.5  0.0
assign (resid  74 and name hg1*) (resid  74 and name hn  )  4.5  4.5  1.0
assign (resid  74 and name hg2*) (resid  74 and name hn  )  3.5  3.5  1.0
assign (resid  74 and name hg1*) (resid  74 and name ha  )  3.5  3.5  1.0
assign (resid  74 and name hg2*) (resid  74 and name ha  )  3.5  3.5  1.0
assign (resid  75 and name hb  ) (resid  75 and name hn  )  3.5  3.5  0.0
assign (resid  75 and name hg1*) (resid  75 and name hn  )  5.5  5.5  0.0
assign (resid  75 and name hg2*) (resid  75 and name hn  )  3.5  3.5  1.0
assign (resid  75 and name hg2*) (resid  75 and name ha  )  3.5  3.5  1.0
assign (resid  76 and name hb  ) (resid  76 and name hn  )  5.5  5.5  0.0
assign (resid  76 and name hg1*) (resid  76 and name hn  )  4.5  4.5  1.0
assign (resid  76 and name hg2*) (resid  76 and name hn  )  3.5  3.5  1.0
assign (resid  76 and name hg1*) (resid  76 and name ha  )  2.5  2.5  1.0
assign (resid  76 and name hg2*) (resid  76 and name ha  )  5.5  5.5  0.0
assign (resid  77 and name hb1 ) (resid  77 and name hn  )  4.5  4.5  0.0
assign (resid  77 and name hb2 ) (resid  77 and name hn  )  3.5  3.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name ha  )  4.5  4.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name hb1 )  5.5  5.5  0.0
assign (resid  77 and name hd2 ) (resid  77 and name hb2 )  3.5  3.5  0.0
assign (resid  78 and name hb* ) (resid  78 and name hn  )  4.5  4.5  1.0
assign (resid  79 and name ha  ) (resid  79 and name hb  )  3.5  3.5  0.0
assign (resid  79 and name hb  ) (resid  79 and name hn  )  3.5  3.5  0.0
assign (resid  80 and name hb* ) (resid  80 and name ha  )  2.5  2.5  1.0
assign (resid  81 and name hb* ) (resid  81 and name ha  )  2.5  2.5  1.0
assign (resid  82 and name hb  ) (resid  82 and name hn  )  3.5  3.5  0.0
assign (resid  82 and name hg1*) (resid  82 and name hn  )  4.5  4.5  1.0
assign (resid  82 and name hg2*) (resid  82 and name hn  )  2.5  2.5  1.0
assign (resid  82 and name hg1*) (resid  82 and name ha  )  2.5  2.5  1.0 
assign (resid  82 and name hg2*) (resid  82 and name ha  )  2.5  2.5  1.0 
assign (resid  83 and name hb1 ) (resid  83 and name hn  )  4.5  4.5  0.0
assign (resid  83 and name hb2 ) (resid  83 and name hn  )  2.5  2.5  0.0
assign (resid  84 and name hb* ) (resid  84 and name ha  )  2.5  2.5  1.0
assign (resid  85 and name hb1 ) (resid  85 and name hn  )  4.0  4.0  0.0
assign (resid  85 and name hb2 ) (resid  85 and name hn  )  3.5  3.5  0.0
assign (resid  86 and name hb* ) (resid  86 and name ha  )  3.5  3.5  1.0
assign (resid  87 and name hb* ) (resid  87 and name ha  )  2.5  2.5  1.0
assign (resid  87 and name hg* ) (resid  87 and name ha  )  4.5  4.5  1.0
assign (resid  88 and name hb* ) (resid  88 and name ha  )  2.5  2.5  1.0
assign (resid  88 and name he2*) (resid  88 and name hg* )  3.5  3.5  2.0
assign (resid  88 and name he2*) (resid  88 and name ha  )  4.5  4.5  1.0
assign (resid  89 and name hb1 ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid  89 and name hb2 ) (resid  89 and name hn  )  3.5  3.5  0.0
assign (resid  89 and name hd2 ) (resid  89 and name ha  )  3.5  3.5  0.0
assign (resid  89 and name hd2 ) (resid  89 and name hn  )  4.5  4.5  0.0
assign (resid  89 and name hb1 ) (resid  89 and name hd2 )  3.5  3.5  0.5 
assign (resid  89 and name hb2 ) (resid  89 and name hd2 )  5.5  5.5  0.0 
assign (resid  91 and name hb* ) (resid  91 and name hn  )  3.5  3.5  1.0
assign (resid  92 and name hb1 ) (resid  92 and name hn  )  4.5  4.5  0.0
assign (resid  92 and name hb2 ) (resid  92 and name hn  )  2.5  2.5  0.0
assign (resid  92 and name hg* ) (resid  92 and name he2*)  3.5  3.5  2.0
assign (resid  93 and name hb1 ) (resid  93 and name hn  )  4.5  4.5  0.0
assign (resid  93 and name hb2 ) (resid  93 and name hn  )  3.5  3.5  0.0
assign (resid  94 and name hb* ) (resid  94 and name hn  )  2.5  2.5  1.0
assign (resid  95 and name hb  ) (resid  95 and name hn  )  3.5  3.5  0.0
assign (resid  96 and name hn  ) (resid  96 and name hd1*)  3.5  3.5  1.0
assign (resid  96 and name hb  ) (resid  96 and name hd1*)  3.5  3.5  1.0
assign (resid  96 and name hd1*) (resid  96 and name ha  )  2.5  2.5  1.0
assign (resid  96 and name hg2*) (resid  96 and name ha  )  3.5  3.5  1.0
assign (resid  96 and name hn  ) (resid  96 and name hb  )  3.5  3.5  0.0
assign (resid  96 and name hn  ) (resid  96 and name hg1*)  3.5  3.5  1.0
assign (resid  96 and name hn  ) (resid  96 and name hg2*)  4.5  4.5  1.0
assign (resid  97 and name hn  ) (resid  97 and name hb* )  3.5  3.5  1.0
assign (resid 101 and name hb1 ) (resid 101 and name hn  )  4.5  4.5  0.0
assign (resid 101 and name hb2 ) (resid 101 and name hn  )  3.5  3.5  0.0
assign (resid 101 and name hg1 ) (resid 101 and name he2*)  3.5  3.5  1.0
assign (resid 101 and name hg2 ) (resid 101 and name he2*)  3.5  3.5  1.0
assign (resid 102 and name hb  ) (resid 102 and name hn  )  3.5  3.5  0.0
assign (resid 102 and name hg* ) (resid 102 and name hn  )  3.5  3.5  1.0
assign (resid 102 and name hn  ) (resid 102 and name hd1*)  4.5  4.5  1.0
assign (resid 103 and name hb1 ) (resid 103 and name hn  )  4.5  4.5  0.0
assign (resid 103 and name hb2 ) (resid 103 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hb  ) (resid 104 and name hn  )  3.5  3.5  0.0
assign (resid 104 and name hg2*) (resid 104 and name ha  )  3.5  3.5  1.0
assign (resid 104 and name hg2*) (resid 104 and name hn  )  4.5  4.5  1.0
assign (resid 105 and name hb* ) (resid 105 and name hn  )  2.5  2.5  1.0
assign (resid 106 and name hb1 ) (resid 106 and name hn  )  4.5  4.5  0.0
assign (resid 106 and name hb2 ) (resid 106 and name hn  )  2.5  2.5  0.5
assign (resid 107 and name hb* ) (resid 107 and name hn  )  3.5  3.5  1.0
assign (resid 107 and name hg* ) (resid 107 and name hn  )  3.5  3.5  1.0
assign (resid 107 and name hd* ) (resid 107 and name hn  )  4.5  4.5  1.0
assign (resid 108 and name hb1 ) (resid 108 and name hn  )  3.5  3.5  0.0
assign (resid 108 and name hb2 ) (resid 108 and name hn  )  3.5  3.5  0.0
assign (resid 109 and name hb1 ) (resid 109 and name hn  )  4.5  4.5  0.0
assign (resid 109 and name hb2 ) (resid 109 and name hn  )  3.5  3.5  0.0
assign (resid 110 and name ha  ) (resid 110 and name hg2*)  3.5  3.5  0.0
assign (resid 110 and name hb  ) (resid 110 and name hn  )  3.5  3.5  0.0
assign (resid 111 and name hb1 ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 111 and name hb2 ) (resid 111 and name hn  )  4.5  4.5  0.0
assign (resid 112 and name hb  ) (resid 112 and name hn  )  3.5  3.5  0.0
assign (resid 112 and name hg2*) (resid 112 and name hn  )  4.5  4.5  1.0
assign (resid 112 and name hg2*) (resid 112 and name ha  )  2.5  2.5  1.0
assign (resid 113 and name hb* ) (resid 113 and name hn  )  3.5  3.5  1.0
assign (resid 113 and name hd1*) (resid 113 and name ha  )  4.5  4.5  1.0
assign (resid 113 and name hd2*) (resid 113 and name ha  )  3.5  3.5  0.0
assign (resid 113 and name hd1*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 113 and name hd2*) (resid 113 and name hn  )  4.5  4.5  1.0
assign (resid 113 and name hg  ) (resid 113 and name hn  )  3.5  3.5  0.0
assign (resid 114 and name hb1 ) (resid 114 and name hn  )  4.5  4.5  0.0
assign (resid 114 and name hb2 ) (resid 114 and name hn  )  3.5  3.5  0.0
assign (resid 114 and name hg  ) (resid 114 and name hn  )  3.5  3.5  0.5
assign (resid 114 and name hg  ) (resid 114 and name ha  )  3.5  3.5  0.0
assign (resid 114 and name hd1*) (resid 114 and name ha  )  5.5  5.5  1.0
assign (resid 114 and name hd2*) (resid 114 and name ha  )  3.5  3.5  1.0
assign (resid 114 and name hd1*) (resid 114 and name hn  )  4.5  4.5  1.0
assign (resid 114 and name hd2*) (resid 114 and name hn  )  4.5  4.5  1.0
assign (resid 114 and name hd1*) (resid 114 and name hb1 )  3.5  3.5  0.5 
assign (resid 114 and name hd2*) (resid 114 and name hb1 )  3.5  3.5  0.5
assign (resid 114 and name hd1*) (resid 114 and name hb2 )  3.5  3.5  0.5 
assign (resid 114 and name hd2*) (resid 114 and name hb2 )  5.5  5.5  0.5
assign (resid 116 and name hb  ) (resid 116 and name hn  )  3.5  3.5  0.0
assign (resid 116 and name hg2*) (resid 116 and name hn  )  4.5  4.5  1.0
assign (resid 116 and name hg2*) (resid 116 and name ha  )  2.5  2.5  1.0
assign (resid 116 and name hg2*) (resid 116 and name hg1 )  2.5  2.5  1.0
assign (resid 117 and name hb1 ) (resid 117 and name hn  )  4.5  4.5  0.0
assign (resid 117 and name hb2 ) (resid 117 and name hn  )  4.5  4.5  0.0
assign (resid 118 and name hb1 ) (resid 118 and name hn  )  4.5  4.5  0.0
assign (resid 118 and name hb2 ) (resid 118 and name hn  )  3.5  3.5  0.0
assign (resid 118 and name hd1*) (resid 118 and name ha  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 118 and name ha  )  4.5  4.5  1.0
assign (resid 118 and name hd1*) (resid 118 and name hb1 )  4.5  4.5  1.0
assign (resid 118 and name hd2*) (resid 118 and name hb1 )  4.5  4.5  1.0
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assign (resid 118 and name hd2*) (resid 118 and name hb2 )  3.5  3.5  1.0
assign (resid 118 and name hd1*) (resid 118 and name hn  )  3.5  3.5  1.0
assign (resid 118 and name hd2*) (resid 118 and name hn  )  5.5  5.5  0.0 
assign (resid 119 and name hb* ) (resid 119 and name ha  )  2.5  2.5  1.0 
assign (resid 121 and name hb* ) (resid 121 and name hn  )  3.5  3.5  1.0 
assign (resid 122 and name hb1 ) (resid 122 and name hn  )  4.5  4.5  0.0
assign (resid 122 and name hb2 ) (resid 122 and name hn  )  3.5  3.5  0.0
assign (resid 123 and name hb* ) (resid 123 and name hn  )  3.5  3.5  1.0 
assign (resid 123 and name hg* ) (resid 123 and name hn  )  4.5  4.5  1.0 
assign (resid 125 and name hb1 ) (resid 125 and name hn  )  4.5  4.5  0.0 
assign (resid 125 and name hb2 ) (resid 125 and name hn  )  4.5  4.5  0.0 
assign (resid 126 and name hb  ) (resid 126 and name hn  )  3.5  3.5  0.0
assign (resid 126 and name hg2*) (resid 126 and name ha  )  2.5  2.5  1.0
assign (resid 126 and name hg2*) (resid 126 and name hn  )  4.5  4.5  1.0
assign (resid 127 and name hb1 ) (resid 127 and name hn  )  4.5  4.5  0.0 
assign (resid 127 and name hb2 ) (resid 127 and name hn  )  3.5  3.5  0.0 
assign (resid 128 and name hb1 ) (resid 128 and name hn  )  3.5  3.5  0.0 
assign (resid 128 and name hb2 ) (resid 128 and name hn  )  3.5  3.5  0.0 
assign (resid 128 and name he* ) (resid 128 and name ha  )  4.5  4.5  1.0 
assign (resid 129 and name hb  ) (resid 129 and name hn  )  4.5  4.5  0.0 
assign (resid 129 and name hg1*) (resid 129 and name hn  )  2.5  2.5  1.0 
assign (resid 129 and name hg2*) (resid 129 and name hn  )  3.5  3.5  1.0 
assign (resid 129 and name hg2*) (resid 129 and name ha  )  3.5  3.5  1.0 
assign (resid 131 and name hb1 ) (resid 131 and name hn  )  4.5  4.5  0.0 
assign (resid 131 and name hb2 ) (resid 131 and name hn  )  2.5  2.5  0.0 
assign (resid 131 and name hg  ) (resid 131 and name hn  )  3.5  3.5  0.0 
assign (resid 131 and name hd1*) (resid 131 and name hn  )  4.5  4.5  1.0 
assign (resid 131 and name hd2*) (resid 131 and name ha  )  4.5  4.5  1.0 
assign (resid 132 and name hb1 ) (resid 132 and name hn  )  3.5  3.5  0.0 
assign (resid 132 and name hb2 ) (resid 132 and name hn  )  3.5  3.5  0.0 
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assign (resid 133 and name hb2 ) (resid 133 and name hn  )  3.5  3.5  0.0 
assign (resid 133 and name hd1 ) (resid 133 and name hn  )  2.5  2.5  0.0 
assign (resid 133 and name hd1 ) (resid 133 and name ha  )  4.5  4.5  0.0 
assign (resid 133 and name he3 ) (resid 133 and name ha  )  4.5  4.5  0.0
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assign (resid 133 and name hd1 ) (resid 133 and name hb1 )  5.5  5.5  0.0 
assign (resid 133 and name hd1 ) (resid 133 and name hb2 )  3.5  3.5  0.0
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assign (resid 134 and name hb2 ) (resid 134 and name hn  )  2.5  2.5  0.0 
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assign (resid 136 and name hb2 ) (resid 136 and name hn  )  3.5  3.5  0.0 
assign (resid 137 and name hg2*) (resid 137 and name hn  )  4.5  4.5  1.0 
assign (resid 137 and name hg2*) (resid 137 and name ha  )  3.5  3.5  1.0 
assign (resid 137 and name hn  ) (resid 137 and name hb  )  3.5  3.5  0.0 
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assign (resid 138 and name hb2 ) (resid 138 and name hn  )  3.5  3.5  0.0 
assign (resid 138 and name hg1 ) (resid 138 and name hn  )  5.5  5.5  0.0 
assign (resid 138 and name hg2 ) (resid 138 and name hn  )  5.5  5.5  0.0 
assign (resid 139 and name hb  ) (resid 139 and name hn  )  4.5  4.5  0.0 
assign (resid 140 and name hb* ) (resid 140 and name hn  )  4.5  4.5  1.0 
assign (resid 141 and name hb1 ) (resid 141 and name hn  )  3.5  3.5  0.0 
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assign (resid 141 and name hb1 ) (resid 141 and name ha  )  3.5  3.5  0.0 
assign (resid 141 and name hb2 ) (resid 141 and name ha  )  3.5  3.5  0.0 
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assign (resid 142 and name hg* ) (resid 142 and name hn  )  4.5  4.5  1.0 
assign (resid 143 and name hb  ) (resid 143 and name hn  )  3.5  3.5  0.0 
assign (resid 143 and name hg2*) (resid 143 and name ha  )  2.5  2.5  1.0 
assign (resid 143 and name hg2*) (resid 143 and name hn  )  4.5  4.5  1.0 
assign (resid 144 and name hb  ) (resid 144 and name hn  )  3.5  3.5  0.0 
assign (resid 144 and name hb  ) (resid 144 and name ha  )  3.5  3.5  0.0 
assign (resid 144 and name hg1*) (resid 144 and name ha  )  4.5  4.5  1.0 
assign (resid 144 and name hg2*) (resid 144 and name ha  )  2.5  2.5  1.0 
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assign (resid 145 and name hg* ) (resid 145 and name hn  )  3.5  3.5  1.0 
assign (resid 146 and name hb1 ) (resid 146 and name hn  )  3.5  3.5  0.0 
assign (resid 146 and name hb2 ) (resid 146 and name hn  )  3.5  3.5  0.0 
assign (resid 146 and name hb2 ) (resid 146 and name ha  )  3.5  3.5  0.0 
assign (resid 147 and name hb  ) (resid 147 and name hn  )  3.5  3.5  1.0 
assign (resid 147 and name hg2*) (resid 147 and name hn  )  3.5  3.5  1.0 
assign (resid 147 and name hg2*) (resid 147 and name ha  )  3.5  3.5  1.0 
assign (resid 148 and name hb1 ) (resid 148 and name hn  )  3.5  3.5  0.0 
assign (resid 148 and name hb2 ) (resid 148 and name hn  )  3.5  3.5  0.0 
assign (resid 148 and name hb1 ) (resid 148 and name hd2*)  4.5  4.5  1.0 
assign (resid 148 and name hb2 ) (resid 148 and name hd2*)  2.5  2.5  1.0 
assign (resid 148 and name hb1 ) (resid 148 and name ha  )  3.5  3.5  0.0 
assign (resid 148 and name hb2 ) (resid 148 and name ha  )  3.5  3.5  0.0 
assign (resid 150 and name hb* ) (resid 150 and name ha  )  2.5  2.5  1.0 
assign (resid 151 and name hb1 ) (resid 151 and name hn  )  4.5  4.5  0.0 
assign (resid 151 and name hb2 ) (resid 151 and name hn  )  3.5  3.5  0.0 
assign (resid 151 and name hg  ) (resid 151 and name hn  )  3.5  3.5  0.0 
assign (resid 151 and name hd1*) (resid 151 and name hn  )  4.5  4.5  1.0 
assign (resid 151 and name hd2*) (resid 151 and name hn  )  4.5  4.5  1.0 
assign (resid 151 and name hd1*) (resid 151 and name ha  )  5.5  5.5  1.0 
assign (resid 151 and name hd2*) (resid 151 and name ha  )  2.5  2.5  1.0 
assign (resid 152 and name hb  ) (resid 152 and name hn  )  4.5  4.5  0.0 
assign (resid 152 and name hg2*) (resid 152 and name hn  )  4.5  4.5  1.0 
assign (resid 152 and name hg2*) (resid 152 and name ha  )  3.5  3.5  1.0 
assign (resid 153 and name hb1 ) (resid 153 and name hn  )  4.5  4.5  0.0 
assign (resid 153 and name hb2 ) (resid 153 and name hn  )  4.5  4.5  0.0 
assign (resid 153 and name hd2 ) (resid 153 and name hb* )  4.5  4.5  1.0 
assign (resid 153 and name hb1 ) (resid 153 and name ha  )  2.5  2.5  0.5 
assign (resid 153 and name hb2 ) (resid 153 and name ha  )  2.5  2.5  0.5 
assign (resid 154 and name hb  ) (resid 154 and name hn  )  3.5  3.5  0.0 
assign (resid 154 and name hg2*) (resid 154 and name hn  )  5.5  5.5  0.0 
assign (resid 154 and name hg2*) (resid 154 and name ha  )  2.5  2.5  1.0 
assign (resid 155 and name hb1 ) (resid 155 and name hn  )  4.5  4.5  0.0 
assign (resid 155 and name hb2 ) (resid 155 and name hn  )  3.5  3.5  0.0 
assign (resid 156 and name hn  ) (resid 156 and name hg* )  4.5  4.5  1.0 
assign (resid 156 and name hb1 ) (resid 156 and name hn  )  4.5  4.5  0.0 
assign (resid 156 and name hb2 ) (resid 156 and name hn  )  5.5  5.5  0.0 
assign (resid 157 and name hb  ) (resid 157 and name hn  )  3.5  3.5  0.0 
assign (resid 158 and name hn  ) (resid 158 and name hd1 )  3.5  3.5  0.0 
assign (resid 158 and name ha  ) (resid 158 and name hd1 )  5.5  5.5  0.0 
assign (resid 158 and name hb1 ) (resid 158 and name hn  )  4.5  4.5  0.0 
assign (resid 158 and name hb2 ) (resid 158 and name hn  )  3.5  3.5  0.0 
assign (resid 158 and name hb1 ) (resid 158 and name ha  )  3.5  3.5  0.0 
assign (resid 158 and name hb2 ) (resid 158 and name ha  )  4.5  4.5  0.0 
assign (resid 158 and name hd1 ) (resid 158 and name hb1 )  5.5  5.5  0.0 
assign (resid 158 and name hd1 ) (resid 158 and name hb2 )  3.5  3.5  0.0  
assign (resid 159 and name hb1 ) (resid 159 and name hn  )  4.5  4.5  0.0 
assign (resid 159 and name hb2 ) (resid 159 and name hn  )  3.5  3.5  0.0 
assign (resid 159 and name hb1 ) (resid 159 and name ha  )  3.5  3.5  0.0 
assign (resid 159 and name hb2 ) (resid 159 and name ha  )  3.5  3.5  0.0 
assign (resid 159 and name hg* ) (resid 159 and name he2*)  3.5  3.5  2.0 
assign (resid 160 and name hb* ) (resid 160 and name hn  )  3.5  3.5  1.0 
!intra-tmq noes 
assign (resid 170 and name hm* ) (resid 170 and name h91 )  2.5  2.5  0.5
assign (resid 170 and name hm* ) (resid 170 and name h92 )  2.5  2.5  0.5
assign (resid 170 and name h7  ) (resid 170 and name h91 )  4.5  4.5  0.0
assign (resid 170 and name h7  ) (resid 170 and name h92 )  4.5  4.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h91 )  5.5  5.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h92 )  3.5  3.5  0.0
assign (resid 170 and name hp2 ) (resid 170 and name h7  )  3.5  3.5  0.5
assign (resid 170 and name hp2 ) (resid 170 and name hm* )  5.5  5.5  1.0
assign (resid 170 and name hp6 ) (resid 170 and name h1n )  3.5  3.5  0.0
assign (resid 170 and name hw2*) (resid 170 and name h1n )  5.5  5.5  0.0
assign (resid 170 and name h91 ) (resid 170 and name h1n )  2.5  2.5  0.0
assign (resid 170 and name h92 ) (resid 170 and name h1n )  3.5  3.5  0.0
!tmq-dhfr noes 
assign (resid 170 and name h1  ) (resid   6 and name hb* )  2.5  2.5  1.0
assign (resid 170 and name h1  ) (resid  26 and name ha  )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  26 and name hb1 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  26 and name hb2 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  27 and name ha  )  3.5  3.5  1.5
assign (resid 170 and name h1  ) (resid  27 and name hd2*)  3.5  3.5  1.0
assign (resid 170 and name h1  ) (resid  29 and name hb1 )  5.5  5.5  1.0
assign (resid 170 and name h1  ) (resid  30 and name ha  )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  30 and name hb1 )  5.5  5.5  1.5
assign (resid 170 and name h1  ) (resid  30 and name hb2 )  5.5  3.5  1.0
assign (resid 170 and name h1  ) (resid  30 and name hd* )  4.5  4.5  1.0
assign (resid 170 and name h1  ) (resid 116 and name hg1 )  5.5  5.5  1.0
assign (resid 170 and name hn2*) (resid   4 and name hg  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid   4 and name hd1*)  3.5  3.5  1.0
assign (resid 170 and name hn2*) (resid   5 and name ha  )  5.5  1.0  1.0
assign (resid 170 and name hn2*) (resid   5 and name hn  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid   6 and name hb* )  3.5  3.5  1.0
assign (resid 170 and name hn2*) (resid  29 and name hd* )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid  29 and name he* )  5.5  5.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hb  )  4.5  4.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hg1 )  2.5  2.5  1.0
assign (resid 170 and name hn2*) (resid 116 and name hg2*)  4.5  4.5  1.0
assign (resid 170 and name hn4*) (resid   4 and name hg  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid   5 and name ha  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid   5 and name hb* )  5.5  5.5  1.0
assign (resid 170 and name hn4*) (resid  30 and name he* )  3.5  3.5  1.0
assign (resid 170 and name hn4*) (resid  97 and name ha  )  2.5  2.5  1.0
assign (resid 170 and name hn4*) (resid  97 and name hb* )  3.5  3.5  1.0
assign (resid 170 and name hm* ) (resid  30 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  30 and name he* )  3.5  3.5  0.0
assign (resid 170 and name hm* ) (resid  30 and name hz  )  5.5  5.5  0.5
assign (resid 170 and name hm* ) (resid  41 and name hg1*)  5.5  5.5  1.0
assign (resid 170 and name hm* ) (resid  45 and name hg2*)  2.5  2.5  0.5
assign (resid 170 and name hm* ) (resid  49 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  49 and name he* )  3.5  3.5  0.5
assign (resid 170 and name hm* ) (resid  49 and name hz  )  3.5  3.5  0.5
assign (resid 170 and name hm* ) (resid  97 and name ha  )  5.5  5.5  0.0
assign (resid 170 and name hm* ) (resid  97 and name hb* )  2.5  2.5  0.5
assign (resid 170 and name h7  ) (resid  19 and name hg  )  5.5  5.5  0.0
assign (resid 170 and name h7  ) (resid  19 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name h7  ) (resid  27 and name hg  )  5.5  1.0  2.0
assign (resid 170 and name h7  ) (resid  27 and name hd2*)  2.5  2.5  1.0
assign (resid 170 and name h8  ) (resid   6 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name h8  ) (resid  19 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name h8  ) (resid  27 and name ha  )  4.5  4.5  0.0
assign (resid 170 and name h8  ) (resid  27 and name hg  )  5.5  1.5  0.5
assign (resid 170 and name h8  ) (resid  27 and name hd2*)  3.5  3.5  0.0
assign (resid 170 and name h9* ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name h9* ) (resid  45 and name hg2*)  5.5  5.5  0.0
assign (resid 170 and name h9* ) (resid  49 and name he* )  3.5  3.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hg  )  4.5  4.5  0.0
assign (resid 170 and name h1n ) (resid  19 and name hd* )  5.5  5.5  0.0
assign (resid 170 and name hp2 ) (resid  49 and name hd* )  4.5  4.5  0.0
assign (resid 170 and name hp2 ) (resid  49 and name he* )  3.5  3.5  0.0
assign (resid 170 and name hp6 ) (resid  19 and name hg  )  5.5  5.5  0.0
assign (resid 170 and name hp6 ) (resid  19 and name hd* )  3.5  3.5  1.0
assign (resid 170 and name hp6 ) (resid  19 and name hb* )  5.5  5.5  0.0
assign (resid 170 and name hp6 ) (resid  27 and name hd2*)  5.5  5.5  0.5
assign (resid 170 and name hw1*) (resid  27 and name hd2*)  4.5  4.5  0.0
assign (resid 170 and name hw1*) (resid  30 and name hd* )  3.5  3.5  0.0
assign (resid 170 and name hw1*) (resid  30 and name he* )  5.5  5.5  0.0
assign (resid 170 and name hw1*) (resid  49 and name he* )  4.5  4.5  0.0
assign (resid 170 and name hw1*) (resid  54 and name hd1*)  3.5  3.5  0.0
assign (resid 170 and name hw1*) (resid  54 and name hd2*)  5.5  5.5  0.0
assign (resid 170 and name hw2*) (resid  18 and name he1 )  5.5  5.5  1.0
assign (resid 170 and name hw2*) (resid  27 and name hd1*)  3.5  3.5  0.0
assign (resid 170 and name hw2*) (resid  27 and name hd2*)  5.5  5.5  0.0
assign (resid 170 and name hw2*) (resid  50 and name hg* )  5.5  5.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hb1 )  2.5  2.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hd1*)  2.5  2.5  1.0
assign (resid 170 and name hi* ) (resid  27 and name hd2*)  3.5  3.5  1.0
!Constraints for Asp-26 - TMQ interaction
assign (resid 170 and name h1 )   (resid  26 and name od1)  2.00  0.40  0.40
assign (resid 170 and name n1)    (resid  26 and name od1)  3.00  0.40  0.40
assign (resid 170 and name hn2*)  (resid  26 and name od2)  2.00  0.40  0.40
assign (resid 170 and name n24)   (resid  26 and name od2)  3.00  0.40  0.40


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